A0A3Q0KKZ6_SCHMA Loading...

Secreted protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KKZ6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 730 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	57.4	Low	79.4	Confident	190 Å²	190	117.4 Å²	117.4	94%	0.936	61%	0.606	S	S	*	*				0	-58.5	0	-70	-179.7	72.5	0	0	111.4	H3 T4 D5	M1-H3 PolarHBondContact O-N 3.18Å; M1-T4 PolarHBondContact O-N 3.48Å; M1-T4 PolarHBondContact O-OG1 3.02Å; M1-D5 PolarHBondContact O-N 2.77Å
2	F	66.7	Low	80.1	Confident	186 Å²	186	116.8 Å²	116.8	82%	0.816	60%	0.603	S	S	*	*	H	α-helix	trans	-42.8	-39.6	-179.5	-70.7	-74.3	0	0	0	117.1	T4 D5 L6	F2-T4 PolarHBondContact O-N 3.17Å; F2-D5 PolarHBondContact O-N 3.42Å; F2-L6 WeakPolarHBondContact O-CB 3.35Å; F2-L6 PolarHBondContact O-N 2.64Å
3	H	73.9	Confident	80.8	Confident	151 Å²	151	113.6 Å²	113.6	70%	0.699	60%	0.596	S	S	*	*	H	α-helix	trans	-65.7	-33	177.2	-107.3	-59.6	0	0	0	115	M1 L7	M1-H3 PolarHBondContact O-N 3.18Å; H3-L7 PolarHBondContact O-N 2.85Å
4	T	77.5	Confident	81.5	Confident	94 Å²	94	114.4 Å²	114.4	58%	0.577	59%	0.593	S	S	*	*	H	α-helix	trans	-74.6	-36.7	177.4	49.8	0	0	0	0	111.3	M1 F2 L7 A8	M1-T4 PolarHBondContact O-N 3.48Å; M1-T4 PolarHBondContact O-OG1 3.02Å; F2-T4 PolarHBondContact O-N 3.17Å; T4-L7 PolarHBondContact O-N 2.93Å; T4-A8 PolarHBondContact O-N 2.9Å
5	D	79.8	Confident	82	Confident	85 Å²	85	111.2 Å²	111.2	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-71.4	-40.5	-179.7	-51	-33.7	0	0	0	110.4	M1 F2 L7 A8 V9	M1-D5 PolarHBondContact O-N 2.77Å; F2-D5 PolarHBondContact O-N 3.42Å; D5-L7 VanDerWaalsContact C-N 3.34Å; D5-L7 PolarHBondContact O-N 3.48Å; D5-A8 PolarHBondContact O-N 3.38Å; D5-V9 WeakPolarHBondContact O-CG2 3.42Å; D5-V9 PolarHBondContact O-N 3.06Å
6	L	84.2	Confident	82.5	Confident	99 Å²	99	110.6 Å²	110.6	52%	0.518	58%	0.576	S	S	.	*	H	α-helix	trans	-60.8	-42.3	171.4	-170.7	71.7	0	0	0	111.6	F2 A8 V9 I10	F2-L6 WeakPolarHBondContact O-CB 3.35Å; F2-L6 PolarHBondContact O-N 2.64Å; L6-A8 VanDerWaalsContact C-N 3.33Å; L6-A8 PolarHBondContact O-N 3.45Å; L6-V9 PolarHBondContact O-N 2.96Å; L6-I10 HydrophobicContact CG-CD1 4.02Å; L6-I10 WeakPolarHBondContact O-CB 3.22Å; L6-I10 VanDerWaalsContact O-CG1 3.26Å; L6-I10 WeakPolarHBondContact O-CG1 3.42Å; L6-I10 PolarHBondContact O-N 3.45Å
7	L	85.4	Confident	83	Confident	114 Å²	114	111.7 Å²	111.7	60%	0.597	58%	0.576	S	S	*	*	H	α-helix	trans	-63.1	-40.5	176.5	-134.9	87.4	0	0	0	111.7	H3 T4 D5 I10 F11	H3-L7 PolarHBondContact O-N 2.85Å; T4-L7 PolarHBondContact O-N 2.93Å; D5-L7 VanDerWaalsContact C-N 3.34Å; D5-L7 PolarHBondContact O-N 3.48Å; L7-I10 PolarHBondContact O-N 3Å; L7-F11 WeakPolarHBondContact O-CB 3.42Å; L7-F11 PolarHBondContact O-N 3.45Å
8	A	84	Confident	83.3	Confident	59 Å²	59	112.3 Å²	112.3	49%	0.488	57%	0.574	S	S	.	*	H	α-helix	trans	-65	-42.3	177.9	0	0	0	0	0	112.2	T4 D5 L6 F11 L12	T4-A8 PolarHBondContact O-N 2.9Å; D5-A8 PolarHBondContact O-N 3.38Å; L6-A8 VanDerWaalsContact C-N 3.33Å; L6-A8 PolarHBondContact O-N 3.45Å; A8-F11 PolarHBondContact O-N 2.71Å; A8-L12 WeakPolarHBondContact O-CB 3.3Å; A8-L12 PolarHBondContact O-N 3.46Å
9	V	86.3	Confident	83.4	Confident	88 Å²	88	111.5 Å²	111.5	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-63.1	-45	174.2	173.3	0	0	0	0	110.9	D5 L6 F11 L12 C13	D5-V9 WeakPolarHBondContact O-CG2 3.42Å; D5-V9 PolarHBondContact O-N 3.06Å; L6-V9 PolarHBondContact O-N 2.96Å; V9-F11 VanDerWaalsContact C-N 3.32Å; V9-F11 PolarHBondContact O-N 3.18Å; V9-L12 PolarHBondContact O-N 2.81Å; V9-C13 PolarHBondContact O-N 3.05Å; V9-C13 PolarHBondContact O-SG 3.39Å; V9-C13 VanDerWaalsContact O-SG 3.35Å
10	I	89	Confident	83.4	Confident	78 Å²	78	108.4 Å²	108.4	40%	0.4	56%	0.562	S	S	.	*	H	α-helix	trans	-59	-44.3	175.3	-70.9	166.2	0	0	0	110.7	L6 L7 C13 F14	L6-I10 HydrophobicContact CG-CD1 4.02Å; L6-I10 WeakPolarHBondContact O-CB 3.22Å; L6-I10 VanDerWaalsContact O-CG1 3.26Å; L6-I10 WeakPolarHBondContact O-CG1 3.42Å; L6-I10 PolarHBondContact O-N 3.45Å; L7-I10 PolarHBondContact O-N 3Å; I10-C13 PolarHBondContact O-N 3.32Å; I10-F14 HydrophobicContact CG2-CD2 3.73Å; I10-F14 HydrophobicContact CG2-CE2 3.57Å; I10-F14 VanDerWaalsContact O-CD2 3.24Å; I10-F14 WeakPolarHBondContact O-CD2 3.42Å; I10-F14 PolarHBondContact O-N 3.12Å
11	F	89.4	Confident	83.3	Confident	147 Å²	147	106.3 Å²	106.3	65%	0.645	55%	0.551	S	S	*	*	H	α-helix	trans	-64.8	-40.2	178.5	-143.7	-85.8	0	0	0	112.1	L7 A8 V9 F14 V15	L7-F11 WeakPolarHBondContact O-CB 3.42Å; L7-F11 PolarHBondContact O-N 3.45Å; A8-F11 PolarHBondContact O-N 2.71Å; V9-F11 VanDerWaalsContact C-N 3.32Å; V9-F11 PolarHBondContact O-N 3.18Å; F11-F14 PolarHBondContact O-N 3.44Å; F11-V15 HydrophobicContact CD1-CG2 4.16Å; F11-V15 HydrophobicContact CE1-CG2 4.39Å; F11-V15 WeakPolarHBondContact O-CG2 3.48Å; F11-V15 PolarHBondContact O-N 3.27Å
12	L	88.1	Confident	84.5	Confident	110 Å²	110	105.6 Å²	105.6	58%	0.576	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-44.3	174.5	-168	75.8	0	0	0	111.3	A8 V9 F14 V15 I16	A8-L12 WeakPolarHBondContact O-CB 3.3Å; A8-L12 PolarHBondContact O-N 3.46Å; V9-L12 PolarHBondContact O-N 2.81Å; L12-F14 VanDerWaalsContact C-N 3.35Å; L12-F14 PolarHBondContact O-N 3.38Å; L12-V15 PolarHBondContact O-N 2.86Å; L12-I16 HydrophobicContact CG-CD1 4.13Å; L12-I16 WeakPolarHBondContact O-CG1 3.46Å; L12-I16 PolarHBondContact O-N 3.24Å
13	C	88.9	Confident	85	Confident	76 Å²	76	103.8 Å²	103.8	51%	0.514	53%	0.527	S	S	.	.	H	α-helix	trans	-59.9	-42.1	174.1	-70.4	0	0	0	0	112.2	V9 I10 I16 F17	V9-C13 PolarHBondContact O-N 3.05Å; V9-C13 PolarHBondContact O-SG 3.39Å; V9-C13 VanDerWaalsContact O-SG 3.35Å; I10-C13 PolarHBondContact O-N 3.32Å; C13-I16 PolarHBondContact O-N 2.89Å; C13-F17 WeakPolarHBondContact O-CB 3.45Å; C13-F17 PolarHBondContact O-N 3.32Å
14	F	89.9	Confident	85.1	Confident	125 Å²	125	102.8 Å²	102.8	55%	0.548	53%	0.526	S	S	.	.	H	α-helix	trans	-63.9	-42.2	174.4	-84.1	-65.2	0	0	0	112.6	I10 F11 L12 F17 F18	I10-F14 HydrophobicContact CG2-CD2 3.73Å; I10-F14 HydrophobicContact CG2-CE2 3.57Å; I10-F14 VanDerWaalsContact O-CD2 3.24Å; I10-F14 WeakPolarHBondContact O-CD2 3.42Å; I10-F14 PolarHBondContact O-N 3.12Å; F11-F14 PolarHBondContact O-N 3.44Å; L12-F14 VanDerWaalsContact C-N 3.35Å; L12-F14 PolarHBondContact O-N 3.38Å; F14-F17 PolarHBondContact O-N 2.95Å; F14-F18 WeakPolarHBondContact O-CD2 3.46Å; F14-F18 PolarHBondContact O-N 3.31Å
15	V	89.8	Confident	85.2	Confident	66 Å²	66	103.1 Å²	103.1	40%	0.4	52%	0.523	S	S	.	.	H	α-helix	trans	-62.9	-44.9	176.8	171.1	0	0	0	0	111.1	F11 L12 F17 F18 I19	F11-V15 HydrophobicContact CD1-CG2 4.16Å; F11-V15 HydrophobicContact CE1-CG2 4.39Å; F11-V15 WeakPolarHBondContact O-CG2 3.48Å; F11-V15 PolarHBondContact O-N 3.27Å; L12-V15 PolarHBondContact O-N 2.86Å; V15-F17 VanDerWaalsContact C-N 3.34Å; V15-F17 PolarHBondContact O-N 3.25Å; V15-F18 PolarHBondContact O-N 3.47Å; V15-I19 HydrophobicContact CG1-CD1 3.83Å; V15-I19 VanDerWaalsContact O-CG1 3.3Å; V15-I19 WeakPolarHBondContact O-CG1 3.26Å; V15-I19 PolarHBondContact O-N 3.37Å
16	I	89.8	Confident	84.9	Confident	102 Å²	102	105.5 Å²	105.5	52%	0.523	53%	0.53	S	S	.	.	H	α-helix	trans	-61	-43.9	175.3	-67.2	165.5	0	0	0	110.7	L12 C13 I19 A20	L12-I16 HydrophobicContact CG-CD1 4.13Å; L12-I16 WeakPolarHBondContact O-CG1 3.46Å; L12-I16 PolarHBondContact O-N 3.24Å; C13-I16 PolarHBondContact O-N 2.89Å; I16-I19 PolarHBondContact O-N 3.48Å; I16-A20 WeakPolarHBondContact O-CB 3.42Å; I16-A20 PolarHBondContact O-N 2.72Å
17	F	91.6	Very high	83.6	Confident	129 Å²	129	108.5 Å²	108.5	57%	0.566	54%	0.535	S	S	*	.	H	α-helix	trans	-62.7	-42.8	177.1	-172.7	-92.5	0	0	0	112.1	C13 F14 V15 A20 L21	C13-F17 WeakPolarHBondContact O-CB 3.45Å; C13-F17 PolarHBondContact O-N 3.32Å; F14-F17 PolarHBondContact O-N 2.95Å; V15-F17 VanDerWaalsContact C-N 3.34Å; V15-F17 PolarHBondContact O-N 3.25Å; F17-A20 PolarHBondContact O-N 3.4Å; F17-L21 HydrophobicContact CE1-CD1 4.27Å; F17-L21 HydrophobicContact CZ-CD1 4.49Å; F17-L21 VanDerWaalsContact O-CB 3.31Å; F17-L21 WeakPolarHBondContact O-CB 3.47Å; F17-L21 PolarHBondContact O-N 3.32Å
18	F	87	Confident	81.7	Confident	123 Å²	123	107.8 Å²	107.8	54%	0.539	54%	0.537	S	S	.	.	H	α-helix	trans	-65.9	-37.9	175.8	-93.2	-74.7	0	0	0	112.8	F14 V15 L21 W22	F14-F18 WeakPolarHBondContact O-CD2 3.46Å; F14-F18 PolarHBondContact O-N 3.31Å; V15-F18 PolarHBondContact O-N 3.47Å; F18-L21 PolarHBondContact O-N 2.97Å; F18-W22 WeakPolarHBondContact O-CB 3.41Å; F18-W22 PolarHBondContact O-N 3.41Å
19	I	86.7	Confident	79.7	Confident	97 Å²	97	110.8 Å²	110.8	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-43.7	174	-68.4	165.5	0	0	0	110.6	V15 I16 W22 Y23	V15-I19 HydrophobicContact CG1-CD1 3.83Å; V15-I19 VanDerWaalsContact O-CG1 3.3Å; V15-I19 WeakPolarHBondContact O-CG1 3.26Å; V15-I19 PolarHBondContact O-N 3.37Å; I16-I19 PolarHBondContact O-N 3.48Å; I19-W22 PolarHBondContact O-N 2.98Å; I19-Y23 HydrophobicContact CG2-CD2 4.5Å; I19-Y23 PolarHBondContact O-N 2.96Å
20	A	82.3	Confident	77.2	Confident	49 Å²	49	111.5 Å²	111.5	41%	0.405	55%	0.554	S	S	.	*	H	α-helix	trans	-63.9	-41.2	175.8	0	0	0	0	0	112.1	I16 F17 Y23 L24	I16-A20 WeakPolarHBondContact O-CB 3.42Å; I16-A20 PolarHBondContact O-N 2.72Å; F17-A20 PolarHBondContact O-N 3.4Å; A20-Y23 PolarHBondContact O-N 3.25Å; A20-L24 PolarHBondContact O-N 3.26Å
21	L	82.5	Confident	74.6	Confident	65 Å²	65	118.9 Å²	118.9	34%	0.34	58%	0.577	S	S	.	*	H	α-helix	trans	-64.6	-41.6	175	-160.9	86.3	0	0	0	111.4	F17 F18 L24 I25	F17-L21 HydrophobicContact CE1-CD1 4.27Å; F17-L21 HydrophobicContact CZ-CD1 4.49Å; F17-L21 VanDerWaalsContact O-CB 3.31Å; F17-L21 WeakPolarHBondContact O-CB 3.47Å; F17-L21 PolarHBondContact O-N 3.32Å; F18-L21 PolarHBondContact O-N 2.97Å; L21-L24 PolarHBondContact O-N 3.22Å; L21-I25 HydrophobicContact CD2-CD1 3.96Å; L21-I25 HydrophobicContact CG-CD1 3.86Å; L21-I25 WeakPolarHBondContact O-CB 3.49Å; L21-I25 VanDerWaalsContact O-CG1 3.22Å; L21-I25 WeakPolarHBondContact O-CG1 3.24Å; L21-I25 PolarHBondContact O-N 2.95Å
22	W	81.7	Confident	72	Confident	174 Å²	174	120.5 Å²	120.5	66%	0.659	59%	0.586	S	S	*	*	H	α-helix	trans	-61.4	-43.9	172.3	-104.9	32.6	0	0	0	111.7	F18 I19 L24 I25 F26	F18-W22 WeakPolarHBondContact O-CB 3.41Å; F18-W22 PolarHBondContact O-N 3.41Å; I19-W22 PolarHBondContact O-N 2.98Å; W22-L24 VanDerWaalsContact C-N 3.34Å; W22-L24 PolarHBondContact O-N 3.14Å; W22-I25 PolarHBondContact O-N 3.19Å; W22-F26 HydrophobicContact CB-CD2 4.43Å; W22-F26 HydrophobicContact CD2-CD2 4.32Å; W22-F26 HydrophobicContact CD2-CE2 4.04Å; W22-F26 AromaticContact CE2-CE2 4Å; W22-F26 HydrophobicContact CG-CD2 4.17Å; W22-F26 HydrophobicContact CG-CE2 4.15Å; W22-F26 WeakPolarHBondContact O-CB 3.4Å; W22-F26 WeakPolarHBondContact O-CD2 3.37Å; W22-F26 PolarHBondContact O-N 2.91Å
23	Y	76.9	Confident	69.3	Low	148 Å²	148	121.4 Å²	121.4	58%	0.58	60%	0.597	S	S	*	*	H	α-helix	trans	-59.5	-44.3	174.1	-110.5	-88.8	0	0	0	111.7	I19 A20 I25 Y27	I19-Y23 HydrophobicContact CG2-CD2 4.5Å; I19-Y23 PolarHBondContact O-N 2.96Å; A20-Y23 PolarHBondContact O-N 3.25Å; Y23-I25 PolarHBondContact O-N 3.12Å; Y23-Y27 AromaticContact CD1-CD2 3.74Å; Y23-Y27 HydrophobicContact CD1-CD2 3.74Å; Y23-Y27 HydrophobicContact CD1-CE2 4.22Å; Y23-Y27 HydrophobicContact CD1-CG 4.46Å; Y23-Y27 AromaticContact CE1-CD2 3.88Å; Y23-Y27 HydrophobicContact CE1-CD2 3.88Å; Y23-Y27 AromaticContact CE1-CE2 3.93Å; Y23-Y27 HydrophobicContact CE1-CE2 3.93Å; Y23-Y27 HydrophobicContact CG-CD2 4.44Å; Y23-Y27 WeakPolarHBondContact O-CA 3.3Å; Y23-Y27 WeakPolarHBondContact O-CB 3.33Å; Y23-Y27 PolarHBondContact O-N 2.97Å
24	L	77	Confident	66.6	Low	131 Å²	131	126.4 Å²	126.4	69%	0.686	62%	0.615	S	S	*	*	H	α-helix	trans	-63.5	-37.2	175.6	-101.2	155.7	0	0	0	113.7	A20 L21 W22	A20-L24 PolarHBondContact O-N 3.26Å; L21-L24 PolarHBondContact O-N 3.22Å; W22-L24 VanDerWaalsContact C-N 3.34Å; W22-L24 PolarHBondContact O-N 3.14Å
25	I	78.5	Confident	64	Low	101 Å²	101	131 Å²	131	52%	0.518	63%	0.634	S	S	.	*	H	α-helix	trans	-78.6	-38.3	-179	-70.5	166.5	0	0	0	111.9	L21 W22 Y23 P28	L21-I25 HydrophobicContact CD2-CD1 3.96Å; L21-I25 HydrophobicContact CG-CD1 3.86Å; L21-I25 WeakPolarHBondContact O-CB 3.49Å; L21-I25 VanDerWaalsContact O-CG1 3.22Å; L21-I25 WeakPolarHBondContact O-CG1 3.24Å; L21-I25 PolarHBondContact O-N 2.95Å; W22-I25 PolarHBondContact O-N 3.19Å; Y23-I25 PolarHBondContact O-N 3.12Å; I25-P28 WeakPolarHBondContact O-CD 3.47Å
26	F	75	Confident	61.3	Low	135 Å²	135	131 Å²	131	59%	0.592	65%	0.649	S	S	*	*	H	α-helix	trans	-93	-17.7	-176.7	-76	-78.5	0	0	0	114.4	W22 P28	W22-F26 HydrophobicContact CB-CD2 4.43Å; W22-F26 HydrophobicContact CD2-CD2 4.32Å; W22-F26 HydrophobicContact CD2-CE2 4.04Å; W22-F26 AromaticContact CE2-CE2 4Å; W22-F26 HydrophobicContact CG-CD2 4.17Å; W22-F26 HydrophobicContact CG-CE2 4.15Å; W22-F26 WeakPolarHBondContact O-CB 3.4Å; W22-F26 WeakPolarHBondContact O-CD2 3.37Å; W22-F26 PolarHBondContact O-N 2.91Å; F26-P28 WeakPolarHBondContact O-CD 3.3Å
27	Y	55.5	Low	58.5	Low	162 Å²	162	132.7 Å²	132.7	64%	0.635	66%	0.664	S	S	*	*			trans	-116.6	57.5	172.1	-69.1	-87.8	0	0	0	114.8	Y23 D29	Y23-Y27 AromaticContact CD1-CD2 3.74Å; Y23-Y27 HydrophobicContact CD1-CD2 3.74Å; Y23-Y27 HydrophobicContact CD1-CE2 4.22Å; Y23-Y27 HydrophobicContact CD1-CG 4.46Å; Y23-Y27 AromaticContact CE1-CD2 3.88Å; Y23-Y27 HydrophobicContact CE1-CD2 3.88Å; Y23-Y27 AromaticContact CE1-CE2 3.93Å; Y23-Y27 HydrophobicContact CE1-CE2 3.93Å; Y23-Y27 HydrophobicContact CG-CD2 4.44Å; Y23-Y27 WeakPolarHBondContact O-CA 3.3Å; Y23-Y27 WeakPolarHBondContact O-CB 3.33Å; Y23-Y27 PolarHBondContact O-N 2.97Å; Y27-D29 PolarHBondContact O-N 3.28Å
28	P	45.6	Very low	55.6	Low	98 Å²	98	138 Å²	138	64%	0.636	68%	0.68	S	S	*	*			trans	-86.3	84	172.2	36	-33.2	0	0	0	111.2	I25 F26	I25-P28 WeakPolarHBondContact O-CD 3.47Å; F26-P28 WeakPolarHBondContact O-CD 3.3Å
29	D	41.6	Very low	52.9	Low	122 Å²	122	144 Å²	144	65%	0.652	70%	0.699	S	S	*	*			trans	-178.2	124.4	133	-133.3	-30.3	0	0	0	114.1	Y27	Y27-D29 PolarHBondContact O-N 3.28Å
30	S	34.9	Very low	50.3	Low	104 Å²	104	145.9 Å²	145.9	73%	0.727	72%	0.715	S	S	*	*	S	Bend	trans	-165.4	40.7	137.8	76.5	0	0	0	0	112
31	R	35	Very low	47.8	Very low	233 Å²	233	153.8 Å²	153.8	88%	0.879	74%	0.74	S	S	*	*			trans	-144.8	65	173.2	-74.2	-162.5	-178	-168.2	2.1	112.2
32	Q	33.2	Very low	45.4	Very low	180 Å²	180	155.3 Å²	155.3	84%	0.841	76%	0.756	S	S	*	*			trans	-112.1	83.9	152.3	-75.4	-161.5	-1.6	0	0	110.7
33	T	32.6	Very low	43.2	Very low	129 Å²	129	155 Å²	155	79%	0.791	77%	0.765	S	S	*	*			trans	-106.9	147.9	154.1	45.3	0	0	0	0	108.7
34	M	32	Very low	40.9	Very low	181 Å²	181	155.6 Å²	155.6	89%	0.892	78%	0.779	S	S	*	*			trans	65.7	93.1	-178	-70.1	-154.7	152.5	0	0	118.8
35	K	35	Very low	38.8	Very low	221 Å²	221	158.3 Å²	158.3	96%	0.961	79%	0.785	S	S	*	*			trans	156.7	131.2	142.6	-86.3	155.9	-171.6	178.5	0	106.5
36	G	32.2	Very low	36.7	Very low	68 Å²	68	163.1 Å²	163.1	70%	0.701	81%	0.805	S	S	*	*			cis	176.1	130.6	-4.3	0	0	0	0	0	108.3
37	T	31.2	Very low	34.9	Very low	136 Å²	136	161.9 Å²	161.9	83%	0.834	81%	0.814	S	S	*	*			trans	33.1	105.2	154.3	-34.7	0	0	0	0	119.4
38	R	32	Very low	33.8	Very low	240 Å²	240	162.1 Å²	162.1	91%	0.906	83%	0.826	S	S	*	*			trans	152.5	94.9	135.7	-83.6	164.6	-174.6	-173.3	3.5	113.6
39	R	29.7	Very low	34	Very low	250 Å²	250	162 Å²	162	94%	0.943	82%	0.82	S	S	*	*			trans	-175.5	70.9	135.5	-107.2	-178.8	-179.9	-173.3	0.6	111.5
40	V	31.3	Very low	34.5	Very low	136 Å²	136	164.5 Å²	164.5	82%	0.824	83%	0.825	S	S	*	*			trans	-125.7	96.4	158	-179.5	0	0	0	0	106.7
41	K	29.4	Very low	35.3	Very low	215 Å²	215	164.2 Å²	164.2	94%	0.935	82%	0.815	S	S	*	*			trans	-146.2	62.5	171.4	-90.8	-160.3	174.3	-172.4	0	109.5
42	S	33.8	Very low	36	Very low	97 Å²	97	155.7 Å²	155.7	68%	0.678	80%	0.795	S	S	*	*	S	Bend	trans	-163.2	139	162	52	0	0	0	0	107.3
43	I	34	Very low	36.7	Very low	167 Å²	167	156.8 Å²	156.8	86%	0.856	79%	0.791	S	S	*	*			trans	69.7	75.7	-177.7	-45.4	171.2	0	0	0	112.8
44	N	30.1	Very low	38	Very low	161 Å²	161	157.4 Å²	157.4	86%	0.861	78%	0.783	S	S	*	*			trans	-132.2	81.8	159.7	-173.4	19.2	0	0	0	108.7
45	K	31.8	Very low	38.8	Very low	189 Å²	189	152.9 Å²	152.9	82%	0.822	76%	0.759	S	S	*	*			trans	-173.6	121.3	164.7	-112.8	177.6	178.6	-175.8	0	109.4
46	Q	35.4	Very low	39.6	Very low	201 Å²	201	147.1 Å²	147.1	94%	0.939	74%	0.738	S	S	*	*			trans	94.4	127.4	-169.6	-65.7	174.2	-35.9	0	0	113.5
47	S	35.8	Very low	40.6	Very low	110 Å²	110	146.7 Å²	146.7	77%	0.769	73%	0.728	S	S	*	*			cis	-154.4	146.1	-14.5	176.3	0	0	0	0	107.9	N49	S47-N49 PolarHBondContact O-N 3.37Å
48	N	33.6	Very low	41.4	Very low	167 Å²	167	147.6 Å²	147.6	89%	0.893	72%	0.716	S	S	*	*			trans	-68.9	89.8	-178.6	-80.2	-34.7	0	0	0	111.4
49	N	50.3	Low	41.9	Very low	96 Å²	96	141.6 Å²	141.6	51%	0.513	70%	0.701	S	S	.	*			trans	-90.5	116.9	170.7	-165.2	-13.6	0	0	0	111.2	S47 D51	S47-N49 PolarHBondContact O-N 3.37Å; N49-D51 VanDerWaalsContact C-N 3.27Å; N49-D51 PolarHBondContact O-N 3.31Å; N49-D51 WeakPolarHBondContact OD1-CB 3.48Å; N49-D51 PolarHBondContact OD1-N 3.31Å; N49-D51 PolarHBondContact OD1-OD2 3.02Å
50	K	50.8	Low	42.4	Very low	174 Å²	174	138.3 Å²	138.3	76%	0.757	69%	0.69	S	S	*	*	H	α-helix	trans	-65	-28.9	174.1	-96.5	178.5	173.6	175.5	0	112.4	R53 K54	K50-R53 PolarHBondContact O-N 3.16Å; K50-K54 PolarHBondContact O-N 3.34Å
51	D	52.5	Low	43.1	Very low	98 Å²	98	134.5 Å²	134.5	52%	0.524	67%	0.67	S	S	.	*	H	α-helix	trans	-74.1	-32.6	-172.6	-60	-38.7	0	0	0	112.3	N49 R53 K54 E55	N49-D51 VanDerWaalsContact C-N 3.27Å; N49-D51 PolarHBondContact O-N 3.31Å; N49-D51 WeakPolarHBondContact OD1-CB 3.48Å; N49-D51 PolarHBondContact OD1-N 3.31Å; N49-D51 PolarHBondContact OD1-OD2 3.02Å; D51-R53 PolarHBondContact O-N 3.32Å; D51-K54 CarbonylContact O-C 3.45Å; D51-K54 WeakPolarHBondContact O-CA 3.39Å; D51-K54 PolarHBondContact O-N 3.38Å; D51-E55 PolarHBondContact O-N 2.75Å
52	A	49.6	Very low	43.7	Very low	54 Å²	54	131.8 Å²	131.8	45%	0.446	66%	0.658	S	S	.	*	H	α-helix	trans	-60.3	-31.6	170.9	0	0	0	0	0	112.4	I56	A52-I56 WeakPolarHBondContact O-CD1 3.34Å; A52-I56 VanDerWaalsContact O-CG1 3.24Å; A52-I56 WeakPolarHBondContact O-CG1 3.31Å; A52-I56 PolarHBondContact O-N 3.45Å; A52-I56 VanDerWaalsContact O-N 3.13Å
53	R	47.9	Very low	44	Very low	202 Å²	202	132.3 Å²	132.3	76%	0.762	65%	0.653	S	S	*	*	H	α-helix	trans	-76.4	-30.8	173.2	-69.5	-173.2	178.1	-174.3	0.2	112.7	K50 D51 A57	K50-R53 PolarHBondContact O-N 3.16Å; D51-R53 PolarHBondContact O-N 3.32Å; R53-A57 VanDerWaalsContact O-CB 3.27Å; R53-A57 WeakPolarHBondContact O-CB 3.43Å; R53-A57 PolarHBondContact O-N 3.31Å
54	K	59.4	Low	44.3	Very low	143 Å²	143	132.1 Å²	132.1	62%	0.622	65%	0.646	S	S	*	*	H	α-helix	trans	-70.6	-39.4	172.1	-85.3	-174.4	176.5	-178.5	0	112.2	K50 D51 A57 R58	K50-K54 PolarHBondContact O-N 3.34Å; D51-K54 CarbonylContact O-C 3.45Å; D51-K54 WeakPolarHBondContact O-CA 3.39Å; D51-K54 PolarHBondContact O-N 3.38Å; K54-A57 PolarHBondContact O-N 2.73Å; K54-R58 WeakPolarHBondContact O-CG 3.45Å; K54-R58 PolarHBondContact O-N 3.26Å
55	E	48.6	Very low	44.8	Very low	86 Å²	86	129 Å²	129	40%	0.402	63%	0.629	S	S	.	*	H	α-helix	trans	-66.4	-46.7	175.7	-95	-55.2	121.3	0	0	112.1	D51 A57 R58 L59	D51-E55 PolarHBondContact O-N 2.75Å; E55-A57 VanDerWaalsContact C-N 3.27Å; E55-A57 PolarHBondContact O-N 2.64Å; E55-R58 WeakPolarHBondContact O-CB 3.39Å; E55-R58 PolarHBondContact O-N 3.02Å; E55-R58 VanDerWaalsContact O-N 3.07Å; E55-R58 WeakPolarHBondContact OE1-CD 3.39Å; E55-R58 IonicContact OE1-NH1 3.11Å; E55-R58 PolarHBondContact OE1-NH1 3.18Å; E55-R58 VanDerWaalsContact OE1-NH1 3.11Å; E55-L59 WeakPolarHBondContact O-CG 3.34Å; E55-L59 PolarHBondContact O-N 3Å
56	I	52.8	Low	45.2	Very low	99 Å²	99	122.5 Å²	122.5	51%	0.508	61%	0.611	S	S	.	*	H	α-helix	trans	-60	-39.9	173.7	-66.7	167.2	0	0	0	110.7	A52 R58 L59 Y60	A52-I56 WeakPolarHBondContact O-CD1 3.34Å; A52-I56 VanDerWaalsContact O-CG1 3.24Å; A52-I56 WeakPolarHBondContact O-CG1 3.31Å; A52-I56 PolarHBondContact O-N 3.45Å; A52-I56 VanDerWaalsContact O-N 3.13Å; I56-R58 PolarHBondContact O-N 3.42Å; I56-L59 PolarHBondContact O-N 3.32Å; I56-Y60 HydrophobicContact CG2-CD2 3.86Å; I56-Y60 HydrophobicContact CG2-CE2 4.05Å; I56-Y60 WeakPolarHBondContact O-CD2 3.26Å; I56-Y60 PolarHBondContact O-N 2.97Å
57	A	52.5	Low	45.3	Very low	60 Å²	60	121.6 Å²	121.6	50%	0.496	60%	0.601	S	S	.	*	H	α-helix	trans	-65.6	-35.3	174.7	0	0	0	0	0	113.3	R53 K54 E55 S61	R53-A57 VanDerWaalsContact O-CB 3.27Å; R53-A57 WeakPolarHBondContact O-CB 3.43Å; R53-A57 PolarHBondContact O-N 3.31Å; K54-A57 PolarHBondContact O-N 2.73Å; E55-A57 VanDerWaalsContact C-N 3.27Å; E55-A57 PolarHBondContact O-N 2.64Å; A57-S61 WeakPolarHBondContact O-CB 3.49Å; A57-S61 PolarHBondContact O-N 2.94Å; A57-S61 PolarHBondContact O-OG 2.93Å
58	R	48.9	Very low	45.3	Very low	154 Å²	154	123.7 Å²	123.7	58%	0.581	60%	0.596	S	S	*	*	H	α-helix	trans	-64.9	-49.5	173.3	-82.9	176.5	172.9	164.8	-5.2	111.7	K54 E55 I56 Y60 S61 F62	K54-R58 WeakPolarHBondContact O-CG 3.45Å; K54-R58 PolarHBondContact O-N 3.26Å; E55-R58 WeakPolarHBondContact O-CB 3.39Å; E55-R58 PolarHBondContact O-N 3.02Å; E55-R58 VanDerWaalsContact O-N 3.07Å; E55-R58 WeakPolarHBondContact OE1-CD 3.39Å; E55-R58 IonicContact OE1-NH1 3.11Å; E55-R58 PolarHBondContact OE1-NH1 3.18Å; E55-R58 VanDerWaalsContact OE1-NH1 3.11Å; I56-R58 PolarHBondContact O-N 3.42Å; R58-Y60 VanDerWaalsContact C-N 3.35Å; R58-Y60 PolarHBondContact O-N 3.26Å; R58-S61 WeakPolarHBondContact CA-OG 3.31Å; R58-S61 WeakPolarHBondContact O-CA 3.42Å; R58-S61 PolarHBondContact O-N 3.35Å; R58-S61 PolarHBondContact O-OG 3.2Å; R58-F62 PolarHBondContact O-N 3.46Å
59	L	40.9	Very low	45.5	Very low	114 Å²	114	122.3 Å²	122.3	60%	0.597	58%	0.584	S	S	*	*	H	α-helix	trans	-57.2	-46	178.1	-70.6	165.1	0	0	0	111.6	E55 I56 S61 F62 D63	E55-L59 WeakPolarHBondContact O-CG 3.34Å; E55-L59 PolarHBondContact O-N 3Å; I56-L59 PolarHBondContact O-N 3.32Å; L59-S61 VanDerWaalsContact C-N 3.28Å; L59-S61 PolarHBondContact O-N 3.29Å; L59-F62 PolarHBondContact O-N 3.43Å; L59-D63 PolarHBondContact O-N 2.73Å
60	Y	41.3	Very low	44.7	Very low	182 Å²	182	125.9 Å²	125.9	71%	0.714	60%	0.6	S	S	*	*	H	α-helix	trans	-71.3	-16.4	174.8	-86.1	-84.7	0	0	0	114.5	I56 R58	I56-Y60 HydrophobicContact CG2-CD2 3.86Å; I56-Y60 HydrophobicContact CG2-CE2 4.05Å; I56-Y60 WeakPolarHBondContact O-CD2 3.26Å; I56-Y60 PolarHBondContact O-N 2.97Å; R58-Y60 VanDerWaalsContact C-N 3.35Å; R58-Y60 PolarHBondContact O-N 3.26Å
61	S	45.6	Very low	43.8	Very low	55 Å²	55	124.4 Å²	124.4	39%	0.385	60%	0.6	S	S	.	*	H	α-helix	trans	-86.5	-32.6	174.4	71.5	0	0	0	0	113	A57 R58 L59 K64 N65	A57-S61 WeakPolarHBondContact O-CB 3.49Å; A57-S61 PolarHBondContact O-N 2.94Å; A57-S61 PolarHBondContact O-OG 2.93Å; R58-S61 WeakPolarHBondContact CA-OG 3.31Å; R58-S61 WeakPolarHBondContact O-CA 3.42Å; R58-S61 PolarHBondContact O-N 3.35Å; R58-S61 PolarHBondContact O-OG 3.2Å; L59-S61 VanDerWaalsContact C-N 3.28Å; L59-S61 PolarHBondContact O-N 3.29Å; S61-K64 PolarHBondContact O-N 3.3Å; S61-N65 PolarHBondContact O-N 3.47Å
62	F	41.6	Very low	42.8	Very low	159 Å²	159	126.3 Å²	126.3	70%	0.697	61%	0.61	S	S	*	*	H	α-helix	trans	-64.7	-46.8	175.5	-113.4	-88.9	0	0	0	111.6	R58 L59 K64 N65 A66	R58-F62 PolarHBondContact O-N 3.46Å; L59-F62 PolarHBondContact O-N 3.43Å; F62-K64 PolarHBondContact O-N 2.99Å; F62-N65 PolarHBondContact O-N 3.11Å; F62-A66 PolarHBondContact O-N 3.47Å
63	D	41.5	Very low	41.8	Very low	108 Å²	108	134.3 Å²	134.3	58%	0.578	63%	0.63	S	S	*	*	H	α-helix	trans	-62	-26.6	-179.9	-141.1	7.2	0	0	0	112.3	L59	L59-D63 PolarHBondContact O-N 2.73Å
64	K	39.6	Very low	40.9	Very low	162 Å²	162	130.4 Å²	130.4	70%	0.704	63%	0.634	S	S	*	*	H	α-helix	trans	-85.6	-17.4	178.3	-149.1	174.7	-172.7	179.1	0	114.1	S61 F62	S61-K64 PolarHBondContact O-N 3.3Å; F62-K64 PolarHBondContact O-N 2.99Å
65	N	41.3	Very low	39.4	Very low	95 Å²	95	130 Å²	130	51%	0.508	65%	0.647	S	S	.	*	H	α-helix	trans	-92.4	-37.4	175.5	-70.8	-9.9	0	0	0	111.5	S61 F62 Y67 K68 E69	S61-N65 PolarHBondContact O-N 3.47Å; F62-N65 PolarHBondContact O-N 3.11Å; N65-Y67 VanDerWaalsContact C-N 3.26Å; N65-Y67 PolarHBondContact O-N 2.98Å; N65-K68 WeakPolarHBondContact O-CA 3.22Å; N65-K68 WeakPolarHBondContact O-CB 3.46Å; N65-K68 PolarHBondContact O-N 3.26Å; N65-E69 PolarHBondContact O-N 3.29Å
66	A	39.7	Very low	38.4	Very low	54 Å²	54	129.3 Å²	129.3	45%	0.446	66%	0.663	S	S	.	*	H	α-helix	trans	-57	-37.6	173.6	0	0	0	0	0	112.7	F62 K68	F62-A66 PolarHBondContact O-N 3.47Å; A66-K68 VanDerWaalsContact C-N 3.25Å; A66-K68 PolarHBondContact O-N 3.02Å
67	Y	37.3	Very low	37.4	Very low	181 Å²	181	132.9 Å²	132.9	71%	0.71	68%	0.682	S	S	*	*	H	α-helix	trans	-74.5	-6.6	173.5	-92.8	-84.4	0	0	0	115.1	N65	N65-Y67 VanDerWaalsContact C-N 3.26Å; N65-Y67 PolarHBondContact O-N 2.98Å
68	K	36.8	Very low	36.2	Very low	155 Å²	155	135.1 Å²	135.1	67%	0.674	69%	0.694	S	S	*	*	H	α-helix	trans	-102.9	-35.1	177.7	-111.9	-174.8	174.3	-168.8	0	113.2	N65 A66 M70	N65-K68 WeakPolarHBondContact O-CA 3.22Å; N65-K68 WeakPolarHBondContact O-CB 3.46Å; N65-K68 PolarHBondContact O-N 3.26Å; A66-K68 VanDerWaalsContact C-N 3.25Å; A66-K68 PolarHBondContact O-N 3.02Å; K68-M70 VanDerWaalsContact C-N 3.33Å
69	E	36.2	Very low	35.5	Very low	137 Å²	137	134.2 Å²	134.2	64%	0.64	71%	0.705	S	S	*	*	H	α-helix	trans	-74	-25	178.9	-69.5	177.4	152.6	0	0	112.6	N65 N71	N65-E69 PolarHBondContact O-N 3.29Å; E69-N71 PolarHBondContact O-N 2.94Å
70	M	34.5	Very low	34.9	Very low	172 Å²	172	134.9 Å²	134.9	85%	0.847	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-0.5	178.5	-148.6	168.7	-178.6	0	0	114.7	K68	K68-M70 VanDerWaalsContact C-N 3.33Å
71	N	32.2	Very low	34.4	Very low	142 Å²	142	134.1 Å²	134.1	76%	0.759	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	12.4	178.6	-83.4	-52.2	0	0	0	113.8	E69	E69-N71 PolarHBondContact O-N 2.94Å
72	L	30.9	Very low	33.8	Very low	139 Å²	139	139.6 Å²	139.6	73%	0.728	74%	0.736	S	S	*	*	S	Bend	trans	-116.6	5.8	-174.5	-85.8	162	0	0	0	115.2
73	Y	29.1	Very low	33.2	Very low	222 Å²	222	137.3 Å²	137.3	87%	0.871	74%	0.74	S	S	*	*	S	Bend	trans	-111.1	53.4	-179.8	-79.1	-82.2	0	0	0	113.6
74	S	29.1	Very low	32.7	Very low	120 Å²	120	140.8 Å²	140.8	84%	0.839	75%	0.753	S	S	*	*	S	Bend	trans	-167.7	55	160.5	-171.6	0	0	0	0	113.1
75	C	26.3	Very low	32.2	Very low	134 Å²	134	142.6 Å²	142.6	91%	0.905	76%	0.757	S	S	*	*			trans	-158.6	140.6	168.1	-163.7	0	0	0	0	112.3
76	G	28.1	Very low	31.7	Very low	72 Å²	72	144.2 Å²	144.2	74%	0.742	77%	0.765	S	S	*	*			trans	98	72.9	161.3	0	0	0	0	0	117
77	I	32.7	Very low	31.3	Very low	174 Å²	174	146.2 Å²	146.2	89%	0.892	78%	0.776	S	S	*	*			trans	-91.4	121.3	141	-68	177.6	0	0	0	106.4
78	S	27.5	Very low	31.1	Very low	107 Å²	107	147.4 Å²	147.4	75%	0.748	79%	0.785	S	S	*	*			trans	-91.8	122.4	-178.9	52.8	0	0	0	0	111.3
79	T	32.8	Very low	30.9	Very low	135 Å²	135	143.3 Å²	143.3	83%	0.828	79%	0.787	S	S	*	*			trans	-135.6	112.8	152.1	46.8	0	0	0	0	109.5
80	T	29.3	Very low	30.7	Very low	128 Å²	128	144.7 Å²	144.7	79%	0.785	80%	0.799	S	S	*	*			trans	-59.4	131	170.3	-14.2	0	0	0	0	110.6
81	E	31.6	Very low	30.6	Very low	165 Å²	165	143 Å²	143	77%	0.771	80%	0.799	S	S	*	*				167.7	145.4	112.8	-93.7	170.8	-159.9	0	0	113.6
82	H	32.9	Very low	30.7	Very low	171 Å²	171	140.1 Å²	140.1	79%	0.792	79%	0.789	S	S	*	*			trans	26.8	121.3	160.9	-68.6	-73.7	0	0	0	122.4
83	S	27.5	Very low	30.8	Very low	110 Å²	110	142.5 Å²	142.5	77%	0.769	80%	0.801	S	S	*	*			trans	-57.7	124	156.5	52.4	0	0	0	0	112.8
84	E	30.6	Very low	31	Very low	182 Å²	182	138.4 Å²	138.4	85%	0.85	79%	0.788	S	S	*	*			trans	-153.1	143.1	136.7	-127.1	165.2	-161.2	0	0	112.2
85	Y	30.5	Very low	31.4	Very low	199 Å²	199	138.3 Å²	138.3	78%	0.78	78%	0.783	S	S	*	*			trans	0.4	144.5	167.7	-81.2	-104.5	0	0	0	123.1
86	D	30.2	Very low	31.9	Very low	130 Å²	130	138.9 Å²	138.9	70%	0.695	78%	0.782	S	S	*	*			trans	75.6	104.6	139.2	-68.4	-12.2	0	0	0	122.8
87	S	31.4	Very low	32.2	Very low	95 Å²	95	145 Å²	145	66%	0.664	79%	0.788	S	S	*	*				88.7	161.5	119.4	81.2	0	0	0	0	118.7
88	F	33.2	Very low	32.4	Very low	207 Å²	207	143.5 Å²	143.5	91%	0.908	78%	0.777	S	S	*	*			trans	63.7	121	-170.4	-60.6	-88.5	0	0	0	115
89	G	32	Very low	32.6	Very low	69 Å²	69	147.1 Å²	147.1	71%	0.711	79%	0.785	S	S	*	*			cis	146.8	79.1	-0.6	0	0	0	0	0	111.2
90	D	32.1	Very low	32.6	Very low	165 Å²	165	148.7 Å²	148.7	88%	0.882	78%	0.784	S	S	*	*			trans	-140.1	62.1	165.6	-140.5	-9.4	0	0	0	111.4	S92	D90-S92 PolarHBondContact O-N 3.3Å
91	T	33	Very low	32.7	Very low	138 Å²	138	153.9 Å²	153.9	85%	0.847	79%	0.79	S	S	*	*			trans	-75.3	107.5	165.4	45.6	0	0	0	0	109.9
92	S	33.7	Very low	32.6	Very low	80 Å²	80	157.2 Å²	157.2	56%	0.559	80%	0.797	S	S	*	*			trans	-154.5	93.6	145.8	-161.3	0	0	0	0	113	D90 K94	D90-S92 PolarHBondContact O-N 3.3Å; S92-K94 PolarHBondContact O-N 2.86Å
93	L	33.5	Very low	32.5	Very low	189 Å²	189	156.5 Å²	156.5	99%	0.99	79%	0.791	S	S	*	*			trans	-52.1	70.3	161.4	-168	92.3	0	0	0	112.2
94	K	33.7	Very low	32.5	Very low	137 Å²	137	158.4 Å²	158.4	60%	0.596	79%	0.788	S	S	*	*			trans	-138.5	-1.2	-171.3	-147.2	170.7	-176.7	-179.5	0	116.7	S92	S92-K94 PolarHBondContact O-N 2.86Å
95	T	36	Very low	32.4	Very low	117 Å²	117	161.2 Å²	161.2	72%	0.718	79%	0.791	S	S	*	*	S	Bend	trans	-112.1	-2.8	-173.8	-26.6	0	0	0	0	114.6
96	V	36.9	Very low	32.2	Very low	147 Å²	147	158.9 Å²	158.9	89%	0.891	79%	0.787	S	S	*	*	S	Bend	trans	-117.5	10.3	-174.5	-172.6	0	0	0	0	112.6
97	K	35.9	Very low	32.1	Very low	199 Å²	199	160.4 Å²	160.4	87%	0.865	79%	0.79	S	S	*	*	S	Bend	trans	-138	0.8	179	-120.1	174.2	-178.4	176.4	0	116.9
98	E	35.5	Very low	31.9	Very low	143 Å²	143	165.8 Å²	165.8	67%	0.668	80%	0.796	S	S	*	*	S	Bend	trans	-111.2	-2.5	176.8	-73.3	-168	136.3	0	0	114.9	M100	E98-M100 PolarHBondContact O-N 3.15Å
99	M	33.2	Very low	31.7	Very low	184 Å²	184	166 Å²	166	91%	0.906	79%	0.792	S	S	*	*	S	Bend	trans	-76.1	-0.2	170.7	-87.9	-173.5	170.9	0	0	114.2
100	M	32	Very low	31.6	Very low	167 Å²	167	168 Å²	168	82%	0.823	80%	0.795	S	S	*	*	S	Bend	trans	-108.6	119.8	166.7	-70.2	-173.7	-178.8	0	0	109.5	E98	E98-M100 PolarHBondContact O-N 3.15Å
101	R	30.6	Very low	31.3	Very low	237 Å²	237	168.4 Å²	168.4	89%	0.894	80%	0.796	S	S	*	*			trans	88.8	71.6	-173.7	-52.8	179.4	-173.7	-169.5	3.3	115.9
102	Y	30.5	Very low	31	Very low	235 Å²	235	170.8 Å²	170.8	92%	0.922	80%	0.798	S	S	*	*			trans	-96.3	121.7	137.4	-135	-89.3	0	0	0	109.4
103	K	31	Very low	30.8	Very low	156 Å²	156	175.7 Å²	175.7	68%	0.678	81%	0.812	S	S	*	*			trans	-91.7	142.9	-173.2	-129.1	-174.8	177.2	-122.1	0	110	R105	K103-R105 PolarHBondContact O-N 2.83Å
104	E	27	Very low	30.5	Very low	151 Å²	151	174.9 Å²	174.9	71%	0.706	81%	0.805	S	S	*	*			trans	29.7	90.6	141.1	-62.1	170	125.6	0	0	117.4
105	R	28.4	Very low	30	Very low	241 Å²	241	173.7 Å²	173.7	91%	0.909	81%	0.814	S	S	*	*			trans	-132.3	119.7	142.5	-76.7	-165.1	173.5	169.7	-0.2	110.4	K103	K103-R105 PolarHBondContact O-N 2.83Å
106	Q	26.5	Very low	29.6	Very low	150 Å²	150	172.5 Å²	172.5	70%	0.701	81%	0.811	S	S	*	*			trans	-63.4	141.7	172.9	-62.1	-172.8	-5	0	0	110.2
107	Q	28.6	Very low	29.3	Very low	162 Å²	162	174.8 Å²	174.8	76%	0.757	80%	0.804	S	S	*	*			trans	-113.9	100.7	149.5	-79.5	-174.4	-26.1	0	0	108.4	Y109	Q107-Y109 PolarHBondContact O-N 3Å
108	R	27.1	Very low	29.1	Very low	207 Å²	207	172.9 Å²	172.9	78%	0.781	80%	0.799	S	S	*	*			trans	-72.5	111.5	163.4	-68.6	174.5	177.4	171.2	-7.5	107.1	S110	R108-S110 PolarHBondContact O-N 2.86Å
109	Y	29.1	Very low	28.7	Very low	213 Å²	213	170.9 Å²	170.9	84%	0.835	80%	0.8	S	S	*	*			trans	-75.4	106.3	161.1	-82.7	-80.8	0	0	0	108.3	Q107	Q107-Y109 PolarHBondContact O-N 3Å
110	S	29.6	Very low	28.7	Very low	110 Å²	110	169.9 Å²	169.9	77%	0.769	80%	0.799	S	S	*	*			trans	-74.9	128.3	-179.9	47.6	0	0	0	0	111.5	R108 Q112	R108-S110 PolarHBondContact O-N 2.86Å; S110-Q112 PolarHBondContact O-N 3.3Å
111	L	24.4	Very low	28.5	Very low	173 Å²	173	170 Å²	170	91%	0.906	80%	0.797	S	S	*	*			trans	-58.3	111	156.6	-82	156.2	0	0	0	109.5
112	Q	26.7	Very low	28.6	Very low	188 Å²	188	165.8 Å²	165.8	88%	0.879	79%	0.793	S	S	*	*			trans	177.1	105.3	148	-103.1	168.8	7	0	0	111.7	S110	S110-Q112 PolarHBondContact O-N 3.3Å
113	Q	29.9	Very low	28.8	Very low	184 Å²	184	162.1 Å²	162.1	86%	0.86	79%	0.789	S	S	*	*			trans	-157.5	92.7	144.2	-108.4	173	7.7	0	0	105.7
114	M	27.1	Very low	28.8	Very low	172 Å²	172	163.1 Å²	163.1	85%	0.847	80%	0.796	S	S	*	*				82.9	102.1	94.7	-80.6	-165.6	81.8	0	0	112.3
115	S	24.3	Very low	29.1	Very low	112 Å²	112	164.1 Å²	164.1	78%	0.783	81%	0.805	S	S	*	*			trans	-55.7	137.1	166.4	49.3	0	0	0	0	113.4
116	S	27.6	Very low	29.1	Very low	92 Å²	92	160.3 Å²	160.3	64%	0.643	80%	0.801	S	S	*	*			trans	155	139.9	153.2	55.7	0	0	0	0	106.2
117	Y	30.4	Very low	29.5	Very low	194 Å²	194	158.2 Å²	158.2	76%	0.761	80%	0.801	S	S	*	*			cis	-142.3	162.7	28.8	-94.1	-92.7	0	0	0	113.6
118	Q	30.6	Very low	29.8	Very low	160 Å²	160	158 Å²	158	75%	0.748	81%	0.81	S	S	*	*			trans	62.7	91.5	147.2	-77.8	155.8	-29.9	0	0	119.7
119	S	27.6	Very low	30.1	Very low	100 Å²	100	152.2 Å²	152.2	70%	0.699	81%	0.807	S	S	*	*				-38.2	135.8	127.3	50.4	0	0	0	0	113.6
120	N	32.9	Very low	30.5	Very low	163 Å²	163	147.7 Å²	147.7	87%	0.872	81%	0.806	S	S	*	*			trans	-127	114.5	143.8	-96.4	-9	0	0	0	107.1
121	E	29.1	Very low	30.8	Very low	170 Å²	170	148.8 Å²	148.8	79%	0.794	80%	0.803	S	S	*	*			trans	-83.5	176.7	162.8	-68	-178.9	122.6	0	0	109.7
122	N	33.3	Very low	31.4	Very low	149 Å²	149	148.3 Å²	148.3	80%	0.797	79%	0.794	S	S	*	*			trans	79.9	128.9	-175	-43.7	-33.6	0	0	0	112.5
123	D	34.1	Very low	31.7	Very low	158 Å²	158	145.4 Å²	145.4	85%	0.845	79%	0.789	S	S	*	*			cis	-130	163.7	18.5	-88.7	-52.2	0	0	0	115.6
124	Q	31	Very low	31.8	Very low	177 Å²	177	143.1 Å²	143.1	83%	0.827	79%	0.788	S	S	*	*			trans	-77.8	149.6	179	-58.1	167	3.5	0	0	111.6
125	I	33.7	Very low	31.8	Very low	172 Å²	172	145.3 Å²	145.3	88%	0.882	79%	0.787	S	S	*	*			trans	177.8	128.4	130	-88.6	150.9	0	0	0	110.1
126	L	27.1	Very low	31.9	Very low	160 Å²	160	147.2 Å²	147.2	84%	0.838	79%	0.788	S	S	*	*			trans	-130.8	176.2	170.2	-86.7	161	0	0	0	106.2
127	P	35.7	Very low	32	Very low	107 Å²	107	148.9 Å²	148.9	70%	0.695	79%	0.788	S	S	*	*				-133	164.2	-52.5	37.2	-22.4	0	0	0	112.3
128	V	34.3	Very low	32	Very low	157 Å²	157	148.9 Å²	148.9	95%	0.952	79%	0.792	S	S	*	*			trans	-140.1	147.8	158.6	-174.3	0	0	0	0	110.5
129	A	34.6	Very low	31.8	Very low	86 Å²	86	144.5 Å²	144.5	71%	0.711	79%	0.79	S	S	*	*			trans	-111.7	-167.6	-162.6	0	0	0	0	0	114.8
130	S	37.4	Very low	32.1	Very low	117 Å²	117	147 Å²	147	82%	0.818	80%	0.795	S	S	*	*			trans	87.9	135.6	177.1	85.5	0	0	0	0	115.2
131	D	34.8	Very low	32.1	Very low	133 Å²	133	148 Å²	148	71%	0.711	79%	0.794	S	S	*	*			cis	-160.6	168	-11.2	-155.6	2.2	0	0	0	112.2
132	K	37.9	Very low	32.3	Very low	163 Å²	163	147.7 Å²	147.7	71%	0.709	80%	0.798	S	S	*	*			trans	77	98.2	158.4	-67.9	163.1	-168.5	173.7	0	121.8
133	T	31.8	Very low	32.5	Very low	128 Å²	128	146.1 Å²	146.1	79%	0.785	80%	0.796	S	S	*	*				50.1	126.5	127.7	58.4	0	0	0	0	119.8
134	T	32.1	Very low	32.6	Very low	136 Å²	136	144.5 Å²	144.5	83%	0.834	79%	0.794	S	S	*	*			cis	-158.3	141.3	44	-43.8	0	0	0	0	111.1
135	R	27	Very low	32.6	Very low	218 Å²	218	143.6 Å²	143.6	82%	0.823	79%	0.794	S	S	*	*			trans	-107.5	146.3	173.8	-87.8	-178.1	172.5	175.6	-1.7	111.4
136	L	27.8	Very low	32.6	Very low	152 Å²	152	143.3 Å²	143.3	80%	0.796	79%	0.794	S	S	*	*			trans	-127.3	119.2	151.9	-91.2	168.8	0	0	0	108.5	F138	L136-F138 HydrophobicContact CD2-CE2 3.82Å; L136-F138 HydrophobicContact CD2-CZ 4.09Å
137	I	29.8	Very low	32.7	Very low	127 Å²	127	142.2 Å²	142.2	65%	0.651	79%	0.788	S	S	*	*			trans	-130	128.9	171.6	-61.8	173.8	0	0	0	105.5
138	F	29.9	Very low	32.7	Very low	193 Å²	193	143.9 Å²	143.9	85%	0.846	80%	0.796	S	S	*	*			trans	-121.2	122.2	168.2	-75	-69	0	0	0	109.6	L136	L136-F138 HydrophobicContact CD2-CE2 3.82Å; L136-F138 HydrophobicContact CD2-CZ 4.09Å
139	G	25.7	Very low	32.6	Very low	68 Å²	68	145.6 Å²	145.6	70%	0.701	79%	0.791	S	S	*	*			trans	-155.1	130.3	166.6	0	0	0	0	0	108.8
140	L	33.6	Very low	32.3	Very low	154 Å²	154	148.2 Å²	148.2	81%	0.806	79%	0.792	S	S	*	*			trans	-172.4	104.2	170.7	-95.8	157.1	0	0	0	103.7
141	Q	34.4	Very low	32	Very low	183 Å²	183	152 Å²	152	86%	0.855	80%	0.797	S	S	*	*				71.4	139.4	90.3	-78.6	-177.1	-25.1	0	0	115.4
142	N	32	Very low	31.7	Very low	163 Å²	163	151 Å²	151	87%	0.872	80%	0.796	S	S	*	*			trans	-79.8	164.2	-159.2	-74.5	-25.9	0	0	0	115.2
143	P	37.1	Very low	31.3	Very low	117 Å²	117	150.2 Å²	150.2	76%	0.76	80%	0.804	S	S	*	*			trans	-101.3	178.8	-169	41.1	-37.1	0	0	0	114.1
144	P	37	Very low	31.3	Very low	123 Å²	123	152.7 Å²	152.7	80%	0.799	81%	0.807	S	S	*	*			trans	-117.2	149.4	156.9	36.4	-25.8	0	0	0	113.9
145	L	30	Very low	31.5	Very low	159 Å²	159	150.9 Å²	150.9	83%	0.832	80%	0.798	S	S	*	*			trans	-73.6	154.7	171.8	-67.9	85	0	0	0	111.8
146	N	33.9	Very low	31.7	Very low	166 Å²	166	147.8 Å²	147.8	89%	0.888	80%	0.798	S	S	*	*			trans	-150.1	151.5	139.2	-139.8	-21.4	0	0	0	113.1
147	I	29.4	Very low	31.7	Very low	136 Å²	136	145 Å²	145	70%	0.697	79%	0.789	S	S	*	*			trans	-119.4	128.6	-167.1	-62.9	169.2	0	0	0	110.4
148	T	35.5	Very low	31.8	Very low	143 Å²	143	147.5 Å²	147.5	88%	0.877	80%	0.796	S	S	*	*			trans	-147.6	154.1	159	21.8	0	0	0	0	112.4
149	K	33.6	Very low	31.8	Very low	192 Å²	192	146 Å²	146	84%	0.835	79%	0.793	S	S	*	*			trans	-92.7	144.5	-159.7	-99.5	174.5	171.6	174.9	0	115.7
150	L	26.8	Very low	32	Very low	142 Å²	142	148.3 Å²	148.3	74%	0.743	79%	0.793	S	S	*	*			trans	28.4	127.8	134.5	-88.3	149.8	0	0	0	121	T152	L150-T152 HydrophobicContact CD2-CG2 4.04Å
151	Q	31	Very low	32.2	Very low	195 Å²	195	147.8 Å²	147.8	91%	0.911	80%	0.797	S	S	*	*				-148	145.9	124.7	-147.5	166.9	6.6	0	0	112
152	T	28.7	Very low	32.1	Very low	112 Å²	112	148.6 Å²	148.6	69%	0.687	80%	0.798	S	S	*	*			trans	-107.3	146.1	-171.2	39.1	0	0	0	0	112.9	L150	L150-T152 HydrophobicContact CD2-CG2 4.04Å
153	V	30.8	Very low	32.2	Very low	147 Å²	147	151 Å²	151	89%	0.891	80%	0.8	S	S	*	*			trans	-134.3	130.8	155.4	-177.9	0	0	0	0	107.7
154	Q	31.3	Very low	32	Very low	181 Å²	181	148.8 Å²	148.8	85%	0.846	80%	0.799	S	S	*	*			trans	-123.4	-179.4	-177.3	-126.6	-144.8	-20.4	0	0	109.9
155	P	36.5	Very low	31.8	Very low	98 Å²	98	155 Å²	155	64%	0.636	81%	0.806	S	S	*	*				-125.4	-174.8	-127.8	40.5	-21.1	0	0	0	114
156	D	30.9	Very low	31.6	Very low	153 Å²	153	155.7 Å²	155.7	82%	0.818	81%	0.81	S	S	*	*			trans	-165.7	161.1	160.9	-102.3	-28.8	0	0	0	108.9
157	C	27.7	Very low	31.5	Very low	92 Å²	92	156.4 Å²	156.4	62%	0.622	81%	0.813	S	S	*	*			cis	-173.8	155.4	-42.7	-130	0	0	0	0	108.9
158	K	32.4	Very low	31.4	Very low	181 Å²	181	161.3 Å²	161.3	79%	0.787	82%	0.822	S	S	*	*			trans	70.3	154.1	161.5	-56.9	155.6	-172.5	168.9	0	116.2
159	M	30.5	Very low	30.9	Very low	160 Å²	160	158.1 Å²	158.1	79%	0.788	81%	0.811	S	S	*	*			cis	-158.4	139.1	-14.7	-111.2	172.8	80.7	0	0	112.3
160	V	29.1	Very low	30.7	Very low	117 Å²	117	158.1 Å²	158.1	71%	0.709	81%	0.811	S	S	*	*			trans	18.1	129.5	137.2	-163.6	0	0	0	0	120.6
161	T	37.1	Very low	30.9	Very low	143 Å²	143	157 Å²	157	88%	0.877	82%	0.815	S	S	*	*				-177.3	163.8	112	29.4	0	0	0	0	115.1
162	K	32.6	Very low	30.8	Very low	201 Å²	201	156.5 Å²	156.5	87%	0.874	81%	0.813	S	S	*	*			trans	-104.7	160.1	-168.7	-105	177.4	179.2	170.7	0	113.4
163	K	35.5	Very low	30.7	Very low	212 Å²	212	156.5 Å²	156.5	92%	0.922	82%	0.817	S	S	*	*			trans	77.8	115.3	161.5	-72.3	-179.3	174.4	178.4	0	118.5
164	G	30.9	Very low	30.8	Very low	71 Å²	71	155.2 Å²	155.2	73%	0.732	81%	0.814	S	S	*	*				126.9	132.3	123.4	0	0	0	0	0	117.1
165	R	33.2	Very low	30.8	Very low	255 Å²	255	150.3 Å²	150.3	96%	0.962	80%	0.804	S	S	*	*			trans	74.6	135.4	166.2	-64.7	-177.9	170.2	173.7	-3.4	118.2
166	L	26.9	Very low	30.7	Very low	172 Å²	172	152.3 Å²	152.3	90%	0.901	81%	0.814	S	S	*	*			trans	-56.2	136.2	163	-70.3	148.6	0	0	0	110.5
167	L	30.9	Very low	30.8	Very low	181 Å²	181	153.8 Å²	153.8	95%	0.948	81%	0.814	S	S	*	*			trans	-160.5	137.1	140.2	-106.6	158.7	0	0	0	108.8
168	R	26.6	Very low	31	Very low	239 Å²	239	155.2 Å²	155.2	90%	0.902	82%	0.823	S	S	*	*			trans	-113.2	106	178.9	174.3	-161.6	-153.8	169.4	8	107.1
169	A	26.2	Very low	31.1	Very low	77 Å²	77	150.9 Å²	150.9	64%	0.636	82%	0.821	S	S	*	*			trans	-175	162	151.1	0	0	0	0	0	113.1
170	F	29.5	Very low	31.4	Very low	192 Å²	192	147.7 Å²	147.7	84%	0.842	82%	0.815	S	S	*	*			trans	68.9	104.1	161.3	-58.1	-63.6	0	0	0	120.2
171	S	30.5	Very low	31.8	Very low	119 Å²	119	151 Å²	151	83%	0.832	82%	0.822	S	S	*	*			trans	-74.8	136.9	141.7	51.7	0	0	0	0	110.2
172	E	28.1	Very low	31.9	Very low	184 Å²	184	149.9 Å²	149.9	86%	0.86	82%	0.815	S	S	*	*			trans	-126.1	149.1	169.8	-90.8	-169.2	162.5	0	0	112.6
173	S	28.3	Very low	32.1	Very low	111 Å²	111	145.3 Å²	145.3	78%	0.776	81%	0.809	S	S	*	*			trans	86.9	141.4	148	-148	0	0	0	0	121.8
174	C	31.9	Very low	32.3	Very low	121 Å²	121	139.6 Å²	139.6	82%	0.818	80%	0.796	S	S	*	*			trans	86	129.9	167.8	-56.6	0	0	0	0	118.1
175	A	31.3	Very low	32.6	Very low	78 Å²	78	143.8 Å²	143.8	65%	0.645	80%	0.799	S	S	*	*			cis	-170.7	172.5	-18.6	0	0	0	0	0	108.7
176	T	35	Very low	32.9	Very low	139 Å²	139	135.7 Å²	135.7	85%	0.853	78%	0.782	S	S	*	*			trans	72.6	145.1	164.5	72.3	0	0	0	0	118
177	K	31.8	Very low	33.5	Very low	185 Å²	185	134.3 Å²	134.3	80%	0.804	77%	0.771	S	S	*	*			cis	-169.5	161.3	-21.9	-160.8	176.2	-174.5	-179.9	0	108.9
178	C	32.9	Very low	33.9	Very low	121 Å²	121	132.8 Å²	132.8	82%	0.818	76%	0.758	S	S	*	*			trans	70.5	147.5	171.3	-50.5	0	0	0	0	115.3
179	A	35	Very low	34.4	Very low	91 Å²	91	127.2 Å²	127.2	75%	0.752	75%	0.747	S	S	*	*			cis	168.6	154.9	-8.4	0	0	0	0	0	103.9
180	S	36.7	Very low	35	Very low	93 Å²	93	128 Å²	128	65%	0.65	75%	0.747	S	S	*	*			cis	-177.5	136.5	-8.7	48.6	0	0	0	0	110.5
181	H	37.9	Very low	35.4	Very low	185 Å²	185	126.6 Å²	126.6	86%	0.856	74%	0.744	S	S	*	*			trans	59.9	160.7	159.6	-51.4	-64.1	0	0	0	118.9
182	T	37.9	Very low	35.9	Very low	120 Å²	120	127.2 Å²	127.2	74%	0.736	74%	0.736	S	S	*	*			cis	-145.2	161.6	9.7	45.3	0	0	0	0	112.4
183	S	37.3	Very low	36.3	Very low	105 Å²	105	122.8 Å²	122.8	73%	0.734	73%	0.726	S	S	*	*			trans	56.2	146	143.7	58.4	0	0	0	0	122.2
184	S	38.9	Very low	36.8	Very low	93 Å²	93	123.9 Å²	123.9	65%	0.65	72%	0.723	S	S	*	*			cis	179	146	-11.2	50.7	0	0	0	0	110.9
185	I	38.8	Very low	37	Very low	158 Å²	158	124.7 Å²	124.7	81%	0.81	72%	0.719	S	S	*	*			trans	56.6	137.2	134.4	-62.4	170.8	0	0	0	119
186	S	38.2	Very low	37.2	Very low	85 Å²	85	129.9 Å²	129.9	59%	0.594	73%	0.727	S	S	*	*			cis	180	176.8	-11.4	58.6	0	0	0	0	111
187	H	39.5	Very low	37.2	Very low	144 Å²	144	132.9 Å²	132.9	67%	0.667	73%	0.728	S	S	*	*			trans	68.1	119.3	162.1	-78.2	-84.8	0	0	0	119
188	E	39.2	Very low	37.3	Very low	148 Å²	148	128.8 Å²	128.8	69%	0.692	72%	0.723	S	S	*	*				76.2	144.9	84	-76.3	-168.3	161	0	0	114
189	N	38.6	Very low	37.4	Very low	122 Å²	122	130.6 Å²	130.6	65%	0.652	72%	0.723	S	S	*	*			cis	-160.1	172.8	3	-113.4	-25	0	0	0	110.7
190	S	38	Very low	37.4	Very low	93 Å²	93	131.9 Å²	131.9	65%	0.65	73%	0.726	S	S	*	*			trans	18.3	152.6	149.3	60.3	0	0	0	0	122.8
191	E	38.3	Very low	37.7	Very low	164 Å²	164	132 Å²	132	77%	0.766	73%	0.727	S	S	*	*			cis	-174.3	164.8	3.5	-114.1	177.3	163.5	0	0	112.6
192	I	39.4	Very low	37.9	Very low	132 Å²	132	129.4 Å²	129.4	68%	0.677	72%	0.719	S	S	*	*			trans	66.3	97.6	139.5	-65.5	167.5	0	0	0	121.8
193	S	37.6	Very low	38.1	Very low	91 Å²	91	131.1 Å²	131.1	64%	0.636	72%	0.719	S	S	*	*				100.5	142	117.9	86	0	0	0	0	125.1
194	N	38.3	Very low	38.1	Very low	134 Å²	134	133.2 Å²	133.2	72%	0.717	72%	0.718	S	S	*	*			trans	75.6	107.9	136.7	-69.8	-20.9	0	0	0	123.7
195	N	35.6	Very low	38	Very low	138 Å²	138	133.6 Å²	133.6	74%	0.738	72%	0.716	S	S	*	*				83.9	136.8	123.7	-76.8	-36.5	0	0	0	123.4
196	K	37.4	Very low	38	Very low	186 Å²	186	133.1 Å²	133.1	81%	0.809	71%	0.71	S	S	*	*			trans	73.2	99.9	149.2	-72.1	173.4	178.7	175.4	0	121
197	K	33.9	Very low	38.1	Very low	202 Å²	202	138.2 Å²	138.2	88%	0.878	72%	0.722	S	S	*	*				50.5	106.4	107	-169.7	-172	-172.2	-175.9	0	118.8
198	S	34.4	Very low	37.8	Very low	100 Å²	100	134.4 Å²	134.4	70%	0.699	72%	0.721	S	S	*	*			trans	171.8	127.2	133.2	45.8	0	0	0	0	110.6
199	I	33.8	Very low	37.8	Very low	159 Å²	159	135.2 Å²	135.2	82%	0.815	73%	0.729	S	S	*	*				97.7	150.3	91.2	-72.3	172.1	0	0	0	113.2
200	S	36.6	Very low	37.7	Very low	117 Å²	117	138 Å²	138	82%	0.818	74%	0.737	S	S	*	*			trans	76.7	135.5	-178.6	75.7	0	0	0	0	114.5
201	S	41.5	Very low	37.5	Very low	97 Å²	97	140.7 Å²	140.7	68%	0.678	74%	0.744	S	S	*	*			cis	-144.6	-176.1	-3.3	72	0	0	0	0	110.2
202	D	41.8	Very low	37.7	Very low	129 Å²	129	137.1 Å²	137.1	69%	0.69	74%	0.735	S	S	*	*			cis	-155.2	-173.4	13.8	-130.9	-42.6	0	0	0	115.4
203	Q	42.7	Very low	37.5	Very low	157 Å²	157	139.5 Å²	139.5	73%	0.734	74%	0.74	S	S	*	*			trans	-47.8	163.4	163.1	-70.3	174.2	-21.2	0	0	115.8
204	E	37.3	Very low	37.4	Very low	149 Å²	149	142.3 Å²	142.3	70%	0.696	75%	0.747	S	S	*	*			cis	-162.3	160.6	8.3	-129.8	-175.8	146.6	0	0	113.2
205	T	37.8	Very low	37.4	Very low	100 Å²	100	139.9 Å²	139.9	61%	0.613	74%	0.741	S	S	*	*			trans	25.7	151.4	143.1	59.4	0	0	0	0	122.5
206	Q	39	Very low	37.5	Very low	149 Å²	149	140.1 Å²	140.1	70%	0.696	74%	0.742	S	S	*	*			cis	-170.5	167.7	-3.8	-120.2	178.5	26.3	0	0	110.7
207	K	38.7	Very low	37.5	Very low	192 Å²	192	135.3 Å²	135.3	84%	0.835	73%	0.732	S	S	*	*			trans	66	127.8	164.4	-62.4	160.5	-174.6	176.1	0	116.5
208	G	34.5	Very low	37.6	Very low	64 Å²	64	132.3 Å²	132.3	66%	0.66	73%	0.725	S	S	*	*			cis	125.2	140.5	-4.8	0	0	0	0	0	113.3
209	I	38.8	Very low	37.8	Very low	165 Å²	165	134.5 Å²	134.5	85%	0.846	73%	0.729	S	S	*	*			trans	76.7	132.1	164.3	-48.8	166	0	0	0	113.4
210	H	36	Very low	37.9	Very low	179 Å²	179	131.8 Å²	131.8	83%	0.829	73%	0.73	S	S	*	*			cis	-141.5	152.3	12.1	-136.2	-68.9	0	0	0	113
211	L	33.6	Very low	37.7	Very low	150 Å²	150	129.1 Å²	129.1	79%	0.785	72%	0.721	S	S	*	*			trans	-104.6	-171.4	171.8	-88.8	155	0	0	0	109.5
212	P	42.7	Very low	37.4	Very low	89 Å²	89	132 Å²	132	58%	0.578	73%	0.729	S	S	*	*			cis	-144.6	-160.4	-38.6	36	-14.2	0	0	0	115
213	K	35.2	Very low	37	Very low	183 Å²	183	132.8 Å²	132.8	80%	0.796	73%	0.732	S	S	*	*			trans	87	146.8	157.4	-65.6	156.3	179	-176.3	0	116.5
214	L	36.1	Very low	36.4	Very low	149 Å²	149	133.2 Å²	133.2	78%	0.78	73%	0.734	S	S	*	*			cis	-130	139.8	18.7	-72.2	161.8	0	0	0	110.6
215	S	37.2	Very low	36.2	Very low	84 Å²	84	133.3 Å²	133.3	59%	0.587	74%	0.738	S	S	*	*				72.7	136.5	84.8	107.8	0	0	0	0	113.3
216	D	38.2	Very low	35.8	Very low	143 Å²	143	139.2 Å²	139.2	77%	0.765	75%	0.75	S	S	*	*			cis	-146.5	159.6	12.2	-83.1	-59.5	0	0	0	115.8
217	S	36.8	Very low	35.6	Very low	84 Å²	84	136.1 Å²	136.1	59%	0.587	74%	0.744	S	S	*	*			trans	-43.8	153.3	168.5	54.8	0	0	0	0	118.9
218	N	37.5	Very low	35.2	Very low	139 Å²	139	133.8 Å²	133.8	74%	0.743	74%	0.741	S	S	*	*				167	157.4	96.7	-86.3	-44.6	0	0	0	109.1
219	L	37.1	Very low	34.9	Very low	147 Å²	147	135.2 Å²	135.2	77%	0.77	74%	0.741	S	S	*	*			cis	-164.6	144	-8.5	-130.4	156.2	0	0	0	109
220	A	36.3	Very low	34.6	Very low	101 Å²	101	134.2 Å²	134.2	84%	0.835	74%	0.742	S	S	*	*			trans	57.6	148.5	162.7	0	0	0	0	0	120.3
221	G	33.5	Very low	34.3	Very low	62 Å²	62	134.8 Å²	134.8	64%	0.639	74%	0.743	S	S	*	*			cis	152	138.6	-6.8	0	0	0	0	0	112.9
222	N	35.4	Very low	34.2	Very low	156 Å²	156	137.2 Å²	137.2	83%	0.834	75%	0.747	S	S	*	*			trans	79	143.9	167.9	-51.5	-30.9	0	0	0	118.6
223	L	32.6	Very low	33.7	Very low	147 Å²	147	139.1 Å²	139.1	77%	0.77	75%	0.752	S	S	*	*			cis	-157.8	152.9	-14.5	-115.6	168.7	0	0	0	111.6
224	H	30.6	Very low	33.5	Very low	166 Å²	166	139.6 Å²	139.6	77%	0.769	76%	0.755	S	S	*	*			trans	-59.4	159.3	178.4	-73.9	-104.9	0	0	0	117.8
225	L	31.7	Very low	33.1	Very low	150 Å²	150	137.3 Å²	137.3	79%	0.785	75%	0.751	S	S	*	*				-162.3	114.7	122.4	-124.6	62.7	0	0	0	109.2
226	W	30.6	Very low	32.8	Very low	225 Å²	225	140 Å²	140	85%	0.852	76%	0.758	S	S	*	*				66.9	140.5	86.6	-113.7	-11.2	0	0	0	113.8
227	S	34.1	Very low	32.5	Very low	84 Å²	84	142.3 Å²	142.3	59%	0.587	76%	0.761	S	S	*	*			cis	-164.1	158.9	3.4	76.9	0	0	0	0	111.4
228	N	29.9	Very low	32.1	Very low	142 Å²	142	149.7 Å²	149.7	76%	0.759	78%	0.776	S	S	*	*				41.4	154.9	129.8	-59	-12.5	0	0	0	121.3
229	S	28.1	Very low	31.7	Very low	95 Å²	95	147.6 Å²	147.6	66%	0.664	77%	0.773	S	S	*	*			cis	175.8	136.9	-12.7	165	0	0	0	0	106.3
230	T	33.5	Very low	31.5	Very low	143 Å²	143	147.3 Å²	147.3	88%	0.877	77%	0.768	S	S	*	*			trans	-169.5	129.8	134.5	12.3	0	0	0	0	111.4
231	K	28.9	Very low	31.3	Very low	192 Å²	192	150 Å²	150	84%	0.835	76%	0.761	S	S	*	*			trans	-89.1	149.3	172.2	-60.9	166.2	179.6	171.1	0	109
232	F	31.4	Very low	31.1	Very low	201 Å²	201	152.1 Å²	152.1	88%	0.882	77%	0.765	S	S	*	*			trans	-137.8	152	145.6	-115.7	-85.8	0	0	0	111.2
233	N	32.3	Very low	30.9	Very low	128 Å²	128	152.2 Å²	152.2	68%	0.684	77%	0.765	S	S	*	*			trans	-68.5	146.2	-159.6	-64.6	-58.4	0	0	0	113.6
234	K	30.9	Very low	31	Very low	194 Å²	194	149.9 Å²	149.9	84%	0.843	76%	0.761	S	S	*	*				53.7	94	66.7	-100.9	-166.2	-178.7	-173.3	0	113.4
235	S	29.1	Very low	31	Very low	100 Å²	100	146.6 Å²	146.6	70%	0.699	76%	0.757	S	S	*	*				169.9	143.1	119.6	58	0	0	0	0	112.2
236	L	29.2	Very low	31.1	Very low	140 Å²	140	145.3 Å²	145.3	73%	0.733	76%	0.758	S	S	*	*			trans	65.6	139.1	160.1	-60.8	151.8	0	0	0	115.9
237	F	32	Very low	31.7	Very low	192 Å²	192	139.1 Å²	139.1	84%	0.842	75%	0.748	S	S	*	*			cis	-127.6	143.3	14.9	-90.5	-93.5	0	0	0	113
238	R	30.1	Very low	32	Very low	239 Å²	239	142.9 Å²	142.9	90%	0.902	76%	0.757	S	S	*	*			trans	-124.2	122.1	159.5	175.6	-179.9	179.9	-177.5	1.1	107.8
239	S	28.3	Very low	33.4	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	75%	0.746	S	S	*	*			trans	72.7	150	163	-146.5	0	0	0	0	119.3
240	E	32.1	Very low	34.6	Very low	140 Å²	140	139.9 Å²	139.9	65%	0.654	74%	0.743	S	S	*	*			trans	88.7	108.9	156.5	-52.1	-137	146.3	0	0	121.2
241	K	32.9	Very low	35.2	Very low	159 Å²	159	142.5 Å²	142.5	69%	0.691	74%	0.737	S	S	*	*			trans	73	103.1	131.6	-64.1	166.6	-173.2	154.9	0	119.6
242	S	29.1	Very low	36.4	Very low	105 Å²	105	136 Å²	136	73%	0.734	72%	0.716	S	S	*	*			trans	87.2	147	131.7	78.2	0	0	0	0	120.6
243	L	32.3	Very low	37.5	Very low	158 Å²	158	130.1 Å²	130.1	83%	0.827	69%	0.691	S	S	*	*			trans	81.1	101.2	159.8	-60	162	0	0	0	120.1
244	S	33.5	Very low	38.4	Very low	99 Å²	99	127.2 Å²	127.2	69%	0.692	68%	0.677	S	S	*	*			trans	55.2	108	137	57.9	0	0	0	0	122.7
245	S	31.4	Very low	39.7	Very low	96 Å²	96	125.4 Å²	125.4	67%	0.671	67%	0.669	S	S	*	*			trans	36.5	126.6	131	60.8	0	0	0	0	121.9
246	P	33.7	Very low	41	Very low	124 Å²	124	127.2 Å²	127.2	81%	0.805	66%	0.661	S	S	*	*			trans	-140.4	25.9	131.7	37.5	-23	0	0	0	116.2
247	S	42.5	Very low	42	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	66%	0.657	S	S	*	*			trans	-90.5	-5.1	-172	54.9	0	0	0	0	117.6
248	E	41.6	Very low	42.7	Very low	163 Å²	163	125.1 Å²	125.1	76%	0.762	65%	0.645	S	S	*	*	H	α-helix	trans	-74.2	-23.4	-176.6	-81.3	-172.5	123.5	0	0	115	V250 S252	E248-V250 PolarHBondContact O-N 2.94Å; E248-S252 PolarHBondContact O-N 3.47Å
249	S	57.7	Low	43.7	Very low	77 Å²	77	116.6 Å²	116.6	54%	0.538	62%	0.623	S	S	.	*	H	α-helix	trans	-63.7	-44.4	-171.3	60.2	0	0	0	0	113.2	W251 S252 E253	S249-W251 PolarHBondContact O-N 3.46Å; S249-S252 PolarHBondContact O-N 3.27Å; S249-S252 PolarHBondContact O-OG 2.93Å; S249-E253 PolarHBondContact O-N 3.47Å
250	V	54.7	Low	44.8	Very low	98 Å²	98	115.3 Å²	115.3	59%	0.594	61%	0.614	S	S	*	*	H	α-helix	trans	-64.7	-41.6	-175.8	-178.4	0	0	0	0	112	E248 E253 V254	E248-V250 PolarHBondContact O-N 2.94Å; V250-E253 PolarHBondContact O-N 3.25Å; V250-V254 WeakPolarHBondContact O-CG2 3.18Å; V250-V254 PolarHBondContact O-N 2.99Å; V250-V254 VanDerWaalsContact O-N 3.11Å
251	W	46.5	Very low	45.7	Very low	198 Å²	198	111.8 Å²	111.8	75%	0.75	60%	0.602	S	S	*	*	H	α-helix	trans	-67.9	-35.2	177.6	-82	107.3	0	0	0	112.5	S249 E253 V254 K255	S249-W251 PolarHBondContact O-N 3.46Å; W251-E253 VanDerWaalsContact C-N 3.29Å; W251-E253 PolarHBondContact O-N 2.91Å; W251-V254 PolarHBondContact O-N 2.95Å; W251-K255 VanDerWaalsContact O-CB 3.3Å; W251-K255 WeakPolarHBondContact O-CB 3.38Å; W251-K255 PolarHBondContact O-N 2.72Å
252	S	53	Low	46.5	Very low	56 Å²	56	110.9 Å²	110.9	39%	0.392	60%	0.6	S	S	.	*	H	α-helix	trans	-63.8	-35	174.7	82.4	0	0	0	0	112.4	E248 S249 R256	E248-S252 PolarHBondContact O-N 3.47Å; S249-S252 PolarHBondContact O-N 3.27Å; S249-S252 PolarHBondContact O-OG 2.93Å; S252-R256 PolarHBondContact O-N 3.31Å
253	E	54.6	Low	47.6	Very low	77 Å²	77	114.2 Å²	114.2	36%	0.36	60%	0.601	S	S	.	*	H	α-helix	trans	-70.9	-45.7	177.5	-163.8	63.3	-136.6	0	0	111.8	S249 V250 W251 K255 R256 R257	S249-E253 PolarHBondContact O-N 3.47Å; V250-E253 PolarHBondContact O-N 3.25Å; W251-E253 VanDerWaalsContact C-N 3.29Å; W251-E253 PolarHBondContact O-N 2.91Å; E253-K255 VanDerWaalsContact C-N 3.33Å; E253-K255 PolarHBondContact O-N 3.44Å; E253-R256 PolarHBondContact O-N 2.83Å; E253-R256 IonicContact OE1-CZ 3.94Å; E253-R256 IonicContact OE1-NH1 2.96Å; E253-R256 PolarHBondContact OE1-NH1 3.35Å; E253-R256 IonicContact OE2-CZ 3.15Å; E253-R256 IonicContact OE2-NH1 2.72Å; E253-R256 PolarHBondContact OE2-NH1 2.88Å; E253-R256 IonicContact OE2-NH2 2.76Å; E253-R256 PolarHBondContact OE2-NH2 2.81Å; E253-R257 PolarHBondContact O-N 3.3Å
254	V	52.2	Low	48.7	Very low	66 Å²	66	111.5 Å²	111.5	40%	0.4	59%	0.591	S	S	.	*	H	α-helix	trans	-61.3	-42.8	174.9	173.2	0	0	0	0	110.9	V250 W251 R257 L258	V250-V254 WeakPolarHBondContact O-CG2 3.18Å; V250-V254 PolarHBondContact O-N 2.99Å; V250-V254 VanDerWaalsContact O-N 3.11Å; W251-V254 PolarHBondContact O-N 2.95Å; V254-R257 PolarHBondContact O-N 2.92Å; V254-L258 HydrophobicContact CG1-CD1 4.05Å; V254-L258 PolarHBondContact O-N 3.33Å
255	K	57.4	Low	49.4	Very low	156 Å²	156	113.4 Å²	113.4	68%	0.678	59%	0.587	S	S	*	*	H	α-helix	trans	-63	-44.3	176.7	-158.9	171.5	-172.6	179.1	0	111.3	W251 E253 R257 L258 S259	W251-K255 VanDerWaalsContact O-CB 3.3Å; W251-K255 WeakPolarHBondContact O-CB 3.38Å; W251-K255 PolarHBondContact O-N 2.72Å; E253-K255 VanDerWaalsContact C-N 3.33Å; E253-K255 PolarHBondContact O-N 3.44Å; K255-R257 VanDerWaalsContact C-N 3.32Å; K255-R257 PolarHBondContact O-N 2.84Å; K255-L258 PolarHBondContact O-N 3.43Å; K255-S259 PolarHBondContact O-N 2.79Å; K255-S259 PolarHBondContact O-OG 3.32Å; K255-S259 VanDerWaalsContact O-OG 3.12Å
256	R	56.1	Low	50.6	Low	138 Å²	138	112.4 Å²	112.4	52%	0.521	57%	0.574	S	S	.	*	H	α-helix	trans	-58.5	-39.5	173.9	-111.7	-177.1	-65.1	110.5	6.1	112.9	S252 E253 S260	S252-R256 PolarHBondContact O-N 3.31Å; E253-R256 PolarHBondContact O-N 2.83Å; E253-R256 IonicContact OE1-CZ 3.94Å; E253-R256 IonicContact OE1-NH1 2.96Å; E253-R256 PolarHBondContact OE1-NH1 3.35Å; E253-R256 IonicContact OE2-CZ 3.15Å; E253-R256 IonicContact OE2-NH1 2.72Å; E253-R256 PolarHBondContact OE2-NH1 2.88Å; E253-R256 IonicContact OE2-NH2 2.76Å; E253-R256 PolarHBondContact OE2-NH2 2.81Å; R256-S260 PolarHBondContact O-N 3.46Å
257	R	49.7	Very low	51.7	Low	176 Å²	176	109.8 Å²	109.8	66%	0.664	56%	0.557	S	S	*	*	H	α-helix	trans	-70.7	-40.1	177.4	-71.4	-170.3	177.8	-174.3	-1.7	112.6	E253 V254 K255 S260 T261	E253-R257 PolarHBondContact O-N 3.3Å; V254-R257 PolarHBondContact O-N 2.92Å; K255-R257 VanDerWaalsContact C-N 3.32Å; K255-R257 PolarHBondContact O-N 2.84Å; R257-S260 WeakPolarHBondContact O-CB 3.45Å; R257-S260 PolarHBondContact O-N 3.3Å; R257-S260 VanDerWaalsContact O-N 3.14Å; R257-S260 PolarHBondContact O-OG 3.46Å; R257-T261 PolarHBondContact O-N 2.92Å
258	L	48.1	Very low	52.3	Low	112 Å²	112	109 Å²	109	59%	0.586	55%	0.548	S	S	*	.	H	α-helix	trans	-63.6	-42	173.7	-77	163.5	0	0	0	112.5	V254 K255 S260 T261 E262	V254-L258 HydrophobicContact CG1-CD1 4.05Å; V254-L258 PolarHBondContact O-N 3.33Å; K255-L258 PolarHBondContact O-N 3.43Å; L258-S260 PolarHBondContact O-N 3.37Å; L258-T261 PolarHBondContact O-N 3.36Å; L258-T261 PolarHBondContact O-OG1 3.31Å; L258-E262 PolarHBondContact O-N 3.41Å
259	S	50.6	Low	52.8	Low	61 Å²	61	106.7 Å²	106.7	43%	0.427	54%	0.539	S	S	.	.	H	α-helix	trans	-61.4	-23.8	173.6	-59.6	0	0	0	0	113.5	K255	K255-S259 PolarHBondContact O-N 2.79Å; K255-S259 PolarHBondContact O-OG 3.32Å; K255-S259 VanDerWaalsContact O-OG 3.12Å
260	S	50.8	Low	52.8	Low	69 Å²	69	109.9 Å²	109.9	48%	0.483	54%	0.539	S	S	.	.	H	α-helix	trans	-75.4	-31.3	173.4	79.9	0	0	0	0	113	R256 R257 L258	R256-S260 PolarHBondContact O-N 3.46Å; R257-S260 WeakPolarHBondContact O-CB 3.45Å; R257-S260 PolarHBondContact O-N 3.3Å; R257-S260 VanDerWaalsContact O-N 3.14Å; R257-S260 PolarHBondContact O-OG 3.46Å; L258-S260 PolarHBondContact O-N 3.37Å
261	T	51.4	Low	52.9	Low	65 Å²	65	110.6 Å²	110.6	40%	0.399	54%	0.539	S	S	.	.	H	α-helix	trans	-75.2	-28.5	178.5	54.5	0	0	0	0	113.1	R257 L258 K263 V264 F265	R257-T261 PolarHBondContact O-N 2.92Å; L258-T261 PolarHBondContact O-N 3.36Å; L258-T261 PolarHBondContact O-OG1 3.31Å; T261-K263 VanDerWaalsContact C-N 3.26Å; T261-K263 PolarHBondContact O-N 3.05Å; T261-V264 WeakPolarHBondContact O-CB 3.22Å; T261-V264 PolarHBondContact O-N 2.76Å; T261-F265 WeakPolarHBondContact O-CD2 3.43Å; T261-F265 PolarHBondContact O-N 3.02Å
262	E	49.1	Very low	52.5	Low	140 Å²	140	106.9 Å²	106.9	65%	0.654	53%	0.533	S	S	*	.	H	α-helix	trans	-57.7	-39.8	177.9	-161.2	165.1	-147.9	0	0	111.7	L258 V264 F265 D266	L258-E262 PolarHBondContact O-N 3.41Å; E262-V264 PolarHBondContact O-N 2.95Å; E262-F265 PolarHBondContact O-N 2.7Å; E262-D266 PolarHBondContact O-N 3.42Å; E262-D266 VanDerWaalsContact O-N 3.16Å
263	K	53	Low	52.4	Low	175 Å²	175	108.6 Å²	108.6	76%	0.761	54%	0.544	S	S	*	.	H	α-helix	trans	-65	-18.3	174.6	-63.3	-172.1	178.2	-174.7	0	114.8	T261	T261-K263 VanDerWaalsContact C-N 3.26Å; T261-K263 PolarHBondContact O-N 3.05Å
264	V	54.5	Low	52.2	Low	102 Å²	102	109.6 Å²	109.6	62%	0.618	56%	0.556	S	S	*	*	H	α-helix	trans	-89.1	-32.1	179.6	-175.7	0	0	0	0	111.3	T261 E262	T261-V264 WeakPolarHBondContact O-CB 3.22Å; T261-V264 PolarHBondContact O-N 2.76Å; E262-V264 PolarHBondContact O-N 2.95Å
265	F	49.1	Very low	51.7	Low	138 Å²	138	111.1 Å²	111.1	61%	0.605	57%	0.565	S	S	*	*	H	α-helix	trans	-85	-29.6	179.5	-79.5	-81.1	0	0	0	113.9	T261 E262 V268 M269	T261-F265 WeakPolarHBondContact O-CD2 3.43Å; T261-F265 PolarHBondContact O-N 3.02Å; E262-F265 PolarHBondContact O-N 2.7Å; F265-V268 WeakPolarHBondContact O-CB 3.4Å; F265-V268 PolarHBondContact O-N 2.8Å; F265-M269 PolarHBondContact O-N 3.34Å
266	D	55.3	Low	50.8	Low	75 Å²	75	108.9 Å²	108.9	40%	0.401	57%	0.567	S	S	.	*	H	α-helix	trans	-54.1	-41.9	-176.3	-171.6	27.4	0	0	0	114.2	E262 V268 M269 R270	E262-D266 PolarHBondContact O-N 3.42Å; E262-D266 VanDerWaalsContact O-N 3.16Å; D266-V268 VanDerWaalsContact C-N 3.35Å; D266-V268 PolarHBondContact O-N 3.37Å; D266-M269 PolarHBondContact O-N 3.13Å; D266-R270 WeakPolarHBondContact O-CB 3.08Å; D266-R270 PolarHBondContact O-N 2.87Å; D266-R270 IonicContact OD1-NE 3.76Å; D266-R270 IonicContact OD1-NH2 3.68Å; D266-R270 IonicContact OD2-CZ 3.7Å; D266-R270 IonicContact OD2-NH2 2.64Å; D266-R270 PolarHBondContact OD2-NH2 3.03Å
267	P	57.1	Low	49.9	Very low	69 Å²	69	110.2 Å²	110.2	45%	0.448	58%	0.583	S	S	.	*	H	α-helix	trans	-62.7	-36.7	174.3	-21.6	33.8	0	0	0	113.9	R270 I271	P267-R270 PolarHBondContact O-N 3.3Å; P267-I271 VanDerWaalsContact O-CG1 3.3Å; P267-I271 WeakPolarHBondContact O-CG1 3.39Å; P267-I271 PolarHBondContact O-N 2.95Å
268	V	56	Low	49.2	Very low	77 Å²	77	110.7 Å²	110.7	47%	0.467	59%	0.59	S	S	.	*	H	α-helix	trans	-70.8	-43.8	-179.2	-179.1	0	0	0	0	110.4	F265 D266 R270 I271 L272	F265-V268 WeakPolarHBondContact O-CB 3.4Å; F265-V268 PolarHBondContact O-N 2.8Å; D266-V268 VanDerWaalsContact C-N 3.35Å; D266-V268 PolarHBondContact O-N 3.37Å; V268-R270 VanDerWaalsContact C-N 3.32Å; V268-R270 PolarHBondContact O-N 3.45Å; V268-I271 PolarHBondContact O-N 2.89Å; V268-L272 HydrophobicContact CG1-CD1 4.41Å; V268-L272 WeakPolarHBondContact O-CG 3.38Å; V268-L272 PolarHBondContact O-N 3.48Å
269	M	51.1	Low	48.3	Very low	116 Å²	116	111.7 Å²	111.7	57%	0.571	60%	0.596	S	S	*	*	H	α-helix	trans	-64	-38.7	174.8	-65.6	-56.3	-65.5	0	0	111.4	F265 D266 L272 S273	F265-M269 PolarHBondContact O-N 3.34Å; D266-M269 PolarHBondContact O-N 3.13Å; M269-L272 PolarHBondContact O-N 2.83Å; M269-L272 HydrophobicContact SD-CD1 4.48Å; M269-S273 WeakPolarHBondContact O-CB 3.26Å; M269-S273 PolarHBondContact O-N 2.77Å; M269-S273 PolarHBondContact O-OG 2.8Å
270	R	58.6	Low	47.5	Very low	143 Å²	143	117.2 Å²	117.2	54%	0.54	62%	0.615	S	S	.	*	H	α-helix	trans	-61.6	-46	174	-122.6	177.8	-75.9	179.6	-7.3	112.1	D266 P267 V268 L272 S273 T274	D266-R270 WeakPolarHBondContact O-CB 3.08Å; D266-R270 PolarHBondContact O-N 2.87Å; D266-R270 IonicContact OD1-NE 3.76Å; D266-R270 IonicContact OD1-NH2 3.68Å; D266-R270 IonicContact OD2-CZ 3.7Å; D266-R270 IonicContact OD2-NH2 2.64Å; D266-R270 PolarHBondContact OD2-NH2 3.03Å; P267-R270 PolarHBondContact O-N 3.3Å; V268-R270 VanDerWaalsContact C-N 3.32Å; V268-R270 PolarHBondContact O-N 3.45Å; R270-L272 PolarHBondContact O-N 2.92Å; R270-S273 WeakPolarHBondContact CA-OG 3.47Å; R270-S273 PolarHBondContact O-N 2.92Å; R270-S273 PolarHBondContact O-OG 3.3Å; R270-T274 WeakPolarHBondContact O-CG2 3.21Å; R270-T274 PolarHBondContact O-N 2.85Å; R270-T274 VanDerWaalsContact O-N 3.12Å; R270-T274 PolarHBondContact O-OG1 2.84Å
271	I	56	Low	46.6	Very low	114 Å²	114	119.2 Å²	119.2	59%	0.585	63%	0.625	S	S	*	*	H	α-helix	trans	-57.5	-49.9	176.3	-70.4	163	0	0	0	110.8	P267 V268 S273 T274	P267-I271 VanDerWaalsContact O-CG1 3.3Å; P267-I271 WeakPolarHBondContact O-CG1 3.39Å; P267-I271 PolarHBondContact O-N 2.95Å; V268-I271 PolarHBondContact O-N 2.89Å; I271-S273 VanDerWaalsContact C-N 3.28Å; I271-S273 PolarHBondContact O-N 2.97Å; I271-T274 PolarHBondContact O-N 3.25Å; I271-T274 PolarHBondContact O-OG1 2.85Å
272	L	39.7	Very low	45.6	Very low	120 Å²	120	123.7 Å²	123.7	63%	0.628	65%	0.646	S	S	*	*	H	α-helix	trans	-60.4	-35.9	178.2	-69.3	171.3	0	0	0	112.6	V268 M269 R270 T274	V268-L272 HydrophobicContact CG1-CD1 4.41Å; V268-L272 WeakPolarHBondContact O-CG 3.38Å; V268-L272 PolarHBondContact O-N 3.48Å; M269-L272 PolarHBondContact O-N 2.83Å; M269-L272 HydrophobicContact SD-CD1 4.48Å; R270-L272 PolarHBondContact O-N 2.92Å; L272-T274 VanDerWaalsContact C-N 3.3Å; L272-T274 PolarHBondContact O-N 2.93Å
273	S	49.8	Very low	45	Very low	91 Å²	91	124.2 Å²	124.2	64%	0.636	65%	0.653	S	S	*	*	H	α-helix	trans	-73.6	-15.2	176.1	72.1	0	0	0	0	114.9	M269 R270 I271	M269-S273 WeakPolarHBondContact O-CB 3.26Å; M269-S273 PolarHBondContact O-N 2.77Å; M269-S273 PolarHBondContact O-OG 2.8Å; R270-S273 WeakPolarHBondContact CA-OG 3.47Å; R270-S273 PolarHBondContact O-N 2.92Å; R270-S273 PolarHBondContact O-OG 3.3Å; I271-S273 VanDerWaalsContact C-N 3.28Å; I271-S273 PolarHBondContact O-N 2.97Å
274	T	50	Low	44.1	Very low	98 Å²	98	123 Å²	123	60%	0.601	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-2.7	-176.7	53.6	0	0	0	0	115	R270 I271 L272 P276	R270-T274 WeakPolarHBondContact O-CG2 3.21Å; R270-T274 PolarHBondContact O-N 2.85Å; R270-T274 VanDerWaalsContact O-N 3.12Å; R270-T274 PolarHBondContact O-OG1 2.84Å; I271-T274 PolarHBondContact O-N 3.25Å; I271-T274 PolarHBondContact O-OG1 2.85Å; L272-T274 VanDerWaalsContact C-N 3.3Å; L272-T274 PolarHBondContact O-N 2.93Å; T274-P276 WeakPolarHBondContact O-CD 3.39Å
275	V	42.7	Very low	42.9	Very low	98 Å²	98	124 Å²	124	59%	0.594	66%	0.656	S	S	*	*			trans	-81.5	110	176.1	-177.8	0	0	0	0	109.3	L277	V275-L277 PolarHBondContact O-N 3.02Å
276	P	38.6	Very low	41.9	Very low	110 Å²	110	124.3 Å²	124.3	71%	0.714	67%	0.665	S	S	*	*			trans	-77.2	117.2	176.4	-2.7	22.2	0	0	0	107.9	T274 K278	T274-P276 WeakPolarHBondContact O-CD 3.39Å; P276-K278 VanDerWaalsContact C-N 3.31Å; P276-K278 PolarHBondContact O-N 2.78Å
277	L	36.5	Very low	40.8	Very low	166 Å²	166	127.1 Å²	127.1	87%	0.869	69%	0.685	S	S	*	*			trans	-72.1	87.2	177.8	-152.2	80.5	0	0	0	109.6	V275 N279	V275-L277 PolarHBondContact O-N 3.02Å; L277-N279 PolarHBondContact O-N 3.28Å
278	K	36.2	Very low	39.6	Very low	186 Å²	186	135 Å²	135	81%	0.809	71%	0.705	S	S	*	*			trans	-84.8	99.3	-172.2	-161.9	174.8	-174.7	-180	0	111.1	P276	P276-K278 VanDerWaalsContact C-N 3.31Å; P276-K278 PolarHBondContact O-N 2.78Å
279	N	29.1	Very low	38.4	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	71%	0.707	S	S	*	*			trans	53.8	85.1	159.6	-57.1	10.3	0	0	0	116.7	L277	L277-N279 PolarHBondContact O-N 3.28Å
280	Q	32.7	Very low	37.3	Very low	176 Å²	176	136.9 Å²	136.9	82%	0.822	72%	0.718	S	S	*	*			trans	-90.9	93.5	144	-90.3	179.4	-18.3	0	0	108.6
281	T	31.8	Very low	36.2	Very low	112 Å²	112	135.9 Å²	135.9	69%	0.687	72%	0.718	S	S	*	*			trans	-83	153.1	154.7	46.8	0	0	0	0	108.4
282	D	31.2	Very low	35.1	Very low	159 Å²	159	135.1 Å²	135.1	85%	0.85	72%	0.719	S	S	*	*	S	Bend	trans	78.1	41.7	179.9	-51.8	-15.3	0	0	0	117.2
283	L	36.8	Very low	35	Very low	151 Å²	151	135.8 Å²	135.8	79%	0.791	73%	0.728	S	S	*	*	S	Bend	trans	-140.7	103.8	152.8	-103.2	147.1	0	0	0	109	N285	L283-N285 PolarHBondContact O-N 3.03Å
284	D	33.7	Very low	34.7	Very low	150 Å²	150	135 Å²	135	80%	0.802	72%	0.717	S	S	*	*			trans	-65.4	113.1	-173.6	-85.3	-51.3	0	0	0	113.2
285	N	28.6	Very low	34.6	Very low	121 Å²	121	135.2 Å²	135.2	65%	0.647	72%	0.72	S	S	*	*	S	Bend	trans	51.3	117.3	138.6	-63.6	-47.7	0	0	0	120.2	L283	L283-N285 PolarHBondContact O-N 3.03Å
286	N	28.7	Very low	35.1	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	72%	0.719	S	S	*	*			trans	75.5	41	142.7	-58.5	-16.5	0	0	0	119.7
287	T	32.4	Very low	36.2	Very low	134 Å²	134	131.9 Å²	131.9	82%	0.822	69%	0.694	S	S	*	*			trans	-95.2	20.3	161.7	-13.9	0	0	0	0	115	T289	T287-T289 VanDerWaalsContact C-N 3.32Å; T287-T289 PolarHBondContact O-N 3.08Å
288	W	30.5	Very low	37.8	Very low	233 Å²	233	124.8 Å²	124.8	88%	0.883	66%	0.657	S	S	*	*	S	Bend	trans	-80.2	90	147.3	-70.2	97.9	0	0	0	107.1	N290	W288-N290 PolarHBondContact O-N 3.42Å
289	T	32.2	Very low	40	Very low	82 Å²	82	116.1 Å²	116.1	50%	0.503	62%	0.621	S	S	.	*			trans	-61.2	109.3	167.3	48.7	0	0	0	0	107.3	T287 F291	T287-T289 VanDerWaalsContact C-N 3.32Å; T287-T289 PolarHBondContact O-N 3.08Å; T289-F291 VanDerWaalsContact C-N 3.32Å; T289-F291 WeakPolarHBondContact O-CD2 3.22Å; T289-F291 PolarHBondContact O-N 2.83Å
290	N	28.1	Very low	42.7	Very low	152 Å²	152	111.2 Å²	111.2	81%	0.813	59%	0.594	S	S	*	*			trans	-61.8	97.8	173.9	-76.7	-32.4	0	0	0	108	W288 T292	W288-N290 PolarHBondContact O-N 3.42Å; N290-T292 VanDerWaalsContact C-N 3.34Å; N290-T292 PolarHBondContact O-N 2.94Å
291	F	34.3	Very low	45.4	Very low	121 Å²	121	102.9 Å²	102.9	53%	0.531	55%	0.554	S	S	.	*			trans	-62.9	97.8	174.8	-63	-73.9	0	0	0	108.1	T289 T293 H300	T289-F291 VanDerWaalsContact C-N 3.32Å; T289-F291 WeakPolarHBondContact O-CD2 3.22Å; T289-F291 PolarHBondContact O-N 2.83Å; F291-T293 PolarHBondContact O-N 3.15Å; F291-T293 VanDerWaalsContact O-N 3.15Å; F291-H300 AromaticContact CD1-NE2 3.76Å
292	T	33.9	Very low	48.2	Very low	98 Å²	98	97.5 Å²	97.5	60%	0.601	52%	0.522	S	S	*	.			trans	-65.2	116.2	166.6	50.6	0	0	0	0	105.8	N290 N294	N290-T292 VanDerWaalsContact C-N 3.34Å; N290-T292 PolarHBondContact O-N 2.94Å; T292-N294 PolarHBondContact O-N 2.87Å
293	T	36.4	Very low	51.2	Low	135 Å²	135	90 Å²	90	83%	0.828	48%	0.481	S	S	*	.			trans	-74	68.3	178.8	53.2	0	0	0	0	109.3	F291 P295	F291-T293 PolarHBondContact O-N 3.15Å; F291-T293 VanDerWaalsContact O-N 3.15Å; T293-P295 WeakPolarHBondContact O-CD 3.47Å
294	N	44.6	Very low	53.9	Low	74 Å²	74	83 Å²	83	40%	0.396	45%	0.446	S	S	.	.			trans	-69.4	115.9	176.9	-172.9	-4.4	0	0	0	107.3	T292 D296 T297	T292-N294 PolarHBondContact O-N 2.87Å; N294-D296 PolarHBondContact O-N 2.9Å; N294-T297 HydrophobicContact CB-CG2 4.12Å; N294-T297 PolarHBondContact O-N 3.37Å; N294-T297 PolarHBondContact O-OG1 2.89Å
295	P	48.2	Very low	56.7	Low	103 Å²	103	76 Å²	76	67%	0.669	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-12	-171	24.8	-35.7	0	0	0	113.8	T293 K497	T293-P295 WeakPolarHBondContact O-CD 3.47Å; P295-K497 PolarHBondContact O-NZ 2.56Å
296	D	52.6	Low	59.5	Low	107 Å²	107	72.1 Å²	72.1	57%	0.572	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-3.4	177.3	-66	-33.9	0	0	0	114.8	N294 K497	N294-D296 PolarHBondContact O-N 2.9Å; D296-K497 WeakPolarHBondContact O-CD 3.3Å; D296-K497 WeakPolarHBondContact O-CE 3.3Å; D296-K497 WeakPolarHBondContact O-CG 3.5Å
297	T	62.9	Low	62.5	Low	31 Å²	31	66.2 Å²	66.2	19%	0.19	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	142.2	170.7	59	0	0	0	0	111	N294 E494	N294-T297 HydrophobicContact CB-CG2 4.12Å; N294-T297 PolarHBondContact O-N 3.37Å; N294-T297 PolarHBondContact O-OG1 2.89Å; T297-E494 HydrophobicContact CG2-CB 4.27Å; T297-E494 HydrophobicContact CG2-CG 4.14Å; T297-E494 WeakPolarHBondContact CG2-OE2 3.35Å
298	N	69.6	Low	65.1	Low	16 Å²	16	63.1 Å²	63.1	9%	0.086	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	29.4	178.8	-110.2	7.4	0	0	0	111.9	I469 L495 K497	N298-I469 HydrophobicContact CB-CG2 3.93Å; N298-I469 PolarHBondContact ND2-O 3.4Å; N298-L495 PolarHBondContact N-O 3.17Å; N298-K497 HydrophobicContact CB-CG 4.01Å; N298-K497 WeakPolarHBondContact ND2-CG 3.49Å; N298-K497 WeakPolarHBondContact OD1-CE 3.49Å
299	G	82.5	Confident	67.7	Low	5 Å²	5	54.7 Å²	54.7	5%	0.052	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	102.6	-170.6	-171.3	0	0	0	0	0	112.7	I322 G323 L495	G299-I322 CarbonylContact C-O 3.52Å; G299-I322 VanDerWaalsContact CA-O 3.31Å; G299-I322 WeakPolarHBondContact CA-O 3.49Å; G299-G323 WeakPolarHBondContact CA-O 3.4Å; G299-L495 VanDerWaalsContact O-CB 3.29Å; G299-L495 WeakPolarHBondContact O-CB 3.4Å; G299-L495 PolarHBondContact O-N 2.76Å
300	H	85.3	Confident	70.1	Confident	30 Å²	30	57.1 Å²	57.1	14%	0.139	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.4	-174.2	-54.6	79.2	0	0	0	109.8	F291 L321 I322 W492 Q493	F291-H300 AromaticContact CD1-NE2 3.76Å; H300-L321 CarbonylContact O-C 3.2Å; H300-L321 VanDerWaalsContact O-CA 3.3Å; H300-L321 WeakPolarHBondContact O-CA 3.31Å; H300-I322 PolarHBondContact N-O 2.88Å; H300-I322 PolarHBondContact O-N 3.23Å; H300-W492 HydrophobicContact CB-CE3 3.94Å; H300-W492 HydrophobicContact CB-CZ3 4.23Å; H300-Q493 WeakPolarHBondContact CA-O 3.33Å
301	I	90.1	Very high	72.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.9	172.6	-177.3	161.4	0	0	0	110.7	F303 I318 L321 V344 L415 V417 T472 W492 Q493 L495	I301-F303 HydrophobicContact CG1-CD1 4.4Å; I301-F303 HydrophobicContact CG2-CD1 4.46Å; I301-I318 HydrophobicContact CD1-CD1 4.36Å; I301-I318 HydrophobicContact CD1-CG2 4.44Å; I301-L321 HydrophobicContact CB-CD2 3.44Å; I301-L321 VanDerWaalsContact CB-CD2 3.44Å; I301-L321 HydrophobicContact CD1-CD2 3.77Å; I301-L321 HydrophobicContact CG1-CD2 3.52Å; I301-V344 HydrophobicContact CD1-CG1 3.78Å; I301-V344 HydrophobicContact CD1-CG2 4.24Å; I301-L415 HydrophobicContact CD1-CB 4.18Å; I301-L415 HydrophobicContact CD1-CD1 3.88Å; I301-L415 HydrophobicContact CG1-CD1 4.44Å; I301-L415 HydrophobicContact CG2-CD1 4.42Å; I301-V417 HydrophobicContact CD1-CG2 4.37Å; I301-T472 HydrophobicContact CG2-CG2 3.51Å; I301-W492 WeakPolarHBondContact O-CA 3.23Å; I301-Q493 HydrophobicContact CG2-CB 4.1Å; I301-Q493 PolarHBondContact N-O 3.29Å; I301-Q493 PolarHBondContact O-N 2.86Å; I301-L495 HydrophobicContact CB-CD2 4.06Å; I301-L495 HydrophobicContact CG2-CD2 3.8Å; I301-L495 HydrophobicContact CG2-CG 4.5Å
302	C	90.8	Very high	75.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126.6	172.4	-177.7	0	0	0	0	109.3	N319 R320 I491 W492	C302-N319 HydrophobicContact CB-CB 4.28Å; C302-N319 PolarHBondContact O-N 3.43Å; C302-R320 HydrophobicContact CB-CG 3.75Å; C302-R320 WeakPolarHBondContact CB-O 3.31Å; C302-R320 PolarHBondContact N-O 3.27Å; C302-R320 PolarHBondContact O-N 3.49Å; C302-I491 WeakPolarHBondContact CA-O 3.2Å; C302-W492 HydrophobicContact CB-CD2 3.97Å; C302-W492 HydrophobicContact CB-CE3 3.79Å; C302-W492 HydrophobicContact CB-CH2 3.5Å; C302-W492 VanDerWaalsContact CB-CH2 3.5Å; C302-W492 HydrophobicContact CB-CZ2 3.68Å; C302-W492 HydrophobicContact CB-CZ3 3.56Å
303	F	93.6	Very high	77.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	157.3	174.9	60.6	-81.6	0	0	0	110.8	I301 L305 T317 I318 N319 L413 L415 Y474 N490 I491 Q493	I301-F303 HydrophobicContact CG1-CD1 4.4Å; I301-F303 HydrophobicContact CG2-CD1 4.46Å; F303-L305 HydrophobicContact CD2-CD2 3.98Å; F303-L305 HydrophobicContact CD2-CG 4.11Å; F303-L305 HydrophobicContact CE2-CD1 4.15Å; F303-L305 HydrophobicContact CE2-CD2 4.13Å; F303-L305 HydrophobicContact CE2-CG 4.06Å; F303-T317 CarbonylContact C-O 3.55Å; F303-T317 WeakPolarHBondContact CA-O 3.37Å; F303-T317 VanDerWaalsContact CB-O 3.24Å; F303-T317 WeakPolarHBondContact CB-O 3.46Å; F303-I318 HydrophobicContact CB-CD1 3.9Å; F303-N319 VanDerWaalsContact C-OD1 3.25Å; F303-N319 WeakPolarHBondContact CA-OD1 3.2Å; F303-L413 HydrophobicContact CD2-CD2 4.15Å; F303-L413 HydrophobicContact CE2-CD2 3.98Å; F303-L415 HydrophobicContact CD1-CD1 3.49Å; F303-L415 VanDerWaalsContact CD1-CD1 3.49Å; F303-L415 HydrophobicContact CD2-CD1 4.39Å; F303-L415 HydrophobicContact CE1-CD1 3.68Å; F303-L415 HydrophobicContact CG-CD1 3.88Å; F303-L415 HydrophobicContact CZ-CD1 4.21Å; F303-Y474 HydrophobicContact CE2-CD1 4.24Å; F303-Y474 HydrophobicContact CE2-CD2 4.36Å; F303-Y474 HydrophobicContact CE2-CG 4.06Å; F303-Y474 HydrophobicContact CZ-CD1 4.33Å; F303-Y474 AromaticContact CZ-CD2 3.75Å; F303-Y474 HydrophobicContact CZ-CD2 3.75Å; F303-Y474 HydrophobicContact CZ-CE2 4.42Å; F303-Y474 AromaticContact CZ-CG 3.69Å; F303-Y474 HydrophobicContact CZ-CG 3.69Å; F303-N490 CarbonylContact O-C 3.57Å; F303-I491 HydrophobicContact CD2-CB 4.36Å; F303-I491 HydrophobicContact CD2-CD1 4.31Å; F303-I491 HydrophobicContact CE1-CB 4.31Å; F303-I491 HydrophobicContact CE1-CG2 4.03Å; F303-I491 HydrophobicContact CE2-CB 4.04Å; F303-I491 HydrophobicContact CE2-CD1 3.85Å; F303-I491 HydrophobicContact CE2-CG2 4.05Å; F303-I491 HydrophobicContact CZ-CB 4Å; F303-I491 HydrophobicContact CZ-CD1 4.47Å; F303-I491 HydrophobicContact CZ-CG2 3.61Å; F303-I491 PolarHBondContact N-O 3.41Å; F303-I491 WeakPolarHBondContact O-CA 3.49Å; F303-I491 WeakPolarHBondContact O-CB 3.11Å; F303-I491 PolarHBondContact O-N 3.05Å; F303-Q493 HydrophobicContact CE1-CB 4.12Å; F303-Q493 HydrophobicContact CE1-CG 3.77Å; F303-Q493 HydrophobicContact CZ-CG 4.05Å
304	S	92.1	Very high	80.2	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	148.1	170.2	-69.4	0	0	0	0	110.4	T317 N319 M488 Q489 N490	S304-T317 PolarHBondContact N-O 3.35Å; S304-T317 PolarHBondContact O-N 3.35Å; S304-N319 PolarHBondContact N-OD1 3.16Å; S304-M488 CarbonylContact C-O 3.59Å; S304-M488 VanDerWaalsContact CA-O 3.28Å; S304-M488 WeakPolarHBondContact CA-O 3.31Å; S304-Q489 WeakPolarHBondContact OG-CA 3.29Å; S304-Q489 PolarHBondContact OG-OE1 2.87Å; S304-N490 PolarHBondContact OG-N 3.35Å; S304-N490 VanDerWaalsContact OG-N 3.08Å
305	L	93.4	Very high	82.3	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.7	171.3	-54.7	174.3	0	0	0	109.4	F303 L314 N315 V316 L413 Y474 L476 L481 M488 I491	F303-L305 HydrophobicContact CD2-CD2 3.98Å; F303-L305 HydrophobicContact CD2-CG 4.11Å; F303-L305 HydrophobicContact CE2-CD1 4.15Å; F303-L305 HydrophobicContact CE2-CD2 4.13Å; F303-L305 HydrophobicContact CE2-CG 4.06Å; L305-L314 HydrophobicContact CB-CD1 4.44Å; L305-N315 WeakPolarHBondContact CA-O 3.5Å; L305-V316 HydrophobicContact CD2-CB 4.16Å; L305-V316 HydrophobicContact CD2-CG1 3.89Å; L305-V316 HydrophobicContact CD2-CG2 3.73Å; L305-L413 HydrophobicContact CD2-CD2 3.83Å; L305-Y474 HydrophobicContact CD1-CD1 3.81Å; L305-Y474 HydrophobicContact CD1-CE1 3.41Å; L305-Y474 VanDerWaalsContact CD1-CE1 3.41Å; L305-L476 HydrophobicContact CD1-CD2 3.74Å; L305-L481 HydrophobicContact CB-CD2 3.7Å; L305-L481 HydrophobicContact CD1-CD2 4.09Å; L305-M488 HydrophobicContact CB-CB 4.22Å; L305-M488 HydrophobicContact CD1-SD 4.47Å; L305-M488 PolarHBondContact N-O 2.89Å; L305-M488 VanDerWaalsContact O-CB 3.25Å; L305-M488 WeakPolarHBondContact O-CB 3.42Å; L305-I491 HydrophobicContact CB-CD1 4.41Å; L305-I491 HydrophobicContact CD1-CD1 3.72Å; L305-I491 HydrophobicContact CG-CD1 3.8Å
306	A	88.6	Confident	84.4	Confident	41 Å²	41	34.3 Å²	34.3	34%	0.339	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	128.6	168.7	0	0	0	0	0	108.6	N315	A306-N315 HydrophobicContact CB-CB 4.44Å; A306-N315 PolarHBondContact N-O 2.77Å; A306-N315 WeakPolarHBondContact O-CB 3.47Å; A306-N315 PolarHBondContact O-N 3.07Å
307	Y	90.8	Very high	86.2	Confident	22 Å²	22	30.3 Å²	30.3	9%	0.086	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.7	-176.6	-178.1	-104.2	0	0	0	111.3	C309 I313 L314 V403 V405 L408 I482	Y307-C309 HydrophobicContact CE1-CB 4.09Å; Y307-I313 WeakPolarHBondContact CD2-O 3.5Å; Y307-L314 HydrophobicContact CD2-CB 4.03Å; Y307-L314 HydrophobicContact CD2-CD1 4.27Å; Y307-V403 WeakPolarHBondContact CE2-O 3.46Å; Y307-V403 PolarHBondContact OH-O 3.05Å; Y307-V403 VanDerWaalsContact OH-O 3.04Å; Y307-V405 HydrophobicContact CE1-CG2 4.01Å; Y307-V405 WeakPolarHBondContact OH-CA 3.49Å; Y307-V405 WeakPolarHBondContact OH-CG2 3.45Å; Y307-V405 PolarHBondContact OH-N 3.37Å; Y307-V405 VanDerWaalsContact OH-N 3.09Å; Y307-L408 HydrophobicContact CD1-CD1 3.83Å; Y307-L408 HydrophobicContact CD2-CD1 4.25Å; Y307-L408 HydrophobicContact CD2-CD2 4.07Å; Y307-L408 HydrophobicContact CE1-CD1 3.65Å; Y307-L408 HydrophobicContact CE2-CD1 4.11Å; Y307-L408 HydrophobicContact CE2-CD2 3.98Å; Y307-L408 HydrophobicContact CE2-CG 4.39Å; Y307-L408 HydrophobicContact CG-CD1 4.12Å; Y307-I482 HydrophobicContact CD1-CG1 4.16Å
308	T	86.7	Confident	87.6	Confident	68 Å²	68	28.8 Å²	28.8	42%	0.417	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	94.6	179.7	-57.5	0	0	0	0	109.6	T310 V311 G312 I313	T308-T310 WeakPolarHBondContact CG2-OG1 3.28Å; T308-T310 PolarHBondContact O-N 2.98Å; T308-V311 HydrophobicContact CG2-CB 4.33Å; T308-V311 HydrophobicContact CG2-CG2 3.88Å; T308-V311 PolarHBondContact O-N 3.33Å; T308-V311 VanDerWaalsContact O-N 3.11Å; T308-G312 PolarHBondContact O-N 3.08Å; T308-I313 PolarHBondContact N-O 3Å
309	C	85.5	Confident	88.5	Confident	57 Å²	57	29.1 Å²	29.1	39%	0.385	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-34.8	-175.5	-53	0	0	0	0	114.1	Y307 V311 V405	Y307-C309 HydrophobicContact CE1-CB 4.09Å; C309-V311 VanDerWaalsContact C-N 3.26Å; C309-V311 PolarHBondContact O-N 2.91Å; C309-V405 HydrophobicContact CB-CG2 4.44Å
310	T	83.1	Confident	88.9	Confident	133 Å²	133	33.9 Å²	33.9	82%	0.816	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-18.8	-177.8	50.2	0	0	0	0	114	T308	T308-T310 WeakPolarHBondContact CG2-OG1 3.28Å; T308-T310 PolarHBondContact O-N 2.98Å
311	V	83.9	Confident	89.1	Confident	96 Å²	96	32.5 Å²	32.5	58%	0.582	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.8	-12.6	-178	-162.2	0	0	0	0	112	T308 C309 I313	T308-V311 HydrophobicContact CG2-CB 4.33Å; T308-V311 HydrophobicContact CG2-CG2 3.88Å; T308-V311 PolarHBondContact O-N 3.33Å; T308-V311 VanDerWaalsContact O-N 3.11Å; C309-V311 VanDerWaalsContact C-N 3.26Å; C309-V311 PolarHBondContact O-N 2.91Å; V311-I313 HydrophobicContact CB-CD1 4.19Å; V311-I313 HydrophobicContact CB-CG1 4.2Å; V311-I313 HydrophobicContact CG1-CD1 3.53Å; V311-I313 HydrophobicContact CG1-CG1 3.92Å
312	G	85.4	Confident	88.9	Confident	13 Å²	13	35.7 Å²	35.7	13%	0.134	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	40.4	-176.5	0	0	0	0	0	112.6	T308 S402 V403	T308-G312 PolarHBondContact O-N 3.08Å; G312-S402 CarbonylContact O-C 3.36Å; G312-S402 WeakPolarHBondContact O-CA 3.29Å; G312-V403 CarbonylContact C-O 3.54Å; G312-V403 WeakPolarHBondContact CA-O 3.48Å; G312-V403 CarbonylContact O-C 3.57Å; G312-V403 PolarHBondContact O-N 2.99Å
313	I	85.3	Confident	88.2	Confident	47 Å²	47	37.9 Å²	37.9	24%	0.241	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124	-177.8	-61.2	178.8	0	0	0	110.4	Y307 T308 V311 L400 F401	Y307-I313 WeakPolarHBondContact CD2-O 3.5Å; T308-I313 PolarHBondContact N-O 3Å; V311-I313 HydrophobicContact CB-CD1 4.19Å; V311-I313 HydrophobicContact CB-CG1 4.2Å; V311-I313 HydrophobicContact CG1-CD1 3.53Å; V311-I313 HydrophobicContact CG1-CG1 3.92Å; I313-L400 HydrophobicContact CG2-CB 3.99Å; I313-L400 HydrophobicContact CG2-CD2 3.98Å; I313-L400 HydrophobicContact CG2-CG 4.41Å; I313-F401 WeakPolarHBondContact CA-O 3.36Å
314	L	88.8	Confident	87.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114.8	166.8	-178.9	72.4	0	0	0	109.5	L305 Y307 V316 L348 F401 V403 L476 L481	L305-L314 HydrophobicContact CB-CD1 4.44Å; Y307-L314 HydrophobicContact CD2-CB 4.03Å; Y307-L314 HydrophobicContact CD2-CD1 4.27Å; L314-V316 HydrophobicContact CD2-CG2 3.88Å; L314-V316 HydrophobicContact CG-CG2 3.95Å; L314-L348 HydrophobicContact CD2-CD1 4.44Å; L314-L348 HydrophobicContact CD2-CD2 4.21Å; L314-F401 HydrophobicContact CB-CB 4.45Å; L314-F401 PolarHBondContact N-O 3.27Å; L314-F401 PolarHBondContact O-N 3.37Å; L314-V403 HydrophobicContact CB-CG2 4.38Å; L314-L476 HydrophobicContact CD2-CD1 3.52Å; L314-L476 HydrophobicContact CD2-CD2 4.22Å; L314-L481 HydrophobicContact CD1-CD1 4.27Å; L314-L481 HydrophobicContact CD1-CD2 3.99Å
315	N	90.2	Very high	85.8	Confident	47 Å²	47	40.2 Å²	40.2	25%	0.251	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	120.3	168.8	-177.1	10.8	0	0	0	109.9	L305 A306 S398 F399 L400	L305-N315 WeakPolarHBondContact CA-O 3.5Å; A306-N315 HydrophobicContact CB-CB 4.44Å; A306-N315 PolarHBondContact N-O 2.77Å; A306-N315 WeakPolarHBondContact O-CB 3.47Å; A306-N315 PolarHBondContact O-N 3.07Å; N315-S398 WeakPolarHBondContact OD1-CB 3.42Å; N315-F399 CarbonylContact C-O 3.58Å; N315-F399 WeakPolarHBondContact CA-O 3.27Å; N315-F399 PolarHBondContact OD1-O 3.25Å; N315-L400 HydrophobicContact CB-CD2 3.66Å
316	V	91.8	Very high	83.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.6	177.1	-175.3	0	0	0	0	108.5	L305 L314 I318 L346 S398 F399 F401 L413	L305-V316 HydrophobicContact CD2-CB 4.16Å; L305-V316 HydrophobicContact CD2-CG1 3.89Å; L305-V316 HydrophobicContact CD2-CG2 3.73Å; L314-V316 HydrophobicContact CD2-CG2 3.88Å; L314-V316 HydrophobicContact CG-CG2 3.95Å; V316-I318 HydrophobicContact CG1-CD1 4.4Å; V316-L346 HydrophobicContact CB-CD2 4.16Å; V316-L346 HydrophobicContact CG1-CD2 3.61Å; V316-S398 WeakPolarHBondContact O-CA 3.45Å; V316-F399 PolarHBondContact N-O 3.48Å; V316-F399 PolarHBondContact O-N 2.72Å; V316-F401 HydrophobicContact CB-CD2 4.49Å; V316-F401 HydrophobicContact CB-CE2 4.18Å; V316-F401 HydrophobicContact CG2-CD2 3.73Å; V316-F401 HydrophobicContact CG2-CE2 3.72Å; V316-L413 HydrophobicContact CG1-CD1 4.31Å; V316-L413 HydrophobicContact CG1-CD2 3.63Å; V316-L413 HydrophobicContact CG2-CD1 4.35Å; V316-L413 HydrophobicContact CG2-CD2 4.23Å
317	T	90.3	Very high	82.1	Confident	23 Å²	23	41.3 Å²	41.3	14%	0.141	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.4	178.6	-59.7	0	0	0	0	110.3	F303 S304 N319 Q397 S398	F303-T317 CarbonylContact C-O 3.55Å; F303-T317 WeakPolarHBondContact CA-O 3.37Å; F303-T317 VanDerWaalsContact CB-O 3.24Å; F303-T317 WeakPolarHBondContact CB-O 3.46Å; S304-T317 PolarHBondContact N-O 3.35Å; S304-T317 PolarHBondContact O-N 3.35Å; T317-N319 PolarHBondContact O-N 2.93Å; T317-Q397 CarbonylContact C-O 3.57Å; T317-Q397 VanDerWaalsContact CA-O 3.31Å; T317-Q397 WeakPolarHBondContact CA-O 2.96Å; T317-S398 WeakPolarHBondContact OG1-CB 3.5Å; T317-S398 PolarHBondContact OG1-OG 2.9Å
318	I	92	Very high	80.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	113.8	169.9	-55.6	-52.1	0	0	0	108.1	I301 F303 V316 V344 L346 T384 F395 D396 Q397 F399 L415	I301-I318 HydrophobicContact CD1-CD1 4.36Å; I301-I318 HydrophobicContact CD1-CG2 4.44Å; F303-I318 HydrophobicContact CB-CD1 3.9Å; V316-I318 HydrophobicContact CG1-CD1 4.4Å; I318-V344 HydrophobicContact CD1-CG1 4.33Å; I318-V344 HydrophobicContact CG1-CG1 4.32Å; I318-V344 HydrophobicContact CG2-CB 4.34Å; I318-V344 HydrophobicContact CG2-CG2 4.03Å; I318-L346 HydrophobicContact CD1-CD2 3.63Å; I318-L346 HydrophobicContact CD1-CG 4.12Å; I318-L346 HydrophobicContact CG1-CD1 4.1Å; I318-L346 HydrophobicContact CG1-CD2 3.73Å; I318-L346 HydrophobicContact CG1-CG 4.14Å; I318-T384 HydrophobicContact CB-CG2 4.15Å; I318-T384 HydrophobicContact CG1-CG2 4.17Å; I318-T384 HydrophobicContact CG2-CG2 4.29Å; I318-F395 HydrophobicContact CG2-CB 4.11Å; I318-F395 HydrophobicContact CG2-CD2 3.89Å; I318-F395 HydrophobicContact CG2-CG 4.12Å; I318-D396 VanDerWaalsContact O-CA 3.3Å; I318-D396 WeakPolarHBondContact O-CA 3.26Å; I318-D396 PolarHBondContact O-N 2.64Å; I318-Q397 PolarHBondContact N-O 3.01Å; I318-Q397 PolarHBondContact O-N 2.74Å; I318-F399 HydrophobicContact CG1-CD2 4.45Å; I318-F399 HydrophobicContact CG1-CE2 4.05Å; I318-L415 HydrophobicContact CD1-CD1 4.23Å; I318-L415 HydrophobicContact CD1-CD2 3.89Å
319	N	88.9	Confident	78.2	Confident	22 Å²	22	47.2 Å²	47.2	12%	0.118	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-76.5	175.9	-53.2	97.9	0	0	0	109.3	C302 F303 S304 T317 N394 F395 D396	C302-N319 HydrophobicContact CB-CB 4.28Å; C302-N319 PolarHBondContact O-N 3.43Å; F303-N319 VanDerWaalsContact C-OD1 3.25Å; F303-N319 WeakPolarHBondContact CA-OD1 3.2Å; S304-N319 PolarHBondContact N-OD1 3.16Å; T317-N319 PolarHBondContact O-N 2.93Å; N319-N394 PolarHBondContact O-OD1 2.77Å; N319-F395 PolarHBondContact O-N 2.99Å; N319-D396 PolarHBondContact O-N 3.45Å; N319-D396 VanDerWaalsContact O-N 3.16Å
320	R	90.8	Very high	76.2	Confident	105 Å²	105	52 Å²	52	40%	0.396	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.6	-166.3	57.4	-175.5	167.4	-173.9	-6.4	113	C302 P393 N394 W492	C302-R320 HydrophobicContact CB-CG 3.75Å; C302-R320 WeakPolarHBondContact CB-O 3.31Å; C302-R320 PolarHBondContact N-O 3.27Å; C302-R320 PolarHBondContact O-N 3.49Å; R320-P393 CarbonylContact C-O 3.11Å; R320-P393 VanDerWaalsContact CA-O 3.3Å; R320-P393 WeakPolarHBondContact CA-O 3.37Å; R320-P393 WeakPolarHBondContact CB-O 3.38Å; R320-N394 HydrophobicContact CB-CB 4.49Å; R320-N394 WeakPolarHBondContact CB-OD1 3.23Å; R320-W492 HydrophobicContact CG-CH2 4.07Å
321	L	89.3	Confident	74.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	148.1	165.9	-55.5	173.6	0	0	0	110.3	H300 I301 V324 V344 N392 P393 F395 V417 L495	H300-L321 CarbonylContact O-C 3.2Å; H300-L321 VanDerWaalsContact O-CA 3.3Å; H300-L321 WeakPolarHBondContact O-CA 3.31Å; I301-L321 HydrophobicContact CB-CD2 3.44Å; I301-L321 VanDerWaalsContact CB-CD2 3.44Å; I301-L321 HydrophobicContact CD1-CD2 3.77Å; I301-L321 HydrophobicContact CG1-CD2 3.52Å; L321-V324 HydrophobicContact CB-CG2 3.7Å; L321-V324 HydrophobicContact CD1-CG2 4.23Å; L321-V324 HydrophobicContact CG-CG2 4.43Å; L321-V344 HydrophobicContact CD1-CG2 4.35Å; L321-N392 CarbonylContact O-C 3.57Å; L321-N392 WeakPolarHBondContact O-CA 3.15Å; L321-P393 HydrophobicContact CB-CG 3.85Å; L321-P393 HydrophobicContact CD1-CG 3.68Å; L321-P393 HydrophobicContact CG-CG 4Å; L321-P393 PolarHBondContact N-O 2.94Å; L321-F395 HydrophobicContact CD1-CE2 3.91Å; L321-F395 HydrophobicContact CD1-CZ 4.31Å; L321-F395 HydrophobicContact CG-CE2 3.91Å; L321-V417 HydrophobicContact CD1-CB 4.41Å; L321-V417 HydrophobicContact CD1-CG1 3.43Å; L321-V417 VanDerWaalsContact CD1-CG1 3.43Å; L321-V417 HydrophobicContact CD1-CG2 4.04Å; L321-V417 HydrophobicContact CD2-CG2 3.88Å; L321-L495 HydrophobicContact CD2-CD1 4.35Å
322	I	85.1	Confident	72.8	Confident	68 Å²	68	52 Å²	52	35%	0.349	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	139.9	174.4	-65.6	-169.8	0	0	0	110.6	G299 H300 V324 N392 W492	G299-I322 CarbonylContact C-O 3.52Å; G299-I322 VanDerWaalsContact CA-O 3.31Å; G299-I322 WeakPolarHBondContact CA-O 3.49Å; H300-I322 PolarHBondContact N-O 2.88Å; H300-I322 PolarHBondContact O-N 3.23Å; I322-V324 PolarHBondContact O-N 2.89Å; I322-N392 WeakPolarHBondContact CA-OD1 3.23Å; I322-W492 HydrophobicContact CB-CH2 4.3Å; I322-W492 HydrophobicContact CB-CZ3 4.06Å; I322-W492 HydrophobicContact CD1-CH2 3.37Å; I322-W492 HydrophobicContact CD1-CZ2 4.21Å; I322-W492 HydrophobicContact CD1-CZ3 4.03Å; I322-W492 HydrophobicContact CG1-CH2 3.7Å; I322-W492 HydrophobicContact CG1-CZ3 3.94Å
323	G	77.5	Confident	71.4	Confident	46 Å²	46	55.6 Å²	55.6	47%	0.474	30%	0.3	S	S	.	.	S	Bend	trans	75.5	10	175.2	0	0	0	0	0	114.2	G299 S325 N392	G299-G323 WeakPolarHBondContact CA-O 3.4Å; G323-S325 PolarHBondContact O-N 2.7Å; G323-N392 PolarHBondContact N-OD1 3.05Å
324	V	72.8	Confident	70	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.315	C	S	.	.			trans	-76.9	110.3	176.6	-175.3	0	0	0	0	108.8	L321 I322 F342 L391 I469 L495	L321-V324 HydrophobicContact CB-CG2 3.7Å; L321-V324 HydrophobicContact CD1-CG2 4.23Å; L321-V324 HydrophobicContact CG-CG2 4.43Å; I322-V324 PolarHBondContact O-N 2.89Å; V324-F342 HydrophobicContact CB-CE1 4.42Å; V324-F342 HydrophobicContact CG1-CD1 4.31Å; V324-F342 HydrophobicContact CG1-CE1 3.64Å; V324-F342 HydrophobicContact CG1-CZ 4.5Å; V324-L391 VanDerWaalsContact O-CD2 3.26Å; V324-L391 WeakPolarHBondContact O-CD2 3.35Å; V324-I469 HydrophobicContact CG1-CD1 3.41Å; V324-I469 VanDerWaalsContact CG1-CD1 3.41Å; V324-I469 HydrophobicContact CG1-CG2 3.84Å; V324-L495 HydrophobicContact CG2-CD1 3.79Å
325	S	60.5	Low	68.3	Low	54 Å²	54	61.6 Å²	61.6	38%	0.378	34%	0.336	S	S	.	.			trans	-97.8	135.4	-174.8	65.9	0	0	0	0	112.7	G323 L327	G323-S325 PolarHBondContact O-N 2.7Å; S325-L327 PolarHBondContact O-N 3.14Å
326	N	54.5	Low	66.9	Low	11 Å²	11	62.7 Å²	62.7	6%	0.059	35%	0.347	C	S	.	.			trans	-67.9	95.1	174.3	-68	-24.4	0	0	0	110.3	V328 P335 T340 S390	N326-V328 PolarHBondContact O-N 3.47Å; N326-P335 PolarHBondContact ND2-O 2.99Å; N326-T340 HydrophobicContact CB-CG2 4.37Å; N326-T340 VanDerWaalsContact CG-CG2 3.46Å; N326-T340 PolarHBondContact ND2-OG1 2.75Å; N326-T340 WeakPolarHBondContact OD1-CB 3.05Å; N326-T340 VanDerWaalsContact OD1-CG2 3.28Å; N326-T340 WeakPolarHBondContact OD1-CG2 3.47Å; N326-T340 PolarHBondContact OD1-OG1 2.97Å; N326-S390 PolarHBondContact ND2-O 3.29Å
327	L	51.7	Low	65.3	Low	55 Å²	55	69 Å²	69	29%	0.288	38%	0.377	S	S	.	.			trans	-71.4	50.5	175.5	-66.6	173.9	0	0	0	113.5	S325 K329 R467	S325-L327 PolarHBondContact O-N 3.14Å; L327-K329 PolarHBondContact O-N 3.17Å; L327-R467 PolarHBondContact O-NH1 2.77Å
328	V	47.3	Very low	64	Low	47 Å²	47	68.7 Å²	68.7	29%	0.285	38%	0.375	S	S	.	.			trans	-91.5	82.3	171	-173.3	0	0	0	0	107.8	N326 N330 S331 T421	N326-V328 PolarHBondContact O-N 3.47Å; V328-N330 PolarHBondContact O-N 2.85Å; V328-N330 VanDerWaalsContact O-N 3.16Å; V328-S331 WeakPolarHBondContact CG1-OG 3.34Å; V328-T421 HydrophobicContact CG2-CG2 3.99Å
329	K	46.7	Very low	62.9	Low	166 Å²	166	71.1 Å²	71.1	72%	0.722	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-3.9	-176.6	-70.1	-176.1	174.9	-180	0	114.7	L327	L327-K329 PolarHBondContact O-N 3.17Å
330	N	44.6	Very low	62.2	Low	158 Å²	158	70.1 Å²	70.1	85%	0.845	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	17.3	-165.1	-77.5	42	0	0	0	115.4	V328	V328-N330 PolarHBondContact O-N 2.85Å; V328-N330 VanDerWaalsContact O-N 3.16Å
331	S	47.1	Very low	61.7	Low	44 Å²	44	65.7 Å²	65.7	31%	0.308	37%	0.371	S	S	.	.			trans	-120.8	141	172.5	61.8	0	0	0	0	112	V328 I333	V328-S331 WeakPolarHBondContact CG1-OG 3.34Å; S331-I333 PolarHBondContact O-N 2.76Å
332	N	47.3	Very low	61.5	Low	185 Å²	185	65.7 Å²	65.7	99%	0.989	37%	0.37	S	S	*	.	S	Bend	trans	-73.3	26.2	177	-64.9	-22.7	0	0	0	112.9
333	I	57.1	Low	61.4	Low	88 Å²	88	62.5 Å²	62.5	45%	0.451	35%	0.354	S	S	.	.	S	Bend	trans	-117.3	132.7	-171.3	-58.4	173.2	0	0	0	107.6	S331 Q337 T338	S331-I333 PolarHBondContact O-N 2.76Å; I333-Q337 HydrophobicContact CG2-CB 3.73Å; I333-T338 WeakPolarHBondContact CG2-OG1 3.49Å
334	L	55.1	Low	61.8	Low	106 Å²	106	60.3 Å²	60.3	56%	0.555	33%	0.332	S	S	*	.			trans	-61.2	139.6	178.9	-71	162.2	0	0	0	110.2	S336 Q337 T338	L334-S336 PolarHBondContact O-N 2.92Å; L334-Q337 HydrophobicContact CB-CG 4.19Å; L334-Q337 WeakPolarHBondContact O-CB 3.49Å; L334-Q337 PolarHBondContact O-N 3.16Å; L334-T338 PolarHBondContact O-N 3.42Å
335	P	54.6	Low	62.2	Low	68 Å²	68	61 Å²	61	44%	0.442	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-25.8	-179.4	-28.6	35.3	0	0	0	114.6	N326	N326-P335 PolarHBondContact ND2-O 2.99Å
336	S	60.6	Low	63.5	Low	69 Å²	69	58.4 Å²	58.4	48%	0.483	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-18.2	175.8	58.3	0	0	0	0	115	L334 S390	L334-S336 PolarHBondContact O-N 2.92Å; S336-S390 WeakPolarHBondContact O-CB 3.47Å; S336-S390 PolarHBondContact O-OG 3.29Å
337	Q	57.4	Low	64.8	Low	133 Å²	133	62 Å²	62	62%	0.621	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-19.4	-178.3	-67.1	176	-24.2	0	0	112.6	I333 L334	I333-Q337 HydrophobicContact CG2-CB 3.73Å; L334-Q337 HydrophobicContact CB-CG 4.19Å; L334-Q337 WeakPolarHBondContact O-CB 3.49Å; L334-Q337 PolarHBondContact O-N 3.16Å
338	T	62.5	Low	66.3	Low	16 Å²	16	59.6 Å²	59.6	10%	0.098	32%	0.319	C	S	.	.	S	Bend	trans	-83.1	115.9	177	-49.9	0	0	0	0	110	I333 L334 T340 S390 T421	I333-T338 WeakPolarHBondContact CG2-OG1 3.49Å; L334-T338 PolarHBondContact O-N 3.42Å; T338-T340 HydrophobicContact CG2-CG2 4.37Å; T338-T340 PolarHBondContact O-N 3.07Å; T338-S390 WeakPolarHBondContact O-CA 3.08Å; T338-T421 HydrophobicContact CG2-CG2 3.47Å; T338-T421 VanDerWaalsContact CG2-CG2 3.47Å
339	S	69.4	Low	67.5	Low	52 Å²	52	60.3 Å²	60.3	36%	0.364	32%	0.316	S	S	.	.			trans	-71.5	121	170.9	179.3	0	0	0	0	110	T422	S339-T422 PolarHBondContact O-OG1 3.36Å
340	T	73.6	Confident	68.6	Low	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.5	174.4	46.3	0	0	0	0	110.7	N326 T338 F342 S388 T389 S420 T421	N326-T340 HydrophobicContact CB-CG2 4.37Å; N326-T340 VanDerWaalsContact CG-CG2 3.46Å; N326-T340 PolarHBondContact ND2-OG1 2.75Å; N326-T340 WeakPolarHBondContact OD1-CB 3.05Å; N326-T340 VanDerWaalsContact OD1-CG2 3.28Å; N326-T340 WeakPolarHBondContact OD1-CG2 3.47Å; N326-T340 PolarHBondContact OD1-OG1 2.97Å; T338-T340 HydrophobicContact CG2-CG2 4.37Å; T338-T340 PolarHBondContact O-N 3.07Å; T340-F342 WeakPolarHBondContact O-CD2 3.28Å; T340-F342 WeakPolarHBondContact OG1-CE2 3.3Å; T340-F342 VanDerWaalsContact OG1-CZ 3.23Å; T340-F342 WeakPolarHBondContact OG1-CZ 3.45Å; T340-S388 WeakPolarHBondContact O-CA 3.44Å; T340-T389 PolarHBondContact N-O 3.07Å; T340-T389 PolarHBondContact O-N 3.16Å; T340-T389 PolarHBondContact OG1-O 3.4Å; T340-T389 VanDerWaalsContact OG1-O 3.14Å; T340-S420 CarbonylContact C-O 3.55Å; T340-S420 WeakPolarHBondContact CA-O 3.23Å; T340-T421 HydrophobicContact CG2-CG2 4.16Å; T340-T421 WeakPolarHBondContact CG2-OG1 3.48Å
341	N	82	Confident	69.4	Low	13 Å²	13	50 Å²	50	7%	0.07	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	110.6	179.6	-68	-39	0	0	0	108.6	S388 Q419 S420 T422	N341-S388 WeakPolarHBondContact OD1-CB 3.13Å; N341-S388 PolarHBondContact OD1-OG 3.03Å; N341-Q419 CarbonylContact O-C 3.59Å; N341-Q419 VanDerWaalsContact O-CA 3.27Å; N341-Q419 WeakPolarHBondContact O-CA 3.37Å; N341-S420 PolarHBondContact N-O 3.33Å; N341-S420 PolarHBondContact O-N 3.11Å; N341-T422 WeakPolarHBondContact ND2-CG2 3.37Å
342	F	84.2	Confident	69.7	Low	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	140.4	177.8	-61.8	-91	0	0	0	111.6	V324 T340 P386 V387 T389 P393 F395 F418 Q419 I469	V324-F342 HydrophobicContact CB-CE1 4.42Å; V324-F342 HydrophobicContact CG1-CD1 4.31Å; V324-F342 HydrophobicContact CG1-CE1 3.64Å; V324-F342 HydrophobicContact CG1-CZ 4.5Å; T340-F342 WeakPolarHBondContact O-CD2 3.28Å; T340-F342 WeakPolarHBondContact OG1-CE2 3.3Å; T340-F342 VanDerWaalsContact OG1-CZ 3.23Å; T340-F342 WeakPolarHBondContact OG1-CZ 3.45Å; F342-P386 WeakPolarHBondContact O-CA 3.28Å; F342-V387 PolarHBondContact N-O 3.17Å; F342-V387 PolarHBondContact O-N 2.94Å; F342-T389 HydrophobicContact CD2-CG2 3.68Å; F342-T389 HydrophobicContact CE2-CG2 3.56Å; F342-P393 HydrophobicContact CB-CB 4.02Å; F342-P393 HydrophobicContact CB-CG 3.75Å; F342-P393 HydrophobicContact CD1-CG 4.12Å; F342-P393 HydrophobicContact CD2-CB 3.95Å; F342-P393 HydrophobicContact CD2-CG 3.74Å; F342-P393 HydrophobicContact CE2-CG 4.34Å; F342-P393 HydrophobicContact CG-CB 4.13Å; F342-P393 HydrophobicContact CG-CG 3.6Å; F342-F395 HydrophobicContact CB-CZ 3.82Å; F342-F395 WeakPolarHBondContact O-CE1 3.36Å; F342-F418 VanDerWaalsContact CA-O 3.31Å; F342-F418 WeakPolarHBondContact CA-O 3.42Å; F342-Q419 HydrophobicContact CD1-CB 4.13Å; F342-Q419 HydrophobicContact CE1-CB 4.13Å; F342-I469 HydrophobicContact CD1-CD1 3.75Å; F342-I469 HydrophobicContact CE1-CD1 3.68Å
343	V	83.5	Confident	69.4	Low	2 Å²	2	49.3 Å²	49.3	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.9	173.8	173.1	0	0	0	0	108.4	F383 P386 F418 M466	V343-F383 HydrophobicContact CG1-CB 4.28Å; V343-F383 HydrophobicContact CG1-CD1 4.12Å; V343-P386 HydrophobicContact CG2-CB 3.87Å; V343-P386 HydrophobicContact CG2-CG 3.76Å; V343-F418 HydrophobicContact CB-CB 4.47Å; V343-F418 PolarHBondContact N-O 2.98Å; V343-F418 PolarHBondContact O-N 2.92Å; V343-M466 HydrophobicContact CB-SD 4.43Å; V343-M466 HydrophobicContact CG2-CE 3.81Å; V343-M466 HydrophobicContact CG2-SD 4.06Å
344	V	84.6	Confident	68.2	Low	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.2	169.3	-174.4	0	0	0	0	108.7	I301 I318 L321 F383 T384 F395 A416 V417	I301-V344 HydrophobicContact CD1-CG1 3.78Å; I301-V344 HydrophobicContact CD1-CG2 4.24Å; I318-V344 HydrophobicContact CD1-CG1 4.33Å; I318-V344 HydrophobicContact CG1-CG1 4.32Å; I318-V344 HydrophobicContact CG2-CB 4.34Å; I318-V344 HydrophobicContact CG2-CG2 4.03Å; L321-V344 HydrophobicContact CD1-CG2 4.35Å; V344-F383 CarbonylContact O-C 3.59Å; V344-F383 WeakPolarHBondContact O-CA 3.11Å; V344-T384 HydrophobicContact CB-CG2 3.9Å; V344-T384 HydrophobicContact CG2-CG2 4.5Å; V344-T384 PolarHBondContact N-OG1 2.66Å; V344-T384 PolarHBondContact O-N 3.03Å; V344-F395 HydrophobicContact CG2-CD2 4.36Å; V344-F395 HydrophobicContact CG2-CE1 4.34Å; V344-F395 HydrophobicContact CG2-CE2 3.83Å; V344-F395 HydrophobicContact CG2-CZ 3.8Å; V344-A416 CarbonylContact C-O 3.5Å; V344-A416 WeakPolarHBondContact CA-O 3.24Å; V344-V417 HydrophobicContact CG2-CG2 4.26Å
345	S	82.9	Confident	66.9	Low	14 Å²	14	45.2 Å²	45.2	10%	0.098	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	142.5	166.4	-174.6	0	0	0	0	110	Y382 F383 L415 A416	S345-Y382 CarbonylContact C-O 3.48Å; S345-Y382 VanDerWaalsContact CA-O 3.24Å; S345-Y382 WeakPolarHBondContact CA-O 3.48Å; S345-Y382 PolarHBondContact OG-O 2.7Å; S345-F383 VanDerWaalsContact CB-CE1 3.43Å; S345-F383 VanDerWaalsContact OG-CE1 3.25Å; S345-F383 WeakPolarHBondContact OG-CE1 3.41Å; S345-L415 WeakPolarHBondContact O-CA 3.24Å; S345-A416 PolarHBondContact N-O 2.9Å; S345-A416 PolarHBondContact O-N 3.04Å
346	L	87.3	Confident	65.9	Low	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	136.5	-179.8	-49.8	83.3	0	0	0	109.8	V316 I318 N381 Y382 F399 F401 V414 L415	V316-L346 HydrophobicContact CB-CD2 4.16Å; V316-L346 HydrophobicContact CG1-CD2 3.61Å; I318-L346 HydrophobicContact CD1-CD2 3.63Å; I318-L346 HydrophobicContact CD1-CG 4.12Å; I318-L346 HydrophobicContact CG1-CD1 4.1Å; I318-L346 HydrophobicContact CG1-CD2 3.73Å; I318-L346 HydrophobicContact CG1-CG 4.14Å; L346-N381 WeakPolarHBondContact O-CA 3.4Å; L346-Y382 PolarHBondContact N-O 3.16Å; L346-Y382 PolarHBondContact O-N 2.85Å; L346-F399 HydrophobicContact CD1-CD2 3.73Å; L346-F399 HydrophobicContact CD1-CE2 3.58Å; L346-F399 HydrophobicContact CD1-CG 4.28Å; L346-F399 HydrophobicContact CD1-CZ 4.01Å; L346-F399 HydrophobicContact CD2-CB 4.45Å; L346-F399 HydrophobicContact CD2-CD2 3.51Å; L346-F399 HydrophobicContact CD2-CE2 4.09Å; L346-F399 HydrophobicContact CD2-CG 4.17Å; L346-F399 HydrophobicContact CG-CD2 4.3Å; L346-F401 HydrophobicContact CB-CZ 4.09Å; L346-V414 WeakPolarHBondContact CA-O 3.31Å; L346-L415 HydrophobicContact CB-CD2 3.97Å; L346-L415 HydrophobicContact CD2-CD2 3.89Å; L346-L415 HydrophobicContact CG-CD2 3.63Å
347	R	82.6	Confident	64.4	Low	85 Å²	85	53.9 Å²	53.9	32%	0.321	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	156.9	168.4	66.4	178.1	-177.5	176.6	-1.4	111.6	N381 V414	R347-N381 WeakPolarHBondContact CB-OD1 3.46Å; R347-N381 WeakPolarHBondContact CD-OD1 3.48Å; R347-V414 HydrophobicContact CG-CB 3.85Å; R347-V414 HydrophobicContact CG-CG2 4.29Å; R347-V414 PolarHBondContact N-O 2.85Å; R347-V414 PolarHBondContact O-N 2.8Å
348	L	81.7	Confident	63.4	Low	5 Å²	5	52.8 Å²	52.8	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.5	169.8	-62.2	-177.3	0	0	0	110.6	L314 F401 V403 V411 L413	L314-L348 HydrophobicContact CD2-CD1 4.44Å; L314-L348 HydrophobicContact CD2-CD2 4.21Å; L348-F401 HydrophobicContact CB-CD1 4.47Å; L348-F401 HydrophobicContact CD1-CB 3.49Å; L348-F401 VanDerWaalsContact CD1-CB 3.49Å; L348-F401 HydrophobicContact CD1-CD1 3.63Å; L348-F401 HydrophobicContact CD1-CD2 4.32Å; L348-F401 HydrophobicContact CD1-CE1 4.36Å; L348-F401 HydrophobicContact CD1-CG 3.58Å; L348-F401 HydrophobicContact CG-CB 4.31Å; L348-F401 HydrophobicContact CG-CD1 3.58Å; L348-F401 HydrophobicContact CG-CD2 4.32Å; L348-F401 HydrophobicContact CG-CE1 3.8Å; L348-F401 HydrophobicContact CG-CG 3.85Å; L348-F401 HydrophobicContact CG-CZ 4.26Å; L348-V403 HydrophobicContact CD1-CG2 3.25Å; L348-V411 HydrophobicContact CB-CG1 4.02Å; L348-V411 HydrophobicContact CD1-CG1 4.13Å; L348-V411 HydrophobicContact CD2-CG1 3.81Å; L348-V411 HydrophobicContact CG-CG1 4.2Å; L348-L413 HydrophobicContact CD2-CB 4.03Å; L348-L413 HydrophobicContact CD2-CD1 3.85Å
349	R	73	Confident	61.9	Low	63 Å²	63	55.2 Å²	55.2	24%	0.238	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.6	175.3	178.8	171.2	71.7	149.6	-0	109.2	N351 V411 E412 V414	R349-N351 PolarHBondContact O-N 3.46Å; R349-V411 CarbonylContact O-C 3.6Å; R349-V411 WeakPolarHBondContact O-CA 3.44Å; R349-E412 IonicContact CZ-OE2 3.99Å; R349-E412 VanDerWaalsContact CZ-OE2 3.26Å; R349-E412 PolarHBondContact N-O 2.87Å; R349-E412 IonicContact NE-OE2 3.59Å; R349-E412 PolarHBondContact NE-OE2 2.81Å; R349-E412 IonicContact NH2-OE1 3.19Å; R349-E412 IonicContact NH2-OE2 3.32Å; R349-E412 PolarHBondContact NH2-OE2 3.29Å; R349-E412 PolarHBondContact O-N 3.14Å; R349-V414 HydrophobicContact CB-CG2 4.05Å
350	H	70.1	Confident	60.1	Low	61 Å²	61	55.5 Å²	55.5	28%	0.282	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	127.4	172.2	-167	-119.5	0	0	0	110.3	K352 S353 F378 S410	H350-K352 VanDerWaalsContact C-N 3.3Å; H350-K352 PolarHBondContact O-N 2.82Å; H350-S353 CarbonylContact O-C 3.58Å; H350-S353 VanDerWaalsContact O-CA 3.29Å; H350-S353 WeakPolarHBondContact O-CA 3.43Å; H350-S353 VanDerWaalsContact O-CB 3.25Å; H350-S353 WeakPolarHBondContact O-CB 3.45Å; H350-S353 PolarHBondContact O-N 2.84Å; H350-F378 HydrophobicContact CB-CD1 4.33Å; H350-F378 HydrophobicContact CB-CE1 3.82Å; H350-F378 HydrophobicContact CB-CZ 4.44Å; H350-S410 CarbonylContact C-O 3.59Å; H350-S410 WeakPolarHBondContact CA-O 3.4Å; H350-S410 PolarHBondContact CD2-O 2.88Å; H350-S410 PolarHBondContact CD2-OG 2.83Å; H350-S410 VanDerWaalsContact CD2-OG 3.26Å; H350-S410 VanDerWaalsContact NE2-CB 3.28Å; H350-S410 WeakPolarHBondContact NE2-CB 3.46Å; H350-S410 PolarHBondContact NE2-OG 2.82Å
351	N	61.6	Low	58.5	Low	46 Å²	46	62 Å²	62	25%	0.246	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-63.3	-29.6	-179.5	-173.2	22.1	0	0	0	112.5	R349 S353 S354 S410	R349-N351 PolarHBondContact O-N 3.46Å; N351-S353 PolarHBondContact O-N 2.93Å; N351-S354 WeakPolarHBondContact O-CB 3.39Å; N351-S354 PolarHBondContact O-N 3.38Å; N351-S354 PolarHBondContact O-OG 2.84Å; N351-S410 WeakPolarHBondContact CB-O 3.25Å; N351-S410 PolarHBondContact N-O 2.84Å
352	K	52.2	Low	56.5	Low	161 Å²	161	69 Å²	69	70%	0.7	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-70.1	-12.7	169.6	-52.1	-169.6	-175.4	-178.8	0	113.3	H350	H350-K352 VanDerWaalsContact C-N 3.3Å; H350-K352 PolarHBondContact O-N 2.82Å
353	S	42.2	Very low	54.4	Low	53 Å²	53	75.6 Å²	75.6	37%	0.371	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-97.5	16.1	168.5	-170.4	0	0	0	0	112.3	H350 N351 T355	H350-S353 CarbonylContact O-C 3.58Å; H350-S353 VanDerWaalsContact O-CA 3.29Å; H350-S353 WeakPolarHBondContact O-CA 3.43Å; H350-S353 VanDerWaalsContact O-CB 3.25Å; H350-S353 WeakPolarHBondContact O-CB 3.45Å; H350-S353 PolarHBondContact O-N 2.84Å; N351-S353 PolarHBondContact O-N 2.93Å; S353-T355 PolarHBondContact O-N 3.39Å
354	S	30.6	Very low	52.6	Low	48 Å²	48	82.9 Å²	82.9	34%	0.336	44%	0.437	S	S	.	.			trans	-74.7	-2.2	173.8	66.1	0	0	0	0	113.3	N351 I356	N351-S354 WeakPolarHBondContact O-CB 3.39Å; N351-S354 PolarHBondContact O-N 3.38Å; N351-S354 PolarHBondContact O-OG 2.84Å; S354-I356 PolarHBondContact O-N 2.93Å
355	T	29.4	Very low	50.5	Low	61 Å²	61	89.8 Å²	89.8	37%	0.374	47%	0.474	S	S	.	.			trans	-79	89.3	-174.6	41	0	0	0	0	112.2	S353 Y357 I358	S353-T355 PolarHBondContact O-N 3.39Å; T355-Y357 VanDerWaalsContact CB-O 3.3Å; T355-Y357 WeakPolarHBondContact CB-O 3.28Å; T355-Y357 WeakPolarHBondContact CG2-O 3.45Å; T355-Y357 PolarHBondContact O-N 2.8Å; T355-I358 HydrophobicContact CG2-CG1 3.81Å; T355-I358 WeakPolarHBondContact OG1-CG1 3.35Å
356	I	31.7	Very low	48.6	Very low	137 Å²	137	96.5 Å²	96.5	70%	0.703	50%	0.504	S	S	*	.	S	Bend	trans	-62.7	-11.9	148.2	-64.9	179.6	0	0	0	110.2	S354	S354-I356 PolarHBondContact O-N 2.93Å
357	Y	30.3	Very low	46.3	Very low	181 Å²	181	100.6 Å²	100.6	71%	0.71	55%	0.546	S	S	*	.	S	Bend	trans	-144.4	116	169.3	-51.1	-79.2	0	0	0	111.1	T355	T355-Y357 VanDerWaalsContact CB-O 3.3Å; T355-Y357 WeakPolarHBondContact CB-O 3.28Å; T355-Y357 WeakPolarHBondContact CG2-O 3.45Å; T355-Y357 PolarHBondContact O-N 2.8Å
358	I	35.1	Very low	44.1	Very low	111 Å²	111	108 Å²	108	57%	0.569	57%	0.574	S	S	*	*			trans	-96.6	134.4	166.1	-60.5	-179.4	0	0	0	108.2	T355 Y523	T355-I358 HydrophobicContact CG2-CG1 3.81Å; T355-I358 WeakPolarHBondContact OG1-CG1 3.35Å; I358-Y523 WeakPolarHBondContact O-CD1 3.38Å
359	A	32.9	Very low	41.9	Very low	67 Å²	67	114.1 Å²	114.1	55%	0.554	61%	0.606	S	S	*	*			trans	-77.5	129.1	170.6	0	0	0	0	0	110.4	D361	A359-D361 PolarHBondContact O-N 2.79Å
360	G	30.9	Very low	40.1	Very low	57 Å²	57	115.9 Å²	115.9	59%	0.588	62%	0.62	S	S	*	*	S	Bend	trans	-94.5	57.1	-162.9	0	0	0	0	0	115.4
361	D	39	Very low	38.7	Very low	136 Å²	136	118.8 Å²	118.8	73%	0.727	65%	0.647	S	S	*	*	S	Bend	trans	-122.8	2.7	-177.1	-66.1	-50.9	0	0	0	114.9	A359	A359-D361 PolarHBondContact O-N 2.79Å
362	D	40.6	Very low	37.4	Very low	161 Å²	161	127.6 Å²	127.6	86%	0.861	68%	0.677	S	S	*	*			trans	-125.9	63.7	-178.2	-72.8	-49.8	0	0	0	112.8
363	E	40	Very low	36.8	Very low	139 Å²	139	127.2 Å²	127.2	65%	0.65	68%	0.682	S	S	*	*			trans	-89.5	-14.7	-170.2	-96.8	-168.6	159.2	0	0	117.5
364	D	45.8	Very low	36.6	Very low	154 Å²	154	132.9 Å²	132.9	82%	0.824	70%	0.7	S	S	*	*	S	Bend	trans	-96.8	-3	-158.1	-75.1	-32.3	0	0	0	118.8
365	N	41.4	Very low	37.2	Very low	145 Å²	145	132 Å²	132	78%	0.775	69%	0.694	S	S	*	*	S	Bend	trans	-132.5	-18.5	-168.5	-87	-66.6	0	0	0	119.8
366	E	42.7	Very low	38	Very low	155 Å²	155	135.6 Å²	135.6	72%	0.724	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-85.9	-9.4	-172.9	-109.2	-166.6	154.4	0	0	115.6	R368	E366-R368 VanDerWaalsContact C-N 3.28Å; E366-R368 PolarHBondContact O-N 2.76Å; E366-R368 VanDerWaalsContact O-N 3.08Å
367	G	38.3	Very low	38.8	Very low	87 Å²	87	129.1 Å²	129.1	90%	0.897	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-69.4	-4.3	-169.1	0	0	0	0	0	117.9
368	R	36.5	Very low	40.1	Very low	241 Å²	241	122.9 Å²	122.9	91%	0.909	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-129.8	-8.2	-168.2	-152.4	169.3	-176.3	167.8	1.5	117.1	E366	E366-R368 VanDerWaalsContact C-N 3.28Å; E366-R368 PolarHBondContact O-N 2.76Å; E366-R368 VanDerWaalsContact O-N 3.08Å
369	I	35.4	Very low	40.9	Very low	133 Å²	133	125 Å²	125	68%	0.682	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-28.5	-163.7	-66.3	178.9	0	0	0	115.1
370	N	36.4	Very low	42.3	Very low	99 Å²	99	123.7 Å²	123.7	53%	0.529	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.6	19.7	-164.2	-69.8	-27.1	0	0	0	117.1	R372	N370-R372 VanDerWaalsContact C-N 3.33Å
371	S	39	Very low	44.1	Very low	123 Å²	123	124.3 Å²	124.3	86%	0.86	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-12.2	176.1	-155.4	0	0	0	0	114.2
372	R	36	Very low	45.8	Very low	231 Å²	231	119.2 Å²	119.2	87%	0.872	60%	0.6	S	S	*	*	S	Bend	trans	-98.3	-14.2	-167.1	-121.8	171.2	177.7	159	-1.5	116.4	N370	N370-R372 VanDerWaalsContact C-N 3.33Å
373	N	37.9	Very low	47.7	Very low	152 Å²	152	116.1 Å²	116.1	81%	0.813	58%	0.579	S	S	*	*			trans	-131.2	35.6	-170.6	-69.8	-15.5	0	0	0	114.2	S375	N373-S375 PolarHBondContact O-N 3.02Å
374	K	39.1	Very low	49.7	Very low	173 Å²	173	109.8 Å²	109.8	75%	0.752	55%	0.549	S	S	*	.			trans	-73.4	108.2	174.3	-85.7	-177.1	176	175.2	0	110.9
375	S	43.4	Very low	51.2	Low	28 Å²	28	106.2 Å²	106.2	20%	0.196	53%	0.528	C	S	.	.			trans	-61.8	137.5	175.3	53.6	0	0	0	0	111.8	N373 G377 F378 E407	N373-S375 PolarHBondContact O-N 3.02Å; S375-G377 PolarHBondContact O-N 2.91Å; S375-F378 VanDerWaalsContact OG-CD2 3.27Å; S375-F378 WeakPolarHBondContact OG-CD2 3.49Å; S375-F378 VanDerWaalsContact OG-CE2 3.25Å; S375-F378 WeakPolarHBondContact OG-CE2 3.45Å; S375-E407 VanDerWaalsContact CB-OE1 3.31Å; S375-E407 WeakPolarHBondContact CB-OE1 3.45Å; S375-E407 PolarHBondContact OG-OE1 3.15Å
376	E	46.5	Very low	53.1	Low	137 Å²	137	101.8 Å²	101.8	64%	0.64	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-67	-10.8	-167.7	-148.9	-164.4	-139.2	0	0	114.2	K380	E376-K380 WeakPolarHBondContact O-CE 3.49Å; E376-K380 IonicContact OE2-NZ 2.73Å; E376-K380 PolarHBondContact OE2-NZ 3.41Å
377	G	48	Very low	55	Low	1 Å²	1	95.9 Å²	95.9	1%	0.01	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-76.7	-29.5	-174.7	0	0	0	0	0	115.6	S375 H379 K380 S402	S375-G377 PolarHBondContact O-N 2.91Å; G377-H379 VanDerWaalsContact C-N 3.27Å; G377-H379 PolarHBondContact O-N 2.97Å; G377-K380 PolarHBondContact O-N 2.8Å; G377-S402 WeakPolarHBondContact CA-O 3.45Å
378	F	56.4	Low	57.1	Low	51 Å²	51	94.6 Å²	94.6	22%	0.224	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-71.7	-12.6	-170	-76.8	-79.9	0	0	0	115.6	H350 S375 E407 V411	H350-F378 HydrophobicContact CB-CD1 4.33Å; H350-F378 HydrophobicContact CB-CE1 3.82Å; H350-F378 HydrophobicContact CB-CZ 4.44Å; S375-F378 VanDerWaalsContact OG-CD2 3.27Å; S375-F378 WeakPolarHBondContact OG-CD2 3.49Å; S375-F378 VanDerWaalsContact OG-CE2 3.25Å; S375-F378 WeakPolarHBondContact OG-CE2 3.45Å; F378-E407 HydrophobicContact CZ-CB 4.49Å; F378-V411 HydrophobicContact CE1-CG2 3.56Å; F378-V411 HydrophobicContact CZ-CG2 3.43Å; F378-V411 VanDerWaalsContact CZ-CG2 3.43Å
379	H	52.1	Low	59	Low	156 Å²	156	85.1 Å²	85.1	72%	0.722	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-101.9	-0.2	178.3	-74.8	-72.8	0	0	0	113.8	G377	G377-H379 VanDerWaalsContact C-N 3.27Å; G377-H379 PolarHBondContact O-N 2.97Å
380	K	62.9	Low	60.7	Low	38 Å²	38	80.6 Å²	80.6	17%	0.165	41%	0.408	C	S	.	.			trans	-88.5	114.7	-174.6	-62.4	-176.9	-175.6	176.1	0	110.9	E376 G377 Y382 F401 H445	E376-K380 WeakPolarHBondContact O-CE 3.49Å; E376-K380 IonicContact OE2-NZ 2.73Å; E376-K380 PolarHBondContact OE2-NZ 3.41Å; G377-K380 PolarHBondContact O-N 2.8Å; K380-Y382 HydrophobicContact CB-CE2 3.81Å; K380-F401 WeakPolarHBondContact O-CE1 3.25Å; K380-H445 PolarHBondContact NZ-NE2 3.02Å
381	N	68.9	Low	62.5	Low	70 Å²	70	79.1 Å²	79.1	37%	0.374	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126.1	167.3	-63.7	-43.6	0	0	0	108.9	L346 R347 F383	L346-N381 WeakPolarHBondContact O-CA 3.4Å; R347-N381 WeakPolarHBondContact CB-OD1 3.46Å; R347-N381 WeakPolarHBondContact CD-OD1 3.48Å; N381-F383 HydrophobicContact CB-CE2 4.29Å
382	Y	75.7	Confident	64.6	Low	30 Å²	30	77.1 Å²	77.1	12%	0.118	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	157.1	173.2	-68.2	-83.7	0	0	0	111.3	S345 L346 K380 F399 L400 F401	S345-Y382 CarbonylContact C-O 3.48Å; S345-Y382 VanDerWaalsContact CA-O 3.24Å; S345-Y382 WeakPolarHBondContact CA-O 3.48Å; S345-Y382 PolarHBondContact OG-O 2.7Å; L346-Y382 PolarHBondContact N-O 3.16Å; L346-Y382 PolarHBondContact O-N 2.85Å; K380-Y382 HydrophobicContact CB-CE2 3.81Å; Y382-F399 HydrophobicContact CD1-CB 4.41Å; Y382-F399 AromaticContact CD1-CD1 3.68Å; Y382-F399 HydrophobicContact CD1-CD1 3.68Å; Y382-F399 HydrophobicContact CD1-CE1 4.49Å; Y382-F399 HydrophobicContact CD1-CG 4.44Å; Y382-F399 HydrophobicContact CD2-CB 4.32Å; Y382-F399 HydrophobicContact CG-CB 4.11Å; Y382-F399 AromaticContact CG-CD1 3.74Å; Y382-F399 HydrophobicContact CG-CD1 3.74Å; Y382-F399 HydrophobicContact CG-CG 4.19Å; Y382-L400 PolarHBondContact OH-O 3.33Å; Y382-L400 VanDerWaalsContact OH-O 3.05Å; Y382-F401 HydrophobicContact CD2-CD1 4.2Å; Y382-F401 AromaticContact CD2-CE1 3.53Å; Y382-F401 HydrophobicContact CD2-CE1 3.53Å; Y382-F401 HydrophobicContact CD2-CE2 4.09Å; Y382-F401 AromaticContact CD2-CZ 3.48Å; Y382-F401 HydrophobicContact CD2-CZ 3.48Å; Y382-F401 VanDerWaalsContact CD2-CZ 3.48Å; Y382-F401 AromaticContact CE2-CD1 3.83Å; Y382-F401 HydrophobicContact CE2-CD1 3.83Å; Y382-F401 AromaticContact CE2-CE1 3.63Å; Y382-F401 HydrophobicContact CE2-CE1 3.63Å; Y382-F401 HydrophobicContact CE2-CE2 4.41Å; Y382-F401 HydrophobicContact CE2-CG 4.33Å; Y382-F401 AromaticContact CE2-CZ 3.96Å; Y382-F401 HydrophobicContact CE2-CZ 3.96Å
383	F	80.5	Confident	67	Low	96 Å²	96	66.2 Å²	66.2	42%	0.421	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	138.3	175.8	-62.3	-93.9	0	0	0	110.2	V343 V344 S345 N381 I462	V343-F383 HydrophobicContact CG1-CB 4.28Å; V343-F383 HydrophobicContact CG1-CD1 4.12Å; V344-F383 CarbonylContact O-C 3.59Å; V344-F383 WeakPolarHBondContact O-CA 3.11Å; S345-F383 VanDerWaalsContact CB-CE1 3.43Å; S345-F383 VanDerWaalsContact OG-CE1 3.25Å; S345-F383 WeakPolarHBondContact OG-CE1 3.41Å; N381-F383 HydrophobicContact CB-CE2 4.29Å; F383-I462 HydrophobicContact CD1-CD1 4.09Å; F383-I462 HydrophobicContact CE1-CD1 4.37Å; F383-I462 HydrophobicContact CG-CD1 4.37Å
384	T	81.7	Confident	69.4	Low	5 Å²	5	62.2 Å²	62.2	3%	0.031	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-70.1	150.5	169.3	62.1	0	0	0	0	111.5	I318 V344 F395 F399	I318-T384 HydrophobicContact CB-CG2 4.15Å; I318-T384 HydrophobicContact CG1-CG2 4.17Å; I318-T384 HydrophobicContact CG2-CG2 4.29Å; V344-T384 HydrophobicContact CB-CG2 3.9Å; V344-T384 HydrophobicContact CG2-CG2 4.5Å; V344-T384 PolarHBondContact N-OG1 2.66Å; V344-T384 PolarHBondContact O-N 3.03Å; T384-F395 HydrophobicContact CG2-CB 4.35Å; T384-F395 HydrophobicContact CG2-CD1 3.82Å; T384-F395 HydrophobicContact CG2-CE1 4.4Å; T384-F395 HydrophobicContact CG2-CG 4.18Å; T384-F395 WeakPolarHBondContact OG1-CD1 3.21Å; T384-F395 VanDerWaalsContact OG1-CE1 3.25Å; T384-F395 WeakPolarHBondContact OG1-CE1 3.39Å; T384-F399 HydrophobicContact CG2-CE2 3.89Å; T384-F399 HydrophobicContact CG2-CZ 3.8Å
385	Q	77.3	Confident	71.7	Confident	80 Å²	80	54.5 Å²	54.5	37%	0.374	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-55.4	137.6	164.1	-60.6	-176.2	18.2	0	0	109.9	V387	Q385-V387 PolarHBondContact O-N 2.8Å
386	P	81.5	Confident	73.9	Confident	52 Å²	52	56 Å²	56	34%	0.338	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-59.3	129.4	179.1	-23.8	32.3	0	0	0	112.5	F342 V343	F342-P386 WeakPolarHBondContact O-CA 3.28Å; V343-P386 HydrophobicContact CG2-CB 3.87Å; V343-P386 HydrophobicContact CG2-CG 3.76Å
387	V	80.6	Confident	75.7	Confident	31 Å²	31	50 Å²	50	19%	0.188	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	109.8	176.4	176.4	0	0	0	0	109.3	F342 Q385 P393 F395	F342-V387 PolarHBondContact N-O 3.17Å; F342-V387 PolarHBondContact O-N 2.94Å; Q385-V387 PolarHBondContact O-N 2.8Å; V387-P393 HydrophobicContact CB-CB 4.07Å; V387-P393 HydrophobicContact CG1-CB 3.72Å; V387-F395 HydrophobicContact CB-CD1 4.24Å; V387-F395 HydrophobicContact CB-CE1 3.92Å; V387-F395 HydrophobicContact CB-CZ 4.38Å; V387-F395 HydrophobicContact CG2-CD1 3.4Å; V387-F395 VanDerWaalsContact CG2-CD1 3.4Å; V387-F395 HydrophobicContact CG2-CE1 3.58Å; V387-F395 HydrophobicContact CG2-CG 4.11Å; V387-F395 HydrophobicContact CG2-CZ 4.39Å
388	S	82.7	Confident	77.6	Confident	59 Å²	59	51 Å²	51	41%	0.413	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.5	172.9	-45	0	0	0	0	110.6	T340 N341	T340-S388 WeakPolarHBondContact O-CA 3.44Å; N341-S388 WeakPolarHBondContact OD1-CB 3.13Å; N341-S388 PolarHBondContact OD1-OG 3.03Å
389	T	77.7	Confident	79	Confident	43 Å²	43	48.6 Å²	48.6	26%	0.264	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	170.8	171.8	-174	0	0	0	0	109.1	T340 F342 L391 P393	T340-T389 PolarHBondContact N-O 3.07Å; T340-T389 PolarHBondContact O-N 3.16Å; T340-T389 PolarHBondContact OG1-O 3.4Å; T340-T389 VanDerWaalsContact OG1-O 3.14Å; F342-T389 HydrophobicContact CD2-CG2 3.68Å; F342-T389 HydrophobicContact CE2-CG2 3.56Å; T389-L391 VanDerWaalsContact CG2-O 3.22Å; T389-L391 WeakPolarHBondContact CG2-O 3.39Å; T389-L391 PolarHBondContact OG1-O 3.24Å; T389-P393 HydrophobicContact CG2-CB 3.71Å; T389-P393 HydrophobicContact CG2-CG 4.33Å
390	S	70.9	Confident	80.7	Confident	38 Å²	38	44.5 Å²	44.5	27%	0.266	24%	0.24	S	C	.	.	S	Bend	trans	-85.5	-37.5	169.1	54.1	0	0	0	0	112.6	N326 S336 T338	N326-S390 PolarHBondContact ND2-O 3.29Å; S336-S390 WeakPolarHBondContact O-CB 3.47Å; S336-S390 PolarHBondContact O-OG 3.29Å; T338-S390 WeakPolarHBondContact O-CA 3.08Å
391	L	74.8	Confident	81.6	Confident	67 Å²	67	42.7 Å²	42.7	35%	0.351	23%	0.232	S	C	.	.	S	Bend	trans	-146.8	164.1	175.9	-65.2	173.2	0	0	0	110.3	V324 T389	V324-L391 VanDerWaalsContact O-CD2 3.26Å; V324-L391 WeakPolarHBondContact O-CD2 3.35Å; T389-L391 VanDerWaalsContact CG2-O 3.22Å; T389-L391 WeakPolarHBondContact CG2-O 3.39Å; T389-L391 PolarHBondContact OG1-O 3.24Å
392	N	82.8	Confident	82.3	Confident	82 Å²	82	41.8 Å²	41.8	44%	0.439	23%	0.232	S	C	.	.	S	Bend	trans	48.2	60.7	169.7	-54.3	-25.7	0	0	0	115.1	L321 I322 G323	L321-N392 CarbonylContact O-C 3.57Å; L321-N392 WeakPolarHBondContact O-CA 3.15Å; I322-N392 WeakPolarHBondContact CA-OD1 3.23Å; G323-N392 PolarHBondContact N-OD1 3.05Å
393	P	86.6	Confident	82.7	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.006	23%	0.227	C	C	.	.			trans	-61.2	142.2	178.6	27.7	-38.5	0	0	0	112.4	R320 L321 F342 V387 T389 F395	R320-P393 CarbonylContact C-O 3.11Å; R320-P393 VanDerWaalsContact CA-O 3.3Å; R320-P393 WeakPolarHBondContact CA-O 3.37Å; R320-P393 WeakPolarHBondContact CB-O 3.38Å; L321-P393 HydrophobicContact CB-CG 3.85Å; L321-P393 HydrophobicContact CD1-CG 3.68Å; L321-P393 HydrophobicContact CG-CG 4Å; L321-P393 PolarHBondContact N-O 2.94Å; F342-P393 HydrophobicContact CB-CB 4.02Å; F342-P393 HydrophobicContact CB-CG 3.75Å; F342-P393 HydrophobicContact CD1-CG 4.12Å; F342-P393 HydrophobicContact CD2-CB 3.95Å; F342-P393 HydrophobicContact CD2-CG 3.74Å; F342-P393 HydrophobicContact CE2-CG 4.34Å; F342-P393 HydrophobicContact CG-CB 4.13Å; F342-P393 HydrophobicContact CG-CG 3.6Å; V387-P393 HydrophobicContact CB-CB 4.07Å; V387-P393 HydrophobicContact CG1-CB 3.72Å; T389-P393 HydrophobicContact CG2-CB 3.71Å; T389-P393 HydrophobicContact CG2-CG 4.33Å; P393-F395 HydrophobicContact CB-CE2 3.79Å; P393-F395 HydrophobicContact CB-CZ 3.95Å; P393-F395 HydrophobicContact CG-CE2 3.76Å; P393-F395 HydrophobicContact CG-CZ 4.04Å
394	N	88.1	Confident	82.9	Confident	68 Å²	68	39.1 Å²	39.1	36%	0.364	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.1	171.5	-167	40.3	0	0	0	108.9	N319 R320 D396	N319-N394 PolarHBondContact O-OD1 2.77Å; R320-N394 HydrophobicContact CB-CB 4.49Å; R320-N394 WeakPolarHBondContact CB-OD1 3.23Å; N394-D396 PolarHBondContact ND2-OD2 3.03Å; N394-D396 PolarHBondContact OD1-OD2 3.42Å
395	F	87.8	Confident	83.1	Confident	11 Å²	11	40.8 Å²	40.8	5%	0.048	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-46.6	-173.3	-64.3	-87.5	0	0	0	112.2	I318 N319 L321 F342 V344 T384 V387 P393 Q397	I318-F395 HydrophobicContact CG2-CB 4.11Å; I318-F395 HydrophobicContact CG2-CD2 3.89Å; I318-F395 HydrophobicContact CG2-CG 4.12Å; N319-F395 PolarHBondContact O-N 2.99Å; L321-F395 HydrophobicContact CD1-CE2 3.91Å; L321-F395 HydrophobicContact CD1-CZ 4.31Å; L321-F395 HydrophobicContact CG-CE2 3.91Å; F342-F395 HydrophobicContact CB-CZ 3.82Å; F342-F395 WeakPolarHBondContact O-CE1 3.36Å; V344-F395 HydrophobicContact CG2-CD2 4.36Å; V344-F395 HydrophobicContact CG2-CE1 4.34Å; V344-F395 HydrophobicContact CG2-CE2 3.83Å; V344-F395 HydrophobicContact CG2-CZ 3.8Å; T384-F395 HydrophobicContact CG2-CB 4.35Å; T384-F395 HydrophobicContact CG2-CD1 3.82Å; T384-F395 HydrophobicContact CG2-CE1 4.4Å; T384-F395 HydrophobicContact CG2-CG 4.18Å; T384-F395 WeakPolarHBondContact OG1-CD1 3.21Å; T384-F395 VanDerWaalsContact OG1-CE1 3.25Å; T384-F395 WeakPolarHBondContact OG1-CE1 3.39Å; V387-F395 HydrophobicContact CB-CD1 4.24Å; V387-F395 HydrophobicContact CB-CE1 3.92Å; V387-F395 HydrophobicContact CB-CZ 4.38Å; V387-F395 HydrophobicContact CG2-CD1 3.4Å; V387-F395 VanDerWaalsContact CG2-CD1 3.4Å; V387-F395 HydrophobicContact CG2-CE1 3.58Å; V387-F395 HydrophobicContact CG2-CG 4.11Å; V387-F395 HydrophobicContact CG2-CZ 4.39Å; P393-F395 HydrophobicContact CB-CE2 3.79Å; P393-F395 HydrophobicContact CB-CZ 3.95Å; P393-F395 HydrophobicContact CG-CE2 3.76Å; P393-F395 HydrophobicContact CG-CZ 4.04Å; F395-Q397 VanDerWaalsContact C-N 3.34Å; F395-Q397 WeakPolarHBondContact O-CG 3.37Å; F395-Q397 PolarHBondContact O-N 3.26Å; F395-Q397 PolarHBondContact O-NE2 3.33Å; F395-Q397 VanDerWaalsContact O-NE2 3.15Å
396	D	89	Confident	83.4	Confident	59 Å²	59	43.8 Å²	43.8	32%	0.316	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	40.7	56.3	-173.1	-64.3	-40.3	0	0	0	113.2	I318 N319 N394 S440	I318-D396 VanDerWaalsContact O-CA 3.3Å; I318-D396 WeakPolarHBondContact O-CA 3.26Å; I318-D396 PolarHBondContact O-N 2.64Å; N319-D396 PolarHBondContact O-N 3.45Å; N319-D396 VanDerWaalsContact O-N 3.16Å; N394-D396 PolarHBondContact ND2-OD2 3.03Å; N394-D396 PolarHBondContact OD1-OD2 3.42Å; D396-S440 VanDerWaalsContact O-CA 3.23Å; D396-S440 WeakPolarHBondContact O-CA 3.36Å; D396-S440 WeakPolarHBondContact O-CB 3.03Å
397	Q	84.1	Confident	83.6	Confident	13 Å²	13	43 Å²	43	6%	0.061	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.7	-175.2	-83.8	163	64.4	0	0	112.3	T317 I318 F395 F399	T317-Q397 CarbonylContact C-O 3.57Å; T317-Q397 VanDerWaalsContact CA-O 3.31Å; T317-Q397 WeakPolarHBondContact CA-O 2.96Å; I318-Q397 PolarHBondContact N-O 3.01Å; I318-Q397 PolarHBondContact O-N 2.74Å; F395-Q397 VanDerWaalsContact C-N 3.34Å; F395-Q397 WeakPolarHBondContact O-CG 3.37Å; F395-Q397 PolarHBondContact O-N 3.26Å; F395-Q397 PolarHBondContact O-NE2 3.33Å; F395-Q397 VanDerWaalsContact O-NE2 3.15Å; Q397-F399 HydrophobicContact CB-CE2 4.01Å; Q397-F399 HydrophobicContact CB-CZ 3.99Å; Q397-F399 WeakPolarHBondContact O-CE2 3.31Å
398	S	86.9	Confident	83.8	Confident	21 Å²	21	41.5 Å²	41.5	15%	0.147	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134	-173.6	-57.2	0	0	0	0	112.1	N315 V316 T317 S443	N315-S398 WeakPolarHBondContact OD1-CB 3.42Å; V316-S398 WeakPolarHBondContact O-CA 3.45Å; T317-S398 WeakPolarHBondContact OG1-CB 3.5Å; T317-S398 PolarHBondContact OG1-OG 2.9Å; S398-S443 PolarHBondContact O-N 2.85Å; S398-S443 PolarHBondContact O-OG 3.07Å
399	F	86.7	Confident	83.9	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.3	-177.1	-54.4	-81.8	0	0	0	110.2	N315 V316 I318 L346 Y382 T384 Q397 F401 S443	N315-F399 CarbonylContact C-O 3.58Å; N315-F399 WeakPolarHBondContact CA-O 3.27Å; N315-F399 PolarHBondContact OD1-O 3.25Å; V316-F399 PolarHBondContact N-O 3.48Å; V316-F399 PolarHBondContact O-N 2.72Å; I318-F399 HydrophobicContact CG1-CD2 4.45Å; I318-F399 HydrophobicContact CG1-CE2 4.05Å; L346-F399 HydrophobicContact CD1-CD2 3.73Å; L346-F399 HydrophobicContact CD1-CE2 3.58Å; L346-F399 HydrophobicContact CD1-CG 4.28Å; L346-F399 HydrophobicContact CD1-CZ 4.01Å; L346-F399 HydrophobicContact CD2-CB 4.45Å; L346-F399 HydrophobicContact CD2-CD2 3.51Å; L346-F399 HydrophobicContact CD2-CE2 4.09Å; L346-F399 HydrophobicContact CD2-CG 4.17Å; L346-F399 HydrophobicContact CG-CD2 4.3Å; Y382-F399 HydrophobicContact CD1-CB 4.41Å; Y382-F399 AromaticContact CD1-CD1 3.68Å; Y382-F399 HydrophobicContact CD1-CD1 3.68Å; Y382-F399 HydrophobicContact CD1-CE1 4.49Å; Y382-F399 HydrophobicContact CD1-CG 4.44Å; Y382-F399 HydrophobicContact CD2-CB 4.32Å; Y382-F399 HydrophobicContact CG-CB 4.11Å; Y382-F399 AromaticContact CG-CD1 3.74Å; Y382-F399 HydrophobicContact CG-CD1 3.74Å; Y382-F399 HydrophobicContact CG-CG 4.19Å; T384-F399 HydrophobicContact CG2-CE2 3.89Å; T384-F399 HydrophobicContact CG2-CZ 3.8Å; Q397-F399 HydrophobicContact CB-CE2 4.01Å; Q397-F399 HydrophobicContact CB-CZ 3.99Å; Q397-F399 WeakPolarHBondContact O-CE2 3.31Å; F399-F401 HydrophobicContact CB-CE2 4.44Å; F399-S443 VanDerWaalsContact CD1-OG 3.23Å; F399-S443 WeakPolarHBondContact CD1-OG 3.5Å; F399-S443 VanDerWaalsContact CE1-OG 3.29Å; F399-S443 WeakPolarHBondContact CE1-OG 3.41Å
400	L	87	Confident	84.1	Confident	69 Å²	69	41.3 Å²	41.3	36%	0.361	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.4	-176.5	-56.9	-179.6	0	0	0	110.5	I313 N315 Y382	I313-L400 HydrophobicContact CG2-CB 3.99Å; I313-L400 HydrophobicContact CG2-CD2 3.98Å; I313-L400 HydrophobicContact CG2-CG 4.41Å; N315-L400 HydrophobicContact CB-CD2 3.66Å; Y382-L400 PolarHBondContact OH-O 3.33Å; Y382-L400 VanDerWaalsContact OH-O 3.05Å
401	F	82.3	Confident	84.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.3	171.7	-63.7	-93.4	0	0	0	110.4	I313 L314 V316 L346 L348 K380 Y382 F399 V403 L413	I313-F401 WeakPolarHBondContact CA-O 3.36Å; L314-F401 HydrophobicContact CB-CB 4.45Å; L314-F401 PolarHBondContact N-O 3.27Å; L314-F401 PolarHBondContact O-N 3.37Å; V316-F401 HydrophobicContact CB-CD2 4.49Å; V316-F401 HydrophobicContact CB-CE2 4.18Å; V316-F401 HydrophobicContact CG2-CD2 3.73Å; V316-F401 HydrophobicContact CG2-CE2 3.72Å; L346-F401 HydrophobicContact CB-CZ 4.09Å; L348-F401 HydrophobicContact CB-CD1 4.47Å; L348-F401 HydrophobicContact CD1-CB 3.49Å; L348-F401 VanDerWaalsContact CD1-CB 3.49Å; L348-F401 HydrophobicContact CD1-CD1 3.63Å; L348-F401 HydrophobicContact CD1-CD2 4.32Å; L348-F401 HydrophobicContact CD1-CE1 4.36Å; L348-F401 HydrophobicContact CD1-CG 3.58Å; L348-F401 HydrophobicContact CG-CB 4.31Å; L348-F401 HydrophobicContact CG-CD1 3.58Å; L348-F401 HydrophobicContact CG-CD2 4.32Å; L348-F401 HydrophobicContact CG-CE1 3.8Å; L348-F401 HydrophobicContact CG-CG 3.85Å; L348-F401 HydrophobicContact CG-CZ 4.26Å; K380-F401 WeakPolarHBondContact O-CE1 3.25Å; Y382-F401 HydrophobicContact CD2-CD1 4.2Å; Y382-F401 AromaticContact CD2-CE1 3.53Å; Y382-F401 HydrophobicContact CD2-CE1 3.53Å; Y382-F401 HydrophobicContact CD2-CE2 4.09Å; Y382-F401 AromaticContact CD2-CZ 3.48Å; Y382-F401 HydrophobicContact CD2-CZ 3.48Å; Y382-F401 VanDerWaalsContact CD2-CZ 3.48Å; Y382-F401 AromaticContact CE2-CD1 3.83Å; Y382-F401 HydrophobicContact CE2-CD1 3.83Å; Y382-F401 AromaticContact CE2-CE1 3.63Å; Y382-F401 HydrophobicContact CE2-CE1 3.63Å; Y382-F401 HydrophobicContact CE2-CE2 4.41Å; Y382-F401 HydrophobicContact CE2-CG 4.33Å; Y382-F401 AromaticContact CE2-CZ 3.96Å; Y382-F401 HydrophobicContact CE2-CZ 3.96Å; F399-F401 HydrophobicContact CB-CE2 4.44Å; F401-V403 HydrophobicContact CB-CG2 4.07Å; F401-V403 PolarHBondContact O-N 2.64Å; F401-L413 HydrophobicContact CE2-CD1 4.45Å
402	S	83.4	Confident	85.2	Confident	52 Å²	52	37.5 Å²	37.5	36%	0.364	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	113.5	170.3	-48.1	0	0	0	0	109.4	G312 G377	G312-S402 CarbonylContact O-C 3.36Å; G312-S402 WeakPolarHBondContact O-CA 3.29Å; G377-S402 WeakPolarHBondContact CA-O 3.45Å
403	V	84.2	Confident	85.4	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.018	19%	0.188	C	C	.	.			trans	-143.1	126.6	-179.4	-170.5	0	0	0	0	107.6	Y307 G312 L314 L348 F401 E407 L408 V411	Y307-V403 WeakPolarHBondContact CE2-O 3.46Å; Y307-V403 PolarHBondContact OH-O 3.05Å; Y307-V403 VanDerWaalsContact OH-O 3.04Å; G312-V403 CarbonylContact C-O 3.54Å; G312-V403 WeakPolarHBondContact CA-O 3.48Å; G312-V403 CarbonylContact O-C 3.57Å; G312-V403 PolarHBondContact O-N 2.99Å; L314-V403 HydrophobicContact CB-CG2 4.38Å; L348-V403 HydrophobicContact CD1-CG2 3.25Å; F401-V403 HydrophobicContact CB-CG2 4.07Å; F401-V403 PolarHBondContact O-N 2.64Å; V403-E407 HydrophobicContact CG1-CB 3.82Å; V403-L408 HydrophobicContact CB-CD2 4.36Å; V403-L408 HydrophobicContact CG1-CD2 3.89Å; V403-V411 HydrophobicContact CG1-CG2 4.05Å
404	T	85.3	Confident	85.4	Confident	67 Å²	67	34 Å²	34	41%	0.411	19%	0.19	S	C	.	.			trans	-77	158.1	177.6	67.5	0	0	0	0	111.1	N406 E407	T404-N406 PolarHBondContact O-N 2.92Å; T404-E407 WeakPolarHBondContact CB-OE2 3.32Å; T404-E407 WeakPolarHBondContact CG2-OE2 3.35Å; T404-E407 PolarHBondContact N-OE2 3.03Å; T404-E407 PolarHBondContact O-N 3.36Å; T404-E407 VanDerWaalsContact OG1-CG 3.32Å; T404-E407 WeakPolarHBondContact OG1-CG 3.48Å; T404-E407 PolarHBondContact OG1-OE2 3.36Å
405	V	85.6	Confident	85.3	Confident	40 Å²	40	30.7 Å²	30.7	24%	0.242	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-53.3	-42.6	-178.3	179.1	0	0	0	0	111.2	Y307 C309 E407 L408 Q478 I482	Y307-V405 HydrophobicContact CE1-CG2 4.01Å; Y307-V405 WeakPolarHBondContact OH-CA 3.49Å; Y307-V405 WeakPolarHBondContact OH-CG2 3.45Å; Y307-V405 PolarHBondContact OH-N 3.37Å; Y307-V405 VanDerWaalsContact OH-N 3.09Å; C309-V405 HydrophobicContact CB-CG2 4.44Å; V405-E407 PolarHBondContact O-N 3.24Å; V405-L408 PolarHBondContact O-N 2.83Å; V405-Q478 HydrophobicContact CG1-CG 4.25Å; V405-Q478 PolarHBondContact O-OE1 3.35Å; V405-I482 HydrophobicContact CG1-CD1 4.06Å
406	N	84.5	Confident	85.1	Confident	143 Å²	143	30.8 Å²	30.8	77%	0.765	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-69.6	-17.6	-176.4	-57.9	-10.5	0	0	0	113.7	T404	T404-N406 PolarHBondContact O-N 2.92Å
407	E	83.8	Confident	84.8	Confident	35 Å²	35	28 Å²	28	16%	0.164	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-91.9	-16.3	179.5	-68.6	164.6	135.6	0	0	112.2	S375 F378 V403 T404 V405 D409 S410 V411	S375-E407 VanDerWaalsContact CB-OE1 3.31Å; S375-E407 WeakPolarHBondContact CB-OE1 3.45Å; S375-E407 PolarHBondContact OG-OE1 3.15Å; F378-E407 HydrophobicContact CZ-CB 4.49Å; V403-E407 HydrophobicContact CG1-CB 3.82Å; T404-E407 WeakPolarHBondContact CB-OE2 3.32Å; T404-E407 WeakPolarHBondContact CG2-OE2 3.35Å; T404-E407 PolarHBondContact N-OE2 3.03Å; T404-E407 PolarHBondContact O-N 3.36Å; T404-E407 VanDerWaalsContact OG1-CG 3.32Å; T404-E407 WeakPolarHBondContact OG1-CG 3.48Å; T404-E407 PolarHBondContact OG1-OE2 3.36Å; V405-E407 PolarHBondContact O-N 3.24Å; E407-D409 PolarHBondContact O-N 2.76Å; E407-S410 CarbonylContact O-C 3.54Å; E407-S410 WeakPolarHBondContact O-CA 3.42Å; E407-S410 PolarHBondContact O-N 2.93Å; E407-S410 PolarHBondContact O-OG 2.9Å; E407-S410 VanDerWaalsContact O-OG 3.07Å; E407-V411 HydrophobicContact CB-CG2 4.28Å; E407-V411 WeakPolarHBondContact O-CG2 3.41Å; E407-V411 PolarHBondContact O-N 3.4Å; E407-V411 VanDerWaalsContact O-N 3.17Å
408	L	85.4	Confident	84.6	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-57.5	-51.3	-171.3	-72	176.8	0	0	0	113.1	Y307 V403 V405 S410 V411 L476 Q478 L481	Y307-L408 HydrophobicContact CD1-CD1 3.83Å; Y307-L408 HydrophobicContact CD2-CD1 4.25Å; Y307-L408 HydrophobicContact CD2-CD2 4.07Å; Y307-L408 HydrophobicContact CE1-CD1 3.65Å; Y307-L408 HydrophobicContact CE2-CD1 4.11Å; Y307-L408 HydrophobicContact CE2-CD2 3.98Å; Y307-L408 HydrophobicContact CE2-CG 4.39Å; Y307-L408 HydrophobicContact CG-CD1 4.12Å; V403-L408 HydrophobicContact CB-CD2 4.36Å; V403-L408 HydrophobicContact CG1-CD2 3.89Å; V405-L408 PolarHBondContact O-N 2.83Å; L408-S410 PolarHBondContact O-N 2.94Å; L408-S410 VanDerWaalsContact O-N 3.16Å; L408-V411 PolarHBondContact O-N 2.82Å; L408-L476 HydrophobicContact CD2-CD1 4.04Å; L408-L476 WeakPolarHBondContact O-CB 3.18Å; L408-Q478 HydrophobicContact CB-CB 4.03Å; L408-Q478 HydrophobicContact CD1-CB 4.38Å; L408-Q478 HydrophobicContact CD1-CG 4.21Å; L408-L481 HydrophobicContact CD1-CD1 4.15Å; L408-L481 HydrophobicContact CD2-CD1 3.91Å; L408-L481 HydrophobicContact CG-CD1 4.48Å
409	D	85.2	Confident	84.2	Confident	75 Å²	75	27.8 Å²	27.8	40%	0.401	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-67.2	-17.1	-179.4	-76	-21.2	0	0	0	113.8	E407 K475 Q478	E407-D409 PolarHBondContact O-N 2.76Å; D409-K475 VanDerWaalsContact O-CE 3.31Å; D409-K475 WeakPolarHBondContact O-CE 3.06Å; D409-Q478 VanDerWaalsContact OD1-CB 3.31Å; D409-Q478 WeakPolarHBondContact OD1-CB 3.39Å; D409-Q478 PolarHBondContact OD1-N 3.14Å
410	S	82	Confident	83.4	Confident	23 Å²	23	28 Å²	28	16%	0.161	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-101	15.5	174.5	74	0	0	0	0	113.2	H350 N351 E407 L408	H350-S410 CarbonylContact C-O 3.59Å; H350-S410 WeakPolarHBondContact CA-O 3.4Å; H350-S410 PolarHBondContact CD2-O 2.88Å; H350-S410 PolarHBondContact CD2-OG 2.83Å; H350-S410 VanDerWaalsContact CD2-OG 3.26Å; H350-S410 VanDerWaalsContact NE2-CB 3.28Å; H350-S410 WeakPolarHBondContact NE2-CB 3.46Å; H350-S410 PolarHBondContact NE2-OG 2.82Å; N351-S410 WeakPolarHBondContact CB-O 3.25Å; N351-S410 PolarHBondContact N-O 2.84Å; E407-S410 CarbonylContact O-C 3.54Å; E407-S410 WeakPolarHBondContact O-CA 3.42Å; E407-S410 PolarHBondContact O-N 2.93Å; E407-S410 PolarHBondContact O-OG 2.9Å; E407-S410 VanDerWaalsContact O-OG 3.07Å; L408-S410 PolarHBondContact O-N 2.94Å; L408-S410 VanDerWaalsContact O-N 3.16Å
411	V	83.4	Confident	82.3	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	145.8	177.6	171.4	0	0	0	0	111.8	L348 R349 F378 V403 E407 L408 L476	L348-V411 HydrophobicContact CB-CG1 4.02Å; L348-V411 HydrophobicContact CD1-CG1 4.13Å; L348-V411 HydrophobicContact CD2-CG1 3.81Å; L348-V411 HydrophobicContact CG-CG1 4.2Å; R349-V411 CarbonylContact O-C 3.6Å; R349-V411 WeakPolarHBondContact O-CA 3.44Å; F378-V411 HydrophobicContact CE1-CG2 3.56Å; F378-V411 HydrophobicContact CZ-CG2 3.43Å; F378-V411 VanDerWaalsContact CZ-CG2 3.43Å; V403-V411 HydrophobicContact CG1-CG2 4.05Å; E407-V411 HydrophobicContact CB-CG2 4.28Å; E407-V411 WeakPolarHBondContact O-CG2 3.41Å; E407-V411 PolarHBondContact O-N 3.4Å; E407-V411 VanDerWaalsContact O-N 3.17Å; L408-V411 PolarHBondContact O-N 2.82Å; V411-L476 HydrophobicContact CB-CD1 3.89Å; V411-L476 HydrophobicContact CB-CG 4.4Å; V411-L476 HydrophobicContact CG1-CD1 3.46Å; V411-L476 VanDerWaalsContact CG1-CD1 3.46Å; V411-L476 HydrophobicContact CG1-CG 4.07Å; V411-L476 PolarHBondContact O-N 3.35Å
412	E	85.4	Confident	81.2	Confident	25 Å²	25	29.4 Å²	29.4	12%	0.117	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.7	172.1	-175.3	-172.4	-122.1	0	0	109.8	R349 F473 Y474	R349-E412 IonicContact CZ-OE2 3.99Å; R349-E412 VanDerWaalsContact CZ-OE2 3.26Å; R349-E412 PolarHBondContact N-O 2.87Å; R349-E412 IonicContact NE-OE2 3.59Å; R349-E412 PolarHBondContact NE-OE2 2.81Å; R349-E412 IonicContact NH2-OE1 3.19Å; R349-E412 IonicContact NH2-OE2 3.32Å; R349-E412 PolarHBondContact NH2-OE2 3.29Å; R349-E412 PolarHBondContact O-N 3.14Å; E412-F473 HydrophobicContact CG-CB 4.21Å; E412-F473 WeakPolarHBondContact OE1-CB 3.45Å; E412-F473 WeakPolarHBondContact OE2-CD1 3.26Å; E412-Y474 CarbonylContact C-O 3.5Å; E412-Y474 WeakPolarHBondContact CA-O 3.45Å
413	L	87.7	Confident	79.6	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	121.4	171.2	174.1	65.5	0	0	0	109.4	F303 L305 V316 L348 F401 L415 Y474 L476	F303-L413 HydrophobicContact CD2-CD2 4.15Å; F303-L413 HydrophobicContact CE2-CD2 3.98Å; L305-L413 HydrophobicContact CD2-CD2 3.83Å; V316-L413 HydrophobicContact CG1-CD1 4.31Å; V316-L413 HydrophobicContact CG1-CD2 3.63Å; V316-L413 HydrophobicContact CG2-CD1 4.35Å; V316-L413 HydrophobicContact CG2-CD2 4.23Å; L348-L413 HydrophobicContact CD2-CB 4.03Å; L348-L413 HydrophobicContact CD2-CD1 3.85Å; F401-L413 HydrophobicContact CE2-CD1 4.45Å; L413-L415 HydrophobicContact CD1-CD2 3.91Å; L413-L415 HydrophobicContact CD2-CD1 4.3Å; L413-L415 HydrophobicContact CD2-CD2 4.11Å; L413-L415 HydrophobicContact CD2-CG 4.28Å; L413-L415 HydrophobicContact CG-CD2 3.91Å; L413-L415 HydrophobicContact CG-CG 4.06Å; L413-Y474 PolarHBondContact N-O 2.83Å; L413-Y474 PolarHBondContact O-N 3.42Å; L413-L476 HydrophobicContact CB-CD2 4.41Å
414	V	85.2	Confident	77.5	Confident	8 Å²	8	37.8 Å²	37.8	5%	0.048	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	123.4	176.8	-170.2	0	0	0	0	108.8	L346 R347 R349 V471 F473	L346-V414 WeakPolarHBondContact CA-O 3.31Å; R347-V414 HydrophobicContact CG-CB 3.85Å; R347-V414 HydrophobicContact CG-CG2 4.29Å; R347-V414 PolarHBondContact N-O 2.85Å; R347-V414 PolarHBondContact O-N 2.8Å; R349-V414 HydrophobicContact CB-CG2 4.05Å; V414-V471 HydrophobicContact CG1-CG1 3.91Å; V414-F473 HydrophobicContact CB-CD1 4.38Å; V414-F473 HydrophobicContact CG1-CD1 3.94Å; V414-F473 HydrophobicContact CG1-CE1 3.74Å; V414-F473 HydrophobicContact CG2-CD1 3.9Å; V414-F473 HydrophobicContact CG2-CE1 4.14Å
415	L	86.8	Confident	74.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.8	179.3	-58.2	177.8	0	0	0	109.7	I301 F303 I318 S345 L346 L413 V471 T472	I301-L415 HydrophobicContact CD1-CB 4.18Å; I301-L415 HydrophobicContact CD1-CD1 3.88Å; I301-L415 HydrophobicContact CG1-CD1 4.44Å; I301-L415 HydrophobicContact CG2-CD1 4.42Å; F303-L415 HydrophobicContact CD1-CD1 3.49Å; F303-L415 VanDerWaalsContact CD1-CD1 3.49Å; F303-L415 HydrophobicContact CD2-CD1 4.39Å; F303-L415 HydrophobicContact CE1-CD1 3.68Å; F303-L415 HydrophobicContact CG-CD1 3.88Å; F303-L415 HydrophobicContact CZ-CD1 4.21Å; I318-L415 HydrophobicContact CD1-CD1 4.23Å; I318-L415 HydrophobicContact CD1-CD2 3.89Å; S345-L415 WeakPolarHBondContact O-CA 3.24Å; L346-L415 HydrophobicContact CB-CD2 3.97Å; L346-L415 HydrophobicContact CD2-CD2 3.89Å; L346-L415 HydrophobicContact CG-CD2 3.63Å; L413-L415 HydrophobicContact CD1-CD2 3.91Å; L413-L415 HydrophobicContact CD2-CD1 4.3Å; L413-L415 HydrophobicContact CD2-CD2 4.11Å; L413-L415 HydrophobicContact CD2-CG 4.28Å; L413-L415 HydrophobicContact CG-CD2 3.91Å; L413-L415 HydrophobicContact CG-CG 4.06Å; L415-V471 CarbonylContact O-C 3.59Å; L415-V471 VanDerWaalsContact O-CA 3.28Å; L415-V471 WeakPolarHBondContact O-CA 3.34Å; L415-T472 HydrophobicContact CB-CG2 3.99Å; L415-T472 HydrophobicContact CD1-CG2 4.31Å; L415-T472 PolarHBondContact N-O 3.39Å; L415-T472 PolarHBondContact O-N 3.24Å
416	A	83.3	Confident	72.4	Confident	13 Å²	13	49.4 Å²	49.4	11%	0.107	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.7	-179.3	0	0	0	0	0	110.8	V344 S345 F418 V471	V344-A416 CarbonylContact C-O 3.5Å; V344-A416 WeakPolarHBondContact CA-O 3.24Å; S345-A416 PolarHBondContact N-O 2.9Å; S345-A416 PolarHBondContact O-N 3.04Å; A416-F418 HydrophobicContact CB-CE2 3.65Å; A416-F418 HydrophobicContact CB-CZ 4.08Å; A416-F418 WeakPolarHBondContact O-CD2 3.42Å; A416-V471 HydrophobicContact CB-CG2 3.58Å
417	V	83.5	Confident	69.9	Low	0 Å²	0	48 Å²	48	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	132.4	-179.3	-178.1	0	0	0	0	110.2	I301 L321 V344 C468 I469 G470 L495	I301-V417 HydrophobicContact CD1-CG2 4.37Å; L321-V417 HydrophobicContact CD1-CB 4.41Å; L321-V417 HydrophobicContact CD1-CG1 3.43Å; L321-V417 VanDerWaalsContact CD1-CG1 3.43Å; L321-V417 HydrophobicContact CD1-CG2 4.04Å; L321-V417 HydrophobicContact CD2-CG2 3.88Å; V344-V417 HydrophobicContact CG2-CG2 4.26Å; V417-C468 CarbonylContact O-C 3.59Å; V417-C468 WeakPolarHBondContact O-CA 3.33Å; V417-C468 PolarHBondContact O-SG 2.84Å; V417-I469 HydrophobicContact CG1-CB 4.35Å; V417-I469 HydrophobicContact CG1-CD1 3.6Å; V417-I469 HydrophobicContact CG1-CG1 4.28Å; V417-I469 PolarHBondContact O-N 3.12Å; V417-G470 PolarHBondContact N-O 2.86Å; V417-L495 HydrophobicContact CB-CD1 4.26Å; V417-L495 HydrophobicContact CG2-CD1 3.78Å; V417-L495 HydrophobicContact CG2-CD2 3.61Å; V417-L495 HydrophobicContact CG2-CG 4.36Å
418	F	79.6	Confident	67.3	Low	25 Å²	25	53.3 Å²	53.3	11%	0.11	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.4	178	-59.9	-94.4	0	0	0	110.7	F342 V343 A416 M466 R467 C468 L689	F342-F418 VanDerWaalsContact CA-O 3.31Å; F342-F418 WeakPolarHBondContact CA-O 3.42Å; V343-F418 HydrophobicContact CB-CB 4.47Å; V343-F418 PolarHBondContact N-O 2.98Å; V343-F418 PolarHBondContact O-N 2.92Å; A416-F418 HydrophobicContact CB-CE2 3.65Å; A416-F418 HydrophobicContact CB-CZ 4.08Å; A416-F418 WeakPolarHBondContact O-CD2 3.42Å; F418-M466 HydrophobicContact CB-CB 4.31Å; F418-R467 CarbonylContact C-O 3.53Å; F418-R467 WeakPolarHBondContact CA-O 3.34Å; F418-C468 HydrophobicContact CD1-CB 3.84Å; F418-C468 HydrophobicContact CE1-CB 3.73Å; F418-C468 HydrophobicContact CZ-CB 4.49Å; F418-L689 HydrophobicContact CZ-CD2 4.47Å
419	Q	77.2	Confident	65.1	Low	5 Å²	5	61 Å²	61	2%	0.023	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	140.7	168.3	62.6	-177	32.6	0	0	110.9	N341 F342 M466 R467 I469	N341-Q419 CarbonylContact O-C 3.59Å; N341-Q419 VanDerWaalsContact O-CA 3.27Å; N341-Q419 WeakPolarHBondContact O-CA 3.37Å; F342-Q419 HydrophobicContact CD1-CB 4.13Å; F342-Q419 HydrophobicContact CE1-CB 4.13Å; Q419-M466 CarbonylContact O-C 3.44Å; Q419-M466 WeakPolarHBondContact O-CA 3.37Å; Q419-R467 HydrophobicContact CG-CB 4.29Å; Q419-R467 PolarHBondContact N-O 2.79Å; Q419-R467 PolarHBondContact O-N 3.49Å; Q419-I469 HydrophobicContact CB-CD1 3.67Å; Q419-I469 HydrophobicContact CB-CG1 4.01Å; Q419-I469 HydrophobicContact CG-CD1 3.8Å; Q419-I469 HydrophobicContact CG-CG1 3.61Å
420	S	70.4	Confident	62.6	Low	6 Å²	6	64.1 Å²	64.1	4%	0.042	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140	157.1	167.2	0	0	0	0	109.5	T340 N341	T340-S420 CarbonylContact C-O 3.55Å; T340-S420 WeakPolarHBondContact CA-O 3.23Å; N341-S420 PolarHBondContact N-O 3.33Å; N341-S420 PolarHBondContact O-N 3.11Å
421	T	64.6	Low	60.5	Low	40 Å²	40	70 Å²	70	25%	0.245	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	108.8	174.5	-56.6	0	0	0	0	109	V328 T338 T340 V423	V328-T421 HydrophobicContact CG2-CG2 3.99Å; T338-T421 HydrophobicContact CG2-CG2 3.47Å; T338-T421 VanDerWaalsContact CG2-CG2 3.47Å; T340-T421 HydrophobicContact CG2-CG2 4.16Å; T340-T421 WeakPolarHBondContact CG2-OG1 3.48Å; T421-V423 HydrophobicContact CG2-CG2 4.08Å; T421-V423 PolarHBondContact O-N 3.04Å
422	T	58.6	Low	57.9	Low	57 Å²	57	78.2 Å²	78.2	35%	0.35	42%	0.415	S	S	.	.			trans	-76.4	93.1	170.6	52.2	0	0	0	0	108.7	S339 N341 N424	S339-T422 PolarHBondContact O-OG1 3.36Å; N341-T422 WeakPolarHBondContact ND2-CG2 3.37Å; T422-N424 PolarHBondContact O-N 3.17Å
423	V	50.5	Low	55.6	Low	94 Å²	94	87.8 Å²	87.8	57%	0.57	45%	0.45	S	S	*	.			trans	-72.3	108.6	166.6	-175.8	0	0	0	0	107	T421 E425	T421-V423 HydrophobicContact CG2-CG2 4.08Å; T421-V423 PolarHBondContact O-N 3.04Å; V423-E425 HydrophobicContact CG1-CG 4.13Å; V423-E425 PolarHBondContact O-N 2.84Å
424	N	38.6	Very low	53.2	Low	137 Å²	137	95 Å²	95	73%	0.733	49%	0.487	S	S	*	.			trans	-75.4	65	179.1	-75.6	-14.3	0	0	0	111.3	T422	T422-N424 PolarHBondContact O-N 3.17Å
425	E	32.7	Very low	50.9	Low	150 Å²	150	99.6 Å²	99.6	70%	0.701	52%	0.517	S	S	*	.			trans	-84.5	138	157.2	-74.4	173	-161.9	0	0	108	V423	V423-E425 HydrophobicContact CG1-CG 4.13Å; V423-E425 PolarHBondContact O-N 2.84Å
426	F	31.7	Very low	48.3	Very low	202 Å²	202	110.2 Å²	110.2	89%	0.886	56%	0.557	S	S	*	*			trans	71.5	62.1	-167.2	-48	-71	0	0	0	116.6	N428	F426-N428 PolarHBondContact O-N 3.04Å; F426-N428 VanDerWaalsContact O-N 3.14Å
427	T	32.1	Very low	45.9	Very low	113 Å²	113	120.3 Å²	120.3	69%	0.693	59%	0.592	S	S	*	*			trans	-58.5	110.6	141.5	51.3	0	0	0	0	109.4
428	N	29	Very low	43.6	Very low	146 Å²	146	125.6 Å²	125.6	78%	0.781	62%	0.62	S	S	*	*			trans	154	87	140.2	-77.5	-27.1	0	0	0	112.4	F426	F426-N428 PolarHBondContact O-N 3.04Å; F426-N428 VanDerWaalsContact O-N 3.14Å
429	L	40.6	Very low	41.4	Very low	162 Å²	162	130.6 Å²	130.6	85%	0.848	65%	0.648	S	S	*	*	S	Bend		-164.9	107.8	127	-127.8	77	0	0	0	110.9
430	N	32.7	Very low	39.4	Very low	140 Å²	140	134.8 Å²	134.8	75%	0.749	68%	0.678	S	S	*	*			trans	31.1	92.9	152.4	-58.6	-22.5	0	0	0	118.7
431	N	36.8	Very low	38	Very low	148 Å²	148	137.5 Å²	137.5	79%	0.791	69%	0.694	S	S	*	*				-179.1	128.9	108.1	-92.1	-49.6	0	0	0	112.9	R433	N431-R433 PolarHBondContact O-N 3.09Å
432	N	29.8	Very low	36.7	Very low	171 Å²	171	138.6 Å²	138.6	91%	0.914	70%	0.701	S	S	*	*			trans	-64.4	97.4	175.9	-67.5	-29.1	0	0	0	111.7
433	R	37	Very low	35.7	Very low	226 Å²	226	137.6 Å²	137.6	85%	0.853	70%	0.696	S	S	*	*			trans	-135.3	83.3	167	-70	-167.7	-177.8	-171.6	2.8	111.3	N431	N431-R433 PolarHBondContact O-N 3.09Å
434	I	36.4	Very low	34.9	Very low	153 Å²	153	142 Å²	142	79%	0.785	70%	0.704	S	S	*	*			trans	-55.5	128	162.6	-59.9	163.9	0	0	0	108	R436	I434-R436 PolarHBondContact O-N 2.84Å; I434-R436 VanDerWaalsContact O-N 3.11Å
435	P	36.1	Very low	34.6	Very low	104 Å²	104	140 Å²	140	68%	0.675	69%	0.69	S	S	*	*			trans	-62.2	113.7	170.8	-19.2	31.8	0	0	0	109.1	R437	P435-R437 PolarHBondContact O-N 3.24Å
436	R	32.3	Very low	34.6	Very low	223 Å²	223	140.6 Å²	140.6	84%	0.842	69%	0.693	S	S	*	*			trans	-72.8	127.7	174.9	-74.2	-176.3	168.2	119.1	-5.6	109.1	I434 N438	I434-R436 PolarHBondContact O-N 2.84Å; I434-R436 VanDerWaalsContact O-N 3.11Å; R436-N438 PolarHBondContact O-N 2.98Å
437	R	33.5	Very low	34.7	Very low	225 Å²	225	134.1 Å²	134.1	85%	0.849	67%	0.672	S	S	*	*			trans	-51.5	126.7	160.2	-91.9	177.8	150.3	151.2	-6.9	108.5	P435	P435-R437 PolarHBondContact O-N 3.24Å
438	N	35	Very low	34.4	Very low	110 Å²	110	138.5 Å²	138.5	59%	0.588	68%	0.677	S	S	*	*			trans	-117.9	143.7	169.1	-75	-17.9	0	0	0	108.9	R436	R436-N438 PolarHBondContact O-N 2.98Å
439	N	33.9	Very low	34.7	Very low	131 Å²	131	136.8 Å²	136.8	70%	0.701	67%	0.674	S	S	*	*			trans	-65.1	162	-174.8	-57.6	-17.6	0	0	0	112.2	V441	N439-V441 WeakPolarHBondContact O-CG2 3.46Å; N439-V441 PolarHBondContact O-N 3.14Å
440	S	35.7	Very low	34.1	Very low	92 Å²	92	135.1 Å²	135.1	64%	0.643	66%	0.657	S	S	*	*			trans	-38.1	108.5	179.1	57.3	0	0	0	0	113.3	D396	D396-S440 VanDerWaalsContact O-CA 3.23Å; D396-S440 WeakPolarHBondContact O-CA 3.36Å; D396-S440 WeakPolarHBondContact O-CB 3.03Å
441	V	41.4	Very low	34.1	Very low	63 Å²	63	131.3 Å²	131.3	38%	0.382	65%	0.652	S	S	.	*			trans	-101.2	117.7	177.9	-174.7	0	0	0	0	108.4	N439 S443	N439-V441 WeakPolarHBondContact O-CG2 3.46Å; N439-V441 PolarHBondContact O-N 3.14Å; V441-S443 PolarHBondContact O-N 3.47Å; V441-S443 VanDerWaalsContact O-N 3.12Å
442	V	35.6	Very low	33.8	Very low	63 Å²	63	130.4 Å²	130.4	38%	0.382	65%	0.647	S	S	.	*	B	Isolated β-bridge	trans	-62.7	109.3	161.2	177.2	0	0	0	0	106.9	Y444	V442-Y444 HydrophobicContact CB-CE2 4.07Å; V442-Y444 HydrophobicContact CG1-CD2 4.3Å; V442-Y444 HydrophobicContact CG1-CE1 4.19Å; V442-Y444 HydrophobicContact CG1-CE2 3.88Å; V442-Y444 WeakPolarHBondContact O-CD2 3.32Å; V442-Y444 PolarHBondContact O-N 2.83Å; V442-Y444 VanDerWaalsContact O-N 3.11Å
443	S	39.2	Very low	33.9	Very low	37 Å²	37	128.1 Å²	128.1	26%	0.259	63%	0.634	S	S	.	*			trans	-80.4	97.2	-179.6	62.7	0	0	0	0	109.4	S398 F399 V441	S398-S443 PolarHBondContact O-N 2.85Å; S398-S443 PolarHBondContact O-OG 3.07Å; F399-S443 VanDerWaalsContact CD1-OG 3.23Å; F399-S443 WeakPolarHBondContact CD1-OG 3.5Å; F399-S443 VanDerWaalsContact CE1-OG 3.29Å; F399-S443 WeakPolarHBondContact CE1-OG 3.41Å; V441-S443 PolarHBondContact O-N 3.47Å; V441-S443 VanDerWaalsContact O-N 3.12Å
444	Y	32.4	Very low	33.8	Very low	186 Å²	186	128.7 Å²	128.7	73%	0.729	64%	0.637	S	S	*	*			trans	-66.5	142.3	172.9	-66.8	-83.4	0	0	0	111.3	V442	V442-Y444 HydrophobicContact CB-CE2 4.07Å; V442-Y444 HydrophobicContact CG1-CD2 4.3Å; V442-Y444 HydrophobicContact CG1-CE1 4.19Å; V442-Y444 HydrophobicContact CG1-CE2 3.88Å; V442-Y444 WeakPolarHBondContact O-CD2 3.32Å; V442-Y444 PolarHBondContact O-N 2.83Å; V442-Y444 VanDerWaalsContact O-N 3.11Å
445	H	32.8	Very low	33.6	Very low	94 Å²	94	126 Å²	126	44%	0.435	63%	0.631	S	S	.	*			trans	-21	131.7	178.4	-140.5	-120.4	0	0	0	117.3	K380 S447	K380-H445 PolarHBondContact NZ-NE2 3.02Å; H445-S447 WeakPolarHBondContact ND1-CB 3.32Å; H445-S447 PolarHBondContact ND1-N 3.18Å; H445-S447 PolarHBondContact ND1-OG 3.29Å
446	H	32.2	Very low	33.4	Very low	164 Å²	164	128.8 Å²	128.8	76%	0.759	64%	0.639	S	S	*	*			trans	-99.1	71.2	153.7	-98.2	18.6	0	0	0	109.5
447	S	33.5	Very low	33.5	Very low	65 Å²	65	129.6 Å²	129.6	46%	0.455	64%	0.642	S	S	.	*			trans	-84.6	121	148.8	43	0	0	0	0	106.9	H445 P449	H445-S447 WeakPolarHBondContact ND1-CB 3.32Å; H445-S447 PolarHBondContact ND1-N 3.18Å; H445-S447 PolarHBondContact ND1-OG 3.29Å; S447-P449 WeakPolarHBondContact O-CD 3.25Å; S447-P449 WeakPolarHBondContact O-CG 3.27Å; S447-P449 VanDerWaalsContact O-N 3.11Å
448	Y	27	Very low	33.6	Very low	205 Å²	205	127.7 Å²	127.7	80%	0.804	64%	0.635	S	S	*	*			trans	-45.1	113.9	175.6	-77.3	-96	0	0	0	111.9
449	P	35.1	Very low	33.7	Very low	110 Å²	110	127.3 Å²	127.3	71%	0.714	64%	0.636	S	S	*	*			trans	-104.9	126.7	164.1	12.3	10.9	0	0	0	108.2	S447 G451	S447-P449 WeakPolarHBondContact O-CD 3.25Å; S447-P449 WeakPolarHBondContact O-CG 3.27Å; S447-P449 VanDerWaalsContact O-N 3.11Å; P449-G451 PolarHBondContact O-N 3.05Å
450	Y	28.1	Very low	33.7	Very low	127 Å²	127	128.1 Å²	128.1	50%	0.498	64%	0.641	S	S	.	*			trans	-63.1	99.9	175	-147.8	-82.1	0	0	0	109.9	D626 Q627	Y450-D626 WeakPolarHBondContact CE2-OD1 3.17Å; Y450-D626 PolarHBondContact OH-OD1 2.99Å; Y450-Q627 HydrophobicContact CE1-CB 3.75Å; Y450-Q627 HydrophobicContact CE1-CG 3.75Å; Y450-Q627 VanDerWaalsContact OH-CB 3.26Å; Y450-Q627 WeakPolarHBondContact OH-CB 3.42Å; Y450-Q627 VanDerWaalsContact OH-CG 3.31Å; Y450-Q627 WeakPolarHBondContact OH-CG 3.24Å; Y450-Q627 PolarHBondContact OH-N 2.9Å
451	G	33.1	Very low	33.8	Very low	61 Å²	61	129.3 Å²	129.3	63%	0.629	64%	0.637	S	S	*	*			trans	178	129.6	-174.3	0	0	0	0	0	115.9	P449 D453	P449-G451 PolarHBondContact O-N 3.05Å; G451-D453 PolarHBondContact O-N 3.11Å
452	N	29.2	Very low	33.7	Very low	128 Å²	128	130.1 Å²	130.1	68%	0.684	64%	0.639	S	S	*	*			trans	-72.2	87.9	175.8	-89	-46.4	0	0	0	112	N628	N452-N628 PolarHBondContact ND2-OD1 2.81Å
453	D	32.6	Very low	34	Very low	123 Å²	123	129.1 Å²	129.1	66%	0.658	64%	0.635	S	S	*	*			trans	-143.2	92.9	166.5	-126.1	-18.4	0	0	0	116.1	G451 C455	G451-D453 PolarHBondContact O-N 3.11Å; D453-C455 VanDerWaalsContact C-N 3.27Å; D453-C455 PolarHBondContact O-N 3.32Å
454	R	34.7	Very low	34.1	Very low	238 Å²	238	132.1 Å²	132.1	90%	0.898	64%	0.644	S	S	*	*	S	Bend	trans	49.6	1.4	141.7	-57.5	179.9	-158.4	-142.5	-0.8	121.9
455	C	31.6	Very low	35	Very low	98 Å²	98	130 Å²	130	66%	0.662	64%	0.642	S	S	*	*			trans	-88.8	-5.4	179.5	-112.1	0	0	0	0	115.2	D453 R457	D453-C455 VanDerWaalsContact C-N 3.27Å; D453-C455 PolarHBondContact O-N 3.32Å; C455-R457 PolarHBondContact O-N 2.86Å
456	L	33.6	Very low	36.3	Very low	162 Å²	162	126.8 Å²	126.8	85%	0.848	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	39.6	-174	-85.9	158.1	0	0	0	116.3
457	R	34.4	Very low	37.8	Very low	240 Å²	240	123.8 Å²	123.8	91%	0.906	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.7	5.4	175.9	-74.7	-162.4	-173.8	-150.5	3.2	116.7	C455	C455-R457 PolarHBondContact O-N 2.86Å
458	R	35.3	Very low	39.8	Very low	184 Å²	184	121.1 Å²	121.1	69%	0.694	59%	0.59	S	S	*	*	S	Bend	trans	-116.7	-9.8	-179.5	-65.6	-173.1	-172.7	157.6	5.5	115.6
459	V	35.7	Very low	42	Very low	102 Å²	102	111.7 Å²	111.7	62%	0.618	55%	0.554	S	S	*	*	S	Bend	trans	-93.8	-20.9	-171.8	-177	0	0	0	0	113.1	M461	V459-M461 PolarHBondContact O-N 3.36Å
460	N	35.1	Very low	43.6	Very low	149 Å²	149	106.5 Å²	106.5	80%	0.797	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	23.6	179.3	-64.8	20	0	0	0	114.6
461	M	37.9	Very low	46.1	Very low	116 Å²	116	100.8 Å²	100.8	57%	0.571	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	4	179	-77.8	-149.1	74.5	0	0	115	V459 S463 M466	V459-M461 PolarHBondContact O-N 3.36Å; M461-S463 VanDerWaalsContact C-N 3.28Å; M461-S463 PolarHBondContact O-N 2.7Å; M461-M466 VanDerWaalsContact O-CE 3.31Å; M461-M466 WeakPolarHBondContact O-CE 3.29Å
462	I	39.7	Very low	48.4	Very low	80 Å²	80	98 Å²	98	41%	0.41	47%	0.469	S	S	.	.			trans	-83	81.1	158.7	-55.1	179.3	0	0	0	107	F383 M466	F383-I462 HydrophobicContact CD1-CD1 4.09Å; F383-I462 HydrophobicContact CE1-CD1 4.37Å; F383-I462 HydrophobicContact CG-CD1 4.37Å; I462-M466 HydrophobicContact CB-SD 4.24Å; I462-M466 HydrophobicContact CG1-SD 4.14Å; I462-M466 HydrophobicContact CG2-SD 3.91Å
463	S	40.3	Very low	51.1	Low	43 Å²	43	95.5 Å²	95.5	30%	0.301	45%	0.452	S	S	.	.			trans	-67.1	160.1	167.6	65.8	0	0	0	0	110	M461 E465 M466	M461-S463 VanDerWaalsContact C-N 3.28Å; M461-S463 PolarHBondContact O-N 2.7Å; S463-E465 PolarHBondContact O-N 2.97Å; S463-E465 PolarHBondContact OG-OE2 3.26Å; S463-M466 PolarHBondContact O-N 2.88Å
464	E	41.6	Very low	53.7	Low	99 Å²	99	91 Å²	91	46%	0.463	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-4.8	177.3	-93.2	145.1	163.9	0	0	115.3	Q665 F667 R678	E464-Q665 PolarHBondContact OE1-NE2 2.95Å; E464-Q665 PolarHBondContact OE1-OE1 3.04Å; E464-F667 WeakPolarHBondContact OE1-CZ 3.27Å; E464-R678 VanDerWaalsContact CG-NH2 3.34Å; E464-R678 IonicContact OE1-CZ 3.32Å; E464-R678 IonicContact OE1-NE 3.03Å; E464-R678 PolarHBondContact OE1-NE 3.16Å; E464-R678 IonicContact OE1-NH2 3.56Å; E464-R678 PolarHBondContact OE1-NH2 2.86Å; E464-R678 VanDerWaalsContact OE1-NH2 3.11Å; E464-R678 IonicContact OE2-CZ 2.95Å; E464-R678 IonicContact OE2-NE 2.68Å; E464-R678 IonicContact OE2-NH2 2.8Å; E464-R678 PolarHBondContact OE2-NH2 3.26Å
465	E	50.8	Low	56.3	Low	143 Å²	143	85.2 Å²	85.2	67%	0.668	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	1.3	-168.9	-57.1	156.9	147.5	0	0	112.8	S463 R467	S463-E465 PolarHBondContact O-N 2.97Å; S463-E465 PolarHBondContact OG-OE2 3.26Å; E465-R467 PolarHBondContact O-N 3.33Å; E465-R467 VanDerWaalsContact O-N 3.14Å
466	M	61.8	Low	59	Low	26 Å²	26	80.6 Å²	80.6	13%	0.128	38%	0.376	C	S	.	.			trans	-73.4	101.5	-179.9	-80.7	-167.8	176.1	0	0	112.3	V343 F418 Q419 M461 I462 S463	V343-M466 HydrophobicContact CB-SD 4.43Å; V343-M466 HydrophobicContact CG2-CE 3.81Å; V343-M466 HydrophobicContact CG2-SD 4.06Å; F418-M466 HydrophobicContact CB-CB 4.31Å; Q419-M466 CarbonylContact O-C 3.44Å; Q419-M466 WeakPolarHBondContact O-CA 3.37Å; M461-M466 VanDerWaalsContact O-CE 3.31Å; M461-M466 WeakPolarHBondContact O-CE 3.29Å; I462-M466 HydrophobicContact CB-SD 4.24Å; I462-M466 HydrophobicContact CG1-SD 4.14Å; I462-M466 HydrophobicContact CG2-SD 3.91Å; S463-M466 PolarHBondContact O-N 2.88Å
467	R	63.6	Low	61.6	Low	100 Å²	100	75.3 Å²	75.3	38%	0.377	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	128	173.9	-177.4	-174.9	-67.8	165.6	-3	110.6	L327 F418 Q419 E465 I469 N600	L327-R467 PolarHBondContact O-NH1 2.77Å; F418-R467 CarbonylContact C-O 3.53Å; F418-R467 WeakPolarHBondContact CA-O 3.34Å; Q419-R467 HydrophobicContact CG-CB 4.29Å; Q419-R467 PolarHBondContact N-O 2.79Å; Q419-R467 PolarHBondContact O-N 3.49Å; E465-R467 PolarHBondContact O-N 3.33Å; E465-R467 VanDerWaalsContact O-N 3.14Å; R467-I469 PolarHBondContact O-N 3.01Å; R467-N600 HydrophobicContact CG-CB 4.17Å
468	C	73.9	Confident	64.1	Low	10 Å²	10	66.7 Å²	66.7	7%	0.068	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	121.7	168.5	-171.9	0	0	0	0	110.6	V417 F418 N600 K688	V417-C468 CarbonylContact O-C 3.59Å; V417-C468 WeakPolarHBondContact O-CA 3.33Å; V417-C468 PolarHBondContact O-SG 2.84Å; F418-C468 HydrophobicContact CD1-CB 3.84Å; F418-C468 HydrophobicContact CE1-CB 3.73Å; F418-C468 HydrophobicContact CZ-CB 4.49Å; C468-N600 PolarHBondContact O-ND2 2.76Å; C468-K688 HydrophobicContact CB-CD 4.15Å; C468-K688 WeakPolarHBondContact SG-CD 3.3Å; C468-K688 WeakPolarHBondContact SG-CE 3.47Å
469	I	73.3	Confident	66.6	Low	7 Å²	7	63.5 Å²	63.5	4%	0.036	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-43.8	-177.9	-48	170.9	0	0	0	110.4	N298 V324 F342 V417 Q419 R467	N298-I469 HydrophobicContact CB-CG2 3.93Å; N298-I469 PolarHBondContact ND2-O 3.4Å; V324-I469 HydrophobicContact CG1-CD1 3.41Å; V324-I469 VanDerWaalsContact CG1-CD1 3.41Å; V324-I469 HydrophobicContact CG1-CG2 3.84Å; F342-I469 HydrophobicContact CD1-CD1 3.75Å; F342-I469 HydrophobicContact CE1-CD1 3.68Å; V417-I469 HydrophobicContact CG1-CB 4.35Å; V417-I469 HydrophobicContact CG1-CD1 3.6Å; V417-I469 HydrophobicContact CG1-CG1 4.28Å; V417-I469 PolarHBondContact O-N 3.12Å; Q419-I469 HydrophobicContact CB-CD1 3.67Å; Q419-I469 HydrophobicContact CB-CG1 4.01Å; Q419-I469 HydrophobicContact CG-CD1 3.8Å; Q419-I469 HydrophobicContact CG-CG1 3.61Å; R467-I469 PolarHBondContact O-N 3.01Å
470	G	70.5	Confident	69.1	Low	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	163.5	-177.9	0	0	0	0	0	111.8	V417 R496	V417-G470 PolarHBondContact N-O 2.86Å; G470-R496 VanDerWaalsContact CA-O 3.26Å; G470-R496 WeakPolarHBondContact CA-O 3.2Å
471	V	79	Confident	71.6	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.1	168.6	165	0	0	0	0	108.5	V414 L415 A416 F473 R496 K688	V414-V471 HydrophobicContact CG1-CG1 3.91Å; L415-V471 CarbonylContact O-C 3.59Å; L415-V471 VanDerWaalsContact O-CA 3.28Å; L415-V471 WeakPolarHBondContact O-CA 3.34Å; A416-V471 HydrophobicContact CB-CG2 3.58Å; V471-F473 HydrophobicContact CB-CE2 4.5Å; V471-F473 HydrophobicContact CG1-CD2 4.01Å; V471-F473 HydrophobicContact CG1-CE1 4.08Å; V471-F473 HydrophobicContact CG1-CE2 3.52Å; V471-F473 HydrophobicContact CG1-CG 4.5Å; V471-F473 HydrophobicContact CG1-CZ 3.55Å; V471-R496 PolarHBondContact N-O 3.38Å; V471-R496 VanDerWaalsContact N-O 3.07Å; V471-R496 PolarHBondContact O-N 3.38Å; V471-R496 VanDerWaalsContact O-N 3.08Å; V471-K688 VanDerWaalsContact CB-NZ 3.33Å; V471-K688 HydrophobicContact CG2-CD 3.6Å; V471-K688 HydrophobicContact CG2-CG 4.31Å
472	T	81.7	Confident	74	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.025	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	161.7	162.8	-157.9	0	0	0	0	110.8	I301 L415 Q493 E494 L495	I301-T472 HydrophobicContact CG2-CG2 3.51Å; L415-T472 HydrophobicContact CB-CG2 3.99Å; L415-T472 HydrophobicContact CD1-CG2 4.31Å; L415-T472 PolarHBondContact N-O 3.39Å; L415-T472 PolarHBondContact O-N 3.24Å; T472-Q493 HydrophobicContact CG2-CB 3.71Å; T472-Q493 HydrophobicContact CG2-CG 4.42Å; T472-Q493 WeakPolarHBondContact OG1-CB 3.25Å; T472-E494 WeakPolarHBondContact CB-O 3.4Å; T472-E494 PolarHBondContact OG1-O 2.81Å; T472-L495 HydrophobicContact CG2-CD2 4.47Å
473	F	85.7	Confident	76.3	Confident	74 Å²	74	52.6 Å²	52.6	33%	0.325	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.7	-174.9	-59.8	-91.5	0	0	0	107.4	E412 V414 V471 Q493	E412-F473 HydrophobicContact CG-CB 4.21Å; E412-F473 WeakPolarHBondContact OE1-CB 3.45Å; E412-F473 WeakPolarHBondContact OE2-CD1 3.26Å; V414-F473 HydrophobicContact CB-CD1 4.38Å; V414-F473 HydrophobicContact CG1-CD1 3.94Å; V414-F473 HydrophobicContact CG1-CE1 3.74Å; V414-F473 HydrophobicContact CG2-CD1 3.9Å; V414-F473 HydrophobicContact CG2-CE1 4.14Å; V471-F473 HydrophobicContact CB-CE2 4.5Å; V471-F473 HydrophobicContact CG1-CD2 4.01Å; V471-F473 HydrophobicContact CG1-CE1 4.08Å; V471-F473 HydrophobicContact CG1-CE2 3.52Å; V471-F473 HydrophobicContact CG1-CG 4.5Å; V471-F473 HydrophobicContact CG1-CZ 3.55Å; F473-Q493 PolarHBondContact O-NE2 3.21Å
474	Y	88.1	Confident	78.6	Confident	29 Å²	29	52 Å²	52	11%	0.114	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	107	179.2	-175.3	-90.4	0	0	0	109.2	F303 L305 E412 L413 L476 M488 I491 Q493	F303-Y474 HydrophobicContact CE2-CD1 4.24Å; F303-Y474 HydrophobicContact CE2-CD2 4.36Å; F303-Y474 HydrophobicContact CE2-CG 4.06Å; F303-Y474 HydrophobicContact CZ-CD1 4.33Å; F303-Y474 AromaticContact CZ-CD2 3.75Å; F303-Y474 HydrophobicContact CZ-CD2 3.75Å; F303-Y474 HydrophobicContact CZ-CE2 4.42Å; F303-Y474 AromaticContact CZ-CG 3.69Å; F303-Y474 HydrophobicContact CZ-CG 3.69Å; L305-Y474 HydrophobicContact CD1-CD1 3.81Å; L305-Y474 HydrophobicContact CD1-CE1 3.41Å; L305-Y474 VanDerWaalsContact CD1-CE1 3.41Å; E412-Y474 CarbonylContact C-O 3.5Å; E412-Y474 WeakPolarHBondContact CA-O 3.45Å; L413-Y474 PolarHBondContact N-O 2.83Å; L413-Y474 PolarHBondContact O-N 3.42Å; Y474-L476 HydrophobicContact CD1-CD2 3.98Å; Y474-L476 HydrophobicContact CE1-CD2 4.18Å; Y474-L476 PolarHBondContact O-N 3.01Å; Y474-M488 WeakPolarHBondContact OH-CE 3.34Å; Y474-I491 HydrophobicContact CD2-CG2 3.98Å; Y474-I491 HydrophobicContact CE1-CD1 4.31Å; Y474-I491 HydrophobicContact CE2-CD1 4.28Å; Y474-I491 HydrophobicContact CE2-CG2 3.56Å; Y474-Q493 HydrophobicContact CD2-CG 4.13Å
475	K	88.6	Confident	80.6	Confident	117 Å²	117	50.4 Å²	50.4	51%	0.509	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	127.1	173.5	-175.9	-174.8	170.5	-171	0	108.4	D409	D409-K475 VanDerWaalsContact O-CE 3.31Å; D409-K475 WeakPolarHBondContact O-CE 3.06Å
476	L	88.7	Confident	82.1	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	25%	0.249	C	C	.	.			trans	-73	148.5	174.4	-59.4	-175.5	0	0	0	110	L305 L314 L408 V411 L413 Y474 L481	L305-L476 HydrophobicContact CD1-CD2 3.74Å; L314-L476 HydrophobicContact CD2-CD1 3.52Å; L314-L476 HydrophobicContact CD2-CD2 4.22Å; L408-L476 HydrophobicContact CD2-CD1 4.04Å; L408-L476 WeakPolarHBondContact O-CB 3.18Å; V411-L476 HydrophobicContact CB-CD1 3.89Å; V411-L476 HydrophobicContact CB-CG 4.4Å; V411-L476 HydrophobicContact CG1-CD1 3.46Å; V411-L476 VanDerWaalsContact CG1-CD1 3.46Å; V411-L476 HydrophobicContact CG1-CG 4.07Å; V411-L476 PolarHBondContact O-N 3.35Å; L413-L476 HydrophobicContact CB-CD2 4.41Å; Y474-L476 HydrophobicContact CD1-CD2 3.98Å; Y474-L476 HydrophobicContact CE1-CD2 4.18Å; Y474-L476 PolarHBondContact O-N 3.01Å; L476-L481 HydrophobicContact CB-CD1 4.05Å; L476-L481 HydrophobicContact CD1-CD1 4.47Å; L476-L481 HydrophobicContact CD2-CD1 4.34Å
477	N	87.4	Confident	83.1	Confident	51 Å²	51	56.7 Å²	56.7	27%	0.273	27%	0.271	S	S	.	.			trans	-129.4	112.5	178.8	178.1	-18.4	0	0	0	107.7	H479 E480 L481	N477-H479 VanDerWaalsContact C-N 3.27Å; N477-H479 PolarHBondContact O-N 3.36Å; N477-H479 WeakPolarHBondContact OD1-CB 3.34Å; N477-H479 PolarHBondContact OD1-N 2.91Å; N477-E480 HydrophobicContact CB-CB 4.15Å; N477-E480 HydrophobicContact CB-CG 4.29Å; N477-E480 WeakPolarHBondContact ND2-CG 3.5Å; N477-E480 PolarHBondContact ND2-OE1 3.33Å; N477-E480 PolarHBondContact O-N 2.91Å; N477-E480 PolarHBondContact OD1-N 3.24Å; N477-L481 WeakPolarHBondContact O-CB 3.31Å; N477-L481 WeakPolarHBondContact O-CG 3.3Å; N477-L481 PolarHBondContact O-N 3.07Å
478	Q	87.9	Confident	84.3	Confident	58 Å²	58	52.1 Å²	52.1	27%	0.271	25%	0.254	S	S	.	.	H	α-helix	trans	-57.8	-40.2	-178.2	-179.1	-178.7	-29.1	0	0	111.4	V405 L408 D409 I482	V405-Q478 HydrophobicContact CG1-CG 4.25Å; V405-Q478 PolarHBondContact O-OE1 3.35Å; L408-Q478 HydrophobicContact CB-CB 4.03Å; L408-Q478 HydrophobicContact CD1-CB 4.38Å; L408-Q478 HydrophobicContact CD1-CG 4.21Å; D409-Q478 VanDerWaalsContact OD1-CB 3.31Å; D409-Q478 WeakPolarHBondContact OD1-CB 3.39Å; D409-Q478 PolarHBondContact OD1-N 3.14Å; Q478-I482 HydrophobicContact CG-CD1 3.68Å; Q478-I482 WeakPolarHBondContact O-CB 3.44Å; Q478-I482 VanDerWaalsContact O-CG1 3.23Å; Q478-I482 WeakPolarHBondContact O-CG1 3.22Å; Q478-I482 PolarHBondContact O-N 3.08Å
479	H	87.8	Confident	85	Confident	117 Å²	117	55.8 Å²	55.8	54%	0.542	27%	0.27	S	S	.	.	H	α-helix	trans	-65.8	-42.9	-179.6	-175.6	94.1	0	0	0	111.7	N477 N483	N477-H479 VanDerWaalsContact C-N 3.27Å; N477-H479 PolarHBondContact O-N 3.36Å; N477-H479 WeakPolarHBondContact OD1-CB 3.34Å; N477-H479 PolarHBondContact OD1-N 2.91Å; H479-N483 PolarHBondContact CE1-ND2 3.48Å; H479-N483 PolarHBondContact ND1-ND2 3.48Å; H479-N483 VanDerWaalsContact ND1-ND2 3.13Å; H479-N483 WeakPolarHBondContact O-CA 3.44Å; H479-N483 VanDerWaalsContact O-CB 3.26Å; H479-N483 WeakPolarHBondContact O-CB 3.42Å; H479-N483 PolarHBondContact O-N 3.36Å; H479-N483 PolarHBondContact O-ND2 3.39Å
480	E	88.2	Confident	85.6	Confident	58 Å²	58	59 Å²	59	27%	0.271	29%	0.288	S	S	.	.	H	α-helix	trans	-71.9	-41.7	-179.4	-71.3	174.4	173.8	0	0	112.4	N477 I482 C484 M488	N477-E480 HydrophobicContact CB-CB 4.15Å; N477-E480 HydrophobicContact CB-CG 4.29Å; N477-E480 WeakPolarHBondContact ND2-CG 3.5Å; N477-E480 PolarHBondContact ND2-OE1 3.33Å; N477-E480 PolarHBondContact O-N 2.91Å; N477-E480 PolarHBondContact OD1-N 3.24Å; E480-I482 VanDerWaalsContact C-N 3.29Å; E480-I482 PolarHBondContact O-N 3.45Å; E480-C484 CarbonylContact O-C 3.56Å; E480-C484 WeakPolarHBondContact O-CA 3.48Å; E480-C484 PolarHBondContact O-N 3.07Å; E480-M488 HydrophobicContact CB-CE 3.76Å; E480-M488 HydrophobicContact CB-SD 4.01Å; E480-M488 HydrophobicContact CG-CE 4.49Å
481	L	88.2	Confident	86.5	Confident	5 Å²	5	60 Å²	60	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-32.7	178.4	-75.3	169.5	0	0	0	113.4	L305 L314 L408 L476 N477 M488	L305-L481 HydrophobicContact CB-CD2 3.7Å; L305-L481 HydrophobicContact CD1-CD2 4.09Å; L314-L481 HydrophobicContact CD1-CD1 4.27Å; L314-L481 HydrophobicContact CD1-CD2 3.99Å; L408-L481 HydrophobicContact CD1-CD1 4.15Å; L408-L481 HydrophobicContact CD2-CD1 3.91Å; L408-L481 HydrophobicContact CG-CD1 4.48Å; L476-L481 HydrophobicContact CB-CD1 4.05Å; L476-L481 HydrophobicContact CD1-CD1 4.47Å; L476-L481 HydrophobicContact CD2-CD1 4.34Å; N477-L481 WeakPolarHBondContact O-CB 3.31Å; N477-L481 WeakPolarHBondContact O-CG 3.3Å; N477-L481 PolarHBondContact O-N 3.07Å; L481-M488 HydrophobicContact CD2-CG 4.07Å; L481-M488 HydrophobicContact CD2-SD 3.82Å; L481-M488 HydrophobicContact CG-SD 4.15Å
482	I	87.9	Confident	87	Confident	58 Å²	58	63.5 Å²	63.5	30%	0.297	31%	0.305	S	S	.	.	H	α-helix	trans	-96.3	-46.9	-175.9	-59.5	-179.8	0	0	0	111.6	Y307 V405 Q478 E480	Y307-I482 HydrophobicContact CD1-CG1 4.16Å; V405-I482 HydrophobicContact CG1-CD1 4.06Å; Q478-I482 HydrophobicContact CG-CD1 3.68Å; Q478-I482 WeakPolarHBondContact O-CB 3.44Å; Q478-I482 VanDerWaalsContact O-CG1 3.23Å; Q478-I482 WeakPolarHBondContact O-CG1 3.22Å; Q478-I482 PolarHBondContact O-N 3.08Å; E480-I482 VanDerWaalsContact C-N 3.29Å; E480-I482 PolarHBondContact O-N 3.45Å
483	N	87.9	Confident	87.1	Confident	98 Å²	98	66 Å²	66	52%	0.524	32%	0.317	S	S	.	.	H	α-helix	trans	-99.4	-12.1	-170.7	-52.6	-49.3	0	0	0	113.8	H479	H479-N483 PolarHBondContact CE1-ND2 3.48Å; H479-N483 PolarHBondContact ND1-ND2 3.48Å; H479-N483 VanDerWaalsContact ND1-ND2 3.13Å; H479-N483 WeakPolarHBondContact O-CA 3.44Å; H479-N483 VanDerWaalsContact O-CB 3.26Å; H479-N483 WeakPolarHBondContact O-CB 3.42Å; H479-N483 PolarHBondContact O-N 3.36Å; H479-N483 PolarHBondContact O-ND2 3.39Å
484	C	87.6	Confident	87	Confident	31 Å²	31	65.5 Å²	65.5	21%	0.209	32%	0.315	C	S	.	.			trans	-136.6	52	-178.2	-69.5	0	0	0	0	112.9	E480 E486 K487	E480-C484 CarbonylContact O-C 3.56Å; E480-C484 WeakPolarHBondContact O-CA 3.48Å; E480-C484 PolarHBondContact O-N 3.07Å; C484-E486 PolarHBondContact O-N 2.85Å; C484-K487 HydrophobicContact CB-CB 4.29Å; C484-K487 HydrophobicContact CB-CD 3.93Å; C484-K487 HydrophobicContact CB-CG 4.1Å; C484-K487 WeakPolarHBondContact O-CB 3.38Å; C484-K487 PolarHBondContact O-N 3.11Å
485	P	83.5	Confident	86.6	Confident	64 Å²	64	64.1 Å²	64.1	42%	0.416	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-58.2	-25.4	-177.5	25.9	-35.9	0	0	0	113.7	K487 M488	P485-K487 VanDerWaalsContact C-N 3.33Å; P485-K487 PolarHBondContact O-N 2.85Å; P485-M488 WeakPolarHBondContact O-CB 3.37Å; P485-M488 PolarHBondContact O-N 3.11Å; P485-M488 VanDerWaalsContact O-N 3.15Å
486	E	82.9	Confident	85.7	Confident	163 Å²	163	66.4 Å²	66.4	76%	0.762	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-57.7	-41.9	172.1	-51	-63.2	170.5	0	0	112.4	C484 M488 Q489	C484-E486 PolarHBondContact O-N 2.85Å; E486-M488 PolarHBondContact O-N 3.12Å; E486-Q489 PolarHBondContact O-N 3.42Å
487	K	83.7	Confident	84.2	Confident	138 Å²	138	70.2 Å²	70.2	60%	0.6	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-71.5	-19.1	178.4	-65.9	-175.2	179.8	176.1	0	112.7	C484 P485 Q489	C484-K487 HydrophobicContact CB-CB 4.29Å; C484-K487 HydrophobicContact CB-CD 3.93Å; C484-K487 HydrophobicContact CB-CG 4.1Å; C484-K487 WeakPolarHBondContact O-CB 3.38Å; C484-K487 PolarHBondContact O-N 3.11Å; P485-K487 VanDerWaalsContact C-N 3.33Å; P485-K487 PolarHBondContact O-N 2.85Å; K487-Q489 PolarHBondContact O-N 3.36Å
488	M	88	Confident	82.5	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.025	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-85.6	6.7	-179.1	-58.8	-68.8	91.2	0	0	112.6	S304 L305 Y474 E480 L481 P485 E486 I491	S304-M488 CarbonylContact C-O 3.59Å; S304-M488 VanDerWaalsContact CA-O 3.28Å; S304-M488 WeakPolarHBondContact CA-O 3.31Å; L305-M488 HydrophobicContact CB-CB 4.22Å; L305-M488 HydrophobicContact CD1-SD 4.47Å; L305-M488 PolarHBondContact N-O 2.89Å; L305-M488 VanDerWaalsContact O-CB 3.25Å; L305-M488 WeakPolarHBondContact O-CB 3.42Å; Y474-M488 WeakPolarHBondContact OH-CE 3.34Å; E480-M488 HydrophobicContact CB-CE 3.76Å; E480-M488 HydrophobicContact CB-SD 4.01Å; E480-M488 HydrophobicContact CG-CE 4.49Å; L481-M488 HydrophobicContact CD2-CG 4.07Å; L481-M488 HydrophobicContact CD2-SD 3.82Å; L481-M488 HydrophobicContact CG-SD 4.15Å; P485-M488 WeakPolarHBondContact O-CB 3.37Å; P485-M488 PolarHBondContact O-N 3.11Å; P485-M488 VanDerWaalsContact O-N 3.15Å; E486-M488 PolarHBondContact O-N 3.12Å; M488-I491 HydrophobicContact CE-CD1 4.34Å; M488-I491 HydrophobicContact SD-CD1 4.3Å
489	Q	87.5	Confident	80	Confident	86 Å²	86	70.7 Å²	70.7	40%	0.402	34%	0.34	S	S	.	.	S	Bend	trans	-96.5	137	173.8	-58.7	-54.9	-39.3	0	0	112	S304 E486 K487 I491	S304-Q489 WeakPolarHBondContact OG-CA 3.29Å; S304-Q489 PolarHBondContact OG-OE1 2.87Å; E486-Q489 PolarHBondContact O-N 3.42Å; K487-Q489 PolarHBondContact O-N 3.36Å; Q489-I491 VanDerWaalsContact C-N 3.31Å; Q489-I491 PolarHBondContact O-N 3.44Å
490	N	87.7	Confident	77.3	Confident	76 Å²	76	68.2 Å²	68.2	41%	0.406	33%	0.328	S	S	.	.	S	Bend	trans	54	42.5	177.7	-55.1	-82.3	0	0	0	114	F303 S304 W492	F303-N490 CarbonylContact O-C 3.57Å; S304-N490 PolarHBondContact OG-N 3.35Å; S304-N490 VanDerWaalsContact OG-N 3.08Å; N490-W492 PolarHBondContact O-N 2.83Å; N490-W492 PolarHBondContact O-NE1 3.44Å
491	I	88.2	Confident	74.5	Confident	19 Å²	19	68.7 Å²	68.7	10%	0.097	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	122.9	173.1	-55.8	168.4	0	0	0	108.3	C302 F303 L305 Y474 M488 Q489 Q493	C302-I491 WeakPolarHBondContact CA-O 3.2Å; F303-I491 HydrophobicContact CD2-CB 4.36Å; F303-I491 HydrophobicContact CD2-CD1 4.31Å; F303-I491 HydrophobicContact CE1-CB 4.31Å; F303-I491 HydrophobicContact CE1-CG2 4.03Å; F303-I491 HydrophobicContact CE2-CB 4.04Å; F303-I491 HydrophobicContact CE2-CD1 3.85Å; F303-I491 HydrophobicContact CE2-CG2 4.05Å; F303-I491 HydrophobicContact CZ-CB 4Å; F303-I491 HydrophobicContact CZ-CD1 4.47Å; F303-I491 HydrophobicContact CZ-CG2 3.61Å; F303-I491 PolarHBondContact N-O 3.41Å; F303-I491 WeakPolarHBondContact O-CA 3.49Å; F303-I491 WeakPolarHBondContact O-CB 3.11Å; F303-I491 PolarHBondContact O-N 3.05Å; L305-I491 HydrophobicContact CB-CD1 4.41Å; L305-I491 HydrophobicContact CD1-CD1 3.72Å; L305-I491 HydrophobicContact CG-CD1 3.8Å; Y474-I491 HydrophobicContact CD2-CG2 3.98Å; Y474-I491 HydrophobicContact CE1-CD1 4.31Å; Y474-I491 HydrophobicContact CE2-CD1 4.28Å; Y474-I491 HydrophobicContact CE2-CG2 3.56Å; M488-I491 HydrophobicContact CE-CD1 4.34Å; M488-I491 HydrophobicContact SD-CD1 4.3Å; Q489-I491 VanDerWaalsContact C-N 3.31Å; Q489-I491 PolarHBondContact O-N 3.44Å; I491-Q493 HydrophobicContact CG2-CG 4.49Å
492	W	89	Confident	71.7	Confident	81 Å²	81	74.9 Å²	74.9	31%	0.307	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.2	175	-70.9	93.9	0	0	0	110.7	H300 I301 C302 R320 I322 N490	H300-W492 HydrophobicContact CB-CE3 3.94Å; H300-W492 HydrophobicContact CB-CZ3 4.23Å; I301-W492 WeakPolarHBondContact O-CA 3.23Å; C302-W492 HydrophobicContact CB-CD2 3.97Å; C302-W492 HydrophobicContact CB-CE3 3.79Å; C302-W492 HydrophobicContact CB-CH2 3.5Å; C302-W492 VanDerWaalsContact CB-CH2 3.5Å; C302-W492 HydrophobicContact CB-CZ2 3.68Å; C302-W492 HydrophobicContact CB-CZ3 3.56Å; R320-W492 HydrophobicContact CG-CH2 4.07Å; I322-W492 HydrophobicContact CB-CH2 4.3Å; I322-W492 HydrophobicContact CB-CZ3 4.06Å; I322-W492 HydrophobicContact CD1-CH2 3.37Å; I322-W492 HydrophobicContact CD1-CZ2 4.21Å; I322-W492 HydrophobicContact CD1-CZ3 4.03Å; I322-W492 HydrophobicContact CG1-CH2 3.7Å; I322-W492 HydrophobicContact CG1-CZ3 3.94Å; N490-W492 PolarHBondContact O-N 2.83Å; N490-W492 PolarHBondContact O-NE1 3.44Å
493	Q	85.3	Confident	68.8	Low	58 Å²	58	76 Å²	76	27%	0.271	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.3	172.2	-76.8	-73.8	56.2	0	0	111.2	H300 I301 F303 T472 F473 Y474 I491	H300-Q493 WeakPolarHBondContact CA-O 3.33Å; I301-Q493 HydrophobicContact CG2-CB 4.1Å; I301-Q493 PolarHBondContact N-O 3.29Å; I301-Q493 PolarHBondContact O-N 2.86Å; F303-Q493 HydrophobicContact CE1-CB 4.12Å; F303-Q493 HydrophobicContact CE1-CG 3.77Å; F303-Q493 HydrophobicContact CZ-CG 4.05Å; T472-Q493 HydrophobicContact CG2-CB 3.71Å; T472-Q493 HydrophobicContact CG2-CG 4.42Å; T472-Q493 WeakPolarHBondContact OG1-CB 3.25Å; F473-Q493 PolarHBondContact O-NE2 3.21Å; Y474-Q493 HydrophobicContact CD2-CG 4.13Å; I491-Q493 HydrophobicContact CG2-CG 4.49Å
494	E	83.3	Confident	66	Low	63 Å²	63	82.6 Å²	82.6	29%	0.294	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	135.6	172.9	-71.1	179.2	-168.8	0	0	111.2	T297 T472 R496	T297-E494 HydrophobicContact CG2-CB 4.27Å; T297-E494 HydrophobicContact CG2-CG 4.14Å; T297-E494 WeakPolarHBondContact CG2-OE2 3.35Å; T472-E494 WeakPolarHBondContact CB-O 3.4Å; T472-E494 PolarHBondContact OG1-O 2.81Å; E494-R496 PolarHBondContact O-N 2.74Å
495	L	79.3	Confident	63.3	Low	0 Å²	0	89.7 Å²	89.7	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	101.9	169.5	-63	176.4	0	0	0	109	N298 G299 I301 L321 V324 V417 T472 K497	N298-L495 PolarHBondContact N-O 3.17Å; G299-L495 VanDerWaalsContact O-CB 3.29Å; G299-L495 WeakPolarHBondContact O-CB 3.4Å; G299-L495 PolarHBondContact O-N 2.76Å; I301-L495 HydrophobicContact CB-CD2 4.06Å; I301-L495 HydrophobicContact CG2-CD2 3.8Å; I301-L495 HydrophobicContact CG2-CG 4.5Å; L321-L495 HydrophobicContact CD2-CD1 4.35Å; V324-L495 HydrophobicContact CG2-CD1 3.79Å; V417-L495 HydrophobicContact CB-CD1 4.26Å; V417-L495 HydrophobicContact CG2-CD1 3.78Å; V417-L495 HydrophobicContact CG2-CD2 3.61Å; V417-L495 HydrophobicContact CG2-CG 4.36Å; T472-L495 HydrophobicContact CG2-CD2 4.47Å; L495-K497 PolarHBondContact O-N 2.66Å
496	R	68.8	Low	60.8	Low	164 Å²	164	92.1 Å²	92.1	62%	0.619	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	128.2	173.1	-60.3	-177.4	-173.8	163.5	4.3	108.9	G470 V471 E494 L498	G470-R496 VanDerWaalsContact CA-O 3.26Å; G470-R496 WeakPolarHBondContact CA-O 3.2Å; V471-R496 PolarHBondContact N-O 3.38Å; V471-R496 VanDerWaalsContact N-O 3.07Å; V471-R496 PolarHBondContact O-N 3.38Å; V471-R496 VanDerWaalsContact O-N 3.08Å; E494-R496 PolarHBondContact O-N 2.74Å; R496-L498 PolarHBondContact O-N 2.86Å
497	K	58	Low	58.2	Low	82 Å²	82	93.8 Å²	93.8	36%	0.357	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-51.6	136	162.2	-76.5	168.5	-168.1	167	0	108.1	P295 D296 N298 L495	P295-K497 PolarHBondContact O-NZ 2.56Å; D296-K497 WeakPolarHBondContact O-CD 3.3Å; D296-K497 WeakPolarHBondContact O-CE 3.3Å; D296-K497 WeakPolarHBondContact O-CG 3.5Å; N298-K497 HydrophobicContact CB-CG 4.01Å; N298-K497 WeakPolarHBondContact ND2-CG 3.49Å; N298-K497 WeakPolarHBondContact OD1-CE 3.49Å; L495-K497 PolarHBondContact O-N 2.66Å
498	L	51.6	Low	55.9	Low	49 Å²	49	95.2 Å²	95.2	26%	0.257	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-67.5	151.6	153	-149.8	70.4	0	0	0	106.9	R496 E500 N659 K688	R496-L498 PolarHBondContact O-N 2.86Å; L498-E500 PolarHBondContact O-N 2.76Å; L498-N659 WeakPolarHBondContact CG-ND2 3.47Å; L498-K688 VanDerWaalsContact CB-CE 3.48Å; L498-K688 HydrophobicContact CD1-CD 4.3Å; L498-K688 HydrophobicContact CD1-CG 3.79Å; L498-K688 VanDerWaalsContact CD1-NZ 3.29Å; L498-K688 HydrophobicContact CD2-CD 4.3Å; L498-K688 HydrophobicContact CD2-CG 3.87Å; L498-K688 HydrophobicContact CG-CG 4.37Å
499	P	35.3	Very low	53.3	Low	69 Å²	69	99.4 Å²	99.4	45%	0.448	49%	0.485	S	S	.	.			trans	-59.7	86.3	164.9	-24.7	32.9	0	0	0	111.3	F501 N659	P499-F501 HydrophobicContact CB-CD2 3.84Å; P499-F501 HydrophobicContact CB-CE2 3.84Å; P499-F501 PolarHBondContact O-N 3.48Å; P499-N659 WeakPolarHBondContact CB-ND2 3.42Å; P499-N659 WeakPolarHBondContact CD-ND2 3.21Å; P499-N659 WeakPolarHBondContact O-CB 3.48Å; P499-N659 VanDerWaalsContact O-CG 3.26Å; P499-N659 PolarHBondContact O-ND2 2.82Å
500	E	32.3	Very low	50.7	Low	66 Å²	66	102.3 Å²	102.3	31%	0.308	50%	0.504	S	S	.	.			trans	-60.1	98.5	147.9	-80.7	-176.6	166.5	0	0	104.6	L498 Q502 N600	L498-E500 PolarHBondContact O-N 2.76Å; E500-Q502 PolarHBondContact O-N 2.92Å; E500-N600 HydrophobicContact CG-CB 4.44Å; E500-N600 WeakPolarHBondContact OE1-CB 3.38Å; E500-N600 PolarHBondContact OE1-ND2 3.11Å
501	F	27.9	Very low	48.1	Very low	67 Å²	67	104.8 Å²	104.8	29%	0.294	53%	0.526	S	S	.	.			trans	-66.3	84.7	175.7	-96.9	-93.7	0	0	0	108.3	P499 S503 L598 Y657 N658 N659	P499-F501 HydrophobicContact CB-CD2 3.84Å; P499-F501 HydrophobicContact CB-CE2 3.84Å; P499-F501 PolarHBondContact O-N 3.48Å; F501-S503 PolarHBondContact O-N 3.23Å; F501-L598 HydrophobicContact CB-CD1 3.91Å; F501-L598 HydrophobicContact CB-CG 4.41Å; F501-Y657 HydrophobicContact CB-CD1 3.63Å; F501-Y657 HydrophobicContact CB-CE1 4.12Å; F501-Y657 AromaticContact CD1-CD1 3.6Å; F501-Y657 HydrophobicContact CD1-CD1 3.6Å; F501-Y657 HydrophobicContact CD1-CE1 4.19Å; F501-Y657 HydrophobicContact CE1-CD1 4.46Å; F501-Y657 AromaticContact CG-CD1 3.82Å; F501-Y657 HydrophobicContact CG-CD1 3.82Å; F501-N658 HydrophobicContact CE2-CB 3.76Å; F501-N658 HydrophobicContact CZ-CB 3.94Å; F501-N659 HydrophobicContact CD2-CB 3.95Å; F501-N659 HydrophobicContact CE2-CB 4.44Å
502	Q	29.9	Very low	45.4	Very low	136 Å²	136	110.1 Å²	110.1	64%	0.636	55%	0.554	S	S	*	*			trans	-65.1	107.4	166.9	-70	177.8	33.5	0	0	106.9	E500 R504	E500-Q502 PolarHBondContact O-N 2.92Å; Q502-R504 PolarHBondContact O-N 2.94Å; Q502-R504 VanDerWaalsContact O-N 3.16Å
503	S	27.8	Very low	43	Very low	82 Å²	82	113.5 Å²	113.5	57%	0.573	58%	0.578	S	S	*	*			trans	-17	107.3	162	49.9	0	0	0	0	114.4	F501 Q505	F501-S503 PolarHBondContact O-N 3.23Å; S503-Q505 VanDerWaalsContact C-N 3.3Å; S503-Q505 PolarHBondContact O-N 3.04Å
504	R	28.8	Very low	40.6	Very low	235 Å²	235	117.4 Å²	117.4	89%	0.887	60%	0.601	S	S	*	*			trans	-70.8	86.5	165.3	-87.8	-173.3	170.3	-177.1	-3.1	109.8	Q502	Q502-R504 PolarHBondContact O-N 2.94Å; Q502-R504 VanDerWaalsContact O-N 3.16Å
505	Q	29.8	Very low	38.3	Very low	181 Å²	181	122 Å²	122	85%	0.846	63%	0.627	S	S	*	*			trans	-88.2	89	151.7	-79.9	-169.2	3.5	0	0	109.2	S503	S503-Q505 VanDerWaalsContact C-N 3.3Å; S503-Q505 PolarHBondContact O-N 3.04Å
506	T	32.1	Very low	36.3	Very low	114 Å²	114	126.3 Å²	126.3	70%	0.699	66%	0.658	S	S	*	*			trans	-179.6	101.2	154.2	41.4	0	0	0	0	105.4
507	K	28.6	Very low	34.7	Very low	198 Å²	198	126 Å²	126	86%	0.861	67%	0.667	S	S	*	*				62.7	147.6	86.6	-92.4	-169.8	172.9	-177.1	0	114.3
508	I	35.7	Very low	33.3	Very low	169 Å²	169	127.1 Å²	127.1	87%	0.867	69%	0.685	S	S	*	*			trans	81.1	90.6	-174.1	-49	160.2	0	0	0	109.9
509	A	33.4	Very low	32.3	Very low	92 Å²	92	130.2 Å²	130.2	76%	0.76	70%	0.702	S	S	*	*				82.4	135.2	63.2	0	0	0	0	0	112.9
510	N	31.3	Very low	32.1	Very low	148 Å²	148	132.6 Å²	132.6	79%	0.791	72%	0.72	S	S	*	*			trans	-47.4	149.2	-173.5	-49.9	-4.5	0	0	0	114
511	C	33.4	Very low	31.9	Very low	128 Å²	128	137.2 Å²	137.2	87%	0.865	74%	0.735	S	S	*	*				-160.6	134.9	109.9	-99.5	0	0	0	0	110.3
512	D	31.6	Very low	31.8	Very low	130 Å²	130	141.6 Å²	141.6	70%	0.695	76%	0.761	S	S	*	*			trans	-70.4	146.5	175.2	-46.2	-87.2	0	0	0	110.9
513	N	38.2	Very low	31.8	Very low	152 Å²	152	140.7 Å²	140.7	81%	0.813	75%	0.753	S	S	*	*				177.4	151.3	108.7	-89	-49.1	0	0	0	112.4
514	N	34.7	Very low	31.7	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	77%	0.765	S	S	*	*			trans	-49.4	141.6	-179.1	-48.9	-52.6	0	0	0	113.7
515	D	36.2	Very low	31.7	Very low	158 Å²	158	140.4 Å²	140.4	85%	0.845	76%	0.758	S	S	*	*				-159.2	146.6	108.4	-102.3	-25.1	0	0	0	114.6
516	S	37	Very low	31.6	Very low	92 Å²	92	140 Å²	140	64%	0.643	75%	0.75	S	S	*	*			trans	-26.6	139.1	177.9	59.2	0	0	0	0	120.4
517	I	34.7	Very low	31.2	Very low	157 Å²	157	138.3 Å²	138.3	81%	0.805	74%	0.74	S	S	*	*				177.1	141.2	103.9	-86.5	159.2	0	0	0	110.9
518	S	29.8	Very low	31.2	Very low	105 Å²	105	138 Å²	138	73%	0.734	74%	0.739	S	S	*	*			trans	-56.1	142.6	-177.1	52.4	0	0	0	0	117.6
519	D	30.7	Very low	30.8	Very low	115 Å²	115	135.2 Å²	135.2	62%	0.615	73%	0.73	S	S	*	*				-162.4	104	108.3	-152.2	2.4	0	0	0	111.2	R521	D519-R521 IonicContact OD1-NE 2.64Å; D519-R521 IonicContact OD2-CZ 3.87Å; D519-R521 VanDerWaalsContact OD2-CZ 3.32Å; D519-R521 IonicContact OD2-NE 3.11Å; D519-R521 PolarHBondContact OD2-NE 3.29Å; D519-R521 IonicContact OD2-NH2 2.72Å; D519-R521 PolarHBondContact OD2-NH2 3.27Å
520	S	29.8	Very low	30.6	Very low	119 Å²	119	136.2 Å²	136.2	83%	0.832	73%	0.727	S	S	*	*			trans	-99.5	90	-178.8	-84	0	0	0	0	111.3
521	R	28	Very low	30.3	Very low	162 Å²	162	137.6 Å²	137.6	61%	0.611	73%	0.729	S	S	*	*			trans	-101.6	117.8	173.6	-58.4	-168.1	-160.1	-162.3	7.6	111.5	D519	D519-R521 IonicContact OD1-NE 2.64Å; D519-R521 IonicContact OD2-CZ 3.87Å; D519-R521 VanDerWaalsContact OD2-CZ 3.32Å; D519-R521 IonicContact OD2-NE 3.11Å; D519-R521 PolarHBondContact OD2-NE 3.29Å; D519-R521 IonicContact OD2-NH2 2.72Å; D519-R521 PolarHBondContact OD2-NH2 3.27Å
522	N	27	Very low	30	Very low	160 Å²	160	138.1 Å²	138.1	86%	0.856	72%	0.723	S	S	*	*			trans	-80.9	131.3	-177.4	-75.7	-57.9	0	0	0	111.4
523	Y	28.3	Very low	30	Very low	117 Å²	117	141.3 Å²	141.3	46%	0.459	73%	0.734	S	S	.	*			trans	-109.5	128	173.8	-57.6	-62.6	0	0	0	112.6	I358 K703	I358-Y523 WeakPolarHBondContact O-CD1 3.38Å; Y523-K703 PolarHBondContact O-NZ 2.83Å; Y523-K703 VanDerWaalsContact O-NZ 3.14Å
524	K	26	Very low	29.5	Very low	188 Å²	188	143.3 Å²	143.3	82%	0.817	74%	0.736	S	S	*	*			trans	-119	140.2	170.4	-103	179.5	172.3	-179.3	0	107.7
525	V	28.9	Very low	29.4	Very low	123 Å²	123	145.3 Å²	145.3	75%	0.745	74%	0.741	S	S	*	*			trans	-141.2	142.8	168.5	-179.7	0	0	0	0	107.8
526	Y	27.5	Very low	29.1	Very low	173 Å²	173	145.5 Å²	145.5	68%	0.678	74%	0.742	S	S	*	*			trans	-72.5	146.2	-162.8	-85.7	-108.8	0	0	0	115.5
527	P	25.1	Very low	28.7	Very low	77 Å²	77	144.6 Å²	144.6	50%	0.5	75%	0.747	S	S	.	*			trans	-81.3	141.9	162.2	33.9	-31.4	0	0	0	111.2	T529	P527-T529 HydrophobicContact CG-CG2 4.41Å; P527-T529 PolarHBondContact O-N 3.25Å; P527-T529 VanDerWaalsContact O-N 3.15Å
528	F	27.5	Very low	28.7	Very low	192 Å²	192	146.6 Å²	146.6	84%	0.842	75%	0.75	S	S	*	*			trans	-76.5	91.5	158.2	-97.2	-90.5	0	0	0	108.4
529	T	28.2	Very low	28.9	Very low	110 Å²	110	147.5 Å²	147.5	68%	0.675	75%	0.751	S	S	*	*			trans	-77.3	117.6	165	40.8	0	0	0	0	109.1	P527 E531	P527-T529 HydrophobicContact CG-CG2 4.41Å; P527-T529 PolarHBondContact O-N 3.25Å; P527-T529 VanDerWaalsContact O-N 3.15Å; T529-E531 PolarHBondContact O-N 3.22Å
530	T	27.9	Very low	29	Very low	114 Å²	114	149.7 Å²	149.7	70%	0.699	76%	0.762	S	S	*	*			trans	-70.9	108.2	163	-52.1	0	0	0	0	107.8	N532	T530-N532 PolarHBondContact O-N 2.94Å; T530-N532 VanDerWaalsContact O-N 3.12Å
531	E	25.8	Very low	29.2	Very low	176 Å²	176	149 Å²	149	82%	0.822	75%	0.754	S	S	*	*			trans	-59.6	112.9	166.6	-68.4	178.7	164.9	0	0	108.5	T529	T529-E531 PolarHBondContact O-N 3.22Å
532	N	27.3	Very low	29.2	Very low	140 Å²	140	148.4 Å²	148.4	75%	0.749	76%	0.763	S	S	*	*			trans	-169.7	64.4	165.2	-95.5	-28.1	0	0	0	108.1	T530	T530-N532 PolarHBondContact O-N 2.94Å; T530-N532 VanDerWaalsContact O-N 3.12Å
533	Q	31.9	Very low	29.7	Very low	196 Å²	196	147.8 Å²	147.8	92%	0.916	77%	0.765	S	S	*	*			trans	-120.9	125.5	154.4	-74.1	-168.2	-8.3	0	0	107.8
534	F	28.1	Very low	29.8	Very low	194 Å²	194	147.3 Å²	147.3	85%	0.851	78%	0.779	S	S	*	*			trans	-69.3	137.7	175.8	-71.1	-116	0	0	0	108.9
535	E	31.9	Very low	30.2	Very low	184 Å²	184	143.6 Å²	143.6	86%	0.86	78%	0.776	S	S	*	*			trans	-165	129.6	134.5	-109.3	163.6	-152	0	0	111.5
536	D	29.1	Very low	30.4	Very low	161 Å²	161	146.4 Å²	146.4	86%	0.861	78%	0.781	S	S	*	*			trans	45.7	106.9	155	-63.7	-8.2	0	0	0	123.1
537	G	29.2	Very low	30.6	Very low	73 Å²	73	144.8 Å²	144.8	75%	0.753	79%	0.789	S	S	*	*				118.6	118.9	115.7	0	0	0	0	0	119.5
538	K	35.4	Very low	30.7	Very low	199 Å²	199	145.9 Å²	145.9	87%	0.865	80%	0.797	S	S	*	*			trans	88.3	97.5	154	-56.7	178.4	-179.2	173.1	0	119.9
539	T	32.7	Very low	30.5	Very low	125 Å²	125	146.3 Å²	146.3	77%	0.767	80%	0.801	S	S	*	*			trans	63	104.1	130.2	53.5	0	0	0	0	122.1
540	L	33.2	Very low	30.5	Very low	161 Å²	161	148.1 Å²	148.1	84%	0.843	81%	0.805	S	S	*	*				45.9	159.7	122.2	-94.1	75.1	0	0	0	122.1
541	P	34.7	Very low	30.5	Very low	103 Å²	103	151.5 Å²	151.5	67%	0.669	81%	0.813	S	S	*	*			cis	-136.9	164.1	-11	35.1	-15.3	0	0	0	117.2
542	N	27.1	Very low	30.7	Very low	150 Å²	150	151.6 Å²	151.6	80%	0.802	81%	0.813	S	S	*	*			trans	16.2	119.2	147.2	-57.1	-6.7	0	0	0	121
543	V	38.6	Very low	31.2	Very low	147 Å²	147	152.4 Å²	152.4	89%	0.891	82%	0.817	S	S	*	*			trans	-130.3	113.4	139.4	179.1	0	0	0	0	108.8
544	S	29.1	Very low	32.4	Very low	107 Å²	107	149.4 Å²	149.4	75%	0.748	80%	0.801	S	S	*	*			trans	-97.5	122.9	173.3	51.1	0	0	0	0	110.2
545	S	35.8	Very low	34.1	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	79%	0.788	S	S	*	*			trans	-165.8	108.8	154.6	-94	0	0	0	0	110.8
546	E	32	Very low	36.3	Very low	182 Å²	182	138.4 Å²	138.4	85%	0.85	75%	0.752	S	S	*	*			trans	23.7	150.7	132.1	-55.4	178.7	179.3	0	0	121.2
547	V	31.9	Very low	38.8	Very low	139 Å²	139	133.3 Å²	133.3	84%	0.842	72%	0.724	S	S	*	*			trans	99.9	125.9	166.7	-178.6	0	0	0	0	116.5
548	P	26.4	Very low	41.5	Very low	101 Å²	101	129.9 Å²	129.9	66%	0.656	69%	0.688	S	S	*	*				-123.6	167.7	-54.7	36.6	-18.6	0	0	0	111.9	I550	P548-I550 PolarHBondContact O-N 2.98Å
549	Q	24.5	Very low	44	Very low	201 Å²	201	122.3 Å²	122.3	94%	0.939	66%	0.656	S	S	*	*			trans	-69.4	115.8	176.3	-68.7	-178.2	-13	0	0	111.7
550	I	27.4	Very low	46.7	Very low	147 Å²	147	116.4 Å²	116.4	75%	0.754	62%	0.619	S	S	*	*			trans	-103.5	124.5	163.7	-62.6	177	0	0	0	106.9	P548 E552	P548-I550 PolarHBondContact O-N 2.98Å; I550-E552 PolarHBondContact O-N 3.43Å
551	E	28.9	Very low	49.5	Very low	185 Å²	185	108.7 Å²	108.7	86%	0.864	58%	0.579	S	S	*	*			trans	-66.1	96.1	-177.6	-64.4	-178.5	140.5	0	0	111.3	L553	E551-L553 PolarHBondContact O-N 3.35Å
552	E	29.6	Very low	52.2	Low	178 Å²	178	103.8 Å²	103.8	83%	0.832	55%	0.547	S	S	*	.			trans	-60.8	122.7	169.5	-67.8	-169.6	141.3	0	0	109.8	I550 K554	I550-E552 PolarHBondContact O-N 3.43Å; E552-K554 PolarHBondContact O-N 3.01Å
553	L	37.4	Very low	55.3	Low	158 Å²	158	97.7 Å²	97.7	83%	0.827	51%	0.514	S	S	*	.			trans	-58.7	104.7	175.9	-80	89.9	0	0	0	109.9	E551 K555	E551-L553 PolarHBondContact O-N 3.35Å; L553-K555 VanDerWaalsContact C-N 3.29Å; L553-K555 PolarHBondContact O-N 3.45Å
554	K	56.9	Low	57.9	Low	132 Å²	132	90.7 Å²	90.7	57%	0.574	47%	0.471	S	S	*	.			trans	-59.4	81.2	176	-88	-175.7	170.1	-170.9	0	111.7	E552 N580 N635	E552-K554 PolarHBondContact O-N 3.01Å; K554-N580 HydrophobicContact CB-CB 4.25Å; K554-N580 WeakPolarHBondContact CD-OD1 3.46Å; K554-N580 WeakPolarHBondContact O-CB 3.45Å; K554-N635 PolarHBondContact NZ-ND2 3.28Å
555	K	64.8	Low	60.8	Low	135 Å²	135	89 Å²	89	59%	0.587	45%	0.45	S	S	*	.			trans	-62.4	139.2	176	-70.2	179.1	-177.3	178.6	0	110.8	L553 N580 L726	L553-K555 VanDerWaalsContact C-N 3.29Å; L553-K555 PolarHBondContact O-N 3.45Å; K555-N580 PolarHBondContact O-ND2 2.78Å; K555-L726 HydrophobicContact CB-CD1 3.93Å; K555-L726 HydrophobicContact CD-CD1 4.01Å; K555-L726 HydrophobicContact CG-CD1 4.33Å
556	S	76.9	Confident	63.2	Low	13 Å²	13	84.8 Å²	84.8	9%	0.091	42%	0.419	C	S	.	.			trans	-71	127.3	172.5	-52	0	0	0	0	109.9	K579 N580 I727	S556-K579 CarbonylContact C-O 3.53Å; S556-K579 VanDerWaalsContact CA-O 3.31Å; S556-K579 WeakPolarHBondContact CA-O 3.25Å; S556-N580 WeakPolarHBondContact CB-O 3.27Å; S556-N580 PolarHBondContact OG-O 2.86Å; S556-I727 PolarHBondContact O-N 2.88Å
557	L	81.9	Confident	65.8	Low	54 Å²	54	81 Å²	81	28%	0.283	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	152.9	-173.5	-66.1	166.9	0	0	0	110.8	M578 K579 W724 H725 L726	L557-M578 CarbonylContact O-C 3.57Å; L557-M578 WeakPolarHBondContact O-CA 3.48Å; L557-K579 HydrophobicContact CB-CB 4.34Å; L557-K579 PolarHBondContact N-O 2.96Å; L557-K579 PolarHBondContact O-N 3.35Å; L557-W724 HydrophobicContact CB-CE3 3.88Å; L557-W724 HydrophobicContact CB-CZ3 4.26Å; L557-H725 WeakPolarHBondContact CA-O 3.42Å; L557-L726 HydrophobicContact CD2-CD1 4.12Å
558	V	85.9	Confident	68.4	Low	0 Å²	0	76.8 Å²	76.8	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	136.3	173.7	58.4	0	0	0	0	111.6	V560 I575 E577 M578 I682 W724 H725 I727	V558-V560 HydrophobicContact CG1-CG2 4.11Å; V558-V560 HydrophobicContact CG2-CG2 3.89Å; V558-I575 HydrophobicContact CG2-CG2 3.36Å; V558-E577 WeakPolarHBondContact CA-O 3.34Å; V558-M578 HydrophobicContact CB-CG 4.32Å; V558-M578 HydrophobicContact CG2-CE 4.12Å; V558-M578 HydrophobicContact CG2-CG 3.98Å; V558-I682 HydrophobicContact CG1-CD1 3.78Å; V558-I682 HydrophobicContact CG1-CG1 3.89Å; V558-W724 CarbonylContact O-C 3.53Å; V558-W724 WeakPolarHBondContact O-CA 3.31Å; V558-H725 HydrophobicContact CG1-CB 4.11Å; V558-H725 PolarHBondContact N-O 3.32Å; V558-H725 PolarHBondContact O-N 3.17Å; V558-I727 HydrophobicContact CB-CD1 3.69Å; V558-I727 HydrophobicContact CB-CG1 4.18Å; V558-I727 HydrophobicContact CG1-CD1 3.8Å; V558-I727 HydrophobicContact CG1-CG1 3.76Å
559	K	88.7	Confident	71.4	Confident	41 Å²	41	73.7 Å²	73.7	18%	0.178	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	108.1	176.5	-166.9	-177.3	179.7	-149.5	0	108.6	E576 E577 T722 W724	K559-E576 HydrophobicContact CB-CB 4.47Å; K559-E576 HydrophobicContact CD-CB 4Å; K559-E576 WeakPolarHBondContact CD-OE2 3.33Å; K559-E576 WeakPolarHBondContact CE-OE2 3.44Å; K559-E576 HydrophobicContact CG-CB 4.34Å; K559-E576 IonicContact NZ-OE2 2.98Å; K559-E576 PolarHBondContact NZ-OE2 3.07Å; K559-E576 PolarHBondContact O-N 3.42Å; K559-E577 HydrophobicContact CB-CB 3.99Å; K559-E577 HydrophobicContact CD-CB 4.09Å; K559-E577 HydrophobicContact CD-CG 4.08Å; K559-E577 WeakPolarHBondContact CD-OE1 3.36Å; K559-E577 WeakPolarHBondContact CE-OE1 3.27Å; K559-E577 PolarHBondContact N-O 2.81Å; K559-E577 IonicContact NZ-OE1 2.69Å; K559-E577 PolarHBondContact NZ-OE1 2.98Å; K559-T722 HydrophobicContact CD-CG2 4.35Å; K559-T722 HydrophobicContact CG-CG2 3.81Å; K559-W724 HydrophobicContact CB-CD2 3.94Å; K559-W724 HydrophobicContact CB-CE3 3.81Å; K559-W724 HydrophobicContact CB-CH2 3.84Å; K559-W724 HydrophobicContact CB-CZ2 3.96Å; K559-W724 HydrophobicContact CB-CZ3 3.78Å; K559-W724 HydrophobicContact CD-CH2 4.22Å; K559-W724 HydrophobicContact CD-CZ2 3.73Å; K559-W724 HydrophobicContact CG-CD2 4.26Å; K559-W724 HydrophobicContact CG-CH2 4.48Å; K559-W724 HydrophobicContact CG-CZ2 4.11Å
560	V	89.4	Confident	74.5	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	130.2	-178.9	-176.5	0	0	0	0	109.2	V558 I562 I573 F574 L664 I684 Q697 Y723	V558-V560 HydrophobicContact CG1-CG2 4.11Å; V558-V560 HydrophobicContact CG2-CG2 3.89Å; V560-I562 HydrophobicContact CG1-CG2 4.35Å; V560-I573 HydrophobicContact CG1-CG2 3.99Å; V560-F574 WeakPolarHBondContact CA-O 3.42Å; V560-L664 HydrophobicContact CG1-CD2 4.03Å; V560-L664 HydrophobicContact CG2-CD2 3.79Å; V560-I684 HydrophobicContact CB-CD1 4.34Å; V560-I684 HydrophobicContact CG1-CD1 3.8Å; V560-Q697 PolarHBondContact O-NE2 2.72Å; V560-Y723 PolarHBondContact N-O 3.46Å; V560-Y723 PolarHBondContact O-N 2.89Å
561	T	91	Very high	77.6	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.8	175.6	-65.7	0	0	0	0	109.8	F574 E576 K720 F721 T722	T561-F574 HydrophobicContact CG2-CD2 4.26Å; T561-F574 PolarHBondContact N-O 2.95Å; T561-F574 PolarHBondContact O-N 2.89Å; T561-E576 VanDerWaalsContact CB-OE1 3.3Å; T561-E576 WeakPolarHBondContact CB-OE1 3.23Å; T561-E576 PolarHBondContact OG1-OE1 3.06Å; T561-K720 HydrophobicContact CG2-CB 3.68Å; T561-K720 HydrophobicContact CG2-CD 4.13Å; T561-K720 HydrophobicContact CG2-CG 4.08Å; T561-F721 WeakPolarHBondContact CA-O 3.31Å; T561-T722 WeakPolarHBondContact CG2-OG1 3.02Å; T561-T722 VanDerWaalsContact OG1-CB 3.27Å; T561-T722 WeakPolarHBondContact OG1-CB 3.36Å; T561-T722 WeakPolarHBondContact OG1-CG2 3.48Å; T561-T722 PolarHBondContact OG1-OG1 3.34Å
562	I	91.9	Very high	80.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	141.3	175.4	65.7	178.2	0	0	0	110.7	V560 F571 D572 I573 I684 Q697 L701 F721	V560-I562 HydrophobicContact CG1-CG2 4.35Å; I562-F571 HydrophobicContact CB-CE1 3.8Å; I562-F571 HydrophobicContact CB-CZ 4.01Å; I562-F571 HydrophobicContact CD1-CZ 4.17Å; I562-F571 HydrophobicContact CG2-CE1 3.95Å; I562-F571 HydrophobicContact CG2-CZ 4.31Å; I562-D572 WeakPolarHBondContact CA-O 3.35Å; I562-I573 HydrophobicContact CG2-CG2 4.5Å; I562-I684 HydrophobicContact CD1-CG2 4.43Å; I562-Q697 HydrophobicContact CD1-CG 3.67Å; I562-Q697 HydrophobicContact CG1-CG 3.95Å; I562-L701 HydrophobicContact CD1-CB 4.08Å; I562-L701 HydrophobicContact CD1-CD2 3.93Å; I562-L701 HydrophobicContact CG1-CD2 4.41Å; I562-F721 HydrophobicContact CG1-CB 3.99Å; I562-F721 PolarHBondContact N-O 3.23Å; I562-F721 PolarHBondContact O-N 3.22Å
563	Q	92.8	Very high	83.6	Confident	22 Å²	22	42.3 Å²	42.3	10%	0.103	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	146.7	177.4	-168.4	176.6	16.5	0	0	109.9	D572 F574 S717 T718 K720	Q563-D572 PolarHBondContact N-O 2.86Å; Q563-D572 PolarHBondContact O-N 3.36Å; Q563-F574 HydrophobicContact CB-CE2 4.41Å; Q563-S717 PolarHBondContact NE2-OG 3.06Å; Q563-T718 WeakPolarHBondContact CG-O 3.5Å; Q563-T718 PolarHBondContact NE2-O 2.91Å; Q563-K720 HydrophobicContact CB-CG 4.28Å; Q563-K720 HydrophobicContact CG-CG 4.28Å
564	Y	92.5	Very high	86.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	127.9	173.9	-176.8	-90	0	0	0	111.1	I566 S569 I570 F571 V649 V651 L654 L705 S717 T718	Y564-I566 HydrophobicContact CD1-CG1 3.9Å; Y564-I566 HydrophobicContact CE1-CB 4.33Å; Y564-I566 HydrophobicContact CE1-CG1 3.87Å; Y564-S569 WeakPolarHBondContact OH-CA 3.12Å; Y564-I570 WeakPolarHBondContact CA-O 3.41Å; Y564-F571 HydrophobicContact CD2-CB 3.98Å; Y564-F571 HydrophobicContact CD2-CD2 4.03Å; Y564-F571 HydrophobicContact CD2-CG 4.35Å; Y564-V649 VanDerWaalsContact CE2-O 3.25Å; Y564-V649 WeakPolarHBondContact CE2-O 3.41Å; Y564-V649 PolarHBondContact OH-O 3Å; Y564-V651 HydrophobicContact CE1-CB 3.98Å; Y564-V651 HydrophobicContact CE1-CG2 4.11Å; Y564-V651 WeakPolarHBondContact OH-CA 3.41Å; Y564-V651 WeakPolarHBondContact OH-CB 3.41Å; Y564-V651 PolarHBondContact OH-N 2.94Å; Y564-L654 HydrophobicContact CD2-CD1 3.51Å; Y564-L654 HydrophobicContact CE2-CD1 3.47Å; Y564-L654 VanDerWaalsContact CE2-CD1 3.47Å; Y564-L654 HydrophobicContact CG-CD1 4.24Å; Y564-L705 HydrophobicContact CD1-CD1 4.44Å; Y564-L705 HydrophobicContact CD1-CD2 3.36Å; Y564-L705 HydrophobicContact CE1-CD2 4.02Å; Y564-L705 HydrophobicContact CG-CD1 4.34Å; Y564-L705 HydrophobicContact CG-CD2 3.94Å; Y564-S717 CarbonylContact O-C 3.59Å; Y564-S717 VanDerWaalsContact O-CA 3.3Å; Y564-S717 WeakPolarHBondContact O-CA 2.96Å; Y564-T718 PolarHBondContact N-OG1 3.25Å; Y564-T718 PolarHBondContact O-N 2.95Å
565	K	91.1	Very high	87.7	Confident	70 Å²	70	29.9 Å²	29.9	30%	0.304	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.8	175.7	-68.8	164.7	178.1	159.2	0	108.2	S568 S569 I570 D572	K565-S568 WeakPolarHBondContact CB-OG 3.44Å; K565-S569 WeakPolarHBondContact O-CA 3.33Å; K565-S569 PolarHBondContact O-N 3.31Å; K565-S569 VanDerWaalsContact O-N 3.13Å; K565-I570 PolarHBondContact N-O 3.08Å; K565-I570 PolarHBondContact O-N 2.91Å; K565-I570 VanDerWaalsContact O-N 3.14Å; K565-D572 WeakPolarHBondContact CD-OD2 3.43Å; K565-D572 WeakPolarHBondContact CE-OD2 3.44Å; K565-D572 IonicContact NZ-OD2 2.87Å; K565-D572 PolarHBondContact NZ-OD2 3.14Å
566	I	86.4	Confident	88.7	Confident	23 Å²	23	25.2 Å²	25.2	12%	0.118	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-46.6	-174.1	-61.4	178.3	0	0	0	110	Y564 S568 S569 L705 L708 G716	Y564-I566 HydrophobicContact CD1-CG1 3.9Å; Y564-I566 HydrophobicContact CE1-CB 4.33Å; Y564-I566 HydrophobicContact CE1-CG1 3.87Å; I566-S568 VanDerWaalsContact C-N 3.28Å; I566-S568 PolarHBondContact O-N 3.05Å; I566-S569 PolarHBondContact O-N 3.32Å; I566-L705 HydrophobicContact CG1-CD2 4.43Å; I566-L708 HydrophobicContact CD1-CB 3.78Å; I566-L708 HydrophobicContact CD1-CD1 3.71Å; I566-L708 HydrophobicContact CD1-CG 4.35Å; I566-G716 PolarHBondContact N-O 3.33Å
567	D	84.8	Confident	89.2	Confident	101 Å²	101	26.5 Å²	26.5	54%	0.54	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-42.5	-174.2	-49.1	3.4	0	0	0	112.9	F715 G716	D567-F715 WeakPolarHBondContact OD1-CA 3.28Å; D567-G716 PolarHBondContact OD1-N 2.93Å
568	S	87	Confident	89.4	Confident	52 Å²	52	23.9 Å²	23.9	36%	0.364	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-5.5	-177.2	55.8	0	0	0	0	113.3	K565 I566 I570	K565-S568 WeakPolarHBondContact CB-OG 3.44Å; I566-S568 VanDerWaalsContact C-N 3.28Å; I566-S568 PolarHBondContact O-N 3.05Å; S568-I570 VanDerWaalsContact C-N 3.26Å; S568-I570 PolarHBondContact O-N 3.1Å; S568-I570 WeakPolarHBondContact OG-CG1 3.22Å
569	S	89.1	Confident	89.3	Confident	36 Å²	36	27.4 Å²	27.4	25%	0.252	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	44.7	-169.2	-62.8	0	0	0	0	113.1	Y564 K565 I566 N648 V649	Y564-S569 WeakPolarHBondContact OH-CA 3.12Å; K565-S569 WeakPolarHBondContact O-CA 3.33Å; K565-S569 PolarHBondContact O-N 3.31Å; K565-S569 VanDerWaalsContact O-N 3.13Å; I566-S569 PolarHBondContact O-N 3.32Å; S569-N648 CarbonylContact O-C 3.52Å; S569-N648 WeakPolarHBondContact O-CA 3.25Å; S569-V649 PolarHBondContact O-N 3.25Å
570	I	91	Very high	88.8	Confident	46 Å²	46	26.4 Å²	26.4	24%	0.236	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.8	-179.8	-63.8	176.2	0	0	0	109.9	Y564 K565 S568 D572	Y564-I570 WeakPolarHBondContact CA-O 3.41Å; K565-I570 PolarHBondContact N-O 3.08Å; K565-I570 PolarHBondContact O-N 2.91Å; K565-I570 VanDerWaalsContact O-N 3.14Å; S568-I570 VanDerWaalsContact C-N 3.26Å; S568-I570 PolarHBondContact O-N 3.1Å; S568-I570 WeakPolarHBondContact OG-CG1 3.22Å; I570-D572 WeakPolarHBondContact CG2-OD1 3.25Å
571	F	91.1	Very high	88.4	Confident	1 Å²	1	26.5 Å²	26.5	0%	0.004	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	113.4	165.8	-163.8	-60.3	0	0	0	108.6	I562 Y564 I573 S646 V647 V649 L654 I662 W698 L701	I562-F571 HydrophobicContact CB-CE1 3.8Å; I562-F571 HydrophobicContact CB-CZ 4.01Å; I562-F571 HydrophobicContact CD1-CZ 4.17Å; I562-F571 HydrophobicContact CG2-CE1 3.95Å; I562-F571 HydrophobicContact CG2-CZ 4.31Å; Y564-F571 HydrophobicContact CD2-CB 3.98Å; Y564-F571 HydrophobicContact CD2-CD2 4.03Å; Y564-F571 HydrophobicContact CD2-CG 4.35Å; F571-I573 HydrophobicContact CD1-CD1 4.47Å; F571-I573 HydrophobicContact CD1-CG1 3.81Å; F571-I573 HydrophobicContact CE1-CG1 3.78Å; F571-S646 CarbonylContact O-C 3.49Å; F571-S646 WeakPolarHBondContact O-CA 3.45Å; F571-V647 PolarHBondContact N-O 2.81Å; F571-V647 PolarHBondContact O-N 3.4Å; F571-V649 HydrophobicContact CB-CG2 4.29Å; F571-L654 HydrophobicContact CD2-CD1 3.99Å; F571-L654 HydrophobicContact CD2-CD2 4.12Å; F571-L654 HydrophobicContact CE2-CD1 4.5Å; F571-L654 HydrophobicContact CE2-CD2 4.23Å; F571-I662 HydrophobicContact CD1-CD1 3.84Å; F571-I662 HydrophobicContact CD2-CD1 4.5Å; F571-I662 HydrophobicContact CE1-CD1 3.25Å; F571-I662 HydrophobicContact CE2-CD1 3.97Å; F571-I662 HydrophobicContact CG-CD1 4.45Å; F571-I662 HydrophobicContact CZ-CD1 3.32Å; F571-W698 HydrophobicContact CE2-CH2 4.08Å; F571-W698 AromaticContact CE2-CZ3 3.68Å; F571-W698 HydrophobicContact CE2-CZ3 3.68Å; F571-W698 HydrophobicContact CZ-CE3 4.44Å; F571-W698 AromaticContact CZ-CZ3 3.77Å; F571-W698 HydrophobicContact CZ-CZ3 3.77Å; F571-L701 HydrophobicContact CD2-CD2 4.21Å; F571-L701 HydrophobicContact CE2-CD2 3.24Å; F571-L701 HydrophobicContact CZ-CD2 3.44Å; F571-L701 VanDerWaalsContact CZ-CD2 3.44Å
572	D	92.3	Very high	87.8	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	134.7	176.4	-67.6	-41.9	0	0	0	111.3	I562 Q563 K565 I570 F574 H644 S646	I562-D572 WeakPolarHBondContact CA-O 3.35Å; Q563-D572 PolarHBondContact N-O 2.86Å; Q563-D572 PolarHBondContact O-N 3.36Å; K565-D572 WeakPolarHBondContact CD-OD2 3.43Å; K565-D572 WeakPolarHBondContact CE-OD2 3.44Å; K565-D572 IonicContact NZ-OD2 2.87Å; K565-D572 PolarHBondContact NZ-OD2 3.14Å; I570-D572 WeakPolarHBondContact CG2-OD1 3.25Å; D572-F574 HydrophobicContact CB-CD2 4.38Å; D572-F574 HydrophobicContact CB-CE2 3.53Å; D572-F574 HydrophobicContact CB-CZ 3.87Å; D572-H644 IonicContact OD1-CD2 3.26Å; D572-S646 VanDerWaalsContact OD1-CB 3.25Å; D572-S646 WeakPolarHBondContact OD1-CB 3.21Å; D572-S646 PolarHBondContact OD1-OG 3.42Å
573	I	92.3	Very high	87.3	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.015	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	117.8	176.1	-51.4	154.4	0	0	0	107.7	V560 I562 F571 A594 H644 V645 V647 I662 L664	V560-I573 HydrophobicContact CG1-CG2 3.99Å; I562-I573 HydrophobicContact CG2-CG2 4.5Å; F571-I573 HydrophobicContact CD1-CD1 4.47Å; F571-I573 HydrophobicContact CD1-CG1 3.81Å; F571-I573 HydrophobicContact CE1-CG1 3.78Å; I573-A594 HydrophobicContact CD1-CB 3.41Å; I573-A594 VanDerWaalsContact CD1-CB 3.41Å; I573-H644 WeakPolarHBondContact O-CA 3.47Å; I573-V645 HydrophobicContact CB-CB 4.44Å; I573-V645 PolarHBondContact N-O 2.82Å; I573-V645 PolarHBondContact O-N 3.09Å; I573-V647 HydrophobicContact CD1-CG2 4.4Å; I573-I662 HydrophobicContact CD1-CD1 3.9Å; I573-I662 HydrophobicContact CD1-CG1 4.46Å; I573-I662 HydrophobicContact CD1-CG2 3.85Å; I573-I662 HydrophobicContact CG1-CD1 4.15Å; I573-L664 HydrophobicContact CG2-CD1 4.44Å; I573-L664 HydrophobicContact CG2-CD2 4.38Å
574	F	91	Very high	86.7	Confident	21 Å²	21	31.2 Å²	31.2	9%	0.092	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143	176.3	-51.7	-102.7	0	0	0	109	V560 T561 Q563 D572 H644	V560-F574 WeakPolarHBondContact CA-O 3.42Å; T561-F574 HydrophobicContact CG2-CD2 4.26Å; T561-F574 PolarHBondContact N-O 2.95Å; T561-F574 PolarHBondContact O-N 2.89Å; Q563-F574 HydrophobicContact CB-CE2 4.41Å; D572-F574 HydrophobicContact CB-CD2 4.38Å; D572-F574 HydrophobicContact CB-CE2 3.53Å; D572-F574 HydrophobicContact CB-CZ 3.87Å; F574-H644 HydrophobicContact CD1-CB 3.45Å; F574-H644 VanDerWaalsContact CD1-CB 3.45Å; F574-H644 HydrophobicContact CE1-CB 3.57Å; F574-H644 AromaticContact CE1-CG 3.69Å; F574-H644 HydrophobicContact CG-CB 4Å; F574-H644 HydrophobicContact CZ-CB 4.23Å
575	I	89.4	Confident	86	Confident	8 Å²	8	34.6 Å²	34.6	4%	0.041	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	114.6	164.4	-48.6	-172	0	0	0	106.8	V558 M578 F592 L639 L664 I666	V558-I575 HydrophobicContact CG2-CG2 3.36Å; I575-M578 HydrophobicContact CD1-CE 4.24Å; I575-M578 HydrophobicContact CG2-CE 3.82Å; I575-F592 HydrophobicContact CB-CD2 4.45Å; I575-F592 HydrophobicContact CB-CE2 4.21Å; I575-F592 HydrophobicContact CD1-CB 4.01Å; I575-F592 HydrophobicContact CD1-CD1 3.54Å; I575-F592 HydrophobicContact CD1-CD2 3.68Å; I575-F592 HydrophobicContact CD1-CE1 3.9Å; I575-F592 HydrophobicContact CD1-CE2 4.01Å; I575-F592 HydrophobicContact CD1-CG 3.43Å; I575-F592 VanDerWaalsContact CD1-CG 3.43Å; I575-F592 HydrophobicContact CD1-CZ 4.13Å; I575-F592 HydrophobicContact CG1-CD2 4.18Å; I575-F592 HydrophobicContact CG1-CE2 4.42Å; I575-F592 HydrophobicContact CG1-CG 4.37Å; I575-L639 HydrophobicContact CB-CD1 3.84Å; I575-L639 HydrophobicContact CG2-CD1 3.56Å; I575-L639 WeakPolarHBondContact O-CB 3.43Å; I575-L639 WeakPolarHBondContact O-CD1 3.42Å; I575-L664 HydrophobicContact CD1-CD1 4.19Å; I575-L664 HydrophobicContact CD1-CD2 3.77Å; I575-L664 HydrophobicContact CD1-CG 4.22Å; I575-L664 HydrophobicContact CG1-CD2 4.07Å; I575-I666 HydrophobicContact CD1-CG1 4.45Å
576	E	85.8	Confident	85.4	Confident	38 Å²	38	36 Å²	36	18%	0.178	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-46.6	-172.2	-66.5	173.9	-163.5	0	0	111.3	K559 T561 L639	K559-E576 HydrophobicContact CB-CB 4.47Å; K559-E576 HydrophobicContact CD-CB 4Å; K559-E576 WeakPolarHBondContact CD-OE2 3.33Å; K559-E576 WeakPolarHBondContact CE-OE2 3.44Å; K559-E576 HydrophobicContact CG-CB 4.34Å; K559-E576 IonicContact NZ-OE2 2.98Å; K559-E576 PolarHBondContact NZ-OE2 3.07Å; K559-E576 PolarHBondContact O-N 3.42Å; T561-E576 VanDerWaalsContact CB-OE1 3.3Å; T561-E576 WeakPolarHBondContact CB-OE1 3.23Å; T561-E576 PolarHBondContact OG1-OE1 3.06Å; E576-L639 PolarHBondContact O-N 3.19Å
577	E	87	Confident	85.2	Confident	39 Å²	39	35.5 Å²	35.5	18%	0.182	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	148.8	-172.5	-65.5	173	-118.2	0	0	111.2	V558 K559 H636 I637 W724	V558-E577 WeakPolarHBondContact CA-O 3.34Å; K559-E577 HydrophobicContact CB-CB 3.99Å; K559-E577 HydrophobicContact CD-CB 4.09Å; K559-E577 HydrophobicContact CD-CG 4.08Å; K559-E577 WeakPolarHBondContact CD-OE1 3.36Å; K559-E577 WeakPolarHBondContact CE-OE1 3.27Å; K559-E577 PolarHBondContact N-O 2.81Å; K559-E577 IonicContact NZ-OE1 2.69Å; K559-E577 PolarHBondContact NZ-OE1 2.98Å; E577-H636 IonicContact OE2-CD2 3.18Å; E577-H636 IonicContact OE2-CE1 2.75Å; E577-H636 IonicContact OE2-NE2 3.79Å; E577-H636 PolarHBondContact OE2-NE2 3.04Å; E577-I637 CarbonylContact C-O 3.53Å; E577-I637 VanDerWaalsContact CA-O 3.32Å; E577-I637 WeakPolarHBondContact CA-O 3.35Å; E577-W724 HydrophobicContact CB-CH2 3.7Å; E577-W724 HydrophobicContact CB-CZ2 4.48Å; E577-W724 HydrophobicContact CB-CZ3 4.31Å
578	M	87.1	Confident	85.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	150.5	164.2	-54.6	-170.6	178.1	0	0	111	L557 V558 I575 V581 M590 F592 H636 I637 L639 I666	L557-M578 CarbonylContact O-C 3.57Å; L557-M578 WeakPolarHBondContact O-CA 3.48Å; V558-M578 HydrophobicContact CB-CG 4.32Å; V558-M578 HydrophobicContact CG2-CE 4.12Å; V558-M578 HydrophobicContact CG2-CG 3.98Å; I575-M578 HydrophobicContact CD1-CE 4.24Å; I575-M578 HydrophobicContact CG2-CE 3.82Å; M578-V581 HydrophobicContact CB-CG2 3.63Å; M578-V581 HydrophobicContact CG-CG2 4.46Å; M578-V581 HydrophobicContact SD-CG2 4.13Å; M578-M590 HydrophobicContact CE-SD 4Å; M578-M590 HydrophobicContact SD-CE 4.1Å; M578-M590 HydrophobicContact SD-SD 4.01Å; M578-F592 HydrophobicContact CE-CD1 4.28Å; M578-F592 HydrophobicContact CE-CE1 3.37Å; M578-F592 HydrophobicContact CE-CZ 3.75Å; M578-H636 CarbonylContact O-C 3.57Å; M578-H636 WeakPolarHBondContact O-CA 3.38Å; M578-I637 HydrophobicContact CB-CB 4.31Å; M578-I637 PolarHBondContact N-O 2.88Å; M578-I637 PolarHBondContact O-N 2.87Å; M578-L639 HydrophobicContact CE-CD1 4.21Å; M578-I666 HydrophobicContact CE-CD1 3.32Å; M578-I666 HydrophobicContact CE-CG1 3.85Å; M578-I666 HydrophobicContact CE-CG2 4.13Å; M578-I666 HydrophobicContact SD-CD1 4.12Å
579	K	82.8	Confident	85.1	Confident	73 Å²	73	30 Å²	30	32%	0.317	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.4	176.2	-70.9	175.1	177.9	171	0	111.6	S556 L557 V581 N635 W724	S556-K579 CarbonylContact C-O 3.53Å; S556-K579 VanDerWaalsContact CA-O 3.31Å; S556-K579 WeakPolarHBondContact CA-O 3.25Å; L557-K579 HydrophobicContact CB-CB 4.34Å; L557-K579 PolarHBondContact N-O 2.96Å; L557-K579 PolarHBondContact O-N 3.35Å; K579-V581 PolarHBondContact O-N 3.18Å; K579-N635 CarbonylContact C-O 3.56Å; K579-N635 WeakPolarHBondContact CA-O 3.43Å; K579-N635 WeakPolarHBondContact CB-O 3.49Å; K579-W724 HydrophobicContact CD-CH2 3.67Å; K579-W724 HydrophobicContact CD-CZ2 4.39Å; K579-W724 HydrophobicContact CD-CZ3 3.91Å; K579-W724 HydrophobicContact CG-CH2 4.06Å; K579-W724 HydrophobicContact CG-CZ3 4.07Å
580	N	78.7	Confident	85.1	Confident	21 Å²	21	28.3 Å²	28.3	11%	0.112	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52.5	44.2	175.7	-48.1	-52.4	0	0	0	114.5	K554 K555 S556 Y634 N635	K554-N580 HydrophobicContact CB-CB 4.25Å; K554-N580 WeakPolarHBondContact CD-OD1 3.46Å; K554-N580 WeakPolarHBondContact O-CB 3.45Å; K555-N580 PolarHBondContact O-ND2 2.78Å; S556-N580 WeakPolarHBondContact CB-O 3.27Å; S556-N580 PolarHBondContact OG-O 2.86Å; N580-Y634 CarbonylContact C-O 3.56Å; N580-Y634 VanDerWaalsContact CA-O 3.3Å; N580-Y634 WeakPolarHBondContact CA-O 3.32Å; N580-Y634 PolarHBondContact N-O 2.82Å; N580-Y634 VanDerWaalsContact N-O 3.16Å; N580-N635 PolarHBondContact N-O 2.93Å; N580-N635 WeakPolarHBondContact OD1-CB 3.3Å
581	V	80.7	Confident	84.9	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	134.4	-177.3	-175	0	0	0	0	111.1	M578 K579 I583 Y634 I637 V679	M578-V581 HydrophobicContact CB-CG2 3.63Å; M578-V581 HydrophobicContact CG-CG2 4.46Å; M578-V581 HydrophobicContact SD-CG2 4.13Å; K579-V581 PolarHBondContact O-N 3.18Å; V581-I583 HydrophobicContact CG1-CD1 4.29Å; V581-I583 HydrophobicContact CG1-CG1 3.96Å; V581-Y634 PolarHBondContact N-O 2.83Å; V581-Y634 PolarHBondContact O-N 3.34Å; V581-I637 HydrophobicContact CB-CD1 4.4Å; V581-V679 HydrophobicContact CG1-CG1 3.82Å
582	K	79.9	Confident	84.8	Confident	79 Å²	79	27.3 Å²	27.3	34%	0.343	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	114.6	178.5	-57.9	-168.9	178.5	-173.8	0	111.4	I633	K582-I633 HydrophobicContact CG-CG1 4.28Å
583	I	81.7	Confident	84.6	Confident	1 Å²	1	28 Å²	28	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.7	-177.2	-57.2	-179.4	0	0	0	108.8	V581 E587 M590 L613 F631 R632 Y634 I637 T668	V581-I583 HydrophobicContact CG1-CD1 4.29Å; V581-I583 HydrophobicContact CG1-CG1 3.96Å; I583-E587 HydrophobicContact CG2-CB 3.72Å; I583-M590 HydrophobicContact CD1-CE 3.56Å; I583-L613 HydrophobicContact CD1-CD1 3.75Å; I583-L613 HydrophobicContact CD1-CD2 3.95Å; I583-L613 HydrophobicContact CG2-CD1 3.91Å; I583-F631 CarbonylContact O-C 3.59Å; I583-F631 VanDerWaalsContact O-CA 3.3Å; I583-F631 WeakPolarHBondContact O-CA 3.5Å; I583-R632 PolarHBondContact N-O 2.88Å; I583-R632 PolarHBondContact O-N 3.15Å; I583-Y634 HydrophobicContact CB-CD2 4.35Å; I583-Y634 HydrophobicContact CB-CE2 4.1Å; I583-Y634 HydrophobicContact CD1-CD2 3.92Å; I583-Y634 HydrophobicContact CD1-CE2 3.93Å; I583-Y634 HydrophobicContact CG1-CD2 4.24Å; I583-Y634 HydrophobicContact CG1-CE2 4.34Å; I583-I637 HydrophobicContact CD1-CD1 4.2Å; I583-T668 HydrophobicContact CD1-CG2 4.35Å; I583-T668 HydrophobicContact CG1-CG2 4.45Å; I583-T668 HydrophobicContact CG2-CG2 4.04Å
584	L	78.8	Confident	84.5	Confident	41 Å²	41	27.9 Å²	27.9	22%	0.215	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	144.2	178	-72.2	164.4	0	0	0	110.5	N586 E587 F631	L584-N586 VanDerWaalsContact CB-OD1 3.27Å; L584-N586 WeakPolarHBondContact CB-OD1 3.37Å; L584-N586 PolarHBondContact O-N 3.38Å; L584-E587 HydrophobicContact CB-CG 3.99Å; L584-E587 PolarHBondContact N-OE2 3.4Å; L584-E587 VanDerWaalsContact N-OE2 3.13Å; L584-E587 WeakPolarHBondContact O-CB 2.99Å; L584-E587 PolarHBondContact O-N 3.19Å; L584-F631 HydrophobicContact CD2-CD1 3.63Å; L584-F631 HydrophobicContact CD2-CE1 3.27Å; L584-F631 HydrophobicContact CD2-CE2 4.31Å; L584-F631 HydrophobicContact CD2-CG 4.3Å; L584-F631 HydrophobicContact CD2-CZ 3.65Å; L584-F631 HydrophobicContact CG-CD1 4.01Å; L584-F631 HydrophobicContact CG-CE1 3.71Å; L584-F631 HydrophobicContact CG-CZ 4.49Å
585	K	77.7	Confident	84.2	Confident	70 Å²	70	27.9 Å²	27.9	30%	0.304	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-23	-175.4	-85.3	-166.6	-175.1	-175.8	0	115.7	D629 L630 R632	K585-D629 WeakPolarHBondContact CD-O 3.47Å; K585-D629 WeakPolarHBondContact CE-O 3.25Å; K585-D629 PolarHBondContact NZ-O 3.03Å; K585-D629 VanDerWaalsContact NZ-O 3.17Å; K585-D629 IonicContact NZ-OD1 2.65Å; K585-D629 PolarHBondContact NZ-OD1 3.18Å; K585-D629 IonicContact NZ-OD2 2.7Å; K585-D629 PolarHBondContact NZ-OD2 2.92Å; K585-L630 PolarHBondContact N-O 2.82Å; K585-R632 HydrophobicContact CG-CG 3.83Å
586	N	78.8	Confident	84.1	Confident	101 Å²	101	27.7 Å²	27.7	54%	0.54	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-6.8	-179.8	57.1	-21.9	0	0	0	113.6	L584 T670	L584-N586 VanDerWaalsContact CB-OD1 3.27Å; L584-N586 WeakPolarHBondContact CB-OD1 3.37Å; L584-N586 PolarHBondContact O-N 3.38Å; N586-T670 HydrophobicContact CB-CG2 4.25Å; N586-T670 WeakPolarHBondContact O-CA 3.41Å; N586-T670 WeakPolarHBondContact O-CB 3.49Å; N586-T670 WeakPolarHBondContact O-CG2 3.3Å
587	E	82.5	Confident	83.7	Confident	11 Å²	11	26.1 Å²	26.1	5%	0.051	13%	0.127	C	C	.	.			trans	-84.3	125.8	174.8	-69.1	171.4	164.9	0	0	109.8	I583 L584 T668 R669 T670 R677	I583-E587 HydrophobicContact CG2-CB 3.72Å; L584-E587 HydrophobicContact CB-CG 3.99Å; L584-E587 PolarHBondContact N-OE2 3.4Å; L584-E587 VanDerWaalsContact N-OE2 3.13Å; L584-E587 WeakPolarHBondContact O-CB 2.99Å; L584-E587 PolarHBondContact O-N 3.19Å; E587-T668 PolarHBondContact OE1-OG1 2.87Å; E587-T668 WeakPolarHBondContact OE2-CB 3.18Å; E587-T668 PolarHBondContact OE2-OG1 3.14Å; E587-R669 CarbonylContact C-O 3.43Å; E587-R669 WeakPolarHBondContact CA-O 3.42Å; E587-T670 HydrophobicContact CG-CG2 4.16Å; E587-R677 WeakPolarHBondContact OE1-CB 3.41Å; E587-R677 WeakPolarHBondContact OE1-CD 3.2Å; E587-R677 IonicContact OE1-NH1 2.83Å; E587-R677 IonicContact OE2-NH1 2.66Å; E587-R677 PolarHBondContact OE2-NH1 2.97Å
588	T	82.9	Confident	83.2	Confident	26 Å²	26	25.1 Å²	25.1	16%	0.16	12%	0.123	C	C	.	.			trans	-119.1	-24.8	-168.2	46.1	0	0	0	0	112.5	R612 L613 R669 D671	T588-R612 WeakPolarHBondContact O-CA 3.4Å; T588-L613 PolarHBondContact O-N 3.05Å; T588-R669 PolarHBondContact N-O 3.32Å; T588-D671 WeakPolarHBondContact CB-OD1 3.35Å; T588-D671 PolarHBondContact OG1-N 2.87Å; T588-D671 PolarHBondContact OG1-OD1 3.13Å
589	E	86.3	Confident	82.3	Confident	12 Å²	12	25.8 Å²	25.8	6%	0.056	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135	-178.1	-69	-172.8	160.7	0	0	111.2	P610 I611 R612 T668 R669	E589-P610 HydrophobicContact CB-CB 4.3Å; E589-P610 HydrophobicContact CG-CB 4.43Å; E589-P610 WeakPolarHBondContact OE2-CB 3.39Å; E589-I611 CarbonylContact C-O 3.6Å; E589-I611 WeakPolarHBondContact CA-O 3.45Å; E589-R612 HydrophobicContact CG-CG 3.75Å; E589-R612 IonicContact OE1-CZ 3.48Å; E589-R612 IonicContact OE1-NE 3.69Å; E589-R612 PolarHBondContact OE1-NE 2.82Å; E589-R612 IonicContact OE1-NH2 3.8Å; E589-R612 PolarHBondContact OE1-NH2 2.92Å; E589-T668 CarbonylContact O-C 3.54Å; E589-T668 VanDerWaalsContact O-CA 3.27Å; E589-T668 WeakPolarHBondContact O-CA 3.31Å; E589-R669 HydrophobicContact CB-CG 3.95Å; E589-R669 PolarHBondContact N-O 3.13Å; E589-R669 VanDerWaalsContact N-O 3.14Å; E589-R669 PolarHBondContact O-N 3.3Å; E589-R669 IonicContact OE2-CZ 3.87Å; E589-R669 IonicContact OE2-NE 3.65Å; E589-R669 PolarHBondContact OE2-NE 2.73Å; E589-R669 IonicContact OE2-NH2 2.81Å; E589-R669 PolarHBondContact OE2-NH2 2.68Å
590	M	88.6	Confident	81.2	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.1	173.6	-178.1	178.1	-82.8	0	0	109.9	M578 I583 F592 I611 L613 I637 I666 F667 T668	M578-M590 HydrophobicContact CE-SD 4Å; M578-M590 HydrophobicContact SD-CE 4.1Å; M578-M590 HydrophobicContact SD-SD 4.01Å; I583-M590 HydrophobicContact CD1-CE 3.56Å; M590-F592 HydrophobicContact CG-CD1 4.44Å; M590-F592 HydrophobicContact CG-CE1 3.6Å; M590-F592 HydrophobicContact CG-CZ 4.08Å; M590-F592 HydrophobicContact SD-CE1 3.5Å; M590-F592 WeakPolarHBondContact SD-CE1 3.46Å; M590-F592 HydrophobicContact SD-CZ 3.74Å; M590-I611 PolarHBondContact N-O 3.24Å; M590-I611 PolarHBondContact O-N 3.08Å; M590-L613 HydrophobicContact CB-CD2 4.05Å; M590-L613 HydrophobicContact CB-CG 4.3Å; M590-L613 HydrophobicContact CE-CD2 4.14Å; M590-L613 HydrophobicContact SD-CD2 4.49Å; M590-I637 HydrophobicContact CE-CD1 4.29Å; M590-I666 HydrophobicContact CE-CG2 4.13Å; M590-I666 HydrophobicContact CG-CG2 4.03Å; M590-I666 HydrophobicContact SD-CG2 4.07Å; M590-F667 CarbonylContact C-O 3.52Å; M590-F667 VanDerWaalsContact CA-O 3.31Å; M590-F667 WeakPolarHBondContact CA-O 3.16Å; M590-T668 HydrophobicContact CB-CG2 4.36Å; M590-T668 HydrophobicContact CE-CG2 4.25Å; M590-T668 HydrophobicContact CG-CG2 4.47Å
591	M	88.2	Confident	80.6	Confident	22 Å²	22	27.9 Å²	27.9	11%	0.108	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	148.3	175.4	-79.4	-169.6	-63.2	0	0	111.4	P610 F667 L676	M591-P610 HydrophobicContact CG-CB 4.03Å; M591-P610 HydrophobicContact CG-CG 4.21Å; M591-P610 HydrophobicContact SD-CB 4.2Å; M591-P610 HydrophobicContact SD-CG 3.76Å; M591-F667 PolarHBondContact N-O 2.87Å; M591-F667 PolarHBondContact O-N 3.41Å; M591-L676 HydrophobicContact CE-CD1 4.19Å; M591-L676 HydrophobicContact CE-CD2 3.23Å; M591-L676 HydrophobicContact CE-CG 4.32Å
592	F	89.5	Confident	80.5	Confident	5 Å²	5	30.9 Å²	30.9	2%	0.022	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.1	175.9	-46.4	-44.9	0	0	0	109.9	I575 M578 M590 R607 C608 I611 L639 Q665 I666	I575-F592 HydrophobicContact CB-CD2 4.45Å; I575-F592 HydrophobicContact CB-CE2 4.21Å; I575-F592 HydrophobicContact CD1-CB 4.01Å; I575-F592 HydrophobicContact CD1-CD1 3.54Å; I575-F592 HydrophobicContact CD1-CD2 3.68Å; I575-F592 HydrophobicContact CD1-CE1 3.9Å; I575-F592 HydrophobicContact CD1-CE2 4.01Å; I575-F592 HydrophobicContact CD1-CG 3.43Å; I575-F592 VanDerWaalsContact CD1-CG 3.43Å; I575-F592 HydrophobicContact CD1-CZ 4.13Å; I575-F592 HydrophobicContact CG1-CD2 4.18Å; I575-F592 HydrophobicContact CG1-CE2 4.42Å; I575-F592 HydrophobicContact CG1-CG 4.37Å; M578-F592 HydrophobicContact CE-CD1 4.28Å; M578-F592 HydrophobicContact CE-CE1 3.37Å; M578-F592 HydrophobicContact CE-CZ 3.75Å; M590-F592 HydrophobicContact CG-CD1 4.44Å; M590-F592 HydrophobicContact CG-CE1 3.6Å; M590-F592 HydrophobicContact CG-CZ 4.08Å; M590-F592 HydrophobicContact SD-CE1 3.5Å; M590-F592 WeakPolarHBondContact SD-CE1 3.46Å; M590-F592 HydrophobicContact SD-CZ 3.74Å; F592-R607 VanDerWaalsContact O-CA 3.25Å; F592-R607 WeakPolarHBondContact O-CA 3.36Å; F592-C608 HydrophobicContact CD2-CB 4.45Å; F592-C608 VanDerWaalsContact CD2-SG 3.58Å; F592-C608 PolarHBondContact N-SG 2.84Å; F592-C608 PolarHBondContact O-N 3.21Å; F592-I611 HydrophobicContact CD2-CD1 4.36Å; F592-I611 HydrophobicContact CE2-CD1 3.6Å; F592-I611 HydrophobicContact CZ-CD1 4.19Å; F592-L639 HydrophobicContact CE2-CD1 3.79Å; F592-L639 HydrophobicContact CE2-CD2 4.14Å; F592-L639 HydrophobicContact CZ-CD1 3.52Å; F592-L639 HydrophobicContact CZ-CD2 3.82Å; F592-L639 HydrophobicContact CZ-CG 4.33Å; F592-Q665 WeakPolarHBondContact CA-O 3.34Å; F592-I666 HydrophobicContact CD1-CB 4.32Å; F592-I666 HydrophobicContact CD1-CG1 3.83Å; F592-I666 HydrophobicContact CD1-CG2 4.11Å; F592-I666 HydrophobicContact CE1-CG1 4.13Å; F592-I666 HydrophobicContact CE1-CG2 3.94Å
593	Q	88	Confident	80.5	Confident	15 Å²	15	30.4 Å²	30.4	7%	0.07	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117.1	176.2	-178.5	178.9	-63	0	0	108.7	L595 V605 V606 R607 Q665 F667	Q593-L595 HydrophobicContact CG-CD1 4Å; Q593-V605 HydrophobicContact CG-CG1 3.48Å; Q593-V605 VanDerWaalsContact CG-CG1 3.48Å; Q593-V606 CarbonylContact C-O 3.45Å; Q593-V606 WeakPolarHBondContact CA-O 3.16Å; Q593-R607 HydrophobicContact CB-CG 4Å; Q593-R607 HydrophobicContact CG-CG 3.87Å; Q593-Q665 HydrophobicContact CB-CB 4.34Å; Q593-Q665 PolarHBondContact N-O 2.96Å; Q593-Q665 PolarHBondContact O-N 3.18Å; Q593-F667 HydrophobicContact CB-CD2 4.27Å; Q593-F667 HydrophobicContact CB-CE2 3.9Å
594	A	89.1	Confident	80.4	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.008	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.8	169.1	0	0	0	0	0	109.5	I573 V605 V606 V645 I662 L664	I573-A594 HydrophobicContact CD1-CB 3.41Å; I573-A594 VanDerWaalsContact CD1-CB 3.41Å; A594-V605 WeakPolarHBondContact O-CA 3.39Å; A594-V606 PolarHBondContact N-O 2.83Å; A594-V606 PolarHBondContact O-N 2.85Å; A594-V645 HydrophobicContact CB-CB 4.43Å; A594-V645 HydrophobicContact CB-CG1 3.67Å; A594-I662 HydrophobicContact CB-CG2 4.26Å; A594-L664 HydrophobicContact CB-CD1 4.41Å
595	L	85.9	Confident	80.7	Confident	20 Å²	20	33.5 Å²	33.5	11%	0.105	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	114.9	169.5	-58	82.4	0	0	0	107.2	Q593 T602 S604 V605 I662 I663 Q665	Q593-L595 HydrophobicContact CG-CD1 4Å; L595-T602 HydrophobicContact CB-CG2 3.98Å; L595-T602 HydrophobicContact CD2-CG2 4.23Å; L595-T602 HydrophobicContact CG-CG2 4.42Å; L595-S604 WeakPolarHBondContact CA-O 3.14Å; L595-V605 HydrophobicContact CD2-CG2 4.38Å; L595-V605 HydrophobicContact CG-CG1 4.47Å; L595-V605 HydrophobicContact CG-CG2 4.14Å; L595-I662 CarbonylContact O-C 3.53Å; L595-I662 WeakPolarHBondContact O-CA 3.35Å; L595-I663 HydrophobicContact CB-CB 4.28Å; L595-I663 HydrophobicContact CD1-CB 4.42Å; L595-I663 HydrophobicContact CD1-CG2 4.48Å; L595-I663 VanDerWaalsContact CD1-O 3.3Å; L595-I663 WeakPolarHBondContact CD1-O 3.3Å; L595-I663 PolarHBondContact N-O 2.81Å; L595-I663 PolarHBondContact O-N 2.68Å; L595-Q665 HydrophobicContact CD1-CG 3.93Å
596	F	86.4	Confident	81.1	Confident	5 Å²	5	32.3 Å²	32.3	2%	0.022	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120	172.6	-170.1	-118	0	0	0	108.3	T602 L603 S604 V647 V649 L654 I660 I662 W698	F596-T602 CarbonylContact O-C 3.56Å; F596-L603 HydrophobicContact CD1-CB 4.03Å; F596-L603 HydrophobicContact CD1-CD1 3.85Å; F596-L603 HydrophobicContact CE1-CD1 3.77Å; F596-L603 PolarHBondContact O-N 3.02Å; F596-S604 WeakPolarHBondContact CB-OG 3.27Å; F596-S604 PolarHBondContact N-O 2.88Å; F596-S604 PolarHBondContact O-N 2.85Å; F596-V647 HydrophobicContact CB-CG1 4.19Å; F596-V647 HydrophobicContact CG-CG1 4.46Å; F596-V649 HydrophobicContact CD1-CG2 3.88Å; F596-V649 HydrophobicContact CD2-CG2 4.28Å; F596-V649 HydrophobicContact CE1-CB 4.26Å; F596-V649 HydrophobicContact CE1-CG1 3.54Å; F596-V649 HydrophobicContact CE1-CG2 3.64Å; F596-V649 HydrophobicContact CE2-CG1 4.25Å; F596-V649 HydrophobicContact CE2-CG2 4.06Å; F596-V649 HydrophobicContact CG-CG2 4.2Å; F596-V649 HydrophobicContact CZ-CB 4.21Å; F596-V649 HydrophobicContact CZ-CG1 3.35Å; F596-V649 HydrophobicContact CZ-CG2 3.74Å; F596-L654 HydrophobicContact CE2-CD2 3.91Å; F596-L654 HydrophobicContact CZ-CD2 3.79Å; F596-I660 HydrophobicContact CE1-CD1 3.62Å; F596-I660 HydrophobicContact CE1-CG1 3.98Å; F596-I660 HydrophobicContact CE2-CD1 4.32Å; F596-I660 HydrophobicContact CE2-CG1 4.05Å; F596-I660 HydrophobicContact CZ-CD1 3.32Å; F596-I660 HydrophobicContact CZ-CG1 3.5Å; F596-I662 HydrophobicContact CD2-CG1 3.86Å; F596-I662 HydrophobicContact CE2-CG1 4.42Å; F596-W698 HydrophobicContact CE2-CH2 4.48Å
597	C	78	Confident	81.6	Confident	4 Å²	4	34.6 Å²	34.6	3%	0.027	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.5	-168.2	-68.5	0	0	0	0	111.4	T601 I660 G661	C597-T601 CarbonylContact C-O 3.58Å; C597-T601 WeakPolarHBondContact CA-O 3.47Å; C597-I660 CarbonylContact O-C 3.51Å; C597-I660 WeakPolarHBondContact O-CA 3.27Å; C597-I660 WeakPolarHBondContact O-CG1 3.3Å; C597-G661 PolarHBondContact N-O 2.86Å; C597-G661 PolarHBondContact O-N 3.46Å
598	L	76.2	Confident	81.8	Confident	19 Å²	19	34.8 Å²	34.8	10%	0.099	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	102.4	167.3	177.4	59.8	0	0	0	108.5	F501 N600 T601 L603 Y657 I660	F501-L598 HydrophobicContact CB-CD1 3.91Å; F501-L598 HydrophobicContact CB-CG 4.41Å; L598-N600 PolarHBondContact O-N 3.25Å; L598-N600 VanDerWaalsContact O-N 3.14Å; L598-T601 PolarHBondContact N-O 2.72Å; L598-T601 PolarHBondContact O-N 3.3Å; L598-L603 HydrophobicContact CB-CD1 3.75Å; L598-L603 HydrophobicContact CB-CD2 4.12Å; L598-L603 HydrophobicContact CB-CG 3.93Å; L598-Y657 HydrophobicContact CD1-CD1 4.03Å; L598-Y657 HydrophobicContact CD1-CD2 4.16Å; L598-Y657 HydrophobicContact CD1-CG 3.66Å; L598-Y657 HydrophobicContact CD2-CD1 4.35Å; L598-Y657 HydrophobicContact CD2-CD2 4.18Å; L598-Y657 HydrophobicContact CD2-CE1 4.35Å; L598-Y657 HydrophobicContact CD2-CE2 4.2Å; L598-Y657 HydrophobicContact CD2-CG 4.26Å; L598-I660 HydrophobicContact CB-CG1 4.46Å; L598-I660 HydrophobicContact CD1-CB 4.13Å; L598-I660 HydrophobicContact CD1-CD1 4.49Å; L598-I660 HydrophobicContact CD1-CG1 4.26Å
599	G	67.6	Low	82	Confident	13 Å²	13	40.4 Å²	40.4	13%	0.134	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	-115.3	-166.5	0	0	0	0	0	110.5	N659	G599-N659 PolarHBondContact N-O 2.87Å
600	N	60.2	Low	81.9	Confident	56 Å²	56	42.6 Å²	42.6	30%	0.299	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-0.3	178.4	-62.7	-30.8	0	0	0	114	R467 C468 E500 L598	R467-N600 HydrophobicContact CG-CB 4.17Å; C468-N600 PolarHBondContact O-ND2 2.76Å; E500-N600 HydrophobicContact CG-CB 4.44Å; E500-N600 WeakPolarHBondContact OE1-CB 3.38Å; E500-N600 PolarHBondContact OE1-ND2 3.11Å; L598-N600 PolarHBondContact O-N 3.25Å; L598-N600 VanDerWaalsContact O-N 3.14Å
601	T	65.3	Low	81.8	Confident	83 Å²	83	43.2 Å²	43.2	51%	0.509	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.8	-176.9	-56.3	0	0	0	0	110.4	C597 L598 L603	C597-T601 CarbonylContact C-O 3.58Å; C597-T601 WeakPolarHBondContact CA-O 3.47Å; L598-T601 PolarHBondContact N-O 2.72Å; L598-T601 PolarHBondContact O-N 3.3Å; T601-L603 HydrophobicContact CG2-CD2 4.39Å; T601-L603 PolarHBondContact O-N 2.99Å
602	T	79.5	Confident	81.7	Confident	64 Å²	64	48.2 Å²	48.2	39%	0.393	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	114	167.9	-53.6	0	0	0	0	109.5	L595 F596 S604 V605	L595-T602 HydrophobicContact CB-CG2 3.98Å; L595-T602 HydrophobicContact CD2-CG2 4.23Å; L595-T602 HydrophobicContact CG-CG2 4.42Å; F596-T602 CarbonylContact O-C 3.56Å; T602-S604 WeakPolarHBondContact CG2-O 3.19Å; T602-V605 HydrophobicContact CG2-CG2 3.51Å
603	L	78.8	Confident	81.1	Confident	70 Å²	70	48.1 Å²	48.1	37%	0.366	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-34.9	177.9	-61.8	178.3	0	0	0	112.1	F596 L598 T601 I660	F596-L603 HydrophobicContact CD1-CB 4.03Å; F596-L603 HydrophobicContact CD1-CD1 3.85Å; F596-L603 HydrophobicContact CE1-CD1 3.77Å; F596-L603 PolarHBondContact O-N 3.02Å; L598-L603 HydrophobicContact CB-CD1 3.75Å; L598-L603 HydrophobicContact CB-CD2 4.12Å; L598-L603 HydrophobicContact CB-CG 3.93Å; T601-L603 HydrophobicContact CG2-CD2 4.39Å; T601-L603 PolarHBondContact O-N 2.99Å; L603-I660 HydrophobicContact CD1-CD1 4.29Å
604	S	79.7	Confident	80.1	Confident	36 Å²	36	52.7 Å²	52.7	25%	0.252	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	154.2	174.4	62.7	0	0	0	0	111.2	L595 F596 T602 V647	L595-S604 WeakPolarHBondContact CA-O 3.14Å; F596-S604 WeakPolarHBondContact CB-OG 3.27Å; F596-S604 PolarHBondContact N-O 2.88Å; F596-S604 PolarHBondContact O-N 2.85Å; T602-S604 WeakPolarHBondContact CG2-O 3.19Å; S604-V647 WeakPolarHBondContact OG-CG1 3.34Å
605	V	85.4	Confident	78.7	Confident	70 Å²	70	60.5 Å²	60.5	42%	0.424	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.3	171.3	-178.1	0	0	0	0	107.4	Q593 A594 L595 T602	Q593-V605 HydrophobicContact CG-CG1 3.48Å; Q593-V605 VanDerWaalsContact CG-CG1 3.48Å; A594-V605 WeakPolarHBondContact O-CA 3.39Å; L595-V605 HydrophobicContact CD2-CG2 4.38Å; L595-V605 HydrophobicContact CG-CG1 4.47Å; L595-V605 HydrophobicContact CG-CG2 4.14Å; T602-V605 HydrophobicContact CG2-CG2 3.51Å
606	V	86.5	Confident	77.4	Confident	45 Å²	45	60 Å²	60	27%	0.273	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	140.5	176	-169.5	0	0	0	0	108.7	Q593 A594 V645 V647	Q593-V606 CarbonylContact C-O 3.45Å; Q593-V606 WeakPolarHBondContact CA-O 3.16Å; A594-V606 PolarHBondContact N-O 2.83Å; A594-V606 PolarHBondContact O-N 2.85Å; V606-V645 HydrophobicContact CB-CG1 3.61Å; V606-V645 HydrophobicContact CG1-CG1 3.69Å; V606-V647 HydrophobicContact CB-CG2 4.37Å; V606-V647 HydrophobicContact CG2-CG1 4.4Å; V606-V647 HydrophobicContact CG2-CG2 3.94Å
607	R	88.6	Confident	75.7	Confident	150 Å²	150	68.6 Å²	68.6	57%	0.566	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.6	179.6	-65.5	178.4	179.4	130.6	5.2	110	F592 Q593	F592-R607 VanDerWaalsContact O-CA 3.25Å; F592-R607 WeakPolarHBondContact O-CA 3.36Å; Q593-R607 HydrophobicContact CB-CG 4Å; Q593-R607 HydrophobicContact CG-CG 3.87Å
608	C	88.2	Confident	74.6	Confident	14 Å²	14	70.7 Å²	70.7	10%	0.095	36%	0.356	C	S	.	.			trans	-74.5	178.1	166.1	73.8	0	0	0	0	110.8	F592 V645	F592-C608 HydrophobicContact CD2-CB 4.45Å; F592-C608 VanDerWaalsContact CD2-SG 3.58Å; F592-C608 PolarHBondContact N-SG 2.84Å; F592-C608 PolarHBondContact O-N 3.21Å; C608-V645 HydrophobicContact CB-CG2 3.93Å
609	K	85.6	Confident	73.1	Confident	145 Å²	145	72.2 Å²	72.2	63%	0.63	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-74.1	157.1	170.4	-67.5	169.9	-173.9	161.9	0	110.6	I611	K609-I611 PolarHBondContact O-N 2.89Å
610	P	85.7	Confident	72.2	Confident	57 Å²	57	79.9 Å²	79.9	37%	0.37	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-62	121.6	170.7	-15.8	27.2	0	0	0	111.6	E589 M591	E589-P610 HydrophobicContact CB-CB 4.3Å; E589-P610 HydrophobicContact CG-CB 4.43Å; E589-P610 WeakPolarHBondContact OE2-CB 3.39Å; M591-P610 HydrophobicContact CG-CB 4.03Å; M591-P610 HydrophobicContact CG-CG 4.21Å; M591-P610 HydrophobicContact SD-CB 4.2Å; M591-P610 HydrophobicContact SD-CG 3.76Å
611	I	86.2	Confident	71.5	Confident	14 Å²	14	85.9 Å²	85.9	7%	0.072	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	121.2	176.6	-57.8	177.1	0	0	0	107.9	E589 M590 F592 K609 L613 T616 L639 E643	E589-I611 CarbonylContact C-O 3.6Å; E589-I611 WeakPolarHBondContact CA-O 3.45Å; M590-I611 PolarHBondContact N-O 3.24Å; M590-I611 PolarHBondContact O-N 3.08Å; F592-I611 HydrophobicContact CD2-CD1 4.36Å; F592-I611 HydrophobicContact CE2-CD1 3.6Å; F592-I611 HydrophobicContact CZ-CD1 4.19Å; K609-I611 PolarHBondContact O-N 2.89Å; I611-L613 PolarHBondContact O-N 2.82Å; I611-T616 HydrophobicContact CG2-CG2 3.82Å; I611-L639 HydrophobicContact CD1-CD2 3.87Å; I611-L639 HydrophobicContact CG2-CD2 4.2Å; I611-E643 HydrophobicContact CD1-CB 4.14Å; I611-E643 HydrophobicContact CD1-CG 4.22Å; I611-E643 HydrophobicContact CG1-CG 4.46Å
612	R	84.7	Confident	70.8	Confident	126 Å²	126	84 Å²	84	48%	0.475	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121	178.8	-75.9	179.8	-177.1	-179.9	3	111.2	T588 E589 D614 K615 T616	T588-R612 WeakPolarHBondContact O-CA 3.4Å; E589-R612 HydrophobicContact CG-CG 3.75Å; E589-R612 IonicContact OE1-CZ 3.48Å; E589-R612 IonicContact OE1-NE 3.69Å; E589-R612 PolarHBondContact OE1-NE 2.82Å; E589-R612 IonicContact OE1-NH2 3.8Å; E589-R612 PolarHBondContact OE1-NH2 2.92Å; R612-D614 PolarHBondContact O-N 3.49Å; R612-K615 HydrophobicContact CB-CB 4.43Å; R612-K615 HydrophobicContact CB-CD 4.36Å; R612-K615 HydrophobicContact CB-CG 4.17Å; R612-K615 WeakPolarHBondContact O-CB 3.32Å; R612-K615 PolarHBondContact O-N 3.3Å; R612-T616 PolarHBondContact O-N 2.81Å
613	L	77.8	Confident	69.5	Low	3 Å²	3	88.7 Å²	88.7	2%	0.016	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.9	-178.4	-67.9	168	0	0	0	113.3	I583 T588 M590 I611 K615 T616 I637	I583-L613 HydrophobicContact CD1-CD1 3.75Å; I583-L613 HydrophobicContact CD1-CD2 3.95Å; I583-L613 HydrophobicContact CG2-CD1 3.91Å; T588-L613 PolarHBondContact O-N 3.05Å; M590-L613 HydrophobicContact CB-CD2 4.05Å; M590-L613 HydrophobicContact CB-CG 4.3Å; M590-L613 HydrophobicContact CE-CD2 4.14Å; M590-L613 HydrophobicContact SD-CD2 4.49Å; I611-L613 PolarHBondContact O-N 2.82Å; L613-K615 VanDerWaalsContact C-N 3.3Å; L613-T616 WeakPolarHBondContact CA-OG1 3.39Å; L613-T616 PolarHBondContact O-OG1 2.94Å; L613-I637 HydrophobicContact CD2-CD1 4.5Å
614	D	67	Low	68.2	Low	111 Å²	111	87.9 Å²	87.9	59%	0.594	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-11.7	172.6	-58.7	-45.1	0	0	0	112.9	R612 R632	R612-D614 PolarHBondContact O-N 3.49Å; D614-R632 IonicContact OD1-NH1 3.71Å
615	K	59.8	Low	66.9	Low	165 Å²	165	89.3 Å²	89.3	72%	0.717	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-26.3	176.7	-67.6	-170.9	175.6	-173	0	113.6	R612 L613 K617	R612-K615 HydrophobicContact CB-CB 4.43Å; R612-K615 HydrophobicContact CB-CD 4.36Å; R612-K615 HydrophobicContact CB-CG 4.17Å; R612-K615 WeakPolarHBondContact O-CB 3.32Å; R612-K615 PolarHBondContact O-N 3.3Å; L613-K615 VanDerWaalsContact C-N 3.3Å; K615-K617 PolarHBondContact O-N 2.58Å; K615-K617 VanDerWaalsContact O-N 3.17Å
616	T	58.2	Low	65.4	Low	11 Å²	11	87.4 Å²	87.4	7%	0.067	43%	0.427	C	S	.	.	S	Bend	trans	-66.9	109.6	169.7	46.6	0	0	0	0	107.9	I611 R612 L613 P618 I637 L639	I611-T616 HydrophobicContact CG2-CG2 3.82Å; R612-T616 PolarHBondContact O-N 2.81Å; L613-T616 WeakPolarHBondContact CA-OG1 3.39Å; L613-T616 PolarHBondContact O-OG1 2.94Å; T616-P618 WeakPolarHBondContact O-CD 2.97Å; T616-I637 HydrophobicContact CG2-CG2 4.2Å; T616-L639 HydrophobicContact CG2-CD2 4.31Å
617	K	51.6	Low	63.8	Low	184 Å²	184	93 Å²	93	80%	0.8	45%	0.45	S	S	*	.			trans	-51.7	107	-179.4	-66.9	-179.7	-178.1	178	0	109.5	K615	K615-K617 PolarHBondContact O-N 2.58Å; K615-K617 VanDerWaalsContact O-N 3.17Å
618	P	53	Low	62.3	Low	49 Å²	49	89.2 Å²	89.2	32%	0.318	44%	0.441	S	S	.	.			trans	-71.6	134.6	165.8	-2.5	22.1	0	0	0	105.8	T616 D620	T616-P618 WeakPolarHBondContact O-CD 2.97Å; P618-D620 PolarHBondContact O-N 2.73Å
619	S	46.1	Very low	61	Low	50 Å²	50	93.3 Å²	93.3	35%	0.35	46%	0.462	S	S	.	.			trans	-55.7	137.1	160.8	40.9	0	0	0	0	108.3	E621 E622	S619-E621 PolarHBondContact O-N 2.99Å; S619-E622 PolarHBondContact O-N 3.16Å; S619-E622 PolarHBondContact OG-OE2 2.84Å
620	D	47.4	Very low	60.3	Low	174 Å²	174	91.1 Å²	91.1	93%	0.93	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-2.8	-167.1	-69.9	-65	0	0	0	114.7	P618	P618-D620 PolarHBondContact O-N 2.73Å
621	E	45.9	Very low	59.5	Low	182 Å²	182	90.9 Å²	90.9	85%	0.85	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-10.9	-171.3	-57.6	-174.4	153.9	0	0	114.4	S619	S619-E621 PolarHBondContact O-N 2.99Å
622	E	51.1	Low	58.9	Low	43 Å²	43	94.3 Å²	94.3	20%	0.201	46%	0.462	C	S	.	.			trans	-117.2	16	-150.2	-59.1	-147.6	116.2	0	0	117.9	S619 S624 I633 N635 H636	S619-E622 PolarHBondContact O-N 3.16Å; S619-E622 PolarHBondContact OG-OE2 2.84Å; E622-S624 PolarHBondContact O-N 2.85Å; E622-I633 VanDerWaalsContact O-O 3.1Å; E622-N635 HydrophobicContact CB-CB 4.35Å; E622-N635 VanDerWaalsContact CD-CB 3.46Å; E622-N635 HydrophobicContact CG-CB 4.45Å; E622-N635 VanDerWaalsContact OE1-CB 3.24Å; E622-N635 WeakPolarHBondContact OE1-CB 3.43Å; E622-N635 PolarHBondContact OE1-ND2 3.35Å; E622-N635 WeakPolarHBondContact OE2-CB 3.13Å; E622-H636 WeakPolarHBondContact OE2-CB 3.41Å; E622-H636 PolarHBondContact OE2-N 3.01Å
623	K	52.5	Low	58.5	Low	164 Å²	164	89.6 Å²	89.6	71%	0.713	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	62.2	174.1	-70.9	173.7	-175.8	159.7	0	112.7	T625	K623-T625 PolarHBondContact O-N 2.75Å
624	S	51.8	Low	58.4	Low	53 Å²	53	90.2 Å²	90.2	37%	0.371	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	126.8	165.9	65.9	0	0	0	0	109.4	E622 I633	E622-S624 PolarHBondContact O-N 2.85Å; S624-I633 WeakPolarHBondContact O-CB 3.36Å; S624-I633 PolarHBondContact O-N 2.73Å; S624-I633 VanDerWaalsContact O-N 3.12Å; S624-I633 WeakPolarHBondContact OG-CB 3.19Å
625	T	52.4	Low	58.8	Low	65 Å²	65	85.8 Å²	85.8	40%	0.399	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	133.1	177.9	-59	0	0	0	0	107.9	K623 D629	K623-T625 PolarHBondContact O-N 2.75Å; T625-D629 VanDerWaalsContact CG2-OD1 3.28Å; T625-D629 WeakPolarHBondContact CG2-OD1 3.47Å
626	D	53.8	Low	59.7	Low	31 Å²	31	80.1 Å²	80.1	17%	0.166	40%	0.401	C	S	.	.			trans	-61	146.2	176.3	-154.3	27.7	0	0	0	109.5	Y450 N628 D629 F631	Y450-D626 WeakPolarHBondContact CE2-OD1 3.17Å; Y450-D626 PolarHBondContact OH-OD1 2.99Å; D626-N628 PolarHBondContact O-N 2.64Å; D626-D629 WeakPolarHBondContact O-CA 3.36Å; D626-D629 PolarHBondContact O-N 2.94Å; D626-F631 HydrophobicContact CB-CB 4.4Å
627	Q	53.1	Low	60.9	Low	162 Å²	162	79.7 Å²	79.7	76%	0.757	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-19.7	-174.3	-53.9	172.6	9.3	0	0	113.8	Y450	Y450-Q627 HydrophobicContact CE1-CB 3.75Å; Y450-Q627 HydrophobicContact CE1-CG 3.75Å; Y450-Q627 VanDerWaalsContact OH-CB 3.26Å; Y450-Q627 WeakPolarHBondContact OH-CB 3.42Å; Y450-Q627 VanDerWaalsContact OH-CG 3.31Å; Y450-Q627 WeakPolarHBondContact OH-CG 3.24Å; Y450-Q627 PolarHBondContact OH-N 2.9Å
628	N	56	Low	62.4	Low	70 Å²	70	73.5 Å²	73.5	37%	0.374	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	1	174.2	-82.8	-32.9	0	0	0	114.4	N452 D626 L630	N452-N628 PolarHBondContact ND2-OD1 2.81Å; D626-N628 PolarHBondContact O-N 2.64Å; N628-L630 HydrophobicContact CB-CD1 4.26Å; N628-L630 PolarHBondContact O-N 3.45Å
629	D	61.9	Low	63.9	Low	100 Å²	100	71.8 Å²	71.8	54%	0.535	37%	0.366	S	S	.	.	S	Bend	trans	61.6	11.3	176.6	-151.8	58.2	0	0	0	116.1	K585 T625 D626	K585-D629 WeakPolarHBondContact CD-O 3.47Å; K585-D629 WeakPolarHBondContact CE-O 3.25Å; K585-D629 PolarHBondContact NZ-O 3.03Å; K585-D629 VanDerWaalsContact NZ-O 3.17Å; K585-D629 IonicContact NZ-OD1 2.65Å; K585-D629 PolarHBondContact NZ-OD1 3.18Å; K585-D629 IonicContact NZ-OD2 2.7Å; K585-D629 PolarHBondContact NZ-OD2 2.92Å; T625-D629 VanDerWaalsContact CG2-OD1 3.28Å; T625-D629 WeakPolarHBondContact CG2-OD1 3.47Å; D626-D629 WeakPolarHBondContact O-CA 3.36Å; D626-D629 PolarHBondContact O-N 2.94Å
630	L	69.3	Low	65.4	Low	99 Å²	99	72.6 Å²	72.6	52%	0.518	37%	0.37	S	S	.	.			trans	-88.3	-30.2	-174.8	-74.4	165	0	0	0	114.9	K585 N628	K585-L630 PolarHBondContact N-O 2.82Å; N628-L630 HydrophobicContact CB-CD1 4.26Å; N628-L630 PolarHBondContact O-N 3.45Å
631	F	70.3	Confident	66.6	Low	53 Å²	53	70.6 Å²	70.6	23%	0.232	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	144	-172.9	-62.8	-88.2	0	0	0	111.6	I583 L584 D626	I583-F631 CarbonylContact O-C 3.59Å; I583-F631 VanDerWaalsContact O-CA 3.3Å; I583-F631 WeakPolarHBondContact O-CA 3.5Å; L584-F631 HydrophobicContact CD2-CD1 3.63Å; L584-F631 HydrophobicContact CD2-CE1 3.27Å; L584-F631 HydrophobicContact CD2-CE2 4.31Å; L584-F631 HydrophobicContact CD2-CG 4.3Å; L584-F631 HydrophobicContact CD2-CZ 3.65Å; L584-F631 HydrophobicContact CG-CD1 4.01Å; L584-F631 HydrophobicContact CG-CE1 3.71Å; L584-F631 HydrophobicContact CG-CZ 4.49Å; D626-F631 HydrophobicContact CB-CB 4.4Å
632	R	73.6	Confident	68	Low	85 Å²	85	68.7 Å²	68.7	32%	0.321	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	124.6	158.4	-62.6	-177.3	-179.6	174.9	1.3	107.6	I583 K585 D614 Y634	I583-R632 PolarHBondContact N-O 2.88Å; I583-R632 PolarHBondContact O-N 3.15Å; K585-R632 HydrophobicContact CG-CG 3.83Å; D614-R632 IonicContact OD1-NH1 3.71Å; R632-Y634 HydrophobicContact CB-CD2 4.13Å; R632-Y634 HydrophobicContact CB-CE2 3.62Å
633	I	75.2	Confident	69.2	Low	28 Å²	28	69 Å²	69	14%	0.144	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	125.2	166.4	-50.8	-178.8	0	0	0	106.2	K582 E622 S624	K582-I633 HydrophobicContact CG-CG1 4.28Å; E622-I633 VanDerWaalsContact O-O 3.1Å; S624-I633 WeakPolarHBondContact O-CB 3.36Å; S624-I633 PolarHBondContact O-N 2.73Å; S624-I633 VanDerWaalsContact O-N 3.12Å; S624-I633 WeakPolarHBondContact OG-CB 3.19Å
634	Y	75.8	Confident	70.8	Confident	16 Å²	16	64.5 Å²	64.5	6%	0.063	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	106.9	171.2	-67.9	-104.6	0	0	0	106.9	N580 V581 I583 R632 H636 I637	N580-Y634 CarbonylContact C-O 3.56Å; N580-Y634 VanDerWaalsContact CA-O 3.3Å; N580-Y634 WeakPolarHBondContact CA-O 3.32Å; N580-Y634 PolarHBondContact N-O 2.82Å; N580-Y634 VanDerWaalsContact N-O 3.16Å; V581-Y634 PolarHBondContact N-O 2.83Å; V581-Y634 PolarHBondContact O-N 3.34Å; I583-Y634 HydrophobicContact CB-CD2 4.35Å; I583-Y634 HydrophobicContact CB-CE2 4.1Å; I583-Y634 HydrophobicContact CD1-CD2 3.92Å; I583-Y634 HydrophobicContact CD1-CE2 3.93Å; I583-Y634 HydrophobicContact CG1-CD2 4.24Å; I583-Y634 HydrophobicContact CG1-CE2 4.34Å; R632-Y634 HydrophobicContact CB-CD2 4.13Å; R632-Y634 HydrophobicContact CB-CE2 3.62Å; Y634-H636 VanDerWaalsContact C-N 3.28Å; Y634-I637 HydrophobicContact CD1-CD1 4.2Å; Y634-I637 HydrophobicContact CD1-CG1 3.95Å; Y634-I637 HydrophobicContact CD2-CD1 4.47Å; Y634-I637 HydrophobicContact CG-CD1 3.92Å; Y634-I637 HydrophobicContact CG-CG1 3.96Å
635	N	75	Confident	72.6	Confident	17 Å²	17	62.2 Å²	62.2	9%	0.091	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-23.6	178.9	-24.5	-40.7	0	0	0	112.1	K554 K579 N580 E622	K554-N635 PolarHBondContact NZ-ND2 3.28Å; K579-N635 CarbonylContact C-O 3.56Å; K579-N635 WeakPolarHBondContact CA-O 3.43Å; K579-N635 WeakPolarHBondContact CB-O 3.49Å; N580-N635 PolarHBondContact N-O 2.93Å; N580-N635 WeakPolarHBondContact OD1-CB 3.3Å; E622-N635 HydrophobicContact CB-CB 4.35Å; E622-N635 VanDerWaalsContact CD-CB 3.46Å; E622-N635 HydrophobicContact CG-CB 4.45Å; E622-N635 VanDerWaalsContact OE1-CB 3.24Å; E622-N635 WeakPolarHBondContact OE1-CB 3.43Å; E622-N635 PolarHBondContact OE1-ND2 3.35Å; E622-N635 WeakPolarHBondContact OE2-CB 3.13Å
636	H	79.7	Confident	74.4	Confident	46 Å²	46	61.3 Å²	61.3	21%	0.213	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	138.8	167.6	-166.3	-121.2	0	0	0	112.1	E577 M578 E622 Y634 S638	E577-H636 IonicContact OE2-CD2 3.18Å; E577-H636 IonicContact OE2-CE1 2.75Å; E577-H636 IonicContact OE2-NE2 3.79Å; E577-H636 PolarHBondContact OE2-NE2 3.04Å; M578-H636 CarbonylContact O-C 3.57Å; M578-H636 WeakPolarHBondContact O-CA 3.38Å; E622-H636 WeakPolarHBondContact OE2-CB 3.41Å; E622-H636 PolarHBondContact OE2-N 3.01Å; Y634-H636 VanDerWaalsContact C-N 3.28Å; H636-S638 PolarHBondContact CE1-OG 3.06Å
637	I	82.9	Confident	76	Confident	3 Å²	3	60 Å²	60	2%	0.015	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	111.2	168.9	-54.8	173.8	0	0	0	107.1	E577 M578 V581 I583 M590 L613 T616 Y634 L639	E577-I637 CarbonylContact C-O 3.53Å; E577-I637 VanDerWaalsContact CA-O 3.32Å; E577-I637 WeakPolarHBondContact CA-O 3.35Å; M578-I637 HydrophobicContact CB-CB 4.31Å; M578-I637 PolarHBondContact N-O 2.88Å; M578-I637 PolarHBondContact O-N 2.87Å; V581-I637 HydrophobicContact CB-CD1 4.4Å; I583-I637 HydrophobicContact CD1-CD1 4.2Å; M590-I637 HydrophobicContact CE-CD1 4.29Å; L613-I637 HydrophobicContact CD2-CD1 4.5Å; T616-I637 HydrophobicContact CG2-CG2 4.2Å; Y634-I637 HydrophobicContact CD1-CD1 4.2Å; Y634-I637 HydrophobicContact CD1-CG1 3.95Å; Y634-I637 HydrophobicContact CD2-CD1 4.47Å; Y634-I637 HydrophobicContact CG-CD1 3.92Å; Y634-I637 HydrophobicContact CG-CG1 3.96Å; I637-L639 HydrophobicContact CG2-CD2 4.3Å; I637-L639 HydrophobicContact CG2-CG 4.46Å
638	S	83.7	Confident	77.7	Confident	54 Å²	54	58.2 Å²	58.2	38%	0.378	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	133.4	164.2	-65	0	0	0	0	110.3	H636	H636-S638 PolarHBondContact CE1-OG 3.06Å
639	L	83.9	Confident	79.1	Confident	13 Å²	13	55 Å²	55	7%	0.068	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-102.9	155.5	175.7	-64.4	159.7	0	0	0	109.7	I575 E576 M578 F592 I611 T616 I637	I575-L639 HydrophobicContact CB-CD1 3.84Å; I575-L639 HydrophobicContact CG2-CD1 3.56Å; I575-L639 WeakPolarHBondContact O-CB 3.43Å; I575-L639 WeakPolarHBondContact O-CD1 3.42Å; E576-L639 PolarHBondContact O-N 3.19Å; M578-L639 HydrophobicContact CE-CD1 4.21Å; F592-L639 HydrophobicContact CE2-CD1 3.79Å; F592-L639 HydrophobicContact CE2-CD2 4.14Å; F592-L639 HydrophobicContact CZ-CD1 3.52Å; F592-L639 HydrophobicContact CZ-CD2 3.82Å; F592-L639 HydrophobicContact CZ-CG 4.33Å; I611-L639 HydrophobicContact CD1-CD2 3.87Å; I611-L639 HydrophobicContact CG2-CD2 4.2Å; T616-L639 HydrophobicContact CG2-CD2 4.31Å; I637-L639 HydrophobicContact CG2-CD2 4.3Å; I637-L639 HydrophobicContact CG2-CG 4.46Å
640	P	78.3	Confident	80.2	Confident	66 Å²	66	53.6 Å²	53.6	43%	0.429	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-68.4	132.2	177.3	-17.2	31.6	0	0	0	111.5	D642 E643	P640-D642 PolarHBondContact O-N 2.87Å; P640-E643 PolarHBondContact O-N 2.95Å
641	D	72.2	Confident	81	Confident	132 Å²	132	50 Å²	50	71%	0.706	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-25.4	-179.5	-64.6	-34.9	0	0	0	113.9
642	D	74.6	Confident	81.6	Confident	143 Å²	143	50.1 Å²	50.1	77%	0.765	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.7	178.8	-66.1	-35.5	0	0	0	113.8	P640 H644	P640-D642 PolarHBondContact O-N 2.87Å; D642-H644 PolarHBondContact O-N 2.81Å; D642-H644 PolarHBondContact O-ND1 2.89Å
643	E	78.1	Confident	82	Confident	50 Å²	50	52.1 Å²	52.1	23%	0.234	28%	0.275	C	S	.	.			trans	-84.9	104.4	-176.9	-76.3	-70.8	164	0	0	110.9	I611 P640	I611-E643 HydrophobicContact CD1-CB 4.14Å; I611-E643 HydrophobicContact CD1-CG 4.22Å; I611-E643 HydrophobicContact CG1-CG 4.46Å; P640-E643 PolarHBondContact O-N 2.95Å
644	H	85.2	Confident	82.3	Confident	68 Å²	68	51 Å²	51	32%	0.315	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	162.8	-178.3	61	-74.1	0	0	0	112	D572 I573 F574 D642 S646	D572-H644 IonicContact OD1-CD2 3.26Å; I573-H644 WeakPolarHBondContact O-CA 3.47Å; F574-H644 HydrophobicContact CD1-CB 3.45Å; F574-H644 VanDerWaalsContact CD1-CB 3.45Å; F574-H644 HydrophobicContact CE1-CB 3.57Å; F574-H644 AromaticContact CE1-CG 3.69Å; F574-H644 HydrophobicContact CG-CB 4Å; F574-H644 HydrophobicContact CZ-CB 4.23Å; D642-H644 PolarHBondContact O-N 2.81Å; D642-H644 PolarHBondContact O-ND1 2.89Å; H644-S646 PolarHBondContact CD2-OG 3.41Å; H644-S646 VanDerWaalsContact CD2-OG 3.3Å; H644-S646 PolarHBondContact NE2-OG 2.82Å
645	V	89.1	Confident	82.7	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.03	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	105.2	177.8	-179.6	0	0	0	0	109.1	I573 A594 V606 C608 V647	I573-V645 HydrophobicContact CB-CB 4.44Å; I573-V645 PolarHBondContact N-O 2.82Å; I573-V645 PolarHBondContact O-N 3.09Å; A594-V645 HydrophobicContact CB-CB 4.43Å; A594-V645 HydrophobicContact CB-CG1 3.67Å; V606-V645 HydrophobicContact CB-CG1 3.61Å; V606-V645 HydrophobicContact CG1-CG1 3.69Å; C608-V645 HydrophobicContact CB-CG2 3.93Å; V645-V647 HydrophobicContact CG1-CG2 4.46Å
646	S	90	Very high	82.8	Confident	46 Å²	46	55.3 Å²	55.3	32%	0.322	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.4	175.4	-56.6	0	0	0	0	111.4	F571 D572 H644	F571-S646 CarbonylContact O-C 3.49Å; F571-S646 WeakPolarHBondContact O-CA 3.45Å; D572-S646 VanDerWaalsContact OD1-CB 3.25Å; D572-S646 WeakPolarHBondContact OD1-CB 3.21Å; D572-S646 PolarHBondContact OD1-OG 3.42Å; H644-S646 PolarHBondContact CD2-OG 3.41Å; H644-S646 VanDerWaalsContact CD2-OG 3.3Å; H644-S646 PolarHBondContact NE2-OG 2.82Å
647	V	88.5	Confident	82.5	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.024	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.5	174.7	-168.6	0	0	0	0	109.2	F571 I573 F596 S604 V606 V645 V649	F571-V647 PolarHBondContact N-O 2.81Å; F571-V647 PolarHBondContact O-N 3.4Å; I573-V647 HydrophobicContact CD1-CG2 4.4Å; F596-V647 HydrophobicContact CB-CG1 4.19Å; F596-V647 HydrophobicContact CG-CG1 4.46Å; S604-V647 WeakPolarHBondContact OG-CG1 3.34Å; V606-V647 HydrophobicContact CB-CG2 4.37Å; V606-V647 HydrophobicContact CG2-CG1 4.4Å; V606-V647 HydrophobicContact CG2-CG2 3.94Å; V645-V647 HydrophobicContact CG1-CG2 4.46Å; V647-V649 HydrophobicContact CB-CG2 4.1Å; V647-V649 HydrophobicContact CG1-CG2 3.68Å; V647-V649 PolarHBondContact O-N 3.14Å
648	N	87.8	Confident	81.9	Confident	125 Å²	125	60.7 Å²	60.7	67%	0.668	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	117.4	171.2	-172.6	-47.2	0	0	0	109.4	S569	S569-N648 CarbonylContact O-C 3.52Å; S569-N648 WeakPolarHBondContact O-CA 3.25Å
649	V	85.9	Confident	81.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.012	31%	0.305	C	S	.	.			trans	-142.9	120.2	-177.3	-176.8	0	0	0	0	108.7	Y564 S569 F571 F596 V647 V651 R653 L654	Y564-V649 VanDerWaalsContact CE2-O 3.25Å; Y564-V649 WeakPolarHBondContact CE2-O 3.41Å; Y564-V649 PolarHBondContact OH-O 3Å; S569-V649 PolarHBondContact O-N 3.25Å; F571-V649 HydrophobicContact CB-CG2 4.29Å; F596-V649 HydrophobicContact CD1-CG2 3.88Å; F596-V649 HydrophobicContact CD2-CG2 4.28Å; F596-V649 HydrophobicContact CE1-CB 4.26Å; F596-V649 HydrophobicContact CE1-CG1 3.54Å; F596-V649 HydrophobicContact CE1-CG2 3.64Å; F596-V649 HydrophobicContact CE2-CG1 4.25Å; F596-V649 HydrophobicContact CE2-CG2 4.06Å; F596-V649 HydrophobicContact CG-CG2 4.2Å; F596-V649 HydrophobicContact CZ-CB 4.21Å; F596-V649 HydrophobicContact CZ-CG1 3.35Å; F596-V649 HydrophobicContact CZ-CG2 3.74Å; V647-V649 HydrophobicContact CB-CG2 4.1Å; V647-V649 HydrophobicContact CG1-CG2 3.68Å; V647-V649 PolarHBondContact O-N 3.14Å; V649-V651 PolarHBondContact O-N 2.66Å; V649-R653 HydrophobicContact CG1-CB 4.39Å; V649-L654 HydrophobicContact CG1-CD1 4.14Å; V649-L654 HydrophobicContact CG1-CD2 3.93Å; V649-L654 HydrophobicContact CG1-CG 3.69Å
650	D	85.5	Confident	81.2	Confident	70 Å²	70	58.2 Å²	58.2	37%	0.374	30%	0.302	S	S	.	.			trans	-61.8	130.5	171.4	-179.5	-31	0	0	0	111.3	N652 R653 L654	D650-N652 PolarHBondContact O-N 2.76Å; D650-N652 VanDerWaalsContact O-N 3.12Å; D650-N652 WeakPolarHBondContact OD1-CB 3.41Å; D650-N652 PolarHBondContact OD1-N 2.95Å; D650-N652 PolarHBondContact OD1-ND2 2.82Å; D650-R653 HydrophobicContact CB-CG 4.13Å; D650-R653 WeakPolarHBondContact O-CA 3.31Å; D650-R653 VanDerWaalsContact O-CB 3.3Å; D650-R653 WeakPolarHBondContact O-CB 3.33Å; D650-R653 PolarHBondContact O-N 2.85Å; D650-L654 PolarHBondContact O-N 2.93Å
651	V	84.8	Confident	81.5	Confident	23 Å²	23	55 Å²	55	14%	0.139	28%	0.282	C	S	.	.	H	α-helix	trans	-53.4	-33.5	179.3	68.5	0	0	0	0	112.7	Y564 V649 R653 L654 L655 L705	Y564-V651 HydrophobicContact CE1-CB 3.98Å; Y564-V651 HydrophobicContact CE1-CG2 4.11Å; Y564-V651 WeakPolarHBondContact OH-CA 3.41Å; Y564-V651 WeakPolarHBondContact OH-CB 3.41Å; Y564-V651 PolarHBondContact OH-N 2.94Å; V649-V651 PolarHBondContact O-N 2.66Å; V651-R653 VanDerWaalsContact C-N 3.29Å; V651-R653 PolarHBondContact O-N 2.81Å; V651-L654 PolarHBondContact O-N 3.05Å; V651-L655 HydrophobicContact CG2-CD1 3.98Å; V651-L655 HydrophobicContact CG2-CG 4.31Å; V651-L655 WeakPolarHBondContact O-CB 3.34Å; V651-L655 WeakPolarHBondContact O-CG 3.5Å; V651-L655 PolarHBondContact O-N 2.71Å; V651-L705 HydrophobicContact CG2-CD2 4.29Å
652	N	83.1	Confident	82.2	Confident	57 Å²	57	48.8 Å²	48.8	31%	0.305	25%	0.248	S	C	.	.	H	α-helix	trans	-68.1	-28.8	176.9	-57.3	-67.9	0	0	0	111.7	D650 N656 K709	D650-N652 PolarHBondContact O-N 2.76Å; D650-N652 VanDerWaalsContact O-N 3.12Å; D650-N652 WeakPolarHBondContact OD1-CB 3.41Å; D650-N652 PolarHBondContact OD1-N 2.95Å; D650-N652 PolarHBondContact OD1-ND2 2.82Å; N652-N656 WeakPolarHBondContact O-CB 3.38Å; N652-N656 PolarHBondContact O-N 2.53Å; N652-N656 PolarHBondContact O-ND2 3.2Å; N652-N656 PolarHBondContact O-OD1 3.12Å; N652-K709 PolarHBondContact OD1-NZ 2.85Å
653	R	81.8	Confident	82.7	Confident	127 Å²	127	43.6 Å²	43.6	48%	0.479	22%	0.22	S	C	.	.	H	α-helix	trans	-69.5	-41.1	172.2	-64.9	179.2	174.1	-162.5	-2.1	111.3	V649 D650 V651 L655 Y657 I660	V649-R653 HydrophobicContact CG1-CB 4.39Å; D650-R653 HydrophobicContact CB-CG 4.13Å; D650-R653 WeakPolarHBondContact O-CA 3.31Å; D650-R653 VanDerWaalsContact O-CB 3.3Å; D650-R653 WeakPolarHBondContact O-CB 3.33Å; D650-R653 PolarHBondContact O-N 2.85Å; V651-R653 VanDerWaalsContact C-N 3.29Å; V651-R653 PolarHBondContact O-N 2.81Å; R653-L655 VanDerWaalsContact C-N 3.32Å; R653-L655 PolarHBondContact O-N 3.32Å; R653-Y657 HydrophobicContact CB-CD2 4.17Å; R653-Y657 HydrophobicContact CB-CE2 4.41Å; R653-Y657 HydrophobicContact CG-CE2 4.29Å; R653-Y657 WeakPolarHBondContact O-CB 3.46Å; R653-Y657 WeakPolarHBondContact O-CD2 3.46Å; R653-Y657 PolarHBondContact O-N 3.41Å; R653-I660 HydrophobicContact CB-CD1 4.12Å; R653-I660 WeakPolarHBondContact O-CD1 3.36Å
654	L	83.2	Confident	83.2	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-63.8	-38.3	176	-66.9	169.8	0	0	0	112.1	Y564 F571 F596 V649 D650 V651 I660 W698 I702 L705	Y564-L654 HydrophobicContact CD2-CD1 3.51Å; Y564-L654 HydrophobicContact CE2-CD1 3.47Å; Y564-L654 VanDerWaalsContact CE2-CD1 3.47Å; Y564-L654 HydrophobicContact CG-CD1 4.24Å; F571-L654 HydrophobicContact CD2-CD1 3.99Å; F571-L654 HydrophobicContact CD2-CD2 4.12Å; F571-L654 HydrophobicContact CE2-CD1 4.5Å; F571-L654 HydrophobicContact CE2-CD2 4.23Å; F596-L654 HydrophobicContact CE2-CD2 3.91Å; F596-L654 HydrophobicContact CZ-CD2 3.79Å; V649-L654 HydrophobicContact CG1-CD1 4.14Å; V649-L654 HydrophobicContact CG1-CD2 3.93Å; V649-L654 HydrophobicContact CG1-CG 3.69Å; D650-L654 PolarHBondContact O-N 2.93Å; V651-L654 PolarHBondContact O-N 3.05Å; L654-I660 HydrophobicContact CD2-CG2 4.39Å; L654-W698 HydrophobicContact CD2-CH2 3.68Å; L654-W698 HydrophobicContact CD2-CZ2 4.12Å; L654-I702 HydrophobicContact CB-CD1 4.15Å; L654-L705 HydrophobicContact CB-CD1 4.48Å; L654-L705 HydrophobicContact CD1-CD1 3.94Å
655	L	83.1	Confident	83.3	Confident	20 Å²	20	38.4 Å²	38.4	11%	0.105	20%	0.196	C	C	.	.	H	α-helix	trans	-88.2	-31.4	-174.5	-66	-178	0	0	0	114.8	V651 R653 I702 L705 K706 K709	V651-L655 HydrophobicContact CG2-CD1 3.98Å; V651-L655 HydrophobicContact CG2-CG 4.31Å; V651-L655 WeakPolarHBondContact O-CB 3.34Å; V651-L655 WeakPolarHBondContact O-CG 3.5Å; V651-L655 PolarHBondContact O-N 2.71Å; R653-L655 VanDerWaalsContact C-N 3.32Å; R653-L655 PolarHBondContact O-N 3.32Å; L655-I702 HydrophobicContact CD2-CG2 4.15Å; L655-L705 HydrophobicContact CD2-CB 4Å; L655-K706 HydrophobicContact CD2-CD 4.49Å; L655-K706 HydrophobicContact CD2-CG 3.62Å; L655-K709 HydrophobicContact CD1-CB 4.38Å; L655-K709 HydrophobicContact CD1-CD 3.53Å
656	N	77.2	Confident	83.2	Confident	103 Å²	103	38.1 Å²	38.1	55%	0.551	19%	0.194	S	C	*	.	H	α-helix	trans	-89.7	-17.6	-175.1	-61.1	-6.8	0	0	0	113.4	N652	N652-N656 WeakPolarHBondContact O-CB 3.38Å; N652-N656 PolarHBondContact O-N 2.53Å; N652-N656 PolarHBondContact O-ND2 3.2Å; N652-N656 PolarHBondContact O-OD1 3.12Å
657	Y	74.4	Confident	83.1	Confident	58 Å²	58	36.7 Å²	36.7	23%	0.227	18%	0.182	C	C	.	.			trans	-111	102.3	-176.4	-67.5	-55.5	0	0	0	111.6	F501 L598 R653 N659 I660	F501-Y657 HydrophobicContact CB-CD1 3.63Å; F501-Y657 HydrophobicContact CB-CE1 4.12Å; F501-Y657 AromaticContact CD1-CD1 3.6Å; F501-Y657 HydrophobicContact CD1-CD1 3.6Å; F501-Y657 HydrophobicContact CD1-CE1 4.19Å; F501-Y657 HydrophobicContact CE1-CD1 4.46Å; F501-Y657 AromaticContact CG-CD1 3.82Å; F501-Y657 HydrophobicContact CG-CD1 3.82Å; L598-Y657 HydrophobicContact CD1-CD1 4.03Å; L598-Y657 HydrophobicContact CD1-CD2 4.16Å; L598-Y657 HydrophobicContact CD1-CG 3.66Å; L598-Y657 HydrophobicContact CD2-CD1 4.35Å; L598-Y657 HydrophobicContact CD2-CD2 4.18Å; L598-Y657 HydrophobicContact CD2-CE1 4.35Å; L598-Y657 HydrophobicContact CD2-CE2 4.2Å; L598-Y657 HydrophobicContact CD2-CG 4.26Å; R653-Y657 HydrophobicContact CB-CD2 4.17Å; R653-Y657 HydrophobicContact CB-CE2 4.41Å; R653-Y657 HydrophobicContact CG-CE2 4.29Å; R653-Y657 WeakPolarHBondContact O-CB 3.46Å; R653-Y657 WeakPolarHBondContact O-CD2 3.46Å; R653-Y657 PolarHBondContact O-N 3.41Å; Y657-N659 PolarHBondContact O-N 3.37Å; Y657-I660 HydrophobicContact CD2-CD1 4.3Å; Y657-I660 VanDerWaalsContact O-CG2 3.26Å; Y657-I660 WeakPolarHBondContact O-CG2 3.37Å; Y657-I660 PolarHBondContact O-N 3.42Å
658	N	69.6	Low	83	Confident	104 Å²	104	36.5 Å²	36.5	56%	0.556	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.4	-177.1	-62.9	-11.2	0	0	0	114.3	F501 V686	F501-N658 HydrophobicContact CE2-CB 3.76Å; F501-N658 HydrophobicContact CZ-CB 3.94Å; N658-V686 WeakPolarHBondContact O-CB 3.42Å; N658-V686 VanDerWaalsContact O-CG1 3.27Å; N658-V686 WeakPolarHBondContact O-CG1 2.95Å; N658-V686 WeakPolarHBondContact O-CG2 3.42Å
659	N	72	Confident	82.8	Confident	13 Å²	13	33.2 Å²	33.2	7%	0.07	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	25.8	-177.6	-66.6	34.2	0	0	0	112.3	L498 P499 F501 G599 Y657	L498-N659 WeakPolarHBondContact CG-ND2 3.47Å; P499-N659 WeakPolarHBondContact CB-ND2 3.42Å; P499-N659 WeakPolarHBondContact CD-ND2 3.21Å; P499-N659 WeakPolarHBondContact O-CB 3.48Å; P499-N659 VanDerWaalsContact O-CG 3.26Å; P499-N659 PolarHBondContact O-ND2 2.82Å; F501-N659 HydrophobicContact CD2-CB 3.95Å; F501-N659 HydrophobicContact CE2-CB 4.44Å; G599-N659 PolarHBondContact N-O 2.87Å; Y657-N659 PolarHBondContact O-N 3.37Å
660	I	81.3	Confident	82.7	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	147	174.4	-150.4	167.1	0	0	0	109.9	F596 C597 L598 L603 R653 L654 Y657 W698	F596-I660 HydrophobicContact CE1-CD1 3.62Å; F596-I660 HydrophobicContact CE1-CG1 3.98Å; F596-I660 HydrophobicContact CE2-CD1 4.32Å; F596-I660 HydrophobicContact CE2-CG1 4.05Å; F596-I660 HydrophobicContact CZ-CD1 3.32Å; F596-I660 HydrophobicContact CZ-CG1 3.5Å; C597-I660 CarbonylContact O-C 3.51Å; C597-I660 WeakPolarHBondContact O-CA 3.27Å; C597-I660 WeakPolarHBondContact O-CG1 3.3Å; L598-I660 HydrophobicContact CB-CG1 4.46Å; L598-I660 HydrophobicContact CD1-CB 4.13Å; L598-I660 HydrophobicContact CD1-CD1 4.49Å; L598-I660 HydrophobicContact CD1-CG1 4.26Å; L603-I660 HydrophobicContact CD1-CD1 4.29Å; R653-I660 HydrophobicContact CB-CD1 4.12Å; R653-I660 WeakPolarHBondContact O-CD1 3.36Å; L654-I660 HydrophobicContact CD2-CG2 4.39Å; Y657-I660 HydrophobicContact CD2-CD1 4.3Å; Y657-I660 VanDerWaalsContact O-CG2 3.26Å; Y657-I660 WeakPolarHBondContact O-CG2 3.37Å; Y657-I660 PolarHBondContact O-N 3.42Å; I660-W698 HydrophobicContact CG2-CH2 4.34Å; I660-W698 HydrophobicContact CG2-CZ2 3.7Å; I660-W698 WeakPolarHBondContact O-CZ2 3.38Å
661	G	84.1	Confident	82	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175	-179.5	-175.1	0	0	0	0	0	113	C597	C597-G661 PolarHBondContact N-O 2.86Å; C597-G661 PolarHBondContact O-N 3.46Å
662	I	87.2	Confident	81.4	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.9	-176	-65.9	161.1	0	0	0	108.7	F571 I573 A594 L595 F596 I684 W698	F571-I662 HydrophobicContact CD1-CD1 3.84Å; F571-I662 HydrophobicContact CD2-CD1 4.5Å; F571-I662 HydrophobicContact CE1-CD1 3.25Å; F571-I662 HydrophobicContact CE2-CD1 3.97Å; F571-I662 HydrophobicContact CG-CD1 4.45Å; F571-I662 HydrophobicContact CZ-CD1 3.32Å; I573-I662 HydrophobicContact CD1-CD1 3.9Å; I573-I662 HydrophobicContact CD1-CG1 4.46Å; I573-I662 HydrophobicContact CD1-CG2 3.85Å; I573-I662 HydrophobicContact CG1-CD1 4.15Å; A594-I662 HydrophobicContact CB-CG2 4.26Å; L595-I662 CarbonylContact O-C 3.53Å; L595-I662 WeakPolarHBondContact O-CA 3.35Å; F596-I662 HydrophobicContact CD2-CG1 3.86Å; F596-I662 HydrophobicContact CE2-CG1 4.42Å; I662-I684 PolarHBondContact N-O 3.32Å; I662-I684 PolarHBondContact O-N 3.06Å; I662-W698 HydrophobicContact CD1-CZ3 3.91Å; I662-W698 HydrophobicContact CG1-CZ3 4.28Å
663	I	85.6	Confident	80.9	Confident	34 Å²	34	39.9 Å²	39.9	17%	0.174	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.6	167.3	-57.5	177.1	0	0	0	106.8	L595 Q665 N681	L595-I663 HydrophobicContact CB-CB 4.28Å; L595-I663 HydrophobicContact CD1-CB 4.42Å; L595-I663 HydrophobicContact CD1-CG2 4.48Å; L595-I663 VanDerWaalsContact CD1-O 3.3Å; L595-I663 WeakPolarHBondContact CD1-O 3.3Å; L595-I663 PolarHBondContact N-O 2.81Å; L595-I663 PolarHBondContact O-N 2.68Å; I663-Q665 HydrophobicContact CG2-CG 4.27Å; I663-N681 WeakPolarHBondContact CG2-OD1 3.45Å
664	L	87.9	Confident	80.3	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	112.2	-178.3	-177.8	64.4	0	0	0	109.5	V560 I573 I575 A594 N681 I682	V560-L664 HydrophobicContact CG1-CD2 4.03Å; V560-L664 HydrophobicContact CG2-CD2 3.79Å; I573-L664 HydrophobicContact CG2-CD1 4.44Å; I573-L664 HydrophobicContact CG2-CD2 4.38Å; I575-L664 HydrophobicContact CD1-CD1 4.19Å; I575-L664 HydrophobicContact CD1-CD2 3.77Å; I575-L664 HydrophobicContact CD1-CG 4.22Å; I575-L664 HydrophobicContact CG1-CD2 4.07Å; A594-L664 HydrophobicContact CB-CD1 4.41Å; L664-N681 WeakPolarHBondContact O-CA 3.19Å; L664-I682 HydrophobicContact CB-CB 4.43Å; L664-I682 PolarHBondContact N-O 3.41Å; L664-I682 PolarHBondContact O-N 2.87Å
665	Q	86.5	Confident	79.7	Confident	7 Å²	7	47.7 Å²	47.7	3%	0.033	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.1	-178.6	-66.9	170.4	-12.4	0	0	110.3	E464 F592 Q593 L595 I663 F667 N681	E464-Q665 PolarHBondContact OE1-NE2 2.95Å; E464-Q665 PolarHBondContact OE1-OE1 3.04Å; F592-Q665 WeakPolarHBondContact CA-O 3.34Å; Q593-Q665 HydrophobicContact CB-CB 4.34Å; Q593-Q665 PolarHBondContact N-O 2.96Å; Q593-Q665 PolarHBondContact O-N 3.18Å; L595-Q665 HydrophobicContact CD1-CG 3.93Å; I663-Q665 HydrophobicContact CG2-CG 4.27Å; Q665-F667 HydrophobicContact CB-CD2 4.18Å; Q665-F667 HydrophobicContact CB-CE2 3.5Å; Q665-F667 HydrophobicContact CB-CZ 4.05Å; Q665-F667 HydrophobicContact CG-CE2 4.46Å; Q665-N681 VanDerWaalsContact CG-OD1 3.24Å; Q665-N681 WeakPolarHBondContact CG-OD1 3.41Å
666	I	88.4	Confident	79.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124	175.2	-60.6	158.6	0	0	0	107.5	I575 M578 M590 F592 V679 A680 I682 I727	I575-I666 HydrophobicContact CD1-CG1 4.45Å; M578-I666 HydrophobicContact CE-CD1 3.32Å; M578-I666 HydrophobicContact CE-CG1 3.85Å; M578-I666 HydrophobicContact CE-CG2 4.13Å; M578-I666 HydrophobicContact SD-CD1 4.12Å; M590-I666 HydrophobicContact CE-CG2 4.13Å; M590-I666 HydrophobicContact CG-CG2 4.03Å; M590-I666 HydrophobicContact SD-CG2 4.07Å; F592-I666 HydrophobicContact CD1-CB 4.32Å; F592-I666 HydrophobicContact CD1-CG1 3.83Å; F592-I666 HydrophobicContact CD1-CG2 4.11Å; F592-I666 HydrophobicContact CE1-CG1 4.13Å; F592-I666 HydrophobicContact CE1-CG2 3.94Å; I666-V679 HydrophobicContact CG2-CB 4.41Å; I666-V679 PolarHBondContact O-N 3.21Å; I666-A680 HydrophobicContact CB-CB 4.08Å; I666-A680 HydrophobicContact CD1-CB 3.82Å; I666-A680 HydrophobicContact CG1-CB 4.37Å; I666-A680 PolarHBondContact N-O 2.94Å; I666-A680 PolarHBondContact O-N 2.75Å; I666-I682 HydrophobicContact CD1-CD1 3.82Å; I666-I727 HydrophobicContact CD1-CD1 3.88Å
667	F	87	Confident	79.5	Confident	15 Å²	15	48.1 Å²	48.1	7%	0.066	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	151	178.6	-66.1	-85	0	0	0	111	E464 M590 M591 Q593 Q665 L676 R677 R678	E464-F667 WeakPolarHBondContact OE1-CZ 3.27Å; M590-F667 CarbonylContact C-O 3.52Å; M590-F667 VanDerWaalsContact CA-O 3.31Å; M590-F667 WeakPolarHBondContact CA-O 3.16Å; M591-F667 PolarHBondContact N-O 2.87Å; M591-F667 PolarHBondContact O-N 3.41Å; Q593-F667 HydrophobicContact CB-CD2 4.27Å; Q593-F667 HydrophobicContact CB-CE2 3.9Å; Q665-F667 HydrophobicContact CB-CD2 4.18Å; Q665-F667 HydrophobicContact CB-CE2 3.5Å; Q665-F667 HydrophobicContact CB-CZ 4.05Å; Q665-F667 HydrophobicContact CG-CE2 4.46Å; F667-L676 HydrophobicContact CB-CB 4.37Å; F667-L676 HydrophobicContact CB-CD2 4.09Å; F667-L676 HydrophobicContact CD1-CB 3.85Å; F667-L676 HydrophobicContact CG-CB 4.35Å; F667-R677 CarbonylContact C-O 3.56Å; F667-R677 WeakPolarHBondContact CA-O 3.39Å; F667-R678 HydrophobicContact CD1-CB 3.97Å; F667-R678 HydrophobicContact CD1-CG 4.16Å; F667-R678 HydrophobicContact CE1-CB 3.81Å; F667-R678 HydrophobicContact CE1-CG 3.87Å; F667-R678 HydrophobicContact CZ-CG 4.24Å
668	T	87	Confident	79.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	153.5	167.5	47.3	0	0	0	0	110.5	I583 E587 E589 M590 R677 V679	I583-T668 HydrophobicContact CD1-CG2 4.35Å; I583-T668 HydrophobicContact CG1-CG2 4.45Å; I583-T668 HydrophobicContact CG2-CG2 4.04Å; E587-T668 PolarHBondContact OE1-OG1 2.87Å; E587-T668 WeakPolarHBondContact OE2-CB 3.18Å; E587-T668 PolarHBondContact OE2-OG1 3.14Å; E589-T668 CarbonylContact O-C 3.54Å; E589-T668 VanDerWaalsContact O-CA 3.27Å; E589-T668 WeakPolarHBondContact O-CA 3.31Å; M590-T668 HydrophobicContact CB-CG2 4.36Å; M590-T668 HydrophobicContact CE-CG2 4.25Å; M590-T668 HydrophobicContact CG-CG2 4.47Å; T668-R677 PolarHBondContact N-O 2.85Å; T668-R677 PolarHBondContact O-N 2.9Å; T668-V679 HydrophobicContact CG2-CG2 3.67Å; T668-V679 WeakPolarHBondContact OG1-CG2 3.5Å
669	R	84	Confident	80.3	Confident	56 Å²	56	44.1 Å²	44.1	21%	0.211	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	163.6	171.1	66.6	173.9	-175.8	177.4	1.4	112	E587 T588 E589 N674 H675 L676	E587-R669 CarbonylContact C-O 3.43Å; E587-R669 WeakPolarHBondContact CA-O 3.42Å; T588-R669 PolarHBondContact N-O 3.32Å; E589-R669 HydrophobicContact CB-CG 3.95Å; E589-R669 PolarHBondContact N-O 3.13Å; E589-R669 VanDerWaalsContact N-O 3.14Å; E589-R669 PolarHBondContact O-N 3.3Å; E589-R669 IonicContact OE2-CZ 3.87Å; E589-R669 IonicContact OE2-NE 3.65Å; E589-R669 PolarHBondContact OE2-NE 2.73Å; E589-R669 IonicContact OE2-NH2 2.81Å; E589-R669 PolarHBondContact OE2-NH2 2.68Å; R669-N674 PolarHBondContact NH1-OD1 2.84Å; R669-H675 WeakPolarHBondContact CB-O 3.11Å; R669-L676 HydrophobicContact CB-CD2 4.05Å; R669-L676 HydrophobicContact CG-CD2 4.37Å
670	T	83	Confident	80.7	Confident	17 Å²	17	43.6 Å²	43.6	10%	0.104	22%	0.221	C	C	.	.			trans	-92.2	142.4	171.9	66.2	0	0	0	0	109.8	N586 E587 T672 S673	N586-T670 HydrophobicContact CB-CG2 4.25Å; N586-T670 WeakPolarHBondContact O-CA 3.41Å; N586-T670 WeakPolarHBondContact O-CB 3.49Å; N586-T670 WeakPolarHBondContact O-CG2 3.3Å; E587-T670 HydrophobicContact CG-CG2 4.16Å; T670-T672 PolarHBondContact O-N 2.83Å; T670-S673 PolarHBondContact O-N 2.84Å; T670-S673 WeakPolarHBondContact OG1-CB 3.4Å; T670-S673 PolarHBondContact OG1-N 2.97Å; T670-S673 PolarHBondContact OG1-OG 3.28Å
671	D	72	Confident	80.7	Confident	101 Å²	101	46.9 Å²	46.9	54%	0.54	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-31.2	177.3	-71.6	-12.4	0	0	0	114.2	T588	T588-D671 WeakPolarHBondContact CB-OD1 3.35Å; T588-D671 PolarHBondContact OG1-N 2.87Å; T588-D671 PolarHBondContact OG1-OD1 3.13Å
672	T	72	Confident	80.6	Confident	140 Å²	140	47.3 Å²	47.3	86%	0.859	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-6	-176.8	56	0	0	0	0	114.6	T670	T670-T672 PolarHBondContact O-N 2.83Å
673	S	72.4	Confident	80.4	Confident	35 Å²	35	47.7 Å²	47.7	25%	0.245	24%	0.243	C	C	.	.			trans	-140.6	136.6	-177.6	88	0	0	0	0	113.2	T670 H675	T670-S673 PolarHBondContact O-N 2.84Å; T670-S673 WeakPolarHBondContact OG1-CB 3.4Å; T670-S673 PolarHBondContact OG1-N 2.97Å; T670-S673 PolarHBondContact OG1-OG 3.28Å; S673-H675 PolarHBondContact O-N 3.37Å
674	N	67.6	Low	80.3	Confident	140 Å²	140	46.1 Å²	46.1	75%	0.749	24%	0.235	S	C	*	.			trans	-79.5	13.3	173.2	-73	-39.5	0	0	0	112.8	R669	R669-N674 PolarHBondContact NH1-OD1 2.84Å
675	H	72.4	Confident	79.6	Confident	155 Å²	155	46.1 Å²	46.1	72%	0.718	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-81	119.9	177	-65.9	-58.1	0	0	0	110	R669 S673	R669-H675 WeakPolarHBondContact CB-O 3.11Å; S673-H675 PolarHBondContact O-N 3.37Å
676	L	76.4	Confident	78.5	Confident	70 Å²	70	48.9 Å²	48.9	37%	0.366	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-91.9	120.3	176.5	-66.1	168.7	0	0	0	109.7	M591 F667 R669	M591-L676 HydrophobicContact CE-CD1 4.19Å; M591-L676 HydrophobicContact CE-CD2 3.23Å; M591-L676 HydrophobicContact CE-CG 4.32Å; F667-L676 HydrophobicContact CB-CB 4.37Å; F667-L676 HydrophobicContact CB-CD2 4.09Å; F667-L676 HydrophobicContact CD1-CB 3.85Å; F667-L676 HydrophobicContact CG-CB 4.35Å; R669-L676 HydrophobicContact CB-CD2 4.05Å; R669-L676 HydrophobicContact CG-CD2 4.37Å
677	R	78.8	Confident	76.8	Confident	63 Å²	63	49.9 Å²	49.9	24%	0.238	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	128.5	164.4	172.5	167.8	169.2	-99.8	-8.1	108	E587 F667 T668 S730	E587-R677 WeakPolarHBondContact OE1-CB 3.41Å; E587-R677 WeakPolarHBondContact OE1-CD 3.2Å; E587-R677 IonicContact OE1-NH1 2.83Å; E587-R677 IonicContact OE2-NH1 2.66Å; E587-R677 PolarHBondContact OE2-NH1 2.97Å; F667-R677 CarbonylContact C-O 3.56Å; F667-R677 WeakPolarHBondContact CA-O 3.39Å; T668-R677 PolarHBondContact N-O 2.85Å; T668-R677 PolarHBondContact O-N 2.9Å; R677-S730 PolarHBondContact NH2-O 2.87Å
678	R	80.3	Confident	75	Confident	76 Å²	76	51.2 Å²	51.2	29%	0.287	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	136.1	167.2	-154.6	-173.5	-50.1	117.1	18.3	108.3	E464 F667 S730	E464-R678 VanDerWaalsContact CG-NH2 3.34Å; E464-R678 IonicContact OE1-CZ 3.32Å; E464-R678 IonicContact OE1-NE 3.03Å; E464-R678 PolarHBondContact OE1-NE 3.16Å; E464-R678 IonicContact OE1-NH2 3.56Å; E464-R678 PolarHBondContact OE1-NH2 2.86Å; E464-R678 VanDerWaalsContact OE1-NH2 3.11Å; E464-R678 IonicContact OE2-CZ 2.95Å; E464-R678 IonicContact OE2-NE 2.68Å; E464-R678 IonicContact OE2-NH2 2.8Å; E464-R678 PolarHBondContact OE2-NH2 3.26Å; F667-R678 HydrophobicContact CD1-CB 3.97Å; F667-R678 HydrophobicContact CD1-CG 4.16Å; F667-R678 HydrophobicContact CE1-CB 3.81Å; F667-R678 HydrophobicContact CE1-CG 3.87Å; F667-R678 HydrophobicContact CZ-CG 4.24Å; R678-S730 PolarHBondContact O-OG 3.44Å; R678-S730 VanDerWaalsContact O-OG 3.09Å
679	V	80.9	Confident	73.1	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-34.8	176.8	178.8	0	0	0	0	110.8	V581 I666 T668 S730	V581-V679 HydrophobicContact CG1-CG1 3.82Å; I666-V679 HydrophobicContact CG2-CB 4.41Å; I666-V679 PolarHBondContact O-N 3.21Å; T668-V679 HydrophobicContact CG2-CG2 3.67Å; T668-V679 WeakPolarHBondContact OG1-CG2 3.5Å; V679-S730 PolarHBondContact O-N 3.46Å
680	A	80.2	Confident	71.5	Confident	3 Å²	3	54.5 Å²	54.5	3%	0.025	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	161.3	-176.9	0	0	0	0	0	112.4	I666 I682 I727	I666-A680 HydrophobicContact CB-CB 4.08Å; I666-A680 HydrophobicContact CD1-CB 3.82Å; I666-A680 HydrophobicContact CG1-CB 4.37Å; I666-A680 PolarHBondContact N-O 2.94Å; I666-A680 PolarHBondContact O-N 2.75Å; A680-I682 HydrophobicContact CB-CD1 4.49Å; A680-I727 HydrophobicContact CB-CB 4.2Å; A680-I727 HydrophobicContact CB-CD1 3.88Å; A680-I727 HydrophobicContact CB-CG1 3.83Å; A680-I727 HydrophobicContact CB-CG2 3.43Å; A680-I727 VanDerWaalsContact CB-CG2 3.43Å
681	N	81.5	Confident	70.2	Confident	70 Å²	70	57.6 Å²	57.6	37%	0.374	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	117.9	175.1	-174.7	49.8	0	0	0	109.6	I663 L664 Q665	I663-N681 WeakPolarHBondContact CG2-OD1 3.45Å; L664-N681 WeakPolarHBondContact O-CA 3.19Å; Q665-N681 VanDerWaalsContact CG-OD1 3.24Å; Q665-N681 WeakPolarHBondContact CG-OD1 3.41Å
682	I	82.2	Confident	69.9	Low	8 Å²	8	58.2 Å²	58.2	4%	0.041	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.7	178.6	-53.2	93.5	0	0	0	108.3	V558 L664 I666 A680 I684 H725 I727	V558-I682 HydrophobicContact CG1-CD1 3.78Å; V558-I682 HydrophobicContact CG1-CG1 3.89Å; L664-I682 HydrophobicContact CB-CB 4.43Å; L664-I682 PolarHBondContact N-O 3.41Å; L664-I682 PolarHBondContact O-N 2.87Å; I666-I682 HydrophobicContact CD1-CD1 3.82Å; A680-I682 HydrophobicContact CB-CD1 4.49Å; I682-I684 HydrophobicContact CG2-CD1 4.38Å; I682-I684 HydrophobicContact CG2-CG1 3.99Å; I682-H725 HydrophobicContact CG1-CB 4.46Å; I682-H725 HydrophobicContact CG2-CB 3.83Å; I682-I727 HydrophobicContact CD1-CG1 4.35Å
683	S	82.5	Confident	70.2	Confident	9 Å²	9	54.9 Å²	54.9	6%	0.063	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.2	174.6	-59.6	0	0	0	0	109.7	T690 A694	S683-T690 WeakPolarHBondContact O-CG2 3.45Å; S683-A694 WeakPolarHBondContact O-CB 3.42Å
684	I	82.5	Confident	70.5	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	115.7	-179.4	-54.7	174.7	0	0	0	108	V560 I562 I662 I682 A694 W698	V560-I684 HydrophobicContact CB-CD1 4.34Å; V560-I684 HydrophobicContact CG1-CD1 3.8Å; I562-I684 HydrophobicContact CD1-CG2 4.43Å; I662-I684 PolarHBondContact N-O 3.32Å; I662-I684 PolarHBondContact O-N 3.06Å; I682-I684 HydrophobicContact CG2-CD1 4.38Å; I682-I684 HydrophobicContact CG2-CG1 3.99Å; I684-A694 HydrophobicContact CG1-CB 4.24Å; I684-W698 HydrophobicContact CG2-CB 4.29Å; I684-W698 HydrophobicContact CG2-CE3 4.26Å
685	G	74.9	Confident	71	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	141.4	-174.9	-172.4	0	0	0	0	0	113.5	T687 T690 W698	G685-T687 PolarHBondContact O-N 2.85Å; G685-T687 VanDerWaalsContact O-N 3.11Å; G685-T690 WeakPolarHBondContact O-CG2 3.49Å; G685-T690 PolarHBondContact O-OG1 2.83Å; G685-W698 VanDerWaalsContact CA-CG 3.47Å
686	V	62.9	Low	71.4	Confident	66 Å²	66	43.8 Å²	43.8	40%	0.4	23%	0.228	S	C	.	.	S	Bend	trans	-89.3	69.9	171.8	-172.2	0	0	0	0	108.8	N658	N658-V686 WeakPolarHBondContact O-CB 3.42Å; N658-V686 VanDerWaalsContact O-CG1 3.27Å; N658-V686 WeakPolarHBondContact O-CG1 2.95Å; N658-V686 WeakPolarHBondContact O-CG2 3.42Å
687	T	52.8	Low	71.9	Confident	20 Å²	20	40.5 Å²	40.5	12%	0.123	21%	0.21	C	C	.	.	S	Bend	trans	-121.1	153.3	174.7	66.9	0	0	0	0	109.4	G685 L689 T690	G685-T687 PolarHBondContact O-N 2.85Å; G685-T687 VanDerWaalsContact O-N 3.11Å; T687-L689 PolarHBondContact O-N 3.01Å; T687-T690 PolarHBondContact O-N 3.05Å; T687-T690 PolarHBondContact O-OG1 2.95Å; T687-T690 WeakPolarHBondContact OG1-CG2 3.24Å
688	K	48.5	Very low	72.3	Confident	44 Å²	44	37.8 Å²	37.8	19%	0.191	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-9.6	-171.6	-69.5	169.7	-173.9	-72.1	0	115.5	C468 V471 L498	C468-K688 HydrophobicContact CB-CD 4.15Å; C468-K688 WeakPolarHBondContact SG-CD 3.3Å; C468-K688 WeakPolarHBondContact SG-CE 3.47Å; V471-K688 VanDerWaalsContact CB-NZ 3.33Å; V471-K688 HydrophobicContact CG2-CD 3.6Å; V471-K688 HydrophobicContact CG2-CG 4.31Å; L498-K688 VanDerWaalsContact CB-CE 3.48Å; L498-K688 HydrophobicContact CD1-CD 4.3Å; L498-K688 HydrophobicContact CD1-CG 3.79Å; L498-K688 VanDerWaalsContact CD1-NZ 3.29Å; L498-K688 HydrophobicContact CD2-CD 4.3Å; L498-K688 HydrophobicContact CD2-CG 3.87Å; L498-K688 HydrophobicContact CG-CG 4.37Å
689	L	47.1	Very low	72.6	Confident	102 Å²	102	38.4 Å²	38.4	53%	0.534	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	1.5	-165.6	-63.2	169.8	0	0	0	113.1	F418 T687	F418-L689 HydrophobicContact CZ-CD2 4.47Å; T687-L689 PolarHBondContact O-N 3.01Å
690	T	51.1	Low	72.9	Confident	22 Å²	22	39.5 Å²	39.5	14%	0.135	22%	0.218	C	C	.	.			trans	-79	137.7	-173	55.7	0	0	0	0	112.9	S683 G685 T687 S695	S683-T690 WeakPolarHBondContact O-CG2 3.45Å; G685-T690 WeakPolarHBondContact O-CG2 3.49Å; G685-T690 PolarHBondContact O-OG1 2.83Å; T687-T690 PolarHBondContact O-N 3.05Å; T687-T690 PolarHBondContact O-OG1 2.95Å; T687-T690 WeakPolarHBondContact OG1-CG2 3.24Å; T690-S695 WeakPolarHBondContact CB-OG 3.44Å; T690-S695 PolarHBondContact OG1-OG 2.83Å
691	D	56.1	Low	73.4	Confident	82 Å²	82	39.4 Å²	39.4	44%	0.439	22%	0.217	S	C	.	.			trans	-65.5	161.1	163.1	-78.2	-28.7	0	0	0	110.7	L693 A694 S695	D691-L693 VanDerWaalsContact C-N 3.25Å; D691-L693 PolarHBondContact O-N 2.75Å; D691-A694 PolarHBondContact O-N 2.69Å; D691-S695 PolarHBondContact O-N 3.13Å; D691-S695 PolarHBondContact O-OG 3.05Å
692	N	65.4	Low	73.7	Confident	114 Å²	114	37 Å²	37	61%	0.61	20%	0.204	S	C	*	.	H	α-helix	trans	-55.7	-41.9	176.7	-71.3	2.8	0	0	0	111.3	S695 I696	N692-S695 PolarHBondContact O-N 3.32Å; N692-I696 WeakPolarHBondContact O-CD1 3.34Å; N692-I696 WeakPolarHBondContact O-CG1 3.41Å; N692-I696 PolarHBondContact O-N 2.91Å
693	L	77.1	Confident	74	Confident	70 Å²	70	41.1 Å²	41.1	37%	0.366	22%	0.222	S	C	.	.	H	α-helix	trans	-65.2	-42.6	179.2	-65.7	175.6	0	0	0	112.8	D691 S695 I696 Q697 Y723 W724	D691-L693 VanDerWaalsContact C-N 3.25Å; D691-L693 PolarHBondContact O-N 2.75Å; L693-S695 VanDerWaalsContact C-N 3.3Å; L693-S695 PolarHBondContact O-N 3.46Å; L693-I696 PolarHBondContact O-N 3.07Å; L693-Q697 WeakPolarHBondContact O-CB 3.48Å; L693-Q697 PolarHBondContact O-N 3.36Å; L693-Y723 HydrophobicContact CD2-CD1 4.5Å; L693-W724 WeakPolarHBondContact CD1-O 3.03Å
694	A	78.9	Confident	74.3	Confident	1 Å²	1	42 Å²	42	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-33.5	177.6	0	0	0	0	0	112.6	S683 I684 D691 W698	S683-A694 WeakPolarHBondContact O-CB 3.42Å; I684-A694 HydrophobicContact CG1-CB 4.24Å; D691-A694 PolarHBondContact O-N 2.69Å; A694-W698 WeakPolarHBondContact O-CB 3.19Å; A694-W698 PolarHBondContact O-N 3.04Å
695	S	77.9	Confident	74.5	Confident	32 Å²	32	42 Å²	42	22%	0.224	23%	0.225	C	C	.	.	H	α-helix	trans	-70.4	-41	173	-50.2	0	0	0	0	111.8	T690 D691 N692 L693 N699	T690-S695 WeakPolarHBondContact CB-OG 3.44Å; T690-S695 PolarHBondContact OG1-OG 2.83Å; D691-S695 PolarHBondContact O-N 3.13Å; D691-S695 PolarHBondContact O-OG 3.05Å; N692-S695 PolarHBondContact O-N 3.32Å; L693-S695 VanDerWaalsContact C-N 3.3Å; L693-S695 PolarHBondContact O-N 3.46Å; S695-N699 WeakPolarHBondContact O-CB 3.27Å; S695-N699 PolarHBondContact O-N 3.5Å; S695-N699 PolarHBondContact O-ND2 3.05Å
696	I	81	Confident	75.1	Confident	65 Å²	65	47.4 Å²	47.4	33%	0.333	25%	0.248	S	C	.	.	H	α-helix	trans	-63.5	-49.2	175.7	-70.4	161.5	0	0	0	110.9	N692 L693 W698 N699 A700 Y723	N692-I696 WeakPolarHBondContact O-CD1 3.34Å; N692-I696 WeakPolarHBondContact O-CG1 3.41Å; N692-I696 PolarHBondContact O-N 2.91Å; L693-I696 PolarHBondContact O-N 3.07Å; I696-W698 VanDerWaalsContact C-N 3.32Å; I696-W698 PolarHBondContact O-N 3.17Å; I696-N699 PolarHBondContact O-N 3.01Å; I696-A700 WeakPolarHBondContact O-CB 3.34Å; I696-A700 PolarHBondContact O-N 2.93Å; I696-Y723 HydrophobicContact CG2-CE1 3.98Å
697	Q	87.5	Confident	76.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56.3	-46.6	178.2	-177.3	-179.9	29.9	0	0	111.5	V560 I562 L693 A700 L701 F721 Y723 H725	V560-Q697 PolarHBondContact O-NE2 2.72Å; I562-Q697 HydrophobicContact CD1-CG 3.67Å; I562-Q697 HydrophobicContact CG1-CG 3.95Å; L693-Q697 WeakPolarHBondContact O-CB 3.48Å; L693-Q697 PolarHBondContact O-N 3.36Å; Q697-A700 PolarHBondContact O-N 3Å; Q697-L701 PolarHBondContact O-N 3.14Å; Q697-F721 HydrophobicContact CG-CB 4.18Å; Q697-F721 PolarHBondContact NE2-O 2.97Å; Q697-Y723 HydrophobicContact CB-CD1 4.38Å; Q697-Y723 HydrophobicContact CB-CD2 3.52Å; Q697-Y723 HydrophobicContact CB-CE2 3.86Å; Q697-Y723 HydrophobicContact CB-CG 3.82Å; Q697-Y723 HydrophobicContact CG-CD2 3.4Å; Q697-Y723 HydrophobicContact CG-CE2 3.92Å; Q697-Y723 HydrophobicContact CG-CG 4.05Å; Q697-H725 PolarHBondContact OE1-CE1 2.87Å; Q697-H725 PolarHBondContact OE1-NE2 3.34Å
698	W	87.5	Confident	77.7	Confident	6 Å²	6	49.4 Å²	49.4	2%	0.023	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-47.4	176.9	-177.1	-100	0	0	0	112.5	F571 F596 L654 I660 I662 I684 G685 A694 I696 A700 L701 I702	F571-W698 HydrophobicContact CE2-CH2 4.08Å; F571-W698 AromaticContact CE2-CZ3 3.68Å; F571-W698 HydrophobicContact CE2-CZ3 3.68Å; F571-W698 HydrophobicContact CZ-CE3 4.44Å; F571-W698 AromaticContact CZ-CZ3 3.77Å; F571-W698 HydrophobicContact CZ-CZ3 3.77Å; F596-W698 HydrophobicContact CE2-CH2 4.48Å; L654-W698 HydrophobicContact CD2-CH2 3.68Å; L654-W698 HydrophobicContact CD2-CZ2 4.12Å; I660-W698 HydrophobicContact CG2-CH2 4.34Å; I660-W698 HydrophobicContact CG2-CZ2 3.7Å; I660-W698 WeakPolarHBondContact O-CZ2 3.38Å; I662-W698 HydrophobicContact CD1-CZ3 3.91Å; I662-W698 HydrophobicContact CG1-CZ3 4.28Å; I684-W698 HydrophobicContact CG2-CB 4.29Å; I684-W698 HydrophobicContact CG2-CE3 4.26Å; G685-W698 VanDerWaalsContact CA-CG 3.47Å; A694-W698 WeakPolarHBondContact O-CB 3.19Å; A694-W698 PolarHBondContact O-N 3.04Å; I696-W698 VanDerWaalsContact C-N 3.32Å; I696-W698 PolarHBondContact O-N 3.17Å; W698-A700 VanDerWaalsContact C-N 3.27Å; W698-A700 PolarHBondContact O-N 2.97Å; W698-L701 PolarHBondContact O-N 3.24Å; W698-I702 HydrophobicContact CD2-CG1 4.44Å; W698-I702 HydrophobicContact CG-CG1 4.45Å; W698-I702 HydrophobicContact CZ2-CD1 4.02Å; W698-I702 HydrophobicContact CZ2-CG1 4.37Å; W698-I702 WeakPolarHBondContact O-CG1 3.46Å; W698-I702 PolarHBondContact O-N 3.01Å
699	N	86	Confident	79.3	Confident	90 Å²	90	51.8 Å²	51.8	48%	0.481	26%	0.263	S	S	.	.	H	α-helix	trans	-63.9	-32.6	179.8	-73	-22.3	0	0	0	112.4	S695 I696 K703	S695-N699 WeakPolarHBondContact O-CB 3.27Å; S695-N699 PolarHBondContact O-N 3.5Å; S695-N699 PolarHBondContact O-ND2 3.05Å; I696-N699 PolarHBondContact O-N 3.01Å; N699-K703 VanDerWaalsContact O-CB 3.23Å; N699-K703 WeakPolarHBondContact O-CB 3.47Å; N699-K703 PolarHBondContact O-N 3.05Å
700	A	87.4	Confident	80.9	Confident	24 Å²	24	51 Å²	51	20%	0.198	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-46.8	174	0	0	0	0	0	111.7	I696 Q697 W698 K703 E704 F721	I696-A700 WeakPolarHBondContact O-CB 3.34Å; I696-A700 PolarHBondContact O-N 2.93Å; Q697-A700 PolarHBondContact O-N 3Å; W698-A700 VanDerWaalsContact C-N 3.27Å; W698-A700 PolarHBondContact O-N 2.97Å; A700-K703 PolarHBondContact O-N 3Å; A700-E704 PolarHBondContact O-N 2.81Å; A700-F721 HydrophobicContact CB-CD1 3.63Å; A700-F721 HydrophobicContact CB-CE1 3.54Å; A700-F721 HydrophobicContact CB-CG 4.4Å; A700-F721 HydrophobicContact CB-CZ 4.23Å
701	L	90.1	Very high	82.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-49.2	174.1	-176.4	77.9	0	0	0	111.8	I562 F571 Q697 W698 K703 E704 L705 T718 F721	I562-L701 HydrophobicContact CD1-CB 4.08Å; I562-L701 HydrophobicContact CD1-CD2 3.93Å; I562-L701 HydrophobicContact CG1-CD2 4.41Å; F571-L701 HydrophobicContact CD2-CD2 4.21Å; F571-L701 HydrophobicContact CE2-CD2 3.24Å; F571-L701 HydrophobicContact CZ-CD2 3.44Å; F571-L701 VanDerWaalsContact CZ-CD2 3.44Å; Q697-L701 PolarHBondContact O-N 3.14Å; W698-L701 PolarHBondContact O-N 3.24Å; L701-K703 VanDerWaalsContact C-N 3.26Å; L701-K703 PolarHBondContact O-N 2.88Å; L701-E704 PolarHBondContact O-N 2.96Å; L701-L705 HydrophobicContact CD2-CD1 4.43Å; L701-L705 HydrophobicContact CG-CD1 4.09Å; L701-L705 HydrophobicContact CG-CG 4.49Å; L701-L705 WeakPolarHBondContact O-CG 3.24Å; L701-L705 PolarHBondContact O-N 2.98Å; L701-T718 HydrophobicContact CD1-CG2 3.81Å; L701-T718 WeakPolarHBondContact CD1-OG1 3.3Å; L701-F721 HydrophobicContact CB-CD2 4.01Å; L701-F721 HydrophobicContact CB-CE2 4.14Å; L701-F721 HydrophobicContact CD1-CD2 3.78Å; L701-F721 HydrophobicContact CD1-CE2 3.85Å
702	I	88.9	Confident	83.3	Confident	19 Å²	19	57.4 Å²	57.4	10%	0.097	30%	0.299	C	S	.	.	H	α-helix	trans	-62	-35.1	179	-64.8	-59.7	0	0	0	111.5	L654 L655 W698 L705 K706	L654-I702 HydrophobicContact CB-CD1 4.15Å; L655-I702 HydrophobicContact CD2-CG2 4.15Å; W698-I702 HydrophobicContact CD2-CG1 4.44Å; W698-I702 HydrophobicContact CG-CG1 4.45Å; W698-I702 HydrophobicContact CZ2-CD1 4.02Å; W698-I702 HydrophobicContact CZ2-CG1 4.37Å; W698-I702 WeakPolarHBondContact O-CG1 3.46Å; W698-I702 PolarHBondContact O-N 3.01Å; I702-L705 HydrophobicContact CD1-CD1 4.38Å; I702-K706 HydrophobicContact CG2-CD 4.3Å; I702-K706 VanDerWaalsContact O-CG 3.31Å; I702-K706 WeakPolarHBondContact O-CG 3.32Å; I702-K706 PolarHBondContact O-N 2.59Å
703	K	87.5	Confident	83.5	Confident	96 Å²	96	56.9 Å²	56.9	42%	0.417	29%	0.293	S	S	.	.	H	α-helix	trans	-66.1	-45.2	175.9	-175.2	170.1	-177.7	168.6	0	111.6	Y523 N699 A700 L701 K706 Q707	Y523-K703 PolarHBondContact O-NZ 2.83Å; Y523-K703 VanDerWaalsContact O-NZ 3.14Å; N699-K703 VanDerWaalsContact O-CB 3.23Å; N699-K703 WeakPolarHBondContact O-CB 3.47Å; N699-K703 PolarHBondContact O-N 3.05Å; A700-K703 PolarHBondContact O-N 3Å; L701-K703 VanDerWaalsContact C-N 3.26Å; L701-K703 PolarHBondContact O-N 2.88Å; K703-K706 PolarHBondContact O-N 2.86Å; K703-Q707 WeakPolarHBondContact O-CG 3.41Å; K703-Q707 PolarHBondContact O-N 2.81Å; K703-Q707 VanDerWaalsContact O-N 3.1Å
704	E	88.5	Confident	82.9	Confident	26 Å²	26	59.3 Å²	59.3	12%	0.121	31%	0.306	C	S	.	.	H	α-helix	trans	-65.9	-41.3	175.9	-172.4	168.5	-142.3	0	0	111.7	A700 L701 K706 Q707 L708 T718 K719 F721	A700-E704 PolarHBondContact O-N 2.81Å; L701-E704 PolarHBondContact O-N 2.96Å; E704-K706 VanDerWaalsContact C-N 3.31Å; E704-K706 PolarHBondContact O-N 3.12Å; E704-Q707 WeakPolarHBondContact O-CB 3.45Å; E704-Q707 PolarHBondContact O-N 2.92Å; E704-Q707 VanDerWaalsContact O-N 3.08Å; E704-L708 HydrophobicContact CG-CD1 4.05Å; E704-L708 HydrophobicContact CG-CG 4.28Å; E704-L708 WeakPolarHBondContact O-CG 3.27Å; E704-L708 PolarHBondContact O-N 3.1Å; E704-T718 HydrophobicContact CG-CG2 4.43Å; E704-T718 VanDerWaalsContact OE2-CB 3.27Å; E704-T718 WeakPolarHBondContact OE2-CB 3.13Å; E704-K719 WeakPolarHBondContact OE1-CD 3.49Å; E704-K719 VanDerWaalsContact OE1-CG 3.32Å; E704-K719 WeakPolarHBondContact OE1-CG 3.39Å; E704-K719 PolarHBondContact OE1-N 3.24Å; E704-K719 WeakPolarHBondContact OE2-CB 3.39Å; E704-K719 PolarHBondContact OE2-N 2.56Å; E704-F721 HydrophobicContact CB-CE2 4.34Å; E704-F721 HydrophobicContact CB-CZ 4.04Å; E704-F721 WeakPolarHBondContact OE2-CE2 3.39Å; E704-F721 WeakPolarHBondContact OE2-CZ 3.44Å
705	L	87.9	Confident	82.5	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-60.6	-37.8	174.9	-72	174.3	0	0	0	113	Y564 I566 V651 L654 L655 L701 I702 K709 T718	Y564-L705 HydrophobicContact CD1-CD1 4.44Å; Y564-L705 HydrophobicContact CD1-CD2 3.36Å; Y564-L705 HydrophobicContact CE1-CD2 4.02Å; Y564-L705 HydrophobicContact CG-CD1 4.34Å; Y564-L705 HydrophobicContact CG-CD2 3.94Å; I566-L705 HydrophobicContact CG1-CD2 4.43Å; V651-L705 HydrophobicContact CG2-CD2 4.29Å; L654-L705 HydrophobicContact CB-CD1 4.48Å; L654-L705 HydrophobicContact CD1-CD1 3.94Å; L655-L705 HydrophobicContact CD2-CB 4Å; L701-L705 HydrophobicContact CD2-CD1 4.43Å; L701-L705 HydrophobicContact CG-CD1 4.09Å; L701-L705 HydrophobicContact CG-CG 4.49Å; L701-L705 WeakPolarHBondContact O-CG 3.24Å; L701-L705 PolarHBondContact O-N 2.98Å; I702-L705 HydrophobicContact CD1-CD1 4.38Å; L705-K709 VanDerWaalsContact O-CB 3.27Å; L705-K709 WeakPolarHBondContact O-CB 3.32Å; L705-K709 PolarHBondContact O-N 3.48Å; L705-T718 HydrophobicContact CD2-CG2 3.44Å; L705-T718 VanDerWaalsContact CD2-CG2 3.44Å; L705-T718 HydrophobicContact CG-CG2 3.86Å
706	K	86.3	Confident	82.6	Confident	115 Å²	115	67.3 Å²	67.3	50%	0.5	35%	0.346	S	S	.	.	H	α-helix	trans	-64.9	-40.2	173.1	-74.4	177.6	-179.3	-178	0	111.8	L655 I702 K703 E704 S710	L655-K706 HydrophobicContact CD2-CD 4.49Å; L655-K706 HydrophobicContact CD2-CG 3.62Å; I702-K706 HydrophobicContact CG2-CD 4.3Å; I702-K706 VanDerWaalsContact O-CG 3.31Å; I702-K706 WeakPolarHBondContact O-CG 3.32Å; I702-K706 PolarHBondContact O-N 2.59Å; K703-K706 PolarHBondContact O-N 2.86Å; E704-K706 VanDerWaalsContact C-N 3.31Å; E704-K706 PolarHBondContact O-N 3.12Å; K706-S710 WeakPolarHBondContact O-CB 3.33Å; K706-S710 PolarHBondContact O-N 3.02Å; K706-S710 PolarHBondContact O-OG 3.11Å
707	Q	86.2	Confident	82.8	Confident	103 Å²	103	67 Å²	67	48%	0.481	35%	0.349	S	S	.	.	H	α-helix	trans	-68.3	-44.8	178.2	-71.9	174.7	-20.6	0	0	112.7	K703 E704 K709 S710 N711	K703-Q707 WeakPolarHBondContact O-CG 3.41Å; K703-Q707 PolarHBondContact O-N 2.81Å; K703-Q707 VanDerWaalsContact O-N 3.1Å; E704-Q707 WeakPolarHBondContact O-CB 3.45Å; E704-Q707 PolarHBondContact O-N 2.92Å; E704-Q707 VanDerWaalsContact O-N 3.08Å; Q707-K709 VanDerWaalsContact C-N 3.33Å; Q707-K709 PolarHBondContact O-N 3.13Å; Q707-S710 WeakPolarHBondContact CA-OG 3.49Å; Q707-S710 PolarHBondContact O-N 3.22Å; Q707-S710 PolarHBondContact O-OG 2.7Å; Q707-N711 WeakPolarHBondContact O-CB 3.5Å; Q707-N711 PolarHBondContact O-N 3.49Å; Q707-N711 PolarHBondContact O-ND2 2.96Å; Q707-N711 PolarHBondContact O-OD1 2.74Å
708	L	85.3	Confident	82.9	Confident	26 Å²	26	67 Å²	67	14%	0.136	35%	0.35	C	S	.	.	H	α-helix	trans	-62.7	-42.6	176.2	-67	172.9	0	0	0	110.9	I566 E704 N711 Q713 T718	I566-L708 HydrophobicContact CD1-CB 3.78Å; I566-L708 HydrophobicContact CD1-CD1 3.71Å; I566-L708 HydrophobicContact CD1-CG 4.35Å; E704-L708 HydrophobicContact CG-CD1 4.05Å; E704-L708 HydrophobicContact CG-CG 4.28Å; E704-L708 WeakPolarHBondContact O-CG 3.27Å; E704-L708 PolarHBondContact O-N 3.1Å; L708-N711 PolarHBondContact O-N 3.01Å; L708-Q713 HydrophobicContact CD2-CB 4.39Å; L708-Q713 VanDerWaalsContact CD2-OE1 3.31Å; L708-Q713 PolarHBondContact O-N 3.22Å; L708-Q713 VanDerWaalsContact O-N 3.08Å; L708-T718 HydrophobicContact CD1-CG2 4.13Å
709	K	81.9	Confident	82.9	Confident	93 Å²	93	73.8 Å²	73.8	40%	0.404	38%	0.379	S	S	.	.	H	α-helix	trans	-67	-38	176.1	-171.1	173.1	177.2	-179.3	0	113.1	N652 L655 L705 Q707 N711 N712	N652-K709 PolarHBondContact OD1-NZ 2.85Å; L655-K709 HydrophobicContact CD1-CB 4.38Å; L655-K709 HydrophobicContact CD1-CD 3.53Å; L705-K709 VanDerWaalsContact O-CB 3.27Å; L705-K709 WeakPolarHBondContact O-CB 3.32Å; L705-K709 PolarHBondContact O-N 3.48Å; Q707-K709 VanDerWaalsContact C-N 3.33Å; Q707-K709 PolarHBondContact O-N 3.13Å; K709-N711 VanDerWaalsContact C-N 3.3Å; K709-N711 PolarHBondContact O-N 3.26Å; K709-N712 PolarHBondContact O-N 3.18Å
710	S	81.2	Confident	83.1	Confident	85 Å²	85	75 Å²	75	59%	0.594	38%	0.38	S	S	*	.	H	α-helix	trans	-68.6	-29.4	176.2	60.9	0	0	0	0	113	K706 Q707 N712	K706-S710 WeakPolarHBondContact O-CB 3.33Å; K706-S710 PolarHBondContact O-N 3.02Å; K706-S710 PolarHBondContact O-OG 3.11Å; Q707-S710 WeakPolarHBondContact CA-OG 3.49Å; Q707-S710 PolarHBondContact O-N 3.22Å; Q707-S710 PolarHBondContact O-OG 2.7Å; S710-N712 PolarHBondContact O-N 3.17Å
711	N	81.7	Confident	83.2	Confident	105 Å²	105	75.5 Å²	75.5	56%	0.561	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	7.9	179.9	-64.5	-3.1	0	0	0	113.1	Q707 L708 K709 Q713	Q707-N711 WeakPolarHBondContact O-CB 3.5Å; Q707-N711 PolarHBondContact O-N 3.49Å; Q707-N711 PolarHBondContact O-ND2 2.96Å; Q707-N711 PolarHBondContact O-OD1 2.74Å; L708-N711 PolarHBondContact O-N 3.01Å; K709-N711 VanDerWaalsContact C-N 3.3Å; K709-N711 PolarHBondContact O-N 3.26Å; N711-Q713 HydrophobicContact CB-CG 4.25Å; N711-Q713 PolarHBondContact O-N 2.65Å
712	N	74.3	Confident	83.1	Confident	134 Å²	134	78.3 Å²	78.3	72%	0.717	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	24.2	-170.8	-72.3	-27.5	0	0	0	114.1	K709 S710 L714	K709-N712 PolarHBondContact O-N 3.18Å; S710-N712 PolarHBondContact O-N 3.17Å; N712-L714 VanDerWaalsContact C-N 3.25Å; N712-L714 PolarHBondContact O-N 2.78Å
713	Q	71.2	Confident	83	Confident	103 Å²	103	79 Å²	79	48%	0.481	40%	0.397	S	S	.	.			trans	-78.6	81.7	173.2	-73.9	-177.5	-29.9	0	0	108.9	L708 N711 F715	L708-Q713 HydrophobicContact CD2-CB 4.39Å; L708-Q713 VanDerWaalsContact CD2-OE1 3.31Å; L708-Q713 PolarHBondContact O-N 3.22Å; L708-Q713 VanDerWaalsContact O-N 3.08Å; N711-Q713 HydrophobicContact CB-CG 4.25Å; N711-Q713 PolarHBondContact O-N 2.65Å; Q713-F715 PolarHBondContact O-N 3.37Å
714	L	63.8	Low	82.8	Confident	122 Å²	122	77.6 Å²	77.6	64%	0.639	39%	0.389	S	S	*	.			trans	-73.3	-0.4	172.9	-75.7	156.9	0	0	0	113.1	N712	N712-L714 VanDerWaalsContact C-N 3.25Å; N712-L714 PolarHBondContact O-N 2.78Å
715	F	69.5	Low	82.5	Confident	169 Å²	169	76.4 Å²	76.4	74%	0.741	38%	0.383	S	S	*	.	S	Bend	trans	-129	139.3	-179.4	-61	-72.4	0	0	0	111.7	D567 Q713	D567-F715 WeakPolarHBondContact OD1-CA 3.28Å; Q713-F715 PolarHBondContact O-N 3.37Å
716	G	80.3	Confident	81.9	Confident	32 Å²	32	79.5 Å²	79.5	33%	0.33	40%	0.399	S	S	.	.	S	Bend	trans	120.3	-168.8	178.5	0	0	0	0	0	115	I566 D567	I566-G716 PolarHBondContact N-O 3.33Å; D567-G716 PolarHBondContact OD1-N 2.93Å
717	S	85.6	Confident	81.4	Confident	57 Å²	57	74.3 Å²	74.3	40%	0.399	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-132.4	152.2	175.4	64.1	0	0	0	0	109.9	Q563 Y564	Q563-S717 PolarHBondContact NE2-OG 3.06Å; Y564-S717 CarbonylContact O-C 3.59Å; Y564-S717 VanDerWaalsContact O-CA 3.3Å; Y564-S717 WeakPolarHBondContact O-CA 2.96Å
718	T	89.2	Confident	80	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.012	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-60.2	163.9	167.9	67.8	0	0	0	0	110.3	Q563 Y564 L701 E704 L705 L708	Q563-T718 WeakPolarHBondContact CG-O 3.5Å; Q563-T718 PolarHBondContact NE2-O 2.91Å; Y564-T718 PolarHBondContact N-OG1 3.25Å; Y564-T718 PolarHBondContact O-N 2.95Å; L701-T718 HydrophobicContact CD1-CG2 3.81Å; L701-T718 WeakPolarHBondContact CD1-OG1 3.3Å; E704-T718 HydrophobicContact CG-CG2 4.43Å; E704-T718 VanDerWaalsContact OE2-CB 3.27Å; E704-T718 WeakPolarHBondContact OE2-CB 3.13Å; L705-T718 HydrophobicContact CD2-CG2 3.44Å; L705-T718 VanDerWaalsContact CD2-CG2 3.44Å; L705-T718 HydrophobicContact CG-CG2 3.86Å; L708-T718 HydrophobicContact CD1-CG2 4.13Å
719	K	89	Confident	78.3	Confident	148 Å²	148	76.4 Å²	76.4	64%	0.643	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-59.6	157.8	162.1	-68.9	165.9	-171	179.5	0	109.8	E704 F721	E704-K719 WeakPolarHBondContact OE1-CD 3.49Å; E704-K719 VanDerWaalsContact OE1-CG 3.32Å; E704-K719 WeakPolarHBondContact OE1-CG 3.39Å; E704-K719 PolarHBondContact OE1-N 3.24Å; E704-K719 WeakPolarHBondContact OE2-CB 3.39Å; E704-K719 PolarHBondContact OE2-N 2.56Å; K719-F721 HydrophobicContact CB-CE2 4.45Å; K719-F721 HydrophobicContact CB-CZ 4.44Å; K719-F721 WeakPolarHBondContact O-CD2 3.26Å
720	K	89.6	Confident	76.1	Confident	116 Å²	116	77.3 Å²	77.3	50%	0.504	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-76.4	120.2	168	-73.2	-170.5	175.8	-166.7	0	108.3	T561 Q563	T561-K720 HydrophobicContact CG2-CB 3.68Å; T561-K720 HydrophobicContact CG2-CD 4.13Å; T561-K720 HydrophobicContact CG2-CG 4.08Å; Q563-K720 HydrophobicContact CB-CG 4.28Å; Q563-K720 HydrophobicContact CG-CG 4.28Å
721	F	89.1	Confident	75.8	Confident	34 Å²	34	77 Å²	77	15%	0.149	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	104.2	175.1	-67	-81	0	0	0	109.4	T561 I562 Q697 A700 L701 E704 K719 Y723	T561-F721 WeakPolarHBondContact CA-O 3.31Å; I562-F721 HydrophobicContact CG1-CB 3.99Å; I562-F721 PolarHBondContact N-O 3.23Å; I562-F721 PolarHBondContact O-N 3.22Å; Q697-F721 HydrophobicContact CG-CB 4.18Å; Q697-F721 PolarHBondContact NE2-O 2.97Å; A700-F721 HydrophobicContact CB-CD1 3.63Å; A700-F721 HydrophobicContact CB-CE1 3.54Å; A700-F721 HydrophobicContact CB-CG 4.4Å; A700-F721 HydrophobicContact CB-CZ 4.23Å; L701-F721 HydrophobicContact CB-CD2 4.01Å; L701-F721 HydrophobicContact CB-CE2 4.14Å; L701-F721 HydrophobicContact CD1-CD2 3.78Å; L701-F721 HydrophobicContact CD1-CE2 3.85Å; E704-F721 HydrophobicContact CB-CE2 4.34Å; E704-F721 HydrophobicContact CB-CZ 4.04Å; E704-F721 WeakPolarHBondContact OE2-CE2 3.39Å; E704-F721 WeakPolarHBondContact OE2-CZ 3.44Å; K719-F721 HydrophobicContact CB-CE2 4.45Å; K719-F721 HydrophobicContact CB-CZ 4.44Å; K719-F721 WeakPolarHBondContact O-CD2 3.26Å; F721-Y723 HydrophobicContact CB-CE2 4.36Å
722	T	88.7	Confident	75.5	Confident	59 Å²	59	75.5 Å²	75.5	36%	0.362	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122.5	-175.5	-54.3	0	0	0	0	111.1	K559 T561	K559-T722 HydrophobicContact CD-CG2 4.35Å; K559-T722 HydrophobicContact CG-CG2 3.81Å; T561-T722 WeakPolarHBondContact CG2-OG1 3.02Å; T561-T722 VanDerWaalsContact OG1-CB 3.27Å; T561-T722 WeakPolarHBondContact OG1-CB 3.36Å; T561-T722 WeakPolarHBondContact OG1-CG2 3.48Å; T561-T722 PolarHBondContact OG1-OG1 3.34Å
723	Y	85.7	Confident	75.6	Confident	33 Å²	33	72.2 Å²	72.2	13%	0.129	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147	-179.9	-76.6	-104.1	0	0	0	111.4	V560 L693 I696 Q697 F721	V560-Y723 PolarHBondContact N-O 3.46Å; V560-Y723 PolarHBondContact O-N 2.89Å; L693-Y723 HydrophobicContact CD2-CD1 4.5Å; I696-Y723 HydrophobicContact CG2-CE1 3.98Å; Q697-Y723 HydrophobicContact CB-CD1 4.38Å; Q697-Y723 HydrophobicContact CB-CD2 3.52Å; Q697-Y723 HydrophobicContact CB-CE2 3.86Å; Q697-Y723 HydrophobicContact CB-CG 3.82Å; Q697-Y723 HydrophobicContact CG-CD2 3.4Å; Q697-Y723 HydrophobicContact CG-CE2 3.92Å; Q697-Y723 HydrophobicContact CG-CG 4.05Å; F721-Y723 HydrophobicContact CB-CE2 4.36Å
724	W	83.6	Confident	75.9	Confident	66 Å²	66	70.4 Å²	70.4	25%	0.25	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	131.2	166.9	-70.4	95.9	0	0	0	110.2	L557 V558 K559 E577 K579 L693	L557-W724 HydrophobicContact CB-CE3 3.88Å; L557-W724 HydrophobicContact CB-CZ3 4.26Å; V558-W724 CarbonylContact O-C 3.53Å; V558-W724 WeakPolarHBondContact O-CA 3.31Å; K559-W724 HydrophobicContact CB-CD2 3.94Å; K559-W724 HydrophobicContact CB-CE3 3.81Å; K559-W724 HydrophobicContact CB-CH2 3.84Å; K559-W724 HydrophobicContact CB-CZ2 3.96Å; K559-W724 HydrophobicContact CB-CZ3 3.78Å; K559-W724 HydrophobicContact CD-CH2 4.22Å; K559-W724 HydrophobicContact CD-CZ2 3.73Å; K559-W724 HydrophobicContact CG-CD2 4.26Å; K559-W724 HydrophobicContact CG-CH2 4.48Å; K559-W724 HydrophobicContact CG-CZ2 4.11Å; E577-W724 HydrophobicContact CB-CH2 3.7Å; E577-W724 HydrophobicContact CB-CZ2 4.48Å; E577-W724 HydrophobicContact CB-CZ3 4.31Å; K579-W724 HydrophobicContact CD-CH2 3.67Å; K579-W724 HydrophobicContact CD-CZ2 4.39Å; K579-W724 HydrophobicContact CD-CZ3 3.91Å; K579-W724 HydrophobicContact CG-CH2 4.06Å; K579-W724 HydrophobicContact CG-CZ3 4.07Å; L693-W724 WeakPolarHBondContact CD1-O 3.03Å
725	H	81.7	Confident	76.6	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.9	175.1	-59	-69.7	0	0	0	110.8	L557 V558 I682 Q697	L557-H725 WeakPolarHBondContact CA-O 3.42Å; V558-H725 HydrophobicContact CG1-CB 4.11Å; V558-H725 PolarHBondContact N-O 3.32Å; V558-H725 PolarHBondContact O-N 3.17Å; I682-H725 HydrophobicContact CG1-CB 4.46Å; I682-H725 HydrophobicContact CG2-CB 3.83Å; Q697-H725 PolarHBondContact OE1-CE1 2.87Å; Q697-H725 PolarHBondContact OE1-NE2 3.34Å
726	L	76.6	Confident	77.1	Confident	66 Å²	66	60.4 Å²	60.4	35%	0.346	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	135.4	173.1	-168	69.8	0	0	0	110	K555 L557	K555-L726 HydrophobicContact CB-CD1 3.93Å; K555-L726 HydrophobicContact CD-CD1 4.01Å; K555-L726 HydrophobicContact CG-CD1 4.33Å; L557-L726 HydrophobicContact CD2-CD1 4.12Å
727	I	74.3	Confident	76.9	Confident	7 Å²	7	62.4 Å²	62.4	4%	0.036	32%	0.321	C	S	.	.			trans	-100.2	115.1	164.9	-73.1	176.3	0	0	0	107.6	S556 V558 I666 A680 I682 S729	S556-I727 PolarHBondContact O-N 2.88Å; V558-I727 HydrophobicContact CB-CD1 3.69Å; V558-I727 HydrophobicContact CB-CG1 4.18Å; V558-I727 HydrophobicContact CG1-CD1 3.8Å; V558-I727 HydrophobicContact CG1-CG1 3.76Å; I666-I727 HydrophobicContact CD1-CD1 3.88Å; A680-I727 HydrophobicContact CB-CB 4.2Å; A680-I727 HydrophobicContact CB-CD1 3.88Å; A680-I727 HydrophobicContact CB-CG1 3.83Å; A680-I727 HydrophobicContact CB-CG2 3.43Å; A680-I727 VanDerWaalsContact CB-CG2 3.43Å; I682-I727 HydrophobicContact CD1-CG1 4.35Å; I727-S729 PolarHBondContact O-N 2.9Å
728	E	58.6	Low	76.2	Confident	142 Å²	142	62.8 Å²	62.8	66%	0.664	32%	0.315	S	S	*	.			trans	-73.9	101.9	155.6	-67.2	-173.2	168.2	0	0	107.7	S730	E728-S730 PolarHBondContact O-N 3.41Å
729	S	49.5	Very low	75.1	Confident	31 Å²	31	67.9 Å²	67.9	22%	0.217	34%	0.341	C	S	.	.			trans	-71.8	121	177.7	68.5	0	0	0	0	110.5	I727	I727-S729 PolarHBondContact O-N 2.9Å
730	S	34.9	Very low	73.8	Confident	112 Å²	112	60.6 Å²	60.6	78%	0.783	31%	0.313	S	S	*	.			trans	-84.4	0	-176.7	65.6	0	0	0	0	115.3	R677 R678 V679 E728	R677-S730 PolarHBondContact NH2-O 2.87Å; R678-S730 PolarHBondContact O-OG 3.44Å; R678-S730 VanDerWaalsContact O-OG 3.09Å; V679-S730 PolarHBondContact O-N 3.46Å; E728-S730 PolarHBondContact O-N 3.41Å

Retrieved 730 of 730 residues in 735.1 ms (Link to these results)

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