A0A077ZJF6_TRITR Loading...

Gag Pol polyprotein

AlphaFold DB , UniProt , Accession A0A077ZJF6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 484 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.8	Very low	41.8	Very low	171 Å²	171	92.8 Å²	92.8	84%	0.842	52%	0.518	S	S	*	.				0	119.5	0	-71.8	173.6	-126.6	0	0	107.8	H3	M1-H3 PolarHBondContact O-N 3.2Å
2	A	28.8	Very low	42.7	Very low	85 Å²	85	92.3 Å²	92.3	70%	0.702	51%	0.512	S	S	*	.			trans	-77.2	89	166.8	0	0	0	0	0	106.4	S4	A2-S4 PolarHBondContact O-N 3.41Å; A2-S4 VanDerWaalsContact O-N 3.14Å
3	H	36.4	Very low	44.1	Very low	82 Å²	82	89.1 Å²	89.1	38%	0.38	51%	0.505	S	S	.	.			trans	-48	121.2	162.1	-74.9	-59.1	0	0	0	106.9	M1 D7 L8	M1-H3 PolarHBondContact O-N 3.2Å; H3-D7 WeakPolarHBondContact CA-OD2 3.39Å; H3-D7 HydrophobicContact CB-CB 3.59Å; H3-L8 HydrophobicContact CB-CD2 3.7Å; H3-L8 HydrophobicContact CB-CG 3.67Å
4	S	39.9	Very low	45.1	Very low	54 Å²	54	87.6 Å²	87.6	38%	0.378	50%	0.499	S	S	.	.			trans	-52.6	158.3	171.7	81.1	0	0	0	0	108.6	A2 A6 D7 L8	A2-S4 PolarHBondContact O-N 3.41Å; A2-S4 VanDerWaalsContact O-N 3.14Å; S4-A6 PolarHBondContact O-N 2.95Å; S4-A6 WeakPolarHBondContact OG-CB 3.49Å; S4-A6 PolarHBondContact OG-N 2.82Å; S4-D7 PolarHBondContact N-OD2 2.68Å; S4-D7 WeakPolarHBondContact O-CA 3.45Å; S4-D7 WeakPolarHBondContact O-CB 3.35Å; S4-D7 PolarHBondContact O-N 2.76Å; S4-D7 PolarHBondContact OG-N 3.44Å; S4-D7 PolarHBondContact OG-OD1 2.93Å; S4-D7 PolarHBondContact OG-OD2 3.34Å; S4-L8 PolarHBondContact O-N 2.76Å
5	K	40.4	Very low	45.6	Very low	165 Å²	165	87.7 Å²	87.7	72%	0.717	49%	0.493	S	S	*	.	H	α-helix	trans	-51.5	-33.1	172.5	-177.2	-179.5	175.8	-177.5	0	111.1	Q9	K5-Q9 WeakPolarHBondContact O-CB 3.44Å; K5-Q9 WeakPolarHBondContact O-CG 3.36Å; K5-Q9 PolarHBondContact O-N 2.82Å; K5-Q9 PolarHBondContact O-OE1 3.14Å
6	A	48.8	Very low	46.4	Very low	61 Å²	61	88.9 Å²	88.9	50%	0.504	49%	0.494	S	S	.	.	H	α-helix	trans	-69.8	-36.2	173.8	0	0	0	0	0	112.9	S4 Q9 S10	S4-A6 PolarHBondContact O-N 2.95Å; S4-A6 WeakPolarHBondContact OG-CB 3.49Å; S4-A6 PolarHBondContact OG-N 2.82Å; A6-Q9 PolarHBondContact O-N 3.04Å; A6-S10 VanDerWaalsContact O-CB 3.31Å; A6-S10 WeakPolarHBondContact O-CB 3.47Å; A6-S10 PolarHBondContact O-N 3.02Å
7	D	43.1	Very low	47.4	Very low	69 Å²	69	90.4 Å²	90.4	37%	0.369	50%	0.496	S	S	.	.	H	α-helix	trans	-70.8	-40.7	177.3	-54.6	-9.7	0	0	0	111.1	H3 S4 Q9 S10 I11	H3-D7 WeakPolarHBondContact CA-OD2 3.39Å; H3-D7 HydrophobicContact CB-CB 3.59Å; S4-D7 PolarHBondContact N-OD2 2.68Å; S4-D7 WeakPolarHBondContact O-CA 3.45Å; S4-D7 WeakPolarHBondContact O-CB 3.35Å; S4-D7 PolarHBondContact O-N 2.76Å; S4-D7 PolarHBondContact OG-N 3.44Å; S4-D7 PolarHBondContact OG-OD1 2.93Å; S4-D7 PolarHBondContact OG-OD2 3.34Å; D7-Q9 VanDerWaalsContact C-N 3.35Å; D7-S10 WeakPolarHBondContact O-CB 3.44Å; D7-S10 PolarHBondContact O-N 2.67Å; D7-I11 WeakPolarHBondContact O-CB 3.43Å; D7-I11 VanDerWaalsContact O-CG1 3.23Å; D7-I11 WeakPolarHBondContact O-CG1 3.19Å; D7-I11 PolarHBondContact O-N 3.07Å
8	L	41.7	Very low	47.9	Very low	95 Å²	95	89.6 Å²	89.6	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-66.2	-38.2	173.6	-71.1	176.6	0	0	0	111.6	H3 S4 S10 I11 L12	H3-L8 HydrophobicContact CB-CD2 3.7Å; H3-L8 HydrophobicContact CB-CG 3.67Å; S4-L8 PolarHBondContact O-N 2.76Å; L8-S10 VanDerWaalsContact C-N 3.34Å; L8-I11 PolarHBondContact O-N 3.1Å; L8-L12 VanDerWaalsContact O-CB 3.3Å; L8-L12 WeakPolarHBondContact O-CB 3.34Å; L8-L12 PolarHBondContact O-N 2.91Å
9	Q	49.2	Very low	48.2	Very low	114 Å²	114	87.6 Å²	87.6	53%	0.533	48%	0.483	S	S	.	.	H	α-helix	trans	-66.1	-36.8	172.5	-76.8	176.9	-38.6	0	0	111.9	K5 A6 D7 A13	K5-Q9 WeakPolarHBondContact O-CB 3.44Å; K5-Q9 WeakPolarHBondContact O-CG 3.36Å; K5-Q9 PolarHBondContact O-N 2.82Å; K5-Q9 PolarHBondContact O-OE1 3.14Å; A6-Q9 PolarHBondContact O-N 3.04Å; D7-Q9 VanDerWaalsContact C-N 3.35Å; Q9-A13 WeakPolarHBondContact O-CB 3.45Å; Q9-A13 PolarHBondContact O-N 2.84Å
10	S	52.6	Low	48.9	Very low	70 Å²	70	89.8 Å²	89.8	49%	0.49	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-45.3	173.8	-176.2	0	0	0	0	111.2	A6 D7 L8 A13 T14	A6-S10 VanDerWaalsContact O-CB 3.31Å; A6-S10 WeakPolarHBondContact O-CB 3.47Å; A6-S10 PolarHBondContact O-N 3.02Å; D7-S10 WeakPolarHBondContact O-CB 3.44Å; D7-S10 PolarHBondContact O-N 2.67Å; L8-S10 VanDerWaalsContact C-N 3.34Å; S10-A13 PolarHBondContact O-N 3.38Å; S10-T14 WeakPolarHBondContact O-CB 3.38Å; S10-T14 PolarHBondContact O-N 2.84Å; S10-T14 PolarHBondContact O-OG1 2.79Å
11	I	49.3	Very low	49.5	Very low	55 Å²	55	90.4 Å²	90.4	28%	0.282	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-44.5	177.3	-69.6	164.1	0	0	0	110.2	D7 L8 T14 Q15	D7-I11 WeakPolarHBondContact O-CB 3.43Å; D7-I11 VanDerWaalsContact O-CG1 3.23Å; D7-I11 WeakPolarHBondContact O-CG1 3.19Å; D7-I11 PolarHBondContact O-N 3.07Å; L8-I11 PolarHBondContact O-N 3.1Å; I11-T14 PolarHBondContact O-N 3.08Å; I11-Q15 WeakPolarHBondContact O-CB 3.45Å; I11-Q15 WeakPolarHBondContact O-CG 3.48Å; I11-Q15 PolarHBondContact O-N 3.35Å
12	L	52.2	Low	50.6	Low	87 Å²	87	84.7 Å²	84.7	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-63.8	-41.3	176.2	-174.8	65.3	0	0	0	111.9	L8 Q15 Q16	L8-L12 VanDerWaalsContact O-CB 3.3Å; L8-L12 WeakPolarHBondContact O-CB 3.34Å; L8-L12 PolarHBondContact O-N 2.91Å; L12-Q15 PolarHBondContact O-N 3.1Å; L12-Q16 WeakPolarHBondContact O-CB 3.5Å; L12-Q16 WeakPolarHBondContact O-CG 3.17Å; L12-Q16 PolarHBondContact O-N 3.43Å
13	A	60.9	Low	51.8	Low	50 Å²	50	82.8 Å²	82.8	41%	0.413	44%	0.444	S	S	.	.	H	α-helix	trans	-64.3	-41.3	175.6	0	0	0	0	0	111.7	Q9 S10 Q16 Q17	Q9-A13 WeakPolarHBondContact O-CB 3.45Å; Q9-A13 PolarHBondContact O-N 2.84Å; S10-A13 PolarHBondContact O-N 3.38Å; A13-Q16 PolarHBondContact O-N 3.3Å; A13-Q17 WeakPolarHBondContact O-CB 3.31Å; A13-Q17 PolarHBondContact O-N 3.26Å
14	T	58.8	Low	53	Low	68 Å²	68	84.7 Å²	84.7	42%	0.417	45%	0.453	S	S	.	.	H	α-helix	trans	-62.6	-46	173.7	-58	0	0	0	0	110.8	S10 I11 Q16 Q17 T18	S10-T14 WeakPolarHBondContact O-CB 3.38Å; S10-T14 PolarHBondContact O-N 2.84Å; S10-T14 PolarHBondContact O-OG1 2.79Å; I11-T14 PolarHBondContact O-N 3.08Å; T14-Q16 PolarHBondContact O-N 3.03Å; T14-Q17 PolarHBondContact O-N 2.98Å; T14-T18 PolarHBondContact O-N 3.03Å; T14-T18 PolarHBondContact O-OG1 2.98Å
15	Q	52.9	Low	53.9	Low	89 Å²	89	85.9 Å²	85.9	42%	0.416	46%	0.455	S	S	.	.	H	α-helix	trans	-59.3	-44.2	175.5	-76.2	-178.7	-18.8	0	0	111.9	I11 L12 T18 L19	I11-Q15 WeakPolarHBondContact O-CB 3.45Å; I11-Q15 WeakPolarHBondContact O-CG 3.48Å; I11-Q15 PolarHBondContact O-N 3.35Å; L12-Q15 PolarHBondContact O-N 3.1Å; Q15-T18 PolarHBondContact O-N 3.25Å; Q15-L19 WeakPolarHBondContact O-CB 3.47Å; Q15-L19 VanDerWaalsContact O-CG 3.29Å; Q15-L19 WeakPolarHBondContact O-CG 3.45Å; Q15-L19 PolarHBondContact O-N 3.47Å
16	Q	57.5	Low	54.5	Low	107 Å²	107	80.6 Å²	80.6	50%	0.5	43%	0.432	S	S	.	.	H	α-helix	trans	-63.3	-41.3	175.8	-75.7	177.9	-18.4	0	0	112.1	L12 A13 T14 L19 Q20	L12-Q16 WeakPolarHBondContact O-CB 3.5Å; L12-Q16 WeakPolarHBondContact O-CG 3.17Å; L12-Q16 PolarHBondContact O-N 3.43Å; A13-Q16 PolarHBondContact O-N 3.3Å; T14-Q16 PolarHBondContact O-N 3.03Å; Q16-L19 PolarHBondContact O-N 3.27Å; Q16-Q20 WeakPolarHBondContact O-CB 3.2Å; Q16-Q20 VanDerWaalsContact O-CG 3.31Å; Q16-Q20 WeakPolarHBondContact O-CG 3.46Å; Q16-Q20 PolarHBondContact O-N 2.82Å
17	Q	64.4	Low	54.9	Low	114 Å²	114	82.1 Å²	82.1	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-66.8	-41.9	177.3	-172.1	175.8	3.7	0	0	111.8	A13 T14 Q20 Q21	A13-Q17 WeakPolarHBondContact O-CB 3.31Å; A13-Q17 PolarHBondContact O-N 3.26Å; T14-Q17 PolarHBondContact O-N 2.98Å; Q17-Q20 PolarHBondContact O-N 3.39Å; Q17-Q21 WeakPolarHBondContact O-CG 3.21Å; Q17-Q21 PolarHBondContact O-N 3.38Å
18	T	55.9	Low	55.6	Low	76 Å²	76	84.8 Å²	84.8	47%	0.466	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-42.5	174.9	-56.7	0	0	0	0	111.2	T14 Q15 Q21 F22	T14-T18 PolarHBondContact O-N 3.03Å; T14-T18 PolarHBondContact O-OG1 2.98Å; Q15-T18 PolarHBondContact O-N 3.25Å; T18-Q21 PolarHBondContact O-N 3.07Å; T18-F22 WeakPolarHBondContact O-CB 3.4Å; T18-F22 PolarHBondContact O-N 2.98Å
19	L	53.8	Low	56	Low	53 Å²	53	82 Å²	82	28%	0.277	42%	0.423	S	S	.	.	H	α-helix	trans	-63.9	-39.6	174.9	-74.3	170.1	0	0	0	112.1	Q15 Q16 F22 A23 L83	Q15-L19 WeakPolarHBondContact O-CB 3.47Å; Q15-L19 VanDerWaalsContact O-CG 3.29Å; Q15-L19 WeakPolarHBondContact O-CG 3.45Å; Q15-L19 PolarHBondContact O-N 3.47Å; Q16-L19 PolarHBondContact O-N 3.27Å; L19-F22 PolarHBondContact O-N 3.18Å; L19-A23 WeakPolarHBondContact O-CB 3.4Å; L19-A23 PolarHBondContact O-N 3.03Å; L19-L83 HydrophobicContact CB-CD1 4.25Å; L19-L83 HydrophobicContact CD1-CD1 4.27Å; L19-L83 HydrophobicContact CD2-CD1 3.96Å; L19-L83 HydrophobicContact CG-CD1 4.39Å
20	Q	61.7	Low	56.1	Low	130 Å²	130	77.7 Å²	77.7	61%	0.607	41%	0.408	S	S	*	.	H	α-helix	trans	-65.9	-42.7	175	-77.1	176.9	-6.9	0	0	112.4	Q16 Q17 F22 A23 Q24	Q16-Q20 WeakPolarHBondContact O-CB 3.2Å; Q16-Q20 VanDerWaalsContact O-CG 3.31Å; Q16-Q20 WeakPolarHBondContact O-CG 3.46Å; Q16-Q20 PolarHBondContact O-N 2.82Å; Q17-Q20 PolarHBondContact O-N 3.39Å; Q20-F22 VanDerWaalsContact C-N 3.33Å; Q20-A23 PolarHBondContact O-N 3.49Å; Q20-Q24 WeakPolarHBondContact O-CG 3.44Å; Q20-Q24 PolarHBondContact O-N 3.18Å
21	Q	61.5	Low	56.2	Low	104 Å²	104	78.7 Å²	78.7	49%	0.486	40%	0.404	S	S	.	.	H	α-helix	trans	-62.4	-41.6	174.3	-76.5	178.4	-16	0	0	111.4	Q17 T18 Q24 L25	Q17-Q21 WeakPolarHBondContact O-CG 3.21Å; Q17-Q21 PolarHBondContact O-N 3.38Å; T18-Q21 PolarHBondContact O-N 3.07Å; Q21-Q24 PolarHBondContact O-N 3Å; Q21-L25 WeakPolarHBondContact O-CB 3.38Å; Q21-L25 PolarHBondContact O-N 3.5Å
22	F	52.2	Low	56.3	Low	50 Å²	50	78.9 Å²	78.9	22%	0.219	41%	0.408	C	S	.	.	H	α-helix	trans	-62.5	-42.7	175.5	-175	-100.2	0	0	0	112	T18 L19 Q20 L25 Q26 L56 L104	T18-F22 WeakPolarHBondContact O-CB 3.4Å; T18-F22 PolarHBondContact O-N 2.98Å; L19-F22 PolarHBondContact O-N 3.18Å; Q20-F22 VanDerWaalsContact C-N 3.33Å; F22-L25 PolarHBondContact O-N 3.25Å; F22-Q26 HydrophobicContact CD1-CG 4.16Å; F22-Q26 HydrophobicContact CE1-CG 3.87Å; F22-Q26 HydrophobicContact CZ-CG 4.22Å; F22-Q26 VanDerWaalsContact O-CG 3.28Å; F22-Q26 WeakPolarHBondContact O-CG 3.46Å; F22-Q26 PolarHBondContact O-N 3.03Å; F22-L56 HydrophobicContact CD2-CD2 3.77Å; F22-L56 HydrophobicContact CE2-CD2 3.72Å; F22-L104 HydrophobicContact CE2-CD1 4.47Å; F22-L104 HydrophobicContact CE2-CD2 4.41Å; F22-L104 HydrophobicContact CZ-CD1 4.16Å
23	A	55.2	Low	56.1	Low	46 Å²	46	75.8 Å²	75.8	38%	0.38	39%	0.392	S	S	.	.	H	α-helix	trans	-62.8	-41.8	175.4	0	0	0	0	0	112.4	L19 Q20 Q26 E27	L19-A23 WeakPolarHBondContact O-CB 3.4Å; L19-A23 PolarHBondContact O-N 3.03Å; Q20-A23 PolarHBondContact O-N 3.49Å; A23-Q26 WeakPolarHBondContact O-CB 3.1Å; A23-Q26 PolarHBondContact O-N 3.18Å; A23-E27 PolarHBondContact O-N 2.92Å
24	Q	62	Low	55.7	Low	122 Å²	122	78.8 Å²	78.8	57%	0.57	40%	0.397	S	S	*	.	H	α-helix	trans	-63.6	-40	174.4	-75.9	178.2	-14	0	0	112.3	Q20 Q21 E27 Q28	Q20-Q24 WeakPolarHBondContact O-CG 3.44Å; Q20-Q24 PolarHBondContact O-N 3.18Å; Q21-Q24 PolarHBondContact O-N 3Å; Q24-E27 PolarHBondContact O-N 3.13Å; Q24-Q28 WeakPolarHBondContact O-CG 3.31Å; Q24-Q28 PolarHBondContact O-N 3.41Å
25	L	58.5	Low	55.3	Low	79 Å²	79	85.4 Å²	85.4	41%	0.414	42%	0.415	S	S	.	.	H	α-helix	trans	-64.4	-40.4	175.6	-112.6	134	0	0	0	111.8	Q21 F22 E27 F29 T52	Q21-L25 WeakPolarHBondContact O-CB 3.38Å; Q21-L25 PolarHBondContact O-N 3.5Å; F22-L25 PolarHBondContact O-N 3.25Å; L25-E27 VanDerWaalsContact C-N 3.34Å; L25-F29 VanDerWaalsContact O-CB 3.23Å; L25-F29 WeakPolarHBondContact O-CB 3.47Å; L25-F29 PolarHBondContact O-N 3.47Å; L25-T52 HydrophobicContact CD2-CG2 4.2Å
26	Q	51.9	Low	55	Low	53 Å²	53	85 Å²	85	25%	0.248	42%	0.415	C	S	.	.	H	α-helix	trans	-61.6	-42	173.6	-70.8	-109.7	-42.6	0	0	111.5	F22 A23 F29 A30	F22-Q26 HydrophobicContact CD1-CG 4.16Å; F22-Q26 HydrophobicContact CE1-CG 3.87Å; F22-Q26 HydrophobicContact CZ-CG 4.22Å; F22-Q26 VanDerWaalsContact O-CG 3.28Å; F22-Q26 WeakPolarHBondContact O-CG 3.46Å; F22-Q26 PolarHBondContact O-N 3.03Å; A23-Q26 WeakPolarHBondContact O-CB 3.1Å; A23-Q26 PolarHBondContact O-N 3.18Å; Q26-F29 PolarHBondContact O-N 2.75Å; Q26-A30 WeakPolarHBondContact O-CB 3.27Å; Q26-A30 PolarHBondContact O-N 2.74Å
27	E	57.4	Low	54.3	Low	93 Å²	93	85.5 Å²	85.5	44%	0.435	43%	0.43	S	S	.	.	H	α-helix	trans	-66.6	-47.4	178.4	-165.4	169.8	-158.4	0	0	111.6	A23 Q24 L25 F29 A30 E31	A23-E27 PolarHBondContact O-N 2.92Å; Q24-E27 PolarHBondContact O-N 3.13Å; L25-E27 VanDerWaalsContact C-N 3.34Å; E27-F29 VanDerWaalsContact C-N 3.29Å; E27-F29 PolarHBondContact O-N 3.22Å; E27-A30 PolarHBondContact O-N 3.38Å; E27-E31 WeakPolarHBondContact O-CG 3.44Å; E27-E31 PolarHBondContact O-N 2.93Å
28	Q	58.3	Low	53.5	Low	126 Å²	126	83 Å²	83	59%	0.589	42%	0.42	S	S	*	.	H	α-helix	trans	-59.7	-38.9	174.2	-73.9	-178	-16.5	0	0	112.3	Q24 T32	Q24-Q28 WeakPolarHBondContact O-CG 3.31Å; Q24-Q28 PolarHBondContact O-N 3.41Å; Q28-T32 WeakPolarHBondContact O-CB 3.47Å; Q28-T32 PolarHBondContact O-N 2.77Å; Q28-T32 PolarHBondContact O-OG1 2.95Å
29	F	49.8	Very low	53	Low	35 Å²	35	82.6 Å²	82.6	15%	0.154	42%	0.421	C	S	.	.	H	α-helix	trans	-67.6	-43.9	176.6	-169.9	-105.2	0	0	0	111.4	L25 Q26 E27 E31 T32 L33 M46 V47 L100	L25-F29 VanDerWaalsContact O-CB 3.23Å; L25-F29 WeakPolarHBondContact O-CB 3.47Å; L25-F29 PolarHBondContact O-N 3.47Å; Q26-F29 PolarHBondContact O-N 2.75Å; E27-F29 VanDerWaalsContact C-N 3.29Å; E27-F29 PolarHBondContact O-N 3.22Å; F29-E31 PolarHBondContact O-N 2.89Å; F29-T32 WeakPolarHBondContact O-CB 3.38Å; F29-T32 PolarHBondContact O-N 2.77Å; F29-L33 HydrophobicContact CD1-CD1 3.94Å; F29-L33 HydrophobicContact CD1-CG 4.21Å; F29-L33 HydrophobicContact CE1-CD1 3.54Å; F29-L33 HydrophobicContact CE1-CD2 4.21Å; F29-L33 HydrophobicContact CE1-CG 3.91Å; F29-L33 HydrophobicContact CZ-CD1 4.24Å; F29-L33 HydrophobicContact CZ-CD2 4.06Å; F29-L33 HydrophobicContact CZ-CG 4.21Å; F29-L33 WeakPolarHBondContact O-CG 3.47Å; F29-L33 PolarHBondContact O-N 3.48Å; F29-M46 HydrophobicContact CE2-CE 3.88Å; F29-M46 HydrophobicContact CZ-CE 4.09Å; F29-V47 HydrophobicContact CE1-CG2 3.89Å; F29-V47 HydrophobicContact CE2-CG2 4.45Å; F29-V47 HydrophobicContact CZ-CG2 3.44Å; F29-V47 VanDerWaalsContact CZ-CG2 3.44Å; F29-L100 HydrophobicContact CD1-CD1 3.95Å; F29-L100 HydrophobicContact CE1-CD1 3.91Å; F29-L100 HydrophobicContact CE1-CD2 4.19Å
30	A	51.1	Low	52.3	Low	25 Å²	25	86.1 Å²	86.1	21%	0.207	44%	0.436	C	S	.	.	H	α-helix	trans	-61.6	-42.7	175.7	0	0	0	0	0	112.3	Q26 E27 T32 L33 Q34 L90	Q26-A30 WeakPolarHBondContact O-CB 3.27Å; Q26-A30 PolarHBondContact O-N 2.74Å; E27-A30 PolarHBondContact O-N 3.38Å; A30-T32 VanDerWaalsContact C-N 3.32Å; A30-T32 PolarHBondContact O-N 2.95Å; A30-L33 PolarHBondContact O-N 2.94Å; A30-Q34 PolarHBondContact O-N 2.88Å; A30-L90 HydrophobicContact CB-CD1 3.93Å
31	E	56	Low	51.2	Low	90 Å²	90	83.2 Å²	83.2	42%	0.421	43%	0.434	S	S	.	.	H	α-helix	trans	-61.5	-40.4	173.1	-73.6	-175.2	171.5	0	0	111.8	E27 F29 Q34 R35	E27-E31 WeakPolarHBondContact O-CG 3.44Å; E27-E31 PolarHBondContact O-N 2.93Å; F29-E31 PolarHBondContact O-N 2.89Å; E31-Q34 PolarHBondContact O-N 3.04Å; E31-R35 WeakPolarHBondContact O-CG 3.37Å; E31-R35 PolarHBondContact O-N 3.21Å
32	T	50.4	Low	50.5	Low	60 Å²	60	80.8 Å²	80.8	37%	0.368	43%	0.429	S	S	.	.	H	α-helix	trans	-65.3	-41.2	177.3	-58.7	0	0	0	0	111.3	Q28 F29 A30 R35 L36	Q28-T32 WeakPolarHBondContact O-CB 3.47Å; Q28-T32 PolarHBondContact O-N 2.77Å; Q28-T32 PolarHBondContact O-OG1 2.95Å; F29-T32 WeakPolarHBondContact O-CB 3.38Å; F29-T32 PolarHBondContact O-N 2.77Å; A30-T32 VanDerWaalsContact C-N 3.32Å; A30-T32 PolarHBondContact O-N 2.95Å; T32-R35 PolarHBondContact O-N 2.54Å; T32-L36 HydrophobicContact CG2-CD1 3.68Å; T32-L36 HydrophobicContact CG2-CG 4.41Å; T32-L36 VanDerWaalsContact O-CG 3.29Å; T32-L36 WeakPolarHBondContact O-CG 3.3Å; T32-L36 PolarHBondContact O-N 3.47Å; T32-L36 VanDerWaalsContact O-N 3.08Å
33	L	47.7	Very low	49.9	Very low	22 Å²	22	79.2 Å²	79.2	12%	0.115	42%	0.423	C	S	.	.	H	α-helix	trans	-64.6	-41.9	175.1	-69.6	-176.3	0	0	0	112.5	F29 A30 R35 L36 S37 T43 M46	F29-L33 HydrophobicContact CD1-CD1 3.94Å; F29-L33 HydrophobicContact CD1-CG 4.21Å; F29-L33 HydrophobicContact CE1-CD1 3.54Å; F29-L33 HydrophobicContact CE1-CD2 4.21Å; F29-L33 HydrophobicContact CE1-CG 3.91Å; F29-L33 HydrophobicContact CZ-CD1 4.24Å; F29-L33 HydrophobicContact CZ-CD2 4.06Å; F29-L33 HydrophobicContact CZ-CG 4.21Å; F29-L33 WeakPolarHBondContact O-CG 3.47Å; F29-L33 PolarHBondContact O-N 3.48Å; A30-L33 PolarHBondContact O-N 2.94Å; L33-R35 VanDerWaalsContact C-N 3.31Å; L33-R35 PolarHBondContact O-N 3.1Å; L33-L36 PolarHBondContact O-N 3.38Å; L33-S37 PolarHBondContact O-N 3.3Å; L33-T43 HydrophobicContact CD1-CG2 3.8Å; L33-T43 HydrophobicContact CD2-CG2 3.56Å; L33-T43 HydrophobicContact CG-CG2 4.35Å; L33-M46 HydrophobicContact CD2-CE 3.75Å
34	Q	52.3	Low	49.3	Very low	112 Å²	112	80.8 Å²	80.8	52%	0.523	42%	0.422	S	S	.	.	H	α-helix	trans	-61.4	-39.2	174.4	-78.8	-174.9	-17.6	0	0	112	A30 E31	A30-Q34 PolarHBondContact O-N 2.88Å; E31-Q34 PolarHBondContact O-N 3.04Å
35	R	50.7	Low	48.7	Very low	207 Å²	207	82.8 Å²	82.8	78%	0.781	43%	0.429	S	S	*	.	H	α-helix	trans	-69.2	-31.5	177.8	-76.5	180	-177.8	177.1	5.4	113.8	E31 T32 L33	E31-R35 WeakPolarHBondContact O-CG 3.37Å; E31-R35 PolarHBondContact O-N 3.21Å; T32-R35 PolarHBondContact O-N 2.54Å; L33-R35 VanDerWaalsContact C-N 3.31Å; L33-R35 PolarHBondContact O-N 3.1Å
36	L	46.7	Very low	48	Very low	82 Å²	82	81.4 Å²	81.4	43%	0.429	42%	0.421	S	S	.	.	H	α-helix	trans	-93.1	-6.3	-171.8	-66.1	171	0	0	0	114.3	T32 L33 L38 M46	T32-L36 HydrophobicContact CG2-CD1 3.68Å; T32-L36 HydrophobicContact CG2-CG 4.41Å; T32-L36 VanDerWaalsContact O-CG 3.29Å; T32-L36 WeakPolarHBondContact O-CG 3.3Å; T32-L36 PolarHBondContact O-N 3.47Å; T32-L36 VanDerWaalsContact O-N 3.08Å; L33-L36 PolarHBondContact O-N 3.38Å; L36-L38 HydrophobicContact CB-CD1 3.68Å; L36-L38 HydrophobicContact CB-CD2 4.43Å; L36-L38 HydrophobicContact CB-CG 3.62Å; L36-L38 HydrophobicContact CD1-CD1 3.91Å; L36-L38 HydrophobicContact CG-CD1 4.44Å; L36-L38 PolarHBondContact O-N 3.44Å; L36-M46 HydrophobicContact CD1-CE 4.46Å; L36-M46 HydrophobicContact CD1-SD 4.41Å
37	S	42.7	Very low	47.6	Very low	117 Å²	117	79.8 Å²	79.8	82%	0.818	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	34.5	178.7	63.6	0	0	0	0	114	L33	L33-S37 PolarHBondContact O-N 3.3Å
38	L	47	Very low	47	Very low	61 Å²	61	83.8 Å²	83.8	32%	0.319	43%	0.426	S	S	.	.			trans	-78.9	141.8	-169.7	-69.1	170.6	0	0	0	111.6	L36 M46	L36-L38 HydrophobicContact CB-CD1 3.68Å; L36-L38 HydrophobicContact CB-CD2 4.43Å; L36-L38 HydrophobicContact CB-CG 3.62Å; L36-L38 HydrophobicContact CD1-CD1 3.91Å; L36-L38 HydrophobicContact CG-CD1 4.44Å; L36-L38 PolarHBondContact O-N 3.44Å; L38-M46 HydrophobicContact CD1-CE 4.19Å; L38-M46 HydrophobicContact CD1-SD 4.04Å
39	S	47.1	Very low	46.5	Very low	68 Å²	68	81.7 Å²	81.7	48%	0.476	43%	0.426	S	S	.	.			trans	-62.1	154.7	169	76.1	0	0	0	0	111.5	A41 S42 T43	S39-A41 PolarHBondContact O-N 2.86Å; S39-S42 WeakPolarHBondContact O-CB 3.22Å; S39-S42 PolarHBondContact O-N 3.25Å; S39-S42 PolarHBondContact OG-N 2.7Å; S39-S42 PolarHBondContact OG-OG 3.4Å; S39-S42 VanDerWaalsContact OG-OG 3.08Å; S39-T43 PolarHBondContact O-N 2.95Å; S39-T43 PolarHBondContact O-OG1 2.82Å
40	Q	37.5	Very low	46.5	Very low	127 Å²	127	83.6 Å²	83.6	59%	0.593	44%	0.435	S	S	*	.	H	α-helix	trans	-50.9	-41.3	177.4	-166.4	177.6	2.7	0	0	112.5	T43 E44	Q40-T43 WeakPolarHBondContact O-CB 3.23Å; Q40-T43 PolarHBondContact O-N 3.42Å; Q40-E44 PolarHBondContact O-N 2.95Å
41	A	39.7	Very low	46.3	Very low	69 Å²	69	86.5 Å²	86.5	57%	0.57	45%	0.452	S	S	*	.	H	α-helix	trans	-69.2	-35.6	178.1	0	0	0	0	0	113.7	S39 T43 K45	S39-A41 PolarHBondContact O-N 2.86Å; A41-T43 VanDerWaalsContact C-N 3.31Å; A41-K45 PolarHBondContact O-N 3.45Å
42	S	46.6	Very low	45.7	Very low	53 Å²	53	85.1 Å²	85.1	37%	0.371	45%	0.449	S	S	.	.	H	α-helix	trans	-68.6	-34.8	173.9	-63.1	0	0	0	0	111.4	S39 K45 M46	S39-S42 WeakPolarHBondContact O-CB 3.22Å; S39-S42 PolarHBondContact O-N 3.25Å; S39-S42 PolarHBondContact OG-N 2.7Å; S39-S42 PolarHBondContact OG-OG 3.4Å; S39-S42 VanDerWaalsContact OG-OG 3.08Å; S42-K45 PolarHBondContact O-N 2.86Å; S42-M46 WeakPolarHBondContact O-CB 3.38Å; S42-M46 PolarHBondContact O-N 2.88Å; S42-M46 VanDerWaalsContact O-N 3.1Å
43	T	39.5	Very low	45.4	Very low	16 Å²	16	84.4 Å²	84.4	10%	0.098	44%	0.443	C	S	.	.	H	α-helix	trans	-67.2	-47.7	178.4	-50.4	0	0	0	0	111.2	L33 S39 Q40 A41 K45 M46 V47	L33-T43 HydrophobicContact CD1-CG2 3.8Å; L33-T43 HydrophobicContact CD2-CG2 3.56Å; L33-T43 HydrophobicContact CG-CG2 4.35Å; S39-T43 PolarHBondContact O-N 2.95Å; S39-T43 PolarHBondContact O-OG1 2.82Å; Q40-T43 WeakPolarHBondContact O-CB 3.23Å; Q40-T43 PolarHBondContact O-N 3.42Å; A41-T43 VanDerWaalsContact C-N 3.31Å; T43-K45 VanDerWaalsContact C-N 3.31Å; T43-K45 PolarHBondContact O-N 2.83Å; T43-M46 PolarHBondContact O-N 2.85Å; T43-V47 VanDerWaalsContact O-CG2 3.28Å; T43-V47 WeakPolarHBondContact O-CG2 3.37Å; T43-V47 PolarHBondContact O-N 2.81Å
44	E	42.9	Very low	45.2	Very low	80 Å²	80	87.5 Å²	87.5	37%	0.374	46%	0.46	S	S	.	.	H	α-helix	trans	-60.2	-39.1	174.9	-74	-178.8	-179.9	0	0	112.8	Q40 R48	Q40-E44 PolarHBondContact O-N 2.95Å; E44-R48 WeakPolarHBondContact O-CB 3.47Å; E44-R48 VanDerWaalsContact O-CG 3.22Å; E44-R48 WeakPolarHBondContact O-CG 3.44Å; E44-R48 PolarHBondContact O-N 2.92Å
45	K	48.9	Very low	44.7	Very low	163 Å²	163	86.3 Å²	86.3	71%	0.709	46%	0.46	S	S	*	.	H	α-helix	trans	-67.5	-38.3	179.1	-164	175.5	-177.9	-179.3	0	112.1	A41 S42 T43 S49	A41-K45 PolarHBondContact O-N 3.45Å; S42-K45 PolarHBondContact O-N 2.86Å; T43-K45 VanDerWaalsContact C-N 3.31Å; T43-K45 PolarHBondContact O-N 2.83Å; K45-S49 PolarHBondContact O-N 3.44Å; K45-S49 PolarHBondContact O-OG 3.25Å
46	M	44.8	Very low	44.2	Very low	50 Å²	50	78.8 Å²	78.8	25%	0.246	44%	0.435	C	S	.	.	H	α-helix	trans	-71.9	-40.7	178.5	-168.1	173.1	80.7	0	0	112.2	F29 L33 L36 L38 S42 T43 R48 S49 H50	F29-M46 HydrophobicContact CE2-CE 3.88Å; F29-M46 HydrophobicContact CZ-CE 4.09Å; L33-M46 HydrophobicContact CD2-CE 3.75Å; L36-M46 HydrophobicContact CD1-CE 4.46Å; L36-M46 HydrophobicContact CD1-SD 4.41Å; L38-M46 HydrophobicContact CD1-CE 4.19Å; L38-M46 HydrophobicContact CD1-SD 4.04Å; S42-M46 WeakPolarHBondContact O-CB 3.38Å; S42-M46 PolarHBondContact O-N 2.88Å; S42-M46 VanDerWaalsContact O-N 3.1Å; T43-M46 PolarHBondContact O-N 2.85Å; M46-R48 VanDerWaalsContact C-N 3.35Å; M46-S49 PolarHBondContact O-N 2.9Å; M46-S49 PolarHBondContact O-OG 2.78Å; M46-S49 VanDerWaalsContact O-OG 3.09Å; M46-H50 PolarHBondContact O-N 3.45Å
47	V	42.8	Very low	43.8	Very low	19 Å²	19	76.7 Å²	76.7	12%	0.115	43%	0.43	C	S	.	.	H	α-helix	trans	-61.5	-43	173.3	172.2	0	0	0	0	110.7	F29 T43 S49 H50 L53 L100	F29-V47 HydrophobicContact CE1-CG2 3.89Å; F29-V47 HydrophobicContact CE2-CG2 4.45Å; F29-V47 HydrophobicContact CZ-CG2 3.44Å; F29-V47 VanDerWaalsContact CZ-CG2 3.44Å; T43-V47 VanDerWaalsContact O-CG2 3.28Å; T43-V47 WeakPolarHBondContact O-CG2 3.37Å; T43-V47 PolarHBondContact O-N 2.81Å; V47-S49 PolarHBondContact O-N 2.89Å; V47-H50 PolarHBondContact O-N 2.81Å; V47-L53 HydrophobicContact CG1-CD1 3.84Å; V47-L53 WeakPolarHBondContact O-CD1 3.42Å; V47-L100 HydrophobicContact CG1-CD2 4.11Å; V47-L100 HydrophobicContact CG2-CD2 4.12Å
48	R	44.8	Very low	43.7	Very low	177 Å²	177	73.1 Å²	73.1	67%	0.668	41%	0.407	S	S	*	.	H	α-helix	trans	-63.9	-21.7	178.4	-76.6	175.8	-172.7	-167.9	6.5	114.3	E44 M46 R107	E44-R48 WeakPolarHBondContact O-CB 3.47Å; E44-R48 VanDerWaalsContact O-CG 3.22Å; E44-R48 WeakPolarHBondContact O-CG 3.44Å; E44-R48 PolarHBondContact O-N 2.92Å; M46-R48 VanDerWaalsContact C-N 3.35Å; R48-R107 PolarHBondContact O-NH2 2.87Å
49	S	47.2	Very low	43.3	Very low	83 Å²	83	73.3 Å²	73.3	58%	0.58	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	2.8	-175.9	60.9	0	0	0	0	114.6	K45 M46 V47 P51	K45-S49 PolarHBondContact O-N 3.44Å; K45-S49 PolarHBondContact O-OG 3.25Å; M46-S49 PolarHBondContact O-N 2.9Å; M46-S49 PolarHBondContact O-OG 2.78Å; M46-S49 VanDerWaalsContact O-OG 3.09Å; V47-S49 PolarHBondContact O-N 2.89Å; S49-P51 WeakPolarHBondContact O-CD 3.46Å
50	H	49.6	Very low	42.7	Very low	74 Å²	74	72.7 Å²	72.7	34%	0.343	41%	0.405	S	S	.	.			trans	-82	116.6	-172	-142.7	-52	0	0	0	111.7	M46 V47 T52 L53	M46-H50 PolarHBondContact O-N 3.45Å; V47-H50 PolarHBondContact O-N 2.81Å; H50-T52 PolarHBondContact CE1-OG1 3.36Å; H50-T52 VanDerWaalsContact CE1-OG1 3.25Å; H50-T52 PolarHBondContact ND1-OG1 2.87Å; H50-T52 PolarHBondContact O-N 2.86Å; H50-T52 VanDerWaalsContact O-N 3.08Å; H50-L53 PolarHBondContact O-N 2.94Å; H50-L53 VanDerWaalsContact O-N 3.11Å
51	P	46.6	Very low	42.7	Very low	87 Å²	87	70.9 Å²	70.9	57%	0.565	41%	0.406	S	S	*	.	H	α-helix	trans	-63	-20.3	-175.5	21	-31.9	0	0	0	114.3	S49 L53 D54 T55	S49-P51 WeakPolarHBondContact O-CD 3.46Å; P51-L53 VanDerWaalsContact C-N 3.33Å; P51-L53 PolarHBondContact O-N 2.85Å; P51-D54 PolarHBondContact O-N 3.31Å; P51-T55 PolarHBondContact O-N 3.36Å; P51-T55 VanDerWaalsContact O-N 3.12Å; P51-T55 PolarHBondContact O-OG1 3.14Å
52	T	44.7	Very low	42.5	Very low	61 Å²	61	75.4 Å²	75.4	37%	0.374	42%	0.415	S	S	.	.	H	α-helix	trans	-66.8	-31.8	176.9	-19.8	0	0	0	0	112.6	L25 H50 T55 L56	L25-T52 HydrophobicContact CD2-CG2 4.2Å; H50-T52 PolarHBondContact CE1-OG1 3.36Å; H50-T52 VanDerWaalsContact CE1-OG1 3.25Å; H50-T52 PolarHBondContact ND1-OG1 2.87Å; H50-T52 PolarHBondContact O-N 2.86Å; H50-T52 VanDerWaalsContact O-N 3.08Å; T52-T55 PolarHBondContact O-N 2.86Å; T52-L56 WeakPolarHBondContact O-CB 3.22Å; T52-L56 PolarHBondContact O-N 2.79Å
53	L	43.4	Very low	41.9	Very low	44 Å²	44	78.7 Å²	78.7	23%	0.23	42%	0.423	C	S	.	.	H	α-helix	trans	-73.2	-33.6	176.7	-77.2	166.7	0	0	0	111.9	V47 H50 P51 T55 L56 A57 L104	V47-L53 HydrophobicContact CG1-CD1 3.84Å; V47-L53 WeakPolarHBondContact O-CD1 3.42Å; H50-L53 PolarHBondContact O-N 2.94Å; H50-L53 VanDerWaalsContact O-N 3.11Å; P51-L53 VanDerWaalsContact C-N 3.33Å; P51-L53 PolarHBondContact O-N 2.85Å; L53-T55 VanDerWaalsContact C-N 3.33Å; L53-L56 PolarHBondContact O-N 2.94Å; L53-A57 VanDerWaalsContact O-CB 3.27Å; L53-A57 WeakPolarHBondContact O-CB 3.34Å; L53-A57 PolarHBondContact O-N 2.97Å; L53-L104 HydrophobicContact CD2-CD1 4.26Å; L53-L104 HydrophobicContact CD2-CG 4.32Å
54	D	43.1	Very low	41.6	Very low	88 Å²	88	82 Å²	82	47%	0.471	44%	0.44	S	S	.	.	H	α-helix	trans	-69.9	-34.8	174	-61.7	-25.2	0	0	0	110.7	P51 A58 R107	P51-D54 PolarHBondContact O-N 3.31Å; D54-A58 VanDerWaalsContact O-CB 3.26Å; D54-A58 WeakPolarHBondContact O-CB 2.98Å; D54-A58 PolarHBondContact O-N 3.32Å; D54-R107 IonicContact OD1-CZ 3.95Å; D54-R107 IonicContact OD1-NH1 2.71Å; D54-R107 PolarHBondContact OD1-NH1 3.02Å
55	T	43.2	Very low	41.4	Very low	86 Å²	86	82.9 Å²	82.9	53%	0.528	44%	0.441	S	S	.	.	H	α-helix	trans	-67.6	-39.6	174.1	-45.6	0	0	0	0	111.6	P51 T52 L53 S59	P51-T55 PolarHBondContact O-N 3.36Å; P51-T55 VanDerWaalsContact O-N 3.12Å; P51-T55 PolarHBondContact O-OG1 3.14Å; T52-T55 PolarHBondContact O-N 2.86Å; L53-T55 VanDerWaalsContact C-N 3.33Å; T55-S59 WeakPolarHBondContact O-CB 3.26Å; T55-S59 PolarHBondContact O-N 3.38Å; T55-S59 PolarHBondContact O-OG 2.95Å
56	L	39.3	Very low	40.6	Very low	50 Å²	50	78.2 Å²	78.2	26%	0.262	44%	0.438	S	S	.	.	H	α-helix	trans	-70.4	-42.6	177.3	-148.4	93.3	0	0	0	111.7	F22 T52 L53 S59 I60 L104	F22-L56 HydrophobicContact CD2-CD2 3.77Å; F22-L56 HydrophobicContact CE2-CD2 3.72Å; T52-L56 WeakPolarHBondContact O-CB 3.22Å; T52-L56 PolarHBondContact O-N 2.79Å; L53-L56 PolarHBondContact O-N 2.94Å; L56-S59 PolarHBondContact O-N 3.35Å; L56-I60 HydrophobicContact CD2-CD1 4.26Å; L56-I60 HydrophobicContact CG-CD1 4.35Å; L56-I60 WeakPolarHBondContact O-CD1 3.36Å; L56-I60 VanDerWaalsContact O-CG1 3.26Å; L56-I60 WeakPolarHBondContact O-CG1 3.4Å; L56-I60 PolarHBondContact O-N 2.81Å; L56-L104 HydrophobicContact CD2-CD2 4.48Å
57	A	39.4	Very low	40	Very low	38 Å²	38	81 Å²	81	31%	0.314	46%	0.458	S	S	.	.	H	α-helix	trans	-63.8	-40.8	175.5	0	0	0	0	0	111.6	L53 I60 S61	L53-A57 VanDerWaalsContact O-CB 3.27Å; L53-A57 WeakPolarHBondContact O-CB 3.34Å; L53-A57 PolarHBondContact O-N 2.97Å; A57-I60 PolarHBondContact O-N 2.81Å; A57-S61 VanDerWaalsContact O-CB 3.29Å; A57-S61 WeakPolarHBondContact O-CB 3.19Å; A57-S61 PolarHBondContact O-N 2.9Å; A57-S61 PolarHBondContact O-OG 3.37Å
58	A	40.3	Very low	39.5	Very low	42 Å²	42	84.1 Å²	84.1	35%	0.347	47%	0.474	S	S	.	.	H	α-helix	trans	-60.7	-48.2	173.5	0	0	0	0	0	111.6	D54 I60 S61 E62	D54-A58 VanDerWaalsContact O-CB 3.26Å; D54-A58 WeakPolarHBondContact O-CB 2.98Å; D54-A58 PolarHBondContact O-N 3.32Å; A58-I60 VanDerWaalsContact C-N 3.25Å; A58-I60 PolarHBondContact O-N 3.17Å; A58-S61 WeakPolarHBondContact CA-OG 3.49Å; A58-S61 PolarHBondContact O-N 3.16Å; A58-S61 VanDerWaalsContact O-N 3.13Å; A58-S61 PolarHBondContact O-OG 3.47Å; A58-E62 PolarHBondContact O-N 2.82Å
59	S	38.4	Very low	38.9	Very low	65 Å²	65	85.2 Å²	85.2	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-30.6	179.4	-56.8	0	0	0	0	113.2	T55 L56 F63	T55-S59 WeakPolarHBondContact O-CB 3.26Å; T55-S59 PolarHBondContact O-N 3.38Å; T55-S59 PolarHBondContact O-OG 2.95Å; L56-S59 PolarHBondContact O-N 3.35Å; S59-F63 WeakPolarHBondContact O-CD2 3.48Å
60	I	34.6	Very low	38.2	Very low	55 Å²	55	85 Å²	85	28%	0.282	49%	0.49	S	S	.	.	H	α-helix	trans	-84.8	-29.9	177.3	-65.9	166.6	0	0	0	111.5	L56 A57 A58 F63 Y65 M108	L56-I60 HydrophobicContact CD2-CD1 4.26Å; L56-I60 HydrophobicContact CG-CD1 4.35Å; L56-I60 WeakPolarHBondContact O-CD1 3.36Å; L56-I60 VanDerWaalsContact O-CG1 3.26Å; L56-I60 WeakPolarHBondContact O-CG1 3.4Å; L56-I60 PolarHBondContact O-N 2.81Å; A57-I60 PolarHBondContact O-N 2.81Å; A58-I60 VanDerWaalsContact C-N 3.25Å; A58-I60 PolarHBondContact O-N 3.17Å; I60-F63 PolarHBondContact O-N 3.44Å; I60-Y65 WeakPolarHBondContact CG2-OH 3.44Å; I60-M108 HydrophobicContact CG2-CE 4.05Å
61	S	36.2	Very low	37.2	Very low	88 Å²	88	88.8 Å²	88.8	62%	0.615	51%	0.506	S	S	*	.	H	α-helix	trans	-76.6	-20.8	177.6	68.9	0	0	0	0	114.2	A57 A58 F63	A57-S61 VanDerWaalsContact O-CB 3.29Å; A57-S61 WeakPolarHBondContact O-CB 3.19Å; A57-S61 PolarHBondContact O-N 2.9Å; A57-S61 PolarHBondContact O-OG 3.37Å; A58-S61 WeakPolarHBondContact CA-OG 3.49Å; A58-S61 PolarHBondContact O-N 3.16Å; A58-S61 VanDerWaalsContact O-N 3.13Å; A58-S61 PolarHBondContact O-OG 3.47Å; S61-F63 PolarHBondContact O-N 3.02Å
62	E	36	Very low	36.7	Very low	165 Å²	165	87.3 Å²	87.3	77%	0.771	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-4.6	173.6	-76.6	179.9	173.3	0	0	113.1	A58	A58-E62 PolarHBondContact O-N 2.82Å
63	F	33.8	Very low	36.1	Very low	122 Å²	122	90 Å²	90	54%	0.535	51%	0.509	S	S	.	.	S	Bend	trans	-84.2	115.4	173.4	-89.9	-92.1	0	0	0	111.3	S59 I60 S61 Y65	S59-F63 WeakPolarHBondContact O-CD2 3.48Å; I60-F63 PolarHBondContact O-N 3.44Å; S61-F63 PolarHBondContact O-N 3.02Å; F63-Y65 HydrophobicContact CB-CE2 4.29Å; F63-Y65 WeakPolarHBondContact O-CD2 3.33Å; F63-Y65 WeakPolarHBondContact O-CE2 3.35Å; F63-Y65 PolarHBondContact O-N 3.14Å; F63-Y65 VanDerWaalsContact O-N 3.1Å
64	D	34.3	Very low	35.6	Very low	84 Å²	84	89.9 Å²	89.9	45%	0.449	51%	0.511	S	S	.	.			trans	-69.6	98.4	169.2	-177.1	8.4	0	0	0	110.2	G66	D64-G66 PolarHBondContact O-N 3.32Å; D64-G66 VanDerWaalsContact O-N 3.17Å; D64-G66 PolarHBondContact OD1-N 3.3Å; D64-G66 VanDerWaalsContact OD1-N 3.13Å
65	Y	38.2	Very low	35.1	Very low	100 Å²	100	86.8 Å²	86.8	39%	0.392	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-66.5	-7.7	179.4	-72	-90.7	0	0	0	113.6	I60 F63 T67 L68	I60-Y65 WeakPolarHBondContact CG2-OH 3.44Å; F63-Y65 HydrophobicContact CB-CE2 4.29Å; F63-Y65 WeakPolarHBondContact O-CD2 3.33Å; F63-Y65 WeakPolarHBondContact O-CE2 3.35Å; F63-Y65 PolarHBondContact O-N 3.14Å; F63-Y65 VanDerWaalsContact O-N 3.1Å; Y65-T67 PolarHBondContact O-N 3.05Å; Y65-L68 PolarHBondContact O-N 3.21Å
66	G	31.9	Very low	34.6	Very low	64 Å²	64	86.2 Å²	86.2	66%	0.66	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-66.1	-5.7	-176	0	0	0	0	0	116.1	D64	D64-G66 PolarHBondContact O-N 3.32Å; D64-G66 VanDerWaalsContact O-N 3.17Å; D64-G66 PolarHBondContact OD1-N 3.3Å; D64-G66 VanDerWaalsContact OD1-N 3.13Å
67	T	32.4	Very low	34.5	Very low	108 Å²	108	86.3 Å²	86.3	66%	0.663	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-112.5	3.1	-178.5	-24.7	0	0	0	0	113.7	Y65	Y65-T67 PolarHBondContact O-N 3.05Å
68	L	32.1	Very low	34.4	Very low	86 Å²	86	88 Å²	88	45%	0.45	50%	0.5	S	S	.	.			trans	-112.6	23.9	-170.5	-82.6	163.9	0	0	0	114.5	Y65 A70	Y65-L68 PolarHBondContact O-N 3.21Å; L68-A70 PolarHBondContact O-N 2.88Å
69	E	32.6	Very low	34.1	Very low	199 Å²	199	89.4 Å²	89.4	93%	0.93	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	6.2	174.6	-77.9	-161.3	149.9	0	0	115.1
70	A	31.8	Very low	33.9	Very low	78 Å²	78	88.9 Å²	88.9	65%	0.645	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	3.8	-175.3	0	0	0	0	0	115.7	L68	L68-A70 PolarHBondContact O-N 2.88Å
71	F	28.3	Very low	33.9	Very low	155 Å²	155	90.8 Å²	90.8	68%	0.68	50%	0.504	S	S	*	.	S	Bend	trans	-123.6	111.8	172.7	-92.7	-92.3	0	0	0	109.8	L73	F71-L73 PolarHBondContact O-N 2.93Å
72	S	36.6	Very low	33.9	Very low	55 Å²	55	90.2 Å²	90.2	39%	0.385	50%	0.5	S	S	.	.			trans	-23	93.9	171.1	166.9	0	0	0	0	113.4	S74 A75 I76	S72-S74 PolarHBondContact O-N 3.37Å; S72-S74 VanDerWaalsContact O-N 3.15Å; S72-S74 PolarHBondContact OG-OG 3.38Å; S72-A75 PolarHBondContact O-N 3.21Å; S72-A75 VanDerWaalsContact OG-CB 3.31Å; S72-A75 WeakPolarHBondContact OG-CB 3.2Å; S72-A75 PolarHBondContact OG-N 3.14Å; S72-I76 PolarHBondContact O-N 3.41Å
73	L	32.5	Very low	33.7	Very low	119 Å²	119	86.6 Å²	86.6	62%	0.623	49%	0.485	S	S	*	.	H	α-helix	trans	-54.8	-23.6	162.3	-83.6	159.6	0	0	0	110.6	F71 A77	F71-L73 PolarHBondContact O-N 2.93Å; L73-A77 VanDerWaalsContact O-CB 3.25Å; L73-A77 WeakPolarHBondContact O-CB 3.47Å; L73-A77 PolarHBondContact O-N 2.78Å
74	S	33.2	Very low	33.7	Very low	40 Å²	40	83.6 Å²	83.6	28%	0.28	48%	0.475	S	S	.	.	H	α-helix	trans	-66.1	-37.6	171.7	55.6	0	0	0	0	113.5	S72 H78	S72-S74 PolarHBondContact O-N 3.37Å; S72-S74 VanDerWaalsContact O-N 3.15Å; S72-S74 PolarHBondContact OG-OG 3.38Å; S74-H78 VanDerWaalsContact O-CB 3.28Å; S74-H78 WeakPolarHBondContact O-CB 3.43Å; S74-H78 PolarHBondContact O-N 2.9Å
75	A	32.5	Very low	33.6	Very low	23 Å²	23	84.7 Å²	84.7	19%	0.19	48%	0.484	C	S	.	.	H	α-helix	trans	-71.5	-37.1	178.4	0	0	0	0	0	112.2	S72 H78 Q79 F378	S72-A75 PolarHBondContact O-N 3.21Å; S72-A75 VanDerWaalsContact OG-CB 3.31Å; S72-A75 WeakPolarHBondContact OG-CB 3.2Å; S72-A75 PolarHBondContact OG-N 3.14Å; A75-H78 PolarHBondContact O-N 3.33Å; A75-Q79 WeakPolarHBondContact O-CB 3.32Å; A75-Q79 PolarHBondContact O-N 3.19Å; A75-F378 HydrophobicContact CB-CE1 4.42Å; A75-F378 HydrophobicContact CB-CZ 3.88Å
76	I	32.4	Very low	33.1	Very low	75 Å²	75	84.1 Å²	84.1	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-69.4	-44.6	174.7	-62.2	174.7	0	0	0	110	S72 H78 Q79 T80	S72-I76 PolarHBondContact O-N 3.41Å; I76-H78 VanDerWaalsContact C-N 3.3Å; I76-H78 PolarHBondContact O-N 2.8Å; I76-Q79 PolarHBondContact O-N 2.88Å; I76-T80 PolarHBondContact O-N 2.87Å; I76-T80 PolarHBondContact O-OG1 3.28Å
77	A	36.5	Very low	32.9	Very low	51 Å²	51	86.9 Å²	86.9	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-61.3	-37.9	173.6	0	0	0	0	0	112.2	L73 T80 N81	L73-A77 VanDerWaalsContact O-CB 3.25Å; L73-A77 WeakPolarHBondContact O-CB 3.47Å; L73-A77 PolarHBondContact O-N 2.78Å; A77-T80 PolarHBondContact O-N 3.36Å; A77-N81 PolarHBondContact O-N 3.05Å
78	H	37.3	Very low	32.7	Very low	74 Å²	74	92.5 Å²	92.5	34%	0.343	51%	0.51	S	S	.	.	H	α-helix	trans	-67.3	-41.4	175.2	-115.9	-73.3	0	0	0	113.2	S74 A75 I76 T80 N81 S82 Y451	S74-H78 VanDerWaalsContact O-CB 3.28Å; S74-H78 WeakPolarHBondContact O-CB 3.43Å; S74-H78 PolarHBondContact O-N 2.9Å; A75-H78 PolarHBondContact O-N 3.33Å; I76-H78 VanDerWaalsContact C-N 3.3Å; I76-H78 PolarHBondContact O-N 2.8Å; H78-T80 VanDerWaalsContact C-N 3.3Å; H78-T80 PolarHBondContact O-N 3.01Å; H78-N81 PolarHBondContact O-N 3.31Å; H78-S82 VanDerWaalsContact O-CB 3.23Å; H78-S82 WeakPolarHBondContact O-CB 3.09Å; H78-S82 PolarHBondContact O-N 3.05Å; H78-Y451 AromaticContact CE1-CD1 3.99Å; H78-Y451 AromaticContact CE1-CE1 3.07Å; H78-Y451 WeakPolarHBondContact CE1-CE1 3.22Å; H78-Y451 AromaticContact CE1-CZ 3.43Å; H78-Y451 VanDerWaalsContact CE1-CZ 3.43Å; H78-Y451 PolarHBondContact CE1-OH 3.03Å; H78-Y451 AromaticContact ND1-CE1 3.91Å; H78-Y451 AromaticContact ND1-CZ 3.93Å; H78-Y451 AromaticContact NE2-CD1 3.99Å; H78-Y451 AromaticContact NE2-CE1 3.44Å; H78-Y451 WeakPolarHBondContact NE2-CE1 3.36Å
79	Q	35.3	Very low	32.5	Very low	72 Å²	72	99.3 Å²	99.3	34%	0.336	53%	0.53	S	S	.	.	H	α-helix	trans	-62.9	-39.1	173.8	-106.5	173.1	-7.8	0	0	111.7	A75 I76 S82 L83	A75-Q79 WeakPolarHBondContact O-CB 3.32Å; A75-Q79 PolarHBondContact O-N 3.19Å; I76-Q79 PolarHBondContact O-N 2.88Å; Q79-S82 PolarHBondContact O-N 3.07Å; Q79-L83 WeakPolarHBondContact O-CB 3.48Å; Q79-L83 VanDerWaalsContact O-CG 3.31Å; Q79-L83 WeakPolarHBondContact O-CG 3.18Å; Q79-L83 PolarHBondContact O-N 3.07Å
80	T	33.5	Very low	32.3	Very low	53 Å²	53	93.3 Å²	93.3	33%	0.325	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-44.4	177.8	-37.2	0	0	0	0	110.8	I76 A77 H78 L83 L84	I76-T80 PolarHBondContact O-N 2.87Å; I76-T80 PolarHBondContact O-OG1 3.28Å; A77-T80 PolarHBondContact O-N 3.36Å; H78-T80 VanDerWaalsContact C-N 3.3Å; H78-T80 PolarHBondContact O-N 3.01Å; T80-L83 PolarHBondContact O-N 3.29Å; T80-L84 HydrophobicContact CG2-CD1 4.26Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 VanDerWaalsContact O-CD1 3.31Å; T80-L84 WeakPolarHBondContact O-CD1 3.28Å; T80-L84 WeakPolarHBondContact O-CG 3.37Å; T80-L84 PolarHBondContact O-N 3.29Å
81	N	35.1	Very low	32	Very low	96 Å²	96	94.9 Å²	94.9	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-37.8	174.5	-91.3	-15.6	0	0	0	113.4	A77 H78 L83 L84 V85	A77-N81 PolarHBondContact O-N 3.05Å; H78-N81 PolarHBondContact O-N 3.31Å; N81-L83 VanDerWaalsContact C-N 3.35Å; N81-L84 PolarHBondContact O-N 3.3Å; N81-V85 WeakPolarHBondContact O-CB 3.42Å; N81-V85 WeakPolarHBondContact O-CG2 3.39Å; N81-V85 PolarHBondContact O-N 3.46Å
82	S	35.2	Very low	32.2	Very low	75 Å²	75	91 Å²	91	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-40.5	175.4	161.7	0	0	0	0	112.1	H78 Q79 S86	H78-S82 VanDerWaalsContact O-CB 3.23Å; H78-S82 WeakPolarHBondContact O-CB 3.09Å; H78-S82 PolarHBondContact O-N 3.05Å; Q79-S82 PolarHBondContact O-N 3.07Å; S82-S86 PolarHBondContact O-N 3.31Å
83	L	32	Very low	31.9	Very low	89 Å²	89	90.1 Å²	90.1	47%	0.466	51%	0.514	S	S	.	.	H	α-helix	trans	-71.5	-32.7	175.7	-72.9	165.3	0	0	0	112.3	L19 Q79 T80 N81	L19-L83 HydrophobicContact CB-CD1 4.25Å; L19-L83 HydrophobicContact CD1-CD1 4.27Å; L19-L83 HydrophobicContact CD2-CD1 3.96Å; L19-L83 HydrophobicContact CG-CD1 4.39Å; Q79-L83 WeakPolarHBondContact O-CB 3.48Å; Q79-L83 VanDerWaalsContact O-CG 3.31Å; Q79-L83 WeakPolarHBondContact O-CG 3.18Å; Q79-L83 PolarHBondContact O-N 3.07Å; T80-L83 PolarHBondContact O-N 3.29Å; N81-L83 VanDerWaalsContact C-N 3.35Å
84	L	33.5	Very low	32	Very low	59 Å²	59	90.8 Å²	90.8	31%	0.309	52%	0.523	S	S	.	.	H	α-helix	trans	-75.5	-19	177.2	-73.4	165.1	0	0	0	114	T80 N81 A101	T80-L84 HydrophobicContact CG2-CD1 4.26Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 VanDerWaalsContact O-CD1 3.31Å; T80-L84 WeakPolarHBondContact O-CD1 3.28Å; T80-L84 WeakPolarHBondContact O-CG 3.37Å; T80-L84 PolarHBondContact O-N 3.29Å; N81-L84 PolarHBondContact O-N 3.3Å; L84-A101 HydrophobicContact CD1-CB 4.1Å
85	V	33.2	Very low	32.2	Very low	108 Å²	108	96.1 Å²	96.1	66%	0.655	54%	0.544	S	S	*	.	H	α-helix	trans	-114.2	2.2	-171.3	-178.2	0	0	0	0	113.2	N81 P87	N81-V85 WeakPolarHBondContact O-CB 3.42Å; N81-V85 WeakPolarHBondContact O-CG2 3.39Å; N81-V85 PolarHBondContact O-N 3.46Å; V85-P87 WeakPolarHBondContact O-CD 3.04Å; V85-P87 VanDerWaalsContact O-N 3.13Å
86	S	27.9	Very low	32.4	Very low	87 Å²	87	98.7 Å²	98.7	61%	0.608	55%	0.551	S	S	*	*			trans	-66.9	111.9	178.1	80	0	0	0	0	112	S82 R88	S82-S86 PolarHBondContact O-N 3.31Å; S86-R88 PolarHBondContact O-N 3.21Å; S86-R88 VanDerWaalsContact O-N 3.16Å
87	P	26.2	Very low	32.4	Very low	123 Å²	123	96.8 Å²	96.8	80%	0.799	55%	0.55	S	S	*	*			trans	-94.8	69.4	-174.3	32.1	-20.2	0	0	0	109	V85	V85-P87 WeakPolarHBondContact O-CD 3.04Å; V85-P87 VanDerWaalsContact O-N 3.13Å
88	R	28.6	Very low	32.4	Very low	225 Å²	225	99.1 Å²	99.1	85%	0.849	56%	0.559	S	S	*	*	S	Bend	trans	-144.5	73.4	173.2	-72.4	-167.9	178.6	-166.6	0.5	111	S86	S86-R88 PolarHBondContact O-N 3.21Å; S86-R88 VanDerWaalsContact O-N 3.16Å
89	R	27.9	Very low	32.6	Very low	230 Å²	230	98.3 Å²	98.3	87%	0.868	56%	0.56	S	S	*	*	S	Bend	trans	164.4	0.5	143.5	-90.9	168.2	-156.6	-135.4	6.7	116.5
90	L	29.2	Very low	32.6	Very low	73 Å²	73	96.1 Å²	96.1	38%	0.382	55%	0.551	S	S	.	*			trans	-128.7	77.8	176.7	-73.7	161.9	0	0	0	111.2	A30 G92	A30-L90 HydrophobicContact CB-CD1 3.93Å; L90-G92 PolarHBondContact O-N 2.84Å; L90-G92 VanDerWaalsContact O-N 3.15Å
91	A	25.8	Very low	32.9	Very low	111 Å²	111	94.6 Å²	94.6	92%	0.917	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	102.5	165.3	0	0	0	0	0	108.3
92	G	30.7	Very low	33.1	Very low	73 Å²	73	93.9 Å²	93.9	75%	0.753	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	153.4	-7.3	170.7	0	0	0	0	0	118.7	L90	L90-G92 PolarHBondContact O-N 2.84Å; L90-G92 VanDerWaalsContact O-N 3.15Å
93	S	31.2	Very low	33.3	Very low	36 Å²	36	92.4 Å²	92.4	25%	0.252	54%	0.538	S	S	.	.			trans	-144.9	34.5	-166.7	41.3	0	0	0	0	116.1	E95 H96	S93-E95 PolarHBondContact O-N 3.49Å; S93-H96 PolarHBondContact O-N 3.17Å; S93-H96 PolarHBondContact O-ND1 2.96Å
94	V	34.8	Very low	33.5	Very low	134 Å²	134	89.9 Å²	89.9	81%	0.812	53%	0.525	S	S	*	.	H	α-helix	trans	-59	-20.8	-173.8	-175.8	0	0	0	0	114.7
95	E	37.3	Very low	33.8	Very low	152 Å²	152	92.1 Å²	92.1	71%	0.71	54%	0.536	S	S	*	.	H	α-helix	trans	-78.6	-15.2	175.6	-73.7	-176.1	148.4	0	0	114.7	S93 T98 T99	S93-E95 PolarHBondContact O-N 3.49Å; E95-T98 PolarHBondContact O-OG1 3.19Å; E95-T99 PolarHBondContact O-OG1 2.86Å; E95-T99 VanDerWaalsContact O-OG1 3.12Å
96	H	36.9	Very low	34	Very low	76 Å²	76	91.9 Å²	91.9	35%	0.352	54%	0.539	S	S	.	.	H	α-helix	trans	-88.1	-29	-170.8	-65.3	74.2	0	0	0	113.5	S93	S93-H96 PolarHBondContact O-N 3.17Å; S93-H96 PolarHBondContact O-ND1 2.96Å
97	G	33.3	Very low	34.4	Very low	35 Å²	35	93.5 Å²	93.5	36%	0.361	53%	0.532	S	S	.	.	H	α-helix	trans	-75.4	-35.5	-177.8	0	0	0	0	0	114.4	T99 L100 A101	G97-T99 VanDerWaalsContact C-N 3.34Å; G97-T99 PolarHBondContact O-N 3.33Å; G97-L100 PolarHBondContact O-N 2.75Å; G97-A101 PolarHBondContact O-N 3.3Å
98	T	36	Very low	34.6	Very low	100 Å²	100	91 Å²	91	61%	0.613	51%	0.51	S	S	*	.	H	α-helix	trans	-67.6	-33	177	36.1	0	0	0	0	112.8	E95 S102	E95-T98 PolarHBondContact O-OG1 3.19Å; T98-S102 PolarHBondContact O-N 3.45Å
99	T	40.2	Very low	34.7	Very low	58 Å²	58	86.1 Å²	86.1	36%	0.356	51%	0.511	S	S	.	.	H	α-helix	trans	-71.9	-37.2	179.2	-47.6	0	0	0	0	111.6	E95 G97 A103	E95-T99 PolarHBondContact O-OG1 2.86Å; E95-T99 VanDerWaalsContact O-OG1 3.12Å; G97-T99 VanDerWaalsContact C-N 3.34Å; G97-T99 PolarHBondContact O-N 3.33Å; T99-A103 WeakPolarHBondContact O-CB 3.29Å; T99-A103 PolarHBondContact O-N 2.86Å; T99-A103 VanDerWaalsContact O-N 3.09Å
100	L	37	Very low	34.8	Very low	26 Å²	26	77.2 Å²	77.2	14%	0.136	48%	0.482	C	S	.	.	H	α-helix	trans	-67.4	-44	175.5	-89.2	156.3	0	0	0	112.6	F29 V47 G97 A103 L104	F29-L100 HydrophobicContact CD1-CD1 3.95Å; F29-L100 HydrophobicContact CE1-CD1 3.91Å; F29-L100 HydrophobicContact CE1-CD2 4.19Å; V47-L100 HydrophobicContact CG1-CD2 4.11Å; V47-L100 HydrophobicContact CG2-CD2 4.12Å; G97-L100 PolarHBondContact O-N 2.75Å; L100-A103 PolarHBondContact O-N 3.33Å; L100-L104 PolarHBondContact O-N 3.07Å
101	A	37.8	Very low	34.6	Very low	21 Å²	21	78.9 Å²	78.9	17%	0.174	50%	0.497	C	S	.	.	H	α-helix	trans	-61.4	-44.3	176.7	0	0	0	0	0	111.5	L84 G97 A103 L104 I105	L84-A101 HydrophobicContact CD1-CB 4.1Å; G97-A101 PolarHBondContact O-N 3.3Å; A101-A103 VanDerWaalsContact C-N 3.33Å; A101-A103 PolarHBondContact O-N 3.3Å; A101-L104 PolarHBondContact O-N 3.18Å; A101-I105 WeakPolarHBondContact O-CB 3.42Å; A101-I105 WeakPolarHBondContact O-CD1 3.44Å; A101-I105 WeakPolarHBondContact O-CG1 3.42Å; A101-I105 PolarHBondContact O-N 2.94Å
102	S	39.4	Very low	34.6	Very low	81 Å²	81	80 Å²	80	57%	0.566	49%	0.488	S	S	*	.	H	α-helix	trans	-63.5	-35.5	176	-173.8	0	0	0	0	113.1	T98 S106	T98-S102 PolarHBondContact O-N 3.45Å; S102-S106 WeakPolarHBondContact O-CB 3.35Å; S102-S106 PolarHBondContact O-N 2.77Å
103	A	40.8	Very low	34.5	Very low	44 Å²	44	80.8 Å²	80.8	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-74.7	-36	179.6	0	0	0	0	0	112.6	T99 L100 A101 R107	T99-A103 WeakPolarHBondContact O-CB 3.29Å; T99-A103 PolarHBondContact O-N 2.86Å; T99-A103 VanDerWaalsContact O-N 3.09Å; L100-A103 PolarHBondContact O-N 3.33Å; A101-A103 VanDerWaalsContact C-N 3.33Å; A101-A103 PolarHBondContact O-N 3.3Å; A103-R107 PolarHBondContact O-N 3.46Å
104	L	36.2	Very low	34.4	Very low	35 Å²	35	84 Å²	84	18%	0.183	49%	0.488	C	S	.	.	H	α-helix	trans	-65.9	-48.9	173.3	-102.3	127.9	0	0	0	111.2	F22 L53 L56 L100 A101 S106 R107 M108	F22-L104 HydrophobicContact CE2-CD1 4.47Å; F22-L104 HydrophobicContact CE2-CD2 4.41Å; F22-L104 HydrophobicContact CZ-CD1 4.16Å; L53-L104 HydrophobicContact CD2-CD1 4.26Å; L53-L104 HydrophobicContact CD2-CG 4.32Å; L56-L104 HydrophobicContact CD2-CD2 4.48Å; L100-L104 PolarHBondContact O-N 3.07Å; A101-L104 PolarHBondContact O-N 3.18Å; L104-S106 PolarHBondContact O-N 3.31Å; L104-R107 PolarHBondContact O-N 3Å; L104-M108 VanDerWaalsContact O-CG 3.31Å; L104-M108 WeakPolarHBondContact O-CG 3.44Å; L104-M108 PolarHBondContact O-N 2.79Å; L104-M108 VanDerWaalsContact O-N 3.07Å
105	I	38.6	Very low	34.1	Very low	107 Å²	107	81.5 Å²	81.5	55%	0.549	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-36.2	178.4	-67.2	164.7	0	0	0	111.5	A101 R107	A101-I105 WeakPolarHBondContact O-CB 3.42Å; A101-I105 WeakPolarHBondContact O-CD1 3.44Å; A101-I105 WeakPolarHBondContact O-CG1 3.42Å; A101-I105 PolarHBondContact O-N 2.94Å; I105-R107 VanDerWaalsContact C-N 3.32Å; I105-R107 PolarHBondContact O-N 2.76Å
106	S	38.6	Very low	33.7	Very low	102 Å²	102	81.9 Å²	81.9	71%	0.713	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-19	177	179.8	0	0	0	0	114.5	S102 L104	S102-S106 WeakPolarHBondContact O-CB 3.35Å; S102-S106 PolarHBondContact O-N 2.77Å; L104-S106 PolarHBondContact O-N 3.31Å
107	R	36.8	Very low	33.1	Very low	121 Å²	121	79.6 Å²	79.6	46%	0.457	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-19.9	-176.9	-99.4	-166.3	171.1	-159	0.6	113.6	R48 D54 A103 L104 I105 S109	R48-R107 PolarHBondContact O-NH2 2.87Å; D54-R107 IonicContact OD1-CZ 3.95Å; D54-R107 IonicContact OD1-NH1 2.71Å; D54-R107 PolarHBondContact OD1-NH1 3.02Å; A103-R107 PolarHBondContact O-N 3.46Å; L104-R107 PolarHBondContact O-N 3Å; I105-R107 VanDerWaalsContact C-N 3.32Å; I105-R107 PolarHBondContact O-N 2.76Å; R107-S109 PolarHBondContact O-N 3.21Å
108	M	29.5	Very low	32.7	Very low	71 Å²	71	81.1 Å²	81.1	35%	0.35	47%	0.468	S	S	.	.			trans	-70.4	103	170.7	-59.7	167.3	76.2	0	0	106.8	I60 L104 V110	I60-M108 HydrophobicContact CG2-CE 4.05Å; L104-M108 VanDerWaalsContact O-CG 3.31Å; L104-M108 WeakPolarHBondContact O-CG 3.44Å; L104-M108 PolarHBondContact O-N 2.79Å; L104-M108 VanDerWaalsContact O-N 3.07Å; M108-V110 HydrophobicContact CB-CG2 3.69Å; M108-V110 HydrophobicContact CE-CG2 4.29Å; M108-V110 PolarHBondContact O-N 3.43Å
109	S	30.3	Very low	32.3	Very low	123 Å²	123	79.9 Å²	79.9	86%	0.86	45%	0.454	S	S	*	.			trans	-67.8	50.5	170.3	-59.4	0	0	0	0	110.9	R107 P111	R107-S109 PolarHBondContact O-N 3.21Å; S109-P111 WeakPolarHBondContact O-CD 3.33Å
110	V	29.8	Very low	31.8	Very low	43 Å²	43	82.7 Å²	82.7	26%	0.261	46%	0.462	S	S	.	.			trans	-76.5	116.8	171.8	-168.4	0	0	0	0	105.5	M108 D112 V113	M108-V110 HydrophobicContact CB-CG2 3.69Å; M108-V110 HydrophobicContact CE-CG2 4.29Å; M108-V110 PolarHBondContact O-N 3.43Å; V110-D112 PolarHBondContact O-N 2.92Å; V110-D112 VanDerWaalsContact O-N 3.13Å; V110-V113 HydrophobicContact CB-CG2 3.73Å; V110-V113 HydrophobicContact CG1-CG2 3.52Å; V110-V113 HydrophobicContact CG2-CG2 4.1Å
111	P	24.7	Very low	31.4	Very low	107 Å²	107	82.2 Å²	82.2	70%	0.695	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	119.2	160.3	0.6	15.5	0	0	0	105.5	S109	S109-P111 WeakPolarHBondContact O-CD 3.33Å
112	D	27.1	Very low	31.1	Very low	135 Å²	135	83 Å²	83	72%	0.722	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	61	169.7	-51.3	-36.2	0	0	0	117.8	V110 E114	V110-D112 PolarHBondContact O-N 2.92Å; V110-D112 VanDerWaalsContact O-N 3.13Å; D112-E114 PolarHBondContact O-N 2.88Å
113	V	28.1	Very low	30.7	Very low	90 Å²	90	80.3 Å²	80.3	55%	0.545	44%	0.444	S	S	.	.			trans	-93.3	79.4	147	-173.7	0	0	0	0	108.2	V110 T115	V110-V113 HydrophobicContact CB-CG2 3.73Å; V110-V113 HydrophobicContact CG1-CG2 3.52Å; V110-V113 HydrophobicContact CG2-CG2 4.1Å; V113-T115 PolarHBondContact O-N 2.93Å; V113-T115 VanDerWaalsContact O-N 3.1Å
114	E	28.8	Very low	30.2	Very low	102 Å²	102	83 Å²	83	48%	0.477	45%	0.449	S	S	.	.			trans	-69.2	100.6	174.3	-70.7	-165.1	132	0	0	110.6	D112 W116 K120	D112-E114 PolarHBondContact O-N 2.88Å; E114-W116 PolarHBondContact O-N 3.43Å; E114-K120 IonicContact OE2-NZ 2.69Å
115	T	29.4	Very low	29.7	Very low	82 Å²	82	83.6 Å²	83.6	50%	0.503	45%	0.452	S	S	.	.			trans	-64.1	95.5	163.5	59.6	0	0	0	0	110.1	V113 G117 R346	V113-T115 PolarHBondContact O-N 2.93Å; V113-T115 VanDerWaalsContact O-N 3.1Å; T115-G117 PolarHBondContact O-N 2.99Å; T115-R346 PolarHBondContact O-NE 3.42Å; T115-R346 VanDerWaalsContact O-NE 3.16Å; T115-R346 VanDerWaalsContact OG1-CZ 3.31Å; T115-R346 PolarHBondContact OG1-NE 3.37Å; T115-R346 PolarHBondContact OG1-NH2 3.36Å
116	W	27.6	Very low	29.2	Very low	160 Å²	160	82.2 Å²	82.2	61%	0.606	45%	0.445	S	S	*	.	S	Bend	trans	12.9	97.9	148.9	-58.2	75	0	0	0	115.3	E114	E114-W116 PolarHBondContact O-N 3.43Å
117	G	24.5	Very low	28.6	Very low	28 Å²	28	83.5 Å²	83.5	29%	0.289	44%	0.438	S	S	.	.			trans	175.9	40.8	-178.6	0	0	0	0	0	114.8	T115	T115-G117 PolarHBondContact O-N 2.99Å
118	T	26	Very low	28.2	Very low	68 Å²	68	81.6 Å²	81.6	42%	0.417	44%	0.441	S	S	.	.	S	Bend	trans	-156.4	120.7	166.7	26	0	0	0	0	108.7	K120 D347	T118-K120 PolarHBondContact O-N 2.85Å; T118-K120 VanDerWaalsContact O-N 3.16Å; T118-D347 HydrophobicContact CG2-CB 4.28Å
119	K	27.8	Very low	28.2	Very low	73 Å²	73	86 Å²	86	32%	0.317	46%	0.455	S	S	.	.			trans	-41.4	112.6	-179	-65.4	178.6	166.5	-172.1	0	112.3	D279	K119-D279 IonicContact NZ-OD1 2.76Å; K119-D279 PolarHBondContact NZ-OD1 3.16Å
120	K	28.9	Very low	28.3	Very low	117 Å²	117	84.8 Å²	84.8	51%	0.509	44%	0.444	S	S	.	.			trans	-140.6	108.3	171.6	-78.2	-178.6	179.6	170.4	0	109.6	E114 T118 S122	E114-K120 IonicContact OE2-NZ 2.69Å; T118-K120 PolarHBondContact O-N 2.85Å; T118-K120 VanDerWaalsContact O-N 3.16Å; K120-S122 PolarHBondContact O-N 2.96Å
121	V	29.8	Very low	28.5	Very low	17 Å²	17	90.1 Å²	90.1	10%	0.103	47%	0.471	C	S	.	.			trans	-69.8	104.6	152.6	-177.7	0	0	0	0	107	V123 Y270 F483 G484	V121-V123 HydrophobicContact CG1-CG2 4.08Å; V121-Y270 HydrophobicContact CG2-CE2 4.23Å; V121-F483 HydrophobicContact CG2-CD2 3.93Å; V121-F483 HydrophobicContact CG2-CE2 4.1Å; V121-G484 WeakPolarHBondContact CG2-O 3.46Å
122	S	30.9	Very low	29.1	Very low	36 Å²	36	89.5 Å²	89.5	25%	0.252	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-99.8	94	174.8	-51.7	0	0	0	0	108.6	K120 H124	K120-S122 PolarHBondContact O-N 2.96Å; S122-H124 WeakPolarHBondContact CB-NE2 2.92Å; S122-H124 PolarHBondContact O-N 2.75Å
123	V	30	Very low	29.6	Very low	25 Å²	25	93.7 Å²	93.7	15%	0.152	47%	0.467	C	S	.	.			trans	-81.1	96.1	165.4	-177.8	0	0	0	0	106.8	V121 L125 A265 V269	V121-V123 HydrophobicContact CG1-CG2 4.08Å; V123-L125 PolarHBondContact O-N 2.88Å; V123-A265 HydrophobicContact CB-CB 3.65Å; V123-A265 HydrophobicContact CG1-CB 4.18Å; V123-A265 HydrophobicContact CG2-CB 4.11Å; V123-V269 HydrophobicContact CG2-CG2 3.76Å
124	H	30	Very low	30.8	Very low	102 Å²	102	94.7 Å²	94.7	47%	0.472	47%	0.465	S	S	.	.			trans	-85.6	97.8	170.1	-66.9	-68.3	0	0	0	108.7	S122 L126	S122-H124 WeakPolarHBondContact CB-NE2 2.92Å; S122-H124 PolarHBondContact O-N 2.75Å; H124-L126 HydrophobicContact CB-CG 4.19Å; H124-L126 PolarHBondContact O-N 3.29Å
125	L	26.3	Very low	32.5	Very low	46 Å²	46	95.1 Å²	95.1	24%	0.241	47%	0.465	C	S	.	.			trans	-65.9	80.9	157.5	-97.3	154.6	0	0	0	107.9	V123 K127 L260 V386	V123-L125 PolarHBondContact O-N 2.88Å; L125-K127 PolarHBondContact O-N 3.03Å; L125-L260 HydrophobicContact CD1-CB 3.61Å; L125-L260 HydrophobicContact CD1-CD1 4.1Å; L125-L260 HydrophobicContact CD1-CG 4.46Å; L125-V386 HydrophobicContact CD2-CG1 4Å; L125-V386 HydrophobicContact CD2-CG2 4.27Å
126	L	28.1	Very low	34.6	Very low	78 Å²	78	94.2 Å²	94.2	41%	0.408	45%	0.453	S	S	.	.			trans	-71.6	78.9	162.7	-65.4	174.3	0	0	0	106	H124 P128 T385 F387	H124-L126 HydrophobicContact CB-CG 4.19Å; H124-L126 PolarHBondContact O-N 3.29Å; L126-P128 VanDerWaalsContact O-N 3.09Å; L126-T385 CarbonylContact C-O 3.58Å; L126-T385 VanDerWaalsContact CB-O 3.29Å; L126-T385 WeakPolarHBondContact CB-O 3.32Å; L126-T385 CarbonylContact O-C 3.46Å; L126-F387 HydrophobicContact CB-CD2 4.01Å; L126-F387 HydrophobicContact CB-CE2 4.39Å; L126-F387 HydrophobicContact CD1-CD2 3.6Å; L126-F387 HydrophobicContact CD1-CE2 3.99Å; L126-F387 HydrophobicContact CD1-CG 4.38Å; L126-F387 HydrophobicContact CG-CD2 4.25Å
127	K	26.3	Very low	37.3	Very low	130 Å²	130	90.5 Å²	90.5	57%	0.565	44%	0.442	S	S	*	.			trans	-56.3	127.6	159.4	-75	-171.3	178.7	-175.7	0	104.7	L125 Y129	L125-K127 PolarHBondContact O-N 3.03Å; K127-Y129 PolarHBondContact O-N 2.89Å
128	P	28.8	Very low	40.2	Very low	80 Å²	80	89.3 Å²	89.3	52%	0.519	43%	0.429	S	S	.	.			trans	-61.8	106.4	163.8	30.1	-23	0	0	0	101.1	L126 P130 T385	L126-P128 VanDerWaalsContact O-N 3.09Å; P128-P130 WeakPolarHBondContact O-CD 3.1Å; P128-T385 HydrophobicContact CB-CG2 4.2Å; P128-T385 HydrophobicContact CG-CG2 3.65Å
129	Y	29.5	Very low	43.3	Very low	164 Å²	164	88.4 Å²	88.4	64%	0.643	43%	0.425	S	S	*	.			trans	-49	122.5	160.2	-88.4	-87.1	0	0	0	102.5	K127 L131	K127-Y129 PolarHBondContact O-N 2.89Å; Y129-L131 VanDerWaalsContact C-N 3.3Å; Y129-L131 PolarHBondContact O-N 3.12Å
130	P	31.7	Very low	46.4	Very low	97 Å²	97	84.9 Å²	84.9	63%	0.63	41%	0.41	S	S	*	.			trans	-48.4	117.7	166.2	22.2	-28.7	0	0	0	101.7	P128 L132	P128-P130 WeakPolarHBondContact O-CD 3.1Å; P130-L132 PolarHBondContact O-N 3.46Å
131	L	33.5	Very low	49.5	Very low	156 Å²	156	82.4 Å²	82.4	82%	0.817	40%	0.402	S	S	*	.			trans	-58.7	91.5	-177.7	-80	166.7	0	0	0	103.4	Y129 R133	Y129-L131 VanDerWaalsContact C-N 3.3Å; Y129-L131 PolarHBondContact O-N 3.12Å; L131-R133 PolarHBondContact O-N 3.23Å
132	L	37.7	Very low	52.6	Low	94 Å²	94	81.7 Å²	81.7	49%	0.492	40%	0.398	S	S	.	.			trans	-66.3	94.5	170.5	-92	159.6	0	0	0	99.2	P130 E134	P130-L132 PolarHBondContact O-N 3.46Å; L132-E134 PolarHBondContact O-N 2.54Å
133	R	39	Very low	55.4	Low	223 Å²	223	85.1 Å²	85.1	84%	0.842	41%	0.41	S	S	*	.			trans	-63.2	20.6	179.2	-78.5	-179.7	171	-176.8	-2.2	111.4	L131	L131-R133 PolarHBondContact O-N 3.23Å
134	E	52.5	Low	58.1	Low	110 Å²	110	93.6 Å²	93.6	51%	0.514	45%	0.445	S	S	.	.			trans	-102	114.4	-172	-64.2	-168.9	167.4	0	0	108	L132 R136	L132-E134 PolarHBondContact O-N 2.54Å; E134-R136 PolarHBondContact O-N 2.81Å
135	K	65.3	Low	61	Low	111 Å²	111	93.1 Å²	93.1	48%	0.483	44%	0.441	S	S	.	.			trans	-45.5	127	161.2	-75	166	159.4	-152.1	0	108.3	H137 Q150	K135-H137 PolarHBondContact O-CE1 2.83Å; K135-H137 PolarHBondContact O-N 3.37Å; K135-H137 PolarHBondContact O-ND1 2.94Å; K135-Q150 HydrophobicContact CB-CG 4.1Å; K135-Q150 VanDerWaalsContact CE-OE1 3.22Å; K135-Q150 HydrophobicContact CG-CG 4.42Å
136	R	72.4	Confident	64.2	Low	64 Å²	64	94.2 Å²	94.2	24%	0.242	46%	0.457	C	S	.	.			trans	-72.2	127.8	177.2	-64.8	-62.6	-170.6	-146.1	4.7	108.5	E134 Q150 I151 L236	E134-R136 PolarHBondContact O-N 2.81Å; R136-Q150 WeakPolarHBondContact O-CA 3.44Å; R136-I151 HydrophobicContact CB-CD1 4.3Å; R136-I151 PolarHBondContact O-N 3.23Å; R136-L236 HydrophobicContact CB-CD2 4.4Å; R136-L236 HydrophobicContact CG-CD2 4.44Å
137	H	83.9	Confident	67.3	Low	82 Å²	82	90.9 Å²	90.9	38%	0.38	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	150	177.4	-65.4	84.4	0	0	0	110.2	K135 T148 F149	K135-H137 PolarHBondContact O-CE1 2.83Å; K135-H137 PolarHBondContact O-N 3.37Å; K135-H137 PolarHBondContact O-ND1 2.94Å; H137-T148 HydrophobicContact CB-CG2 3.87Å; H137-F149 CarbonylContact C-O 3.55Å; H137-F149 WeakPolarHBondContact CA-O 3.31Å
138	I	86.9	Confident	70.4	Confident	3 Å²	3	88.6 Å²	88.6	2%	0.015	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.6	177.3	-170.8	173	0	0	0	109.4	V140 T148 F149 I151 F201 L221 L231 L239	I138-V140 HydrophobicContact CG2-CG2 4.19Å; I138-T148 WeakPolarHBondContact O-CA 3.37Å; I138-F149 HydrophobicContact CG2-CB 4.2Å; I138-F149 PolarHBondContact N-O 2.88Å; I138-F149 PolarHBondContact O-N 3.34Å; I138-I151 HydrophobicContact CB-CD1 4.12Å; I138-I151 HydrophobicContact CB-CG1 4.15Å; I138-I151 HydrophobicContact CG2-CD1 4.1Å; I138-I151 HydrophobicContact CG2-CG1 3.62Å; I138-F201 HydrophobicContact CD1-CD1 4.43Å; I138-F201 HydrophobicContact CD1-CD2 3.76Å; I138-F201 HydrophobicContact CD1-CE1 4.2Å; I138-F201 HydrophobicContact CD1-CE2 3.51Å; I138-F201 HydrophobicContact CD1-CG 4.22Å; I138-F201 HydrophobicContact CD1-CZ 3.76Å; I138-F201 HydrophobicContact CG1-CD2 3.94Å; I138-F201 HydrophobicContact CG1-CE2 3.55Å; I138-F201 HydrophobicContact CG1-CZ 4.17Å; I138-L221 HydrophobicContact CG2-CD2 3.73Å; I138-L231 HydrophobicContact CD1-CD1 3.68Å; I138-L231 HydrophobicContact CD1-CD2 3.77Å; I138-L231 HydrophobicContact CD1-CG 4.41Å; I138-L239 HydrophobicContact CD1-CB 4.5Å; I138-L239 HydrophobicContact CD1-CD1 4.33Å; I138-L239 HydrophobicContact CD1-CD2 4.3Å
139	S	90.7	Very high	73.4	Confident	48 Å²	48	84.8 Å²	84.8	34%	0.336	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	112.5	174.6	-167.8	0	0	0	0	109.6	F201	S139-F201 WeakPolarHBondContact O-CD2 3.35Å
140	V	92	Very high	76.3	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.6	176.7	176.7	0	0	0	0	108.4	I138 I142 V147 F149 L221 W225 L229	I138-V140 HydrophobicContact CG2-CG2 4.19Å; V140-I142 PolarHBondContact O-N 3.35Å; V140-V147 PolarHBondContact N-O 3.49Å; V140-V147 PolarHBondContact O-N 3.13Å; V140-F149 HydrophobicContact CB-CD2 3.86Å; V140-F149 HydrophobicContact CB-CE2 3.91Å; V140-F149 HydrophobicContact CG2-CD2 4.1Å; V140-L221 HydrophobicContact CG2-CD1 4.29Å; V140-L221 HydrophobicContact CG2-CD2 4.27Å; V140-W225 HydrophobicContact CG1-CE3 4.5Å; V140-W225 HydrophobicContact CG1-CZ3 4.4Å; V140-L229 HydrophobicContact CG1-CD1 4.07Å; V140-L229 HydrophobicContact CG2-CD1 4.05Å
141	N	93.9	Very high	79	Confident	65 Å²	65	75 Å²	75	35%	0.348	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	119.9	176.3	-73.7	-41.3	0	0	0	109.7	K145 A146 Y199 S200	N141-K145 CarbonylContact C-O 3.46Å; N141-K145 WeakPolarHBondContact CA-O 3.02Å; N141-A146 WeakPolarHBondContact OD1-CA 3.31Å; N141-Y199 CarbonylContact O-C 3.56Å; N141-Y199 WeakPolarHBondContact O-CA 3.44Å; N141-S200 WeakPolarHBondContact CB-OG 3.26Å; N141-S200 PolarHBondContact N-O 2.94Å; N141-S200 PolarHBondContact O-N 2.8Å
142	I	94.9	Very high	81.5	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121.6	168.3	-61.2	169.1	0	0	0	108	V140 K144 K145 V147 F149 L168 C197 W225	V140-I142 PolarHBondContact O-N 3.35Å; I142-K144 PolarHBondContact O-N 2.97Å; I142-K144 VanDerWaalsContact O-N 3.17Å; I142-K145 PolarHBondContact N-O 2.88Å; I142-K145 WeakPolarHBondContact O-CB 3.5Å; I142-K145 PolarHBondContact O-N 3.2Å; I142-V147 HydrophobicContact CB-CG2 4.44Å; I142-V147 HydrophobicContact CD1-CB 4.21Å; I142-V147 HydrophobicContact CD1-CG1 4.47Å; I142-V147 HydrophobicContact CD1-CG2 4.01Å; I142-V147 HydrophobicContact CG1-CG2 4.42Å; I142-F149 HydrophobicContact CD1-CE2 3.85Å; I142-F149 HydrophobicContact CD1-CZ 3.54Å; I142-F149 HydrophobicContact CG1-CE2 4.48Å; I142-L168 HydrophobicContact CB-CD1 4.4Å; I142-L168 HydrophobicContact CB-CD2 4.13Å; I142-L168 HydrophobicContact CD1-CD1 4.21Å; I142-L168 HydrophobicContact CG2-CD1 4.05Å; I142-L168 HydrophobicContact CG2-CD2 4.27Å; I142-C197 HydrophobicContact CG2-CB 3.81Å; I142-W225 HydrophobicContact CD1-CH2 3.93Å; I142-W225 HydrophobicContact CD1-CZ3 3.94Å; I142-W225 HydrophobicContact CG1-CH2 4Å; I142-W225 HydrophobicContact CG1-CZ3 3.91Å
143	E	90.7	Very high	83.8	Confident	108 Å²	108	66.9 Å²	66.9	51%	0.505	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	44.4	-178.9	-60.4	-60.6	159.2	0	0	112.9	K145 C197 A198	E143-K145 PolarHBondContact O-N 2.92Å; E143-C197 HydrophobicContact CG-CB 4.12Å; E143-C197 VanDerWaalsContact OE1-CA 3.31Å; E143-C197 WeakPolarHBondContact OE1-CA 3.37Å; E143-A198 PolarHBondContact N-O 2.96Å; E143-A198 PolarHBondContact OE1-N 3.25Å
144	K	85.3	Confident	85.9	Confident	204 Å²	204	59.1 Å²	59.1	89%	0.887	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	9.5	-177.4	-49.2	175.8	-179.9	177.6	0	115.6	I142	I142-K144 PolarHBondContact O-N 2.97Å; I142-K144 VanDerWaalsContact O-N 3.17Å
145	K	92.4	Very high	87.5	Confident	91 Å²	91	54.9 Å²	54.9	40%	0.396	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.3	173	-67.3	176.2	175.8	177.8	0	109.9	N141 I142 E143 V147 Q167 L168	N141-K145 CarbonylContact C-O 3.46Å; N141-K145 WeakPolarHBondContact CA-O 3.02Å; I142-K145 PolarHBondContact N-O 2.88Å; I142-K145 WeakPolarHBondContact O-CB 3.5Å; I142-K145 PolarHBondContact O-N 3.2Å; E143-K145 PolarHBondContact O-N 2.92Å; K145-V147 PolarHBondContact O-N 3.24Å; K145-Q167 PolarHBondContact NZ-O 3.45Å; K145-L168 HydrophobicContact CB-CD2 3.81Å; K145-L168 HydrophobicContact CD-CD2 3.89Å; K145-L168 HydrophobicContact CG-CD2 4.47Å; K145-L168 PolarHBondContact NZ-O 3.39Å
146	A	92.9	Very high	88.6	Confident	69 Å²	69	55.6 Å²	55.6	57%	0.57	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	127.8	175.6	0	0	0	0	0	110.4	N141	N141-A146 WeakPolarHBondContact OD1-CA 3.31Å
147	V	93.1	Very high	89.5	Confident	8 Å²	8	57.8 Å²	57.8	5%	0.048	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.6	175.8	177.5	0	0	0	0	108.3	V140 I142 K145 F149 T164 L168 N219	V140-V147 PolarHBondContact N-O 3.49Å; V140-V147 PolarHBondContact O-N 3.13Å; I142-V147 HydrophobicContact CB-CG2 4.44Å; I142-V147 HydrophobicContact CD1-CB 4.21Å; I142-V147 HydrophobicContact CD1-CG1 4.47Å; I142-V147 HydrophobicContact CD1-CG2 4.01Å; I142-V147 HydrophobicContact CG1-CG2 4.42Å; K145-V147 PolarHBondContact O-N 3.24Å; V147-F149 HydrophobicContact CB-CD2 4.3Å; V147-F149 HydrophobicContact CB-CE2 3.68Å; V147-F149 HydrophobicContact CB-CZ 4.31Å; V147-F149 HydrophobicContact CG1-CD2 3.98Å; V147-F149 HydrophobicContact CG1-CE1 4.45Å; V147-F149 HydrophobicContact CG1-CE2 3.45Å; V147-F149 VanDerWaalsContact CG1-CE2 3.45Å; V147-F149 HydrophobicContact CG1-CZ 3.73Å; V147-F149 VanDerWaalsContact O-CD2 3.27Å; V147-F149 WeakPolarHBondContact O-CD2 3.31Å; V147-T164 HydrophobicContact CB-CG2 4.49Å; V147-T164 HydrophobicContact CG1-CG2 3.56Å; V147-T164 HydrophobicContact CG2-CG2 4.04Å; V147-L168 HydrophobicContact CG2-CD2 3.87Å; V147-L168 HydrophobicContact CG2-CG 4.46Å; V147-N219 HydrophobicContact CG1-CB 4.48Å
148	T	91.6	Very high	90	Very high	82 Å²	82	54 Å²	54	50%	0.503	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	125.6	174.3	-51.5	0	0	0	0	109.7	H137 I138 N219	H137-T148 HydrophobicContact CB-CG2 3.87Å; I138-T148 WeakPolarHBondContact O-CA 3.37Å; T148-N219 WeakPolarHBondContact O-CB 3.34Å; T148-N219 PolarHBondContact O-ND2 3Å
149	F	92.3	Very high	90.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142	175.2	-71.6	-89.7	0	0	0	110.9	H137 I138 V140 I142 V147 T158 I160 N219 L221 W225	H137-F149 CarbonylContact C-O 3.55Å; H137-F149 WeakPolarHBondContact CA-O 3.31Å; I138-F149 HydrophobicContact CG2-CB 4.2Å; I138-F149 PolarHBondContact N-O 2.88Å; I138-F149 PolarHBondContact O-N 3.34Å; V140-F149 HydrophobicContact CB-CD2 3.86Å; V140-F149 HydrophobicContact CB-CE2 3.91Å; V140-F149 HydrophobicContact CG2-CD2 4.1Å; I142-F149 HydrophobicContact CD1-CE2 3.85Å; I142-F149 HydrophobicContact CD1-CZ 3.54Å; I142-F149 HydrophobicContact CG1-CE2 4.48Å; V147-F149 HydrophobicContact CB-CD2 4.3Å; V147-F149 HydrophobicContact CB-CE2 3.68Å; V147-F149 HydrophobicContact CB-CZ 4.31Å; V147-F149 HydrophobicContact CG1-CD2 3.98Å; V147-F149 HydrophobicContact CG1-CE1 4.45Å; V147-F149 HydrophobicContact CG1-CE2 3.45Å; V147-F149 VanDerWaalsContact CG1-CE2 3.45Å; V147-F149 HydrophobicContact CG1-CZ 3.73Å; V147-F149 VanDerWaalsContact O-CD2 3.27Å; V147-F149 WeakPolarHBondContact O-CD2 3.31Å; F149-T158 HydrophobicContact CD1-CG2 4.24Å; F149-T158 HydrophobicContact CE1-CG2 3.47Å; F149-T158 VanDerWaalsContact CE1-CG2 3.47Å; F149-T158 HydrophobicContact CZ-CG2 3.99Å; F149-I160 HydrophobicContact CE1-CG2 3.51Å; F149-I160 HydrophobicContact CZ-CG2 3.69Å; F149-N219 WeakPolarHBondContact CA-O 3.46Å; F149-N219 HydrophobicContact CD1-CB 3.52Å; F149-N219 HydrophobicContact CE1-CB 3.76Å; F149-N219 HydrophobicContact CG-CB 4.17Å; F149-L221 HydrophobicContact CB-CB 3.71Å; F149-L221 HydrophobicContact CD1-CB 4.11Å; F149-L221 HydrophobicContact CD1-CD1 4.46Å; F149-L221 HydrophobicContact CG-CB 4.03Å; F149-L221 HydrophobicContact CG-CD1 4.32Å; F149-W225 HydrophobicContact CZ-CZ3 4.21Å
150	Q	89.4	Confident	90.5	Very high	24 Å²	24	52.2 Å²	52.2	11%	0.112	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	128.4	156.7	178.6	-173.7	-37.1	0	0	108.1	K135 R136 D152 N219 L220 L221	K135-Q150 HydrophobicContact CB-CG 4.1Å; K135-Q150 VanDerWaalsContact CE-OE1 3.22Å; K135-Q150 HydrophobicContact CG-CG 4.42Å; R136-Q150 WeakPolarHBondContact O-CA 3.44Å; Q150-D152 PolarHBondContact O-N 3.11Å; Q150-N219 PolarHBondContact N-O 3.37Å; Q150-L220 HydrophobicContact CB-CD2 4.2Å; Q150-L220 HydrophobicContact CG-CD2 4.48Å; Q150-L221 PolarHBondContact O-N 2.74Å
151	I	87.8	Confident	90.5	Very high	32 Å²	32	52.4 Å²	52.4	16%	0.164	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	125.6	173.8	-58.3	174.8	0	0	0	108.3	R136 I138 I226 L236 L239	R136-I151 HydrophobicContact CB-CD1 4.3Å; R136-I151 PolarHBondContact O-N 3.23Å; I138-I151 HydrophobicContact CB-CD1 4.12Å; I138-I151 HydrophobicContact CB-CG1 4.15Å; I138-I151 HydrophobicContact CG2-CD1 4.1Å; I138-I151 HydrophobicContact CG2-CG1 3.62Å; I151-I226 HydrophobicContact CG2-CD1 3.86Å; I151-L236 HydrophobicContact CD1-CD2 3.52Å; I151-L239 HydrophobicContact CD1-CD1 4.44Å
152	D	87.4	Confident	90.5	Very high	28 Å²	28	50.4 Å²	50.4	15%	0.15	27%	0.274	C	S	.	.			trans	-138.8	90.4	-178.3	-163.8	-7.1	0	0	0	110.8	Q150 G154 S155 L220 L221	Q150-D152 PolarHBondContact O-N 3.11Å; D152-G154 PolarHBondContact O-N 3.33Å; D152-G154 PolarHBondContact OD1-N 2.91Å; D152-S155 PolarHBondContact O-N 3.07Å; D152-L220 HydrophobicContact CB-CB 4.43Å; D152-L220 HydrophobicContact CB-CD2 4.39Å; D152-L221 PolarHBondContact N-O 3.1Å
153	T	84.6	Confident	90.3	Very high	52 Å²	52	56.4 Å²	56.4	32%	0.319	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.6	178.3	56.7	0	0	0	0	112.5	S155 I226 Y232	T153-S155 VanDerWaalsContact C-N 3.27Å; T153-S155 PolarHBondContact O-N 2.83Å; T153-I226 HydrophobicContact CG2-CD1 3.94Å; T153-Y232 HydrophobicContact CG2-CE1 4.11Å
154	G	83.3	Confident	90.5	Very high	60 Å²	60	51.7 Å²	51.7	62%	0.619	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.7	176	0	0	0	0	0	114.2	D152	D152-G154 PolarHBondContact O-N 3.33Å; D152-G154 PolarHBondContact OD1-N 2.91Å
155	S	87.3	Confident	90.9	Very high	20 Å²	20	43.7 Å²	43.7	14%	0.14	25%	0.245	C	C	.	.			trans	-102	122.2	173.4	-177.8	0	0	0	0	110.2	D152 T153 R157 G222 A223	D152-S155 PolarHBondContact O-N 3.07Å; T153-S155 VanDerWaalsContact C-N 3.27Å; T153-S155 PolarHBondContact O-N 2.83Å; S155-R157 PolarHBondContact O-N 2.88Å; S155-R157 PolarHBondContact OG-O 2.8Å; S155-G222 CarbonylContact O-C 3.48Å; S155-G222 WeakPolarHBondContact O-CA 3.45Å; S155-A223 PolarHBondContact O-N 2.83Å
156	D	88.3	Confident	91	Very high	127 Å²	127	45.3 Å²	45.3	68%	0.679	25%	0.252	S	S	*	.	S	Bend	trans	-62.6	-33.6	175.6	-66	-41.3	0	0	0	112.7	E224	D156-E224 PolarHBondContact O-N 3.22Å
157	R	90.2	Very high	90.9	Very high	110 Å²	110	48.7 Å²	48.7	42%	0.415	26%	0.256	S	S	.	.	S	Bend	trans	-117.5	148	-168.5	-57.7	-55.5	-172.5	170.6	-1.9	111.8	S155 Y211 E224	S155-R157 PolarHBondContact O-N 2.88Å; S155-R157 PolarHBondContact OG-O 2.8Å; R157-Y211 HydrophobicContact CB-CD2 3.84Å; R157-Y211 HydrophobicContact CB-CE2 3.96Å; R157-Y211 HydrophobicContact CG-CD2 4.25Å; R157-Y211 HydrophobicContact CG-CE2 3.88Å; R157-E224 IonicContact CZ-OE2 3.38Å; R157-E224 IonicContact NH1-OE2 2.83Å; R157-E224 PolarHBondContact NH1-OE2 3Å
158	T	94.4	Very high	91	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.006	26%	0.26	C	S	.	.			trans	-81.3	123	170.5	-63	0	0	0	0	109.8	F149 Y211 L220 L221 G222 W225	F149-T158 HydrophobicContact CD1-CG2 4.24Å; F149-T158 HydrophobicContact CE1-CG2 3.47Å; F149-T158 VanDerWaalsContact CE1-CG2 3.47Å; F149-T158 HydrophobicContact CZ-CG2 3.99Å; T158-Y211 PolarHBondContact O-N 2.83Å; T158-L220 VanDerWaalsContact CA-O 3.31Å; T158-L220 WeakPolarHBondContact CA-O 3.4Å; T158-L220 WeakPolarHBondContact CG2-O 3.03Å; T158-L221 HydrophobicContact CG2-CD1 4.39Å; T158-G222 PolarHBondContact OG1-N 2.92Å; T158-W225 HydrophobicContact CG2-CD2 3.84Å; T158-W225 HydrophobicContact CG2-CE3 3.78Å; T158-W225 HydrophobicContact CG2-CG 4.44Å; T158-W225 HydrophobicContact CG2-CH2 4.13Å; T158-W225 HydrophobicContact CG2-CZ2 4.19Å; T158-W225 HydrophobicContact CG2-CZ3 3.93Å; T158-W225 WeakPolarHBondContact OG1-CB 3.46Å
159	I	93.5	Very high	91.1	Very high	15 Å²	15	48.1 Å²	48.1	8%	0.077	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.1	-176.7	-56	175.8	0	0	0	108.4	Y211 N219 L220	I159-Y211 CarbonylContact C-O 3.42Å; I159-Y211 WeakPolarHBondContact CA-O 3.29Å; I159-N219 CarbonylContact O-C 3.59Å; I159-N219 WeakPolarHBondContact O-CA 3.47Å; I159-L220 PolarHBondContact N-O 3.08Å; I159-L220 PolarHBondContact O-N 3.33Å
160	I	94.7	Very high	91.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	154.1	172.8	63.7	172.3	0	0	0	110.9	F149 T164 W165 L168 F195 Y211 V212 S213 N219	F149-I160 HydrophobicContact CE1-CG2 3.51Å; F149-I160 HydrophobicContact CZ-CG2 3.69Å; I160-T164 HydrophobicContact CB-CG2 4.12Å; I160-T164 HydrophobicContact CD1-CG2 4.23Å; I160-T164 HydrophobicContact CG2-CG2 4.26Å; I160-W165 HydrophobicContact CD1-CB 3.95Å; I160-L168 HydrophobicContact CD1-CD1 3.79Å; I160-F195 HydrophobicContact CD1-CE1 3.75Å; I160-F195 HydrophobicContact CD1-CZ 3.82Å; I160-Y211 PolarHBondContact N-O 3.22Å; I160-V212 HydrophobicContact CD1-CG2 4.3Å; I160-V212 HydrophobicContact CG1-CG2 4.04Å; I160-V212 WeakPolarHBondContact O-CA 3.42Å; I160-S213 PolarHBondContact O-N 2.65Å; I160-S213 VanDerWaalsContact O-N 3.07Å; I160-N219 WeakPolarHBondContact CA-OD1 3.39Å; I160-N219 HydrophobicContact CG2-CB 4.2Å
161	S	93.2	Very high	91.4	Very high	4 Å²	4	51.1 Å²	51.1	3%	0.028	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	157.1	173.3	77	0	0	0	0	111.5	Q163 T164 W165 S216 N219	S161-Q163 PolarHBondContact O-N 3.04Å; S161-Q163 PolarHBondContact OG-N 3.26Å; S161-T164 PolarHBondContact O-N 2.64Å; S161-T164 PolarHBondContact OG-N 2.77Å; S161-T164 PolarHBondContact OG-OG1 3Å; S161-T164 VanDerWaalsContact OG-OG1 3.08Å; S161-W165 PolarHBondContact O-N 3.35Å; S161-S216 WeakPolarHBondContact CB-O 3.11Å; S161-N219 PolarHBondContact N-OD1 2.89Å
162	V	93.1	Very high	91.8	Very high	22 Å²	22	55.3 Å²	55.3	13%	0.133	32%	0.315	C	S	.	.	H	α-helix	trans	-56.1	-31.8	171	176.6	0	0	0	0	112.2	W165 K166 V212 S213 D214	V162-W165 HydrophobicContact CG1-CE3 4.34Å; V162-K166 HydrophobicContact CG1-CD 4.46Å; V162-K166 WeakPolarHBondContact O-CG 3.39Å; V162-K166 PolarHBondContact O-N 3.08Å; V162-V212 HydrophobicContact CG2-CG1 4.06Å; V162-S213 PolarHBondContact N-O 2.89Å; V162-D214 WeakPolarHBondContact CG2-OD1 3.3Å
163	Q	91.7	Very high	92.2	Very high	127 Å²	127	56.7 Å²	56.7	59%	0.593	32%	0.321	S	S	*	.	H	α-helix	trans	-67	-47.4	178.2	-66.6	177.5	-13.5	0	0	111	S161 W165 K166 Q167	S161-Q163 PolarHBondContact O-N 3.04Å; S161-Q163 PolarHBondContact OG-N 3.26Å; Q163-W165 PolarHBondContact O-N 3.01Å; Q163-K166 WeakPolarHBondContact O-CB 3.21Å; Q163-K166 PolarHBondContact O-N 3.42Å; Q163-Q167 WeakPolarHBondContact O-CG 3.49Å; Q163-Q167 PolarHBondContact O-N 2.87Å
164	T	93.5	Very high	92.6	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.055	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-44.4	174.8	-54.4	0	0	0	0	111.1	V147 I160 S161 K166 Q167 L168 N219	V147-T164 HydrophobicContact CB-CG2 4.49Å; V147-T164 HydrophobicContact CG1-CG2 3.56Å; V147-T164 HydrophobicContact CG2-CG2 4.04Å; I160-T164 HydrophobicContact CB-CG2 4.12Å; I160-T164 HydrophobicContact CD1-CG2 4.23Å; I160-T164 HydrophobicContact CG2-CG2 4.26Å; S161-T164 PolarHBondContact O-N 2.64Å; S161-T164 PolarHBondContact OG-N 2.77Å; S161-T164 PolarHBondContact OG-OG1 3Å; S161-T164 VanDerWaalsContact OG-OG1 3.08Å; T164-K166 VanDerWaalsContact C-N 3.31Å; T164-K166 PolarHBondContact O-N 2.83Å; T164-Q167 WeakPolarHBondContact O-CB 3.49Å; T164-Q167 PolarHBondContact O-N 2.87Å; T164-Q167 VanDerWaalsContact O-N 3.1Å; T164-L168 HydrophobicContact CG2-CD1 4.38Å; T164-L168 WeakPolarHBondContact O-CG 3.41Å; T164-L168 PolarHBondContact O-N 3.02Å; T164-N219 WeakPolarHBondContact CB-OD1 3.32Å; T164-N219 VanDerWaalsContact OG1-CG 3.28Å; T164-N219 PolarHBondContact OG1-ND2 3.13Å; T164-N219 VanDerWaalsContact OG1-ND2 3.1Å; T164-N219 PolarHBondContact OG1-OD1 3.28Å
165	W	95	Very high	93	Very high	36 Å²	36	60.5 Å²	60.5	14%	0.136	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-41.6	176.2	171.4	75.1	0	0	0	112.5	I160 S161 V162 Q163 L168 G169 S170 P171 L173 F195 V212	I160-W165 HydrophobicContact CD1-CB 3.95Å; S161-W165 PolarHBondContact O-N 3.35Å; V162-W165 HydrophobicContact CG1-CE3 4.34Å; Q163-W165 PolarHBondContact O-N 3.01Å; W165-L168 PolarHBondContact O-N 2.91Å; W165-G169 PolarHBondContact O-N 3.3Å; W165-S170 PolarHBondContact O-N 3.17Å; W165-P171 PolarHBondContact NE1-O 3.13Å; W165-L173 HydrophobicContact CZ2-CD1 3.98Å; W165-L173 HydrophobicContact CZ2-CG 3.97Å; W165-F195 AromaticContact CD1-CE1 3.98Å; W165-V212 HydrophobicContact CB-CG1 3.95Å; W165-V212 HydrophobicContact CB-CG2 4.01Å; W165-V212 HydrophobicContact CG-CG1 4.19Å; W165-V212 HydrophobicContact CG-CG2 3.89Å
166	K	93.3	Very high	93	Very high	125 Å²	125	60.2 Å²	60.2	54%	0.543	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-43.4	173.4	-74.3	176.3	179.3	-177.9	0	112.1	V162 Q163 T164 L168 G169	V162-K166 HydrophobicContact CG1-CD 4.46Å; V162-K166 WeakPolarHBondContact O-CG 3.39Å; V162-K166 PolarHBondContact O-N 3.08Å; Q163-K166 WeakPolarHBondContact O-CB 3.21Å; Q163-K166 PolarHBondContact O-N 3.42Å; T164-K166 VanDerWaalsContact C-N 3.31Å; T164-K166 PolarHBondContact O-N 2.83Å; K166-L168 VanDerWaalsContact C-N 3.27Å; K166-L168 PolarHBondContact O-N 3Å; K166-G169 PolarHBondContact O-N 3.03Å
167	Q	91.8	Very high	92.7	Very high	141 Å²	141	59 Å²	59	66%	0.659	33%	0.33	S	S	*	.	H	α-helix	trans	-63.3	-32.2	177	-69.6	170.5	-3.2	0	0	112.6	K145 Q163 T164 G169	K145-Q167 PolarHBondContact NZ-O 3.45Å; Q163-Q167 WeakPolarHBondContact O-CG 3.49Å; Q163-Q167 PolarHBondContact O-N 2.87Å; T164-Q167 WeakPolarHBondContact O-CB 3.49Å; T164-Q167 PolarHBondContact O-N 2.87Å; T164-Q167 VanDerWaalsContact O-N 3.1Å; Q167-G169 PolarHBondContact O-N 3.44Å
168	L	93.8	Very high	92.3	Very high	23 Å²	23	59.1 Å²	59.1	12%	0.12	35%	0.348	C	S	.	.	H	α-helix	trans	-69.3	-12.6	173.7	-68.9	175.1	0	0	0	113.2	I142 K145 V147 I160 T164 W165 K166 F195	I142-L168 HydrophobicContact CB-CD1 4.4Å; I142-L168 HydrophobicContact CB-CD2 4.13Å; I142-L168 HydrophobicContact CD1-CD1 4.21Å; I142-L168 HydrophobicContact CG2-CD1 4.05Å; I142-L168 HydrophobicContact CG2-CD2 4.27Å; K145-L168 HydrophobicContact CB-CD2 3.81Å; K145-L168 HydrophobicContact CD-CD2 3.89Å; K145-L168 HydrophobicContact CG-CD2 4.47Å; K145-L168 PolarHBondContact NZ-O 3.39Å; V147-L168 HydrophobicContact CG2-CD2 3.87Å; V147-L168 HydrophobicContact CG2-CG 4.46Å; I160-L168 HydrophobicContact CD1-CD1 3.79Å; T164-L168 HydrophobicContact CG2-CD1 4.38Å; T164-L168 WeakPolarHBondContact O-CG 3.41Å; T164-L168 PolarHBondContact O-N 3.02Å; W165-L168 PolarHBondContact O-N 2.91Å; K166-L168 VanDerWaalsContact C-N 3.27Å; K166-L168 PolarHBondContact O-N 3Å; L168-F195 HydrophobicContact CD1-CZ 4.05Å
169	G	93.8	Very high	91.7	Very high	54 Å²	54	61.3 Å²	61.3	56%	0.557	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.5	15.8	179.6	0	0	0	0	0	113.4	W165 K166 Q167	W165-G169 PolarHBondContact O-N 3.3Å; K166-G169 PolarHBondContact O-N 3.03Å; Q167-G169 PolarHBondContact O-N 3.44Å
170	S	94	Very high	91.1	Very high	54 Å²	54	70.8 Å²	70.8	38%	0.378	40%	0.396	S	S	.	.			trans	54.4	53.6	178.8	-49.4	0	0	0	0	113.7	W165	W165-S170 PolarHBondContact O-N 3.17Å
171	P	94.7	Very high	90.5	Very high	34 Å²	34	71.7 Å²	71.7	22%	0.221	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-54.6	144.8	178.6	23.9	-34.3	0	0	0	111.3	W165 L173 F195	W165-P171 PolarHBondContact NE1-O 3.13Å; P171-L173 PolarHBondContact O-N 3.39Å; P171-F195 HydrophobicContact CB-CD2 4.07Å; P171-F195 HydrophobicContact CB-CG 4.3Å; P171-F195 HydrophobicContact CG-CD1 4.18Å; P171-F195 HydrophobicContact CG-CD2 3.61Å; P171-F195 HydrophobicContact CG-CE1 4.34Å; P171-F195 HydrophobicContact CG-CE2 3.77Å; P171-F195 HydrophobicContact CG-CG 3.84Å; P171-F195 HydrophobicContact CG-CZ 4.14Å
172	P	95.5	Very high	90.1	Very high	120 Å²	120	75.1 Å²	75.1	78%	0.779	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-53.4	130.1	-179.8	-26.2	34	0	0	0	112
173	L	95.8	Very high	89.5	Confident	56 Å²	56	76.7 Å²	76.7	29%	0.293	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-91	133.8	-179.6	-64.4	179.4	0	0	0	110.6	W165 P171 R192 S194 F195 V212	W165-L173 HydrophobicContact CZ2-CD1 3.98Å; W165-L173 HydrophobicContact CZ2-CG 3.97Å; P171-L173 PolarHBondContact O-N 3.39Å; L173-R192 HydrophobicContact CD1-CB 4.4Å; L173-R192 HydrophobicContact CD1-CG 3.82Å; L173-S194 CarbonylContact C-O 3.54Å; L173-S194 WeakPolarHBondContact CA-O 3.47Å; L173-F195 HydrophobicContact CD2-CB 4.39Å; L173-F195 HydrophobicContact CD2-CD1 3.95Å; L173-V212 HydrophobicContact CD2-CB 4.49Å; L173-V212 HydrophobicContact CD2-CG2 3.79Å
174	S	94.6	Very high	88.5	Confident	71 Å²	71	79.9 Å²	79.9	50%	0.497	44%	0.442	S	S	.	.	B	Isolated β-bridge	trans	-86.8	150.6	167.1	-57.6	0	0	0	0	110.1	G193 S194	S174-G193 WeakPolarHBondContact O-CA 3.49Å; S174-S194 PolarHBondContact N-O 3.38Å; S174-S194 PolarHBondContact O-N 3.24Å
175	D	90.5	Very high	87.5	Confident	122 Å²	122	85.5 Å²	85.5	65%	0.652	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-60.5	144.3	176.2	-178.8	41.6	0	0	0	111.9	S177	D175-S177 PolarHBondContact OD1-N 3.32Å; D175-S177 WeakPolarHBondContact OD2-CB 3.32Å; D175-S177 PolarHBondContact OD2-N 3.45Å; D175-S177 PolarHBondContact OD2-OG 3.04Å
176	T	87.8	Confident	86.7	Confident	13 Å²	13	86.1 Å²	86.1	8%	0.08	49%	0.49	C	S	.	.			trans	-123.1	18.7	179.8	51.6	0	0	0	0	112.1	S178 V179 G193 Y211	T176-S178 PolarHBondContact O-N 3.45Å; T176-S178 VanDerWaalsContact O-N 3.12Å; T176-V179 PolarHBondContact O-N 2.99Å; T176-G193 VanDerWaalsContact CG2-C 3.46Å; T176-Y211 HydrophobicContact CG2-CD1 4.01Å; T176-Y211 HydrophobicContact CG2-CE1 4.05Å
177	S	81.1	Confident	86.1	Confident	101 Å²	101	85 Å²	85	71%	0.706	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.5	179.5	63.8	0	0	0	0	114.2	D175	D175-S177 PolarHBondContact OD1-N 3.32Å; D175-S177 WeakPolarHBondContact OD2-CB 3.32Å; D175-S177 PolarHBondContact OD2-N 3.45Å; D175-S177 PolarHBondContact OD2-OG 3.04Å
178	S	82.2	Confident	85.7	Confident	113 Å²	113	83 Å²	83	79%	0.79	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-5.2	175.4	59.3	0	0	0	0	114.4	T176	T176-S178 PolarHBondContact O-N 3.45Å; T176-S178 VanDerWaalsContact O-N 3.12Å
179	V	82.1	Confident	85.2	Confident	48 Å²	48	83.3 Å²	83.3	29%	0.291	49%	0.489	S	S	.	.			trans	-113.9	114.3	-175.2	-176.6	0	0	0	0	109.5	T176 L191 Y211	T176-V179 PolarHBondContact O-N 2.99Å; V179-L191 HydrophobicContact CG1-CD1 4.2Å; V179-Y211 HydrophobicContact CB-CE1 4.36Å; V179-Y211 HydrophobicContact CG1-CE1 3.91Å; V179-Y211 HydrophobicContact CG2-CE1 4.2Å
180	R	81.2	Confident	84.9	Confident	214 Å²	214	83.8 Å²	83.8	81%	0.808	48%	0.482	S	S	*	.			trans	-96	116.5	171.3	-169.5	-176.4	-62.7	165.3	1.7	108.8	T182	R180-T182 HydrophobicContact CG-CG2 4.17Å
181	A	82.2	Confident	84.7	Confident	19 Å²	19	82.8 Å²	82.8	16%	0.157	47%	0.472	C	S	.	.			trans	-101.5	131.5	170.1	0	0	0	0	0	109.2	I189 L191	A181-I189 HydrophobicContact CB-CB 3.85Å; A181-I189 HydrophobicContact CB-CD1 4.45Å; A181-I189 HydrophobicContact CB-CG2 4.35Å; A181-I189 PolarHBondContact O-N 2.98Å; A181-L191 HydrophobicContact CB-CD1 3.9Å; A181-L191 HydrophobicContact CB-CD2 4.3Å; A181-L191 HydrophobicContact CB-CG 4.11Å
182	T	84.7	Confident	84.5	Confident	75 Å²	75	86.9 Å²	86.9	46%	0.46	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-132.3	145.9	-179.4	46.9	0	0	0	0	110.3	R180 D187	R180-T182 HydrophobicContact CG-CG2 4.17Å; T182-D187 CarbonylContact C-O 3.51Å; T182-D187 VanDerWaalsContact CA-O 3.22Å; T182-D187 WeakPolarHBondContact CA-O 2.92Å
183	T	79.8	Confident	84.5	Confident	56 Å²	56	81.2 Å²	81.2	34%	0.344	45%	0.446	S	S	.	.			trans	-72.8	169	167	71.3	0	0	0	0	110	N185 G186 D187 I189	T183-N185 PolarHBondContact O-N 3.09Å; T183-N185 VanDerWaalsContact O-N 3.14Å; T183-N185 PolarHBondContact OG1-N 2.86Å; T183-G186 PolarHBondContact O-N 3.39Å; T183-D187 HydrophobicContact CG2-CB 4.28Å; T183-D187 PolarHBondContact N-O 2.81Å; T183-D187 WeakPolarHBondContact OG1-CB 3.49Å; T183-D187 PolarHBondContact OG1-N 3.16Å; T183-I189 HydrophobicContact CG2-CD1 3.98Å; T183-I189 HydrophobicContact CG2-CG1 3.77Å
184	Y	70.3	Confident	84.4	Confident	193 Å²	193	79.3 Å²	79.3	76%	0.757	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-29.5	173.6	177.5	-99.5	0	0	0	113.4	G186	Y184-G186 VanDerWaalsContact C-N 3.25Å; Y184-G186 PolarHBondContact O-N 2.9Å
185	N	74.2	Confident	84.5	Confident	128 Å²	128	76.4 Å²	76.4	68%	0.684	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	2	178.9	-65.2	-13.2	0	0	0	113.5	T183 D187	T183-N185 PolarHBondContact O-N 3.09Å; T183-N185 VanDerWaalsContact O-N 3.14Å; T183-N185 PolarHBondContact OG1-N 2.86Å; N185-D187 VanDerWaalsContact C-N 3.32Å
186	G	77.6	Confident	84.7	Confident	49 Å²	49	79.8 Å²	79.8	51%	0.505	42%	0.42	S	S	.	.	S	Bend	trans	84.6	-2.5	-176.2	0	0	0	0	0	114.8	T183 Y184	T183-G186 PolarHBondContact O-N 3.39Å; Y184-G186 VanDerWaalsContact C-N 3.25Å; Y184-G186 PolarHBondContact O-N 2.9Å
187	D	79.6	Confident	85.1	Confident	102 Å²	102	79.2 Å²	79.2	55%	0.545	42%	0.416	S	S	.	.			trans	-65.1	135.5	176.1	-64.9	-41.6	0	0	0	110.9	T182 T183 N185	T182-D187 CarbonylContact C-O 3.51Å; T182-D187 VanDerWaalsContact CA-O 3.22Å; T182-D187 WeakPolarHBondContact CA-O 2.92Å; T183-D187 HydrophobicContact CG2-CB 4.28Å; T183-D187 PolarHBondContact N-O 2.81Å; T183-D187 WeakPolarHBondContact OG1-CB 3.49Å; T183-D187 PolarHBondContact OG1-N 3.16Å; N185-D187 VanDerWaalsContact C-N 3.32Å
188	T	83.3	Confident	85.8	Confident	99 Å²	99	76.3 Å²	76.3	61%	0.607	40%	0.399	S	S	*	.	B	Isolated β-bridge	trans	-74.5	133.4	179.9	-59.6	0	0	0	0	111.2	P190	T188-P190 WeakPolarHBondContact O-CD 3.35Å
189	I	84.6	Confident	86.4	Confident	29 Å²	29	71 Å²	71	15%	0.149	36%	0.361	C	S	.	.			trans	-93.8	104.5	174.4	-60.3	173.7	0	0	0	108.6	A181 T183 L191 S213 I215	A181-I189 HydrophobicContact CB-CB 3.85Å; A181-I189 HydrophobicContact CB-CD1 4.45Å; A181-I189 HydrophobicContact CB-CG2 4.35Å; A181-I189 PolarHBondContact O-N 2.98Å; T183-I189 HydrophobicContact CG2-CD1 3.98Å; T183-I189 HydrophobicContact CG2-CG1 3.77Å; I189-L191 HydrophobicContact CG2-CD2 4.19Å; I189-L191 PolarHBondContact O-N 3.05Å; I189-S213 WeakPolarHBondContact CG2-OG 3.13Å; I189-I215 HydrophobicContact CB-CD1 3.94Å; I189-I215 HydrophobicContact CG1-CD1 4.24Å; I189-I215 HydrophobicContact CG2-CD1 3.6Å
190	P	86.9	Confident	87	Confident	64 Å²	64	70.3 Å²	70.3	42%	0.416	36%	0.358	S	S	.	.			trans	-55.7	119.8	171	17.5	-34.2	0	0	0	112.2	T188 S213 I215	T188-P190 WeakPolarHBondContact O-CD 3.35Å; P190-S213 WeakPolarHBondContact O-CA 3.31Å; P190-S213 WeakPolarHBondContact O-CB 3.28Å; P190-S213 PolarHBondContact O-OG 3.33Å; P190-I215 HydrophobicContact CG-CD1 3.7Å; P190-I215 HydrophobicContact CG-CG1 3.69Å
191	L	90	Very high	87.3	Confident	32 Å²	32	62.4 Å²	62.4	17%	0.168	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.6	172.7	-60.9	-179.8	0	0	0	109.1	V179 A181 I189 G193 Y211 V212	V179-L191 HydrophobicContact CG1-CD1 4.2Å; A181-L191 HydrophobicContact CB-CD1 3.9Å; A181-L191 HydrophobicContact CB-CD2 4.3Å; A181-L191 HydrophobicContact CB-CG 4.11Å; I189-L191 HydrophobicContact CG2-CD2 4.19Å; I189-L191 PolarHBondContact O-N 3.05Å; L191-G193 VanDerWaalsContact C-N 3.34Å; L191-Y211 HydrophobicContact CD1-CD1 3.82Å; L191-Y211 HydrophobicContact CD1-CE1 4.44Å; L191-Y211 HydrophobicContact CD1-CG 4.47Å; L191-V212 CarbonylContact C-O 3.54Å; L191-V212 WeakPolarHBondContact CA-O 3.31Å
192	R	91.3	Very high	87.4	Confident	121 Å²	121	65.1 Å²	65.1	46%	0.457	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-27.1	174.2	-173.7	176.3	-71.5	-144.1	-6.7	112	L173 V212 D214	L173-R192 HydrophobicContact CD1-CB 4.4Å; L173-R192 HydrophobicContact CD1-CG 3.82Å; R192-V212 HydrophobicContact CB-CB 4.43Å; R192-V212 HydrophobicContact CB-CG1 4.32Å; R192-V212 PolarHBondContact N-O 3.2Å; R192-D214 IonicContact CZ-OD1 3.17Å; R192-D214 IonicContact NE-OD1 3.31Å; R192-D214 PolarHBondContact NE-OD1 2.9Å; R192-D214 IonicContact NH2-OD1 2.68Å; R192-D214 PolarHBondContact NH2-OD1 3.13Å
193	G	93.8	Very high	87.3	Confident	1 Å²	1	68 Å²	68	1%	0.01	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.4	-172.5	179.2	0	0	0	0	0	111.4	S174 T176 L191 V212	S174-G193 WeakPolarHBondContact O-CA 3.49Å; T176-G193 VanDerWaalsContact CG2-C 3.46Å; L191-G193 VanDerWaalsContact C-N 3.34Å; G193-V212 PolarHBondContact O-N 2.91Å
194	S	95.2	Very high	87.5	Confident	15 Å²	15	69.5 Å²	69.5	11%	0.105	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	156.8	177.4	66.7	0	0	0	0	111.7	L173 S174 C210	L173-S194 CarbonylContact C-O 3.54Å; L173-S194 WeakPolarHBondContact CA-O 3.47Å; S174-S194 PolarHBondContact N-O 3.38Å; S174-S194 PolarHBondContact O-N 3.24Å; S194-C210 CarbonylContact C-O 3.59Å; S194-C210 VanDerWaalsContact CA-O 3.3Å; S194-C210 WeakPolarHBondContact CA-O 3.48Å
195	F	95.7	Very high	88.5	Confident	10 Å²	10	64.8 Å²	64.8	4%	0.044	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	150.3	172.3	66.5	-78.5	0	0	0	110.2	I160 W165 L168 P171 L173 C197 C210 V212	I160-F195 HydrophobicContact CD1-CE1 3.75Å; I160-F195 HydrophobicContact CD1-CZ 3.82Å; W165-F195 AromaticContact CD1-CE1 3.98Å; L168-F195 HydrophobicContact CD1-CZ 4.05Å; P171-F195 HydrophobicContact CB-CD2 4.07Å; P171-F195 HydrophobicContact CB-CG 4.3Å; P171-F195 HydrophobicContact CG-CD1 4.18Å; P171-F195 HydrophobicContact CG-CD2 3.61Å; P171-F195 HydrophobicContact CG-CE1 4.34Å; P171-F195 HydrophobicContact CG-CE2 3.77Å; P171-F195 HydrophobicContact CG-CG 3.84Å; P171-F195 HydrophobicContact CG-CZ 4.14Å; L173-F195 HydrophobicContact CD2-CB 4.39Å; L173-F195 HydrophobicContact CD2-CD1 3.95Å; F195-C197 HydrophobicContact CD2-CB 4.03Å; F195-C197 HydrophobicContact CE2-CB 3.74Å; F195-C210 HydrophobicContact CD1-CB 4.29Å; F195-C210 HydrophobicContact CE1-CB 3.73Å; F195-C210 HydrophobicContact CE2-CB 4.22Å; F195-C210 HydrophobicContact CZ-CB 3.69Å; F195-C210 PolarHBondContact N-O 2.83Å; F195-C210 PolarHBondContact O-N 3.08Å; F195-V212 HydrophobicContact CD1-CG2 4.03Å; F195-V212 HydrophobicContact CE1-CG2 3.83Å
196	R	95.4	Very high	89.4	Confident	193 Å²	193	60.7 Å²	60.7	73%	0.728	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	133.6	174.4	-166.1	175.6	-176.2	-162.7	3.6	109.2	S207 G208	R196-S207 PolarHBondContact NE-OG 2.95Å; R196-G208 WeakPolarHBondContact CA-O 3.43Å
197	C	95.7	Very high	90.2	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.014	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	160.8	178.8	54.1	0	0	0	0	111.4	I142 E143 F195 S207 G208	I142-C197 HydrophobicContact CG2-CB 3.81Å; E143-C197 HydrophobicContact CG-CB 4.12Å; E143-C197 VanDerWaalsContact OE1-CA 3.31Å; E143-C197 WeakPolarHBondContact OE1-CA 3.37Å; F195-C197 HydrophobicContact CD2-CB 4.03Å; F195-C197 HydrophobicContact CE2-CB 3.74Å; C197-S207 VanDerWaalsContact O-CA 3.27Å; C197-S207 WeakPolarHBondContact O-CA 3.36Å; C197-S207 PolarHBondContact O-OG 3.49Å; C197-S207 VanDerWaalsContact O-OG 3.13Å; C197-G208 PolarHBondContact N-O 2.62Å; C197-G208 PolarHBondContact O-N 3.42Å
198	A	95.8	Very high	90.8	Very high	40 Å²	40	56 Å²	56	33%	0.331	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	131.9	161.5	0	0	0	0	0	109.4	E143 V206	E143-A198 PolarHBondContact N-O 2.96Å; E143-A198 PolarHBondContact OE1-N 3.25Å; A198-V206 CarbonylContact C-O 3.44Å; A198-V206 WeakPolarHBondContact CA-O 3.12Å
199	Y	95.6	Very high	91.4	Very high	1 Å²	1	53.3 Å²	53.3	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.6	176	59.9	-94.2	0	0	0	111.7	N141 V206 W225 K228 L229	N141-Y199 CarbonylContact O-C 3.56Å; N141-Y199 WeakPolarHBondContact O-CA 3.44Å; Y199-V206 HydrophobicContact CD2-CB 4.43Å; Y199-V206 HydrophobicContact CE2-CB 3.78Å; Y199-V206 HydrophobicContact CE2-CG1 4.39Å; Y199-V206 HydrophobicContact CE2-CG2 4.49Å; Y199-V206 PolarHBondContact N-O 3.34Å; Y199-V206 PolarHBondContact O-N 3.32Å; Y199-V206 VanDerWaalsContact O-O 3.11Å; Y199-W225 AromaticContact CD1-CD2 3.88Å; Y199-W225 HydrophobicContact CD1-CD2 3.88Å; Y199-W225 AromaticContact CD1-CE2 3.59Å; Y199-W225 HydrophobicContact CD1-CE3 4.01Å; Y199-W225 AromaticContact CD1-CH2 3.62Å; Y199-W225 HydrophobicContact CD1-CH2 3.62Å; Y199-W225 AromaticContact CD1-CZ2 3.46Å; Y199-W225 HydrophobicContact CD1-CZ2 3.46Å; Y199-W225 VanDerWaalsContact CD1-CZ2 3.46Å; Y199-W225 AromaticContact CD1-CZ3 3.89Å; Y199-W225 HydrophobicContact CD1-CZ3 3.89Å; Y199-W225 HydrophobicContact CD2-CD2 4.02Å; Y199-W225 AromaticContact CD2-CE3 3.83Å; Y199-W225 HydrophobicContact CD2-CE3 3.83Å; Y199-W225 HydrophobicContact CD2-CZ3 4.23Å; Y199-W225 AromaticContact CE1-CD2 3.76Å; Y199-W225 HydrophobicContact CE1-CD2 3.76Å; Y199-W225 AromaticContact CE1-CE2 3.41Å; Y199-W225 VanDerWaalsContact CE1-CE2 3.41Å; Y199-W225 HydrophobicContact CE1-CE3 4.34Å; Y199-W225 HydrophobicContact CE1-CG 4.17Å; Y199-W225 HydrophobicContact CE1-CH2 4.31Å; Y199-W225 AromaticContact CE1-CZ2 3.72Å; Y199-W225 HydrophobicContact CE1-CZ2 3.72Å; Y199-W225 AromaticContact CE1-NE1 3.64Å; Y199-W225 HydrophobicContact CE2-CB 4.35Å; Y199-W225 AromaticContact CE2-CD2 3.96Å; Y199-W225 HydrophobicContact CE2-CD2 3.96Å; Y199-W225 HydrophobicContact CE2-CE3 4.22Å; Y199-W225 HydrophobicContact CE2-CG 4.02Å; Y199-W225 AromaticContact CG-CD2 3.99Å; Y199-W225 HydrophobicContact CG-CD2 3.99Å; Y199-W225 AromaticContact CG-CE3 3.72Å; Y199-W225 HydrophobicContact CG-CE3 3.72Å; Y199-W225 AromaticContact CG-CH2 3.86Å; Y199-W225 HydrophobicContact CG-CH2 3.86Å; Y199-W225 HydrophobicContact CG-CZ2 4.12Å; Y199-W225 AromaticContact CG-CZ3 3.66Å; Y199-W225 HydrophobicContact CG-CZ3 3.66Å; Y199-W225 AromaticContact CZ-CD1 3.88Å; Y199-W225 AromaticContact CZ-CD2 3.81Å; Y199-W225 AromaticContact CZ-CE2 3.9Å; Y199-W225 AromaticContact CZ-CG 3.82Å; Y199-W225 AromaticContact CZ-NE1 3.94Å; Y199-K228 HydrophobicContact CE2-CB 4.43Å; Y199-K228 WeakPolarHBondContact OH-CD 3.38Å; Y199-L229 HydrophobicContact CD2-CD1 4.15Å; Y199-L229 HydrophobicContact CD2-CD2 3.79Å; Y199-L229 HydrophobicContact CD2-CG 4.02Å; Y199-L229 HydrophobicContact CE2-CD1 4.38Å; Y199-L229 HydrophobicContact CE2-CD2 3.96Å; Y199-L229 HydrophobicContact CE2-CG 3.91Å
200	S	93.1	Very high	91.9	Very high	33 Å²	33	52 Å²	52	23%	0.231	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	148.7	-175.7	54.7	0	0	0	0	113.6	N141 H204	N141-S200 WeakPolarHBondContact CB-OG 3.26Å; N141-S200 PolarHBondContact N-O 2.94Å; N141-S200 PolarHBondContact O-N 2.8Å; S200-H204 CarbonylContact C-O 3.18Å; S200-H204 WeakPolarHBondContact CA-O 3.28Å; S200-H204 WeakPolarHBondContact CB-O 3.42Å
201	F	89.5	Confident	92.2	Very high	49 Å²	49	49.7 Å²	49.7	22%	0.215	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	127	172	-178.4	-98.3	0	0	0	109.1	I138 S139 T203 H204 L229 L231 L239	I138-F201 HydrophobicContact CD1-CD1 4.43Å; I138-F201 HydrophobicContact CD1-CD2 3.76Å; I138-F201 HydrophobicContact CD1-CE1 4.2Å; I138-F201 HydrophobicContact CD1-CE2 3.51Å; I138-F201 HydrophobicContact CD1-CG 4.22Å; I138-F201 HydrophobicContact CD1-CZ 3.76Å; I138-F201 HydrophobicContact CG1-CD2 3.94Å; I138-F201 HydrophobicContact CG1-CE2 3.55Å; I138-F201 HydrophobicContact CG1-CZ 4.17Å; S139-F201 WeakPolarHBondContact O-CD2 3.35Å; F201-T203 PolarHBondContact O-N 3.41Å; F201-H204 PolarHBondContact N-O 3.38Å; F201-H204 PolarHBondContact O-N 2.91Å; F201-L229 HydrophobicContact CB-CB 4.49Å; F201-L229 HydrophobicContact CB-CD1 4.02Å; F201-L229 HydrophobicContact CB-CD2 3.9Å; F201-L229 HydrophobicContact CB-CG 4.36Å; F201-L231 HydrophobicContact CD1-CD2 3.56Å; F201-L231 HydrophobicContact CE1-CD2 3.65Å; F201-L231 HydrophobicContact CG-CD2 4.3Å; F201-L231 HydrophobicContact CZ-CD2 4.47Å; F201-L239 HydrophobicContact CE1-CD2 3.55Å; F201-L239 HydrophobicContact CZ-CD2 3.47Å; F201-L239 VanDerWaalsContact CZ-CD2 3.47Å
202	G	83.4	Confident	92.5	Very high	75 Å²	75	48.1 Å²	48.1	77%	0.773	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	-124.1	-172.5	0	0	0	0	0	111.9
203	T	81.5	Confident	92.4	Very high	136 Å²	136	42.5 Å²	42.5	83%	0.834	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-6.6	177.9	55	0	0	0	0	113.8	F201	F201-T203 PolarHBondContact O-N 3.41Å
204	H	85.2	Confident	91.8	Very high	88 Å²	88	46.5 Å²	46.5	41%	0.407	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.5	-177.9	-62.2	96.6	0	0	0	110.4	S200 F201 L229	S200-H204 CarbonylContact C-O 3.18Å; S200-H204 WeakPolarHBondContact CA-O 3.28Å; S200-H204 WeakPolarHBondContact CB-O 3.42Å; F201-H204 PolarHBondContact N-O 3.38Å; F201-H204 PolarHBondContact O-N 2.91Å; H204-L229 HydrophobicContact CB-CD2 4.32Å
205	S	91.4	Very high	90.4	Very high	93 Å²	93	49.6 Å²	49.6	65%	0.65	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	121.3	176.5	-179.4	0	0	0	0	109.4
206	V	92.6	Very high	88.9	Confident	43 Å²	43	52.7 Å²	52.7	26%	0.261	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	167.2	-172.3	-168.8	0	0	0	0	109.7	A198 Y199 K228	A198-V206 CarbonylContact C-O 3.44Å; A198-V206 WeakPolarHBondContact CA-O 3.12Å; Y199-V206 HydrophobicContact CD2-CB 4.43Å; Y199-V206 HydrophobicContact CE2-CB 3.78Å; Y199-V206 HydrophobicContact CE2-CG1 4.39Å; Y199-V206 HydrophobicContact CE2-CG2 4.49Å; Y199-V206 PolarHBondContact N-O 3.34Å; Y199-V206 PolarHBondContact O-N 3.32Å; Y199-V206 VanDerWaalsContact O-O 3.11Å; V206-K228 HydrophobicContact CG1-CB 4.15Å; V206-K228 HydrophobicContact CG1-CD 4.01Å; V206-K228 HydrophobicContact CG1-CG 4.38Å; V206-K228 HydrophobicContact CG2-CB 4.39Å; V206-K228 WeakPolarHBondContact CG2-O 3.4Å
207	S	93.8	Very high	87.6	Confident	47 Å²	47	47.1 Å²	47.1	33%	0.329	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.9	170.1	177.8	0	0	0	0	111	R196 C197	R196-S207 PolarHBondContact NE-OG 2.95Å; C197-S207 VanDerWaalsContact O-CA 3.27Å; C197-S207 WeakPolarHBondContact O-CA 3.36Å; C197-S207 PolarHBondContact O-OG 3.49Å; C197-S207 VanDerWaalsContact O-OG 3.13Å
208	G	93.6	Very high	86.9	Confident	5 Å²	5	50.2 Å²	50.2	5%	0.052	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	-175.2	178.5	0	0	0	0	0	112.8	R196 C197	R196-G208 WeakPolarHBondContact CA-O 3.43Å; C197-G208 PolarHBondContact N-O 2.62Å; C197-G208 PolarHBondContact O-N 3.42Å
209	T	94.8	Very high	86.7	Confident	43 Å²	43	49.2 Å²	49.2	26%	0.264	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132.9	-176.4	-55.2	0	0	0	0	110.1	Y211 W225	T209-Y211 HydrophobicContact CG2-CD2 4.34Å; T209-Y211 HydrophobicContact CG2-CE1 4.3Å; T209-Y211 HydrophobicContact CG2-CE2 3.81Å; T209-W225 PolarHBondContact O-NE1 3.46Å; T209-W225 VanDerWaalsContact O-NE1 3.16Å
210	C	94.9	Very high	86.6	Confident	0 Å²	0	51 Å²	51	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	133.9	169.4	-169.9	0	0	0	0	108.7	S194 F195 W225	S194-C210 CarbonylContact C-O 3.59Å; S194-C210 VanDerWaalsContact CA-O 3.3Å; S194-C210 WeakPolarHBondContact CA-O 3.48Å; F195-C210 HydrophobicContact CD1-CB 4.29Å; F195-C210 HydrophobicContact CE1-CB 3.73Å; F195-C210 HydrophobicContact CE2-CB 4.22Å; F195-C210 HydrophobicContact CZ-CB 3.69Å; F195-C210 PolarHBondContact N-O 2.83Å; F195-C210 PolarHBondContact O-N 3.08Å; C210-W225 HydrophobicContact CB-CH2 4.09Å; C210-W225 HydrophobicContact CB-CZ2 3.83Å
211	Y	94.9	Very high	86.6	Confident	16 Å²	16	49.5 Å²	49.5	6%	0.063	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	145.3	178.4	-65.1	-90.3	0	0	0	110.4	R157 T158 I159 I160 T176 V179 L191 T209	R157-Y211 HydrophobicContact CB-CD2 3.84Å; R157-Y211 HydrophobicContact CB-CE2 3.96Å; R157-Y211 HydrophobicContact CG-CD2 4.25Å; R157-Y211 HydrophobicContact CG-CE2 3.88Å; T158-Y211 PolarHBondContact O-N 2.83Å; I159-Y211 CarbonylContact C-O 3.42Å; I159-Y211 WeakPolarHBondContact CA-O 3.29Å; I160-Y211 PolarHBondContact N-O 3.22Å; T176-Y211 HydrophobicContact CG2-CD1 4.01Å; T176-Y211 HydrophobicContact CG2-CE1 4.05Å; V179-Y211 HydrophobicContact CB-CE1 4.36Å; V179-Y211 HydrophobicContact CG1-CE1 3.91Å; V179-Y211 HydrophobicContact CG2-CE1 4.2Å; L191-Y211 HydrophobicContact CD1-CD1 3.82Å; L191-Y211 HydrophobicContact CD1-CE1 4.44Å; L191-Y211 HydrophobicContact CD1-CG 4.47Å; T209-Y211 HydrophobicContact CG2-CD2 4.34Å; T209-Y211 HydrophobicContact CG2-CE1 4.3Å; T209-Y211 HydrophobicContact CG2-CE2 3.81Å
212	V	94.7	Very high	86.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.8	177.8	-175.2	0	0	0	0	108.5	I160 V162 W165 L173 L191 R192 G193 F195	I160-V212 HydrophobicContact CD1-CG2 4.3Å; I160-V212 HydrophobicContact CG1-CG2 4.04Å; I160-V212 WeakPolarHBondContact O-CA 3.42Å; V162-V212 HydrophobicContact CG2-CG1 4.06Å; W165-V212 HydrophobicContact CB-CG1 3.95Å; W165-V212 HydrophobicContact CB-CG2 4.01Å; W165-V212 HydrophobicContact CG-CG1 4.19Å; W165-V212 HydrophobicContact CG-CG2 3.89Å; L173-V212 HydrophobicContact CD2-CB 4.49Å; L173-V212 HydrophobicContact CD2-CG2 3.79Å; L191-V212 CarbonylContact C-O 3.54Å; L191-V212 WeakPolarHBondContact CA-O 3.31Å; R192-V212 HydrophobicContact CB-CB 4.43Å; R192-V212 HydrophobicContact CB-CG1 4.32Å; R192-V212 PolarHBondContact N-O 3.2Å; G193-V212 PolarHBondContact O-N 2.91Å; F195-V212 HydrophobicContact CD1-CG2 4.03Å; F195-V212 HydrophobicContact CE1-CG2 3.83Å
213	S	90	Very high	87	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	149.4	177.3	-175.5	0	0	0	0	111.7	I160 V162 I189 P190 I215	I160-S213 PolarHBondContact O-N 2.65Å; I160-S213 VanDerWaalsContact O-N 3.07Å; V162-S213 PolarHBondContact N-O 2.89Å; I189-S213 WeakPolarHBondContact CG2-OG 3.13Å; P190-S213 WeakPolarHBondContact O-CA 3.31Å; P190-S213 WeakPolarHBondContact O-CB 3.28Å; P190-S213 PolarHBondContact O-OG 3.33Å; S213-I215 PolarHBondContact OG-N 3.48Å
214	D	81.4	Confident	87.5	Confident	84 Å²	84	40.2 Å²	40.2	45%	0.449	24%	0.238	S	C	.	.	S	Bend	trans	-79.8	-6.3	172.6	-66.1	-43.7	0	0	0	112.7	V162 R192	V162-D214 WeakPolarHBondContact CG2-OD1 3.3Å; R192-D214 IonicContact CZ-OD1 3.17Å; R192-D214 IonicContact NE-OD1 3.31Å; R192-D214 PolarHBondContact NE-OD1 2.9Å; R192-D214 IonicContact NH2-OD1 2.68Å; R192-D214 PolarHBondContact NH2-OD1 3.13Å
215	I	66.5	Low	88	Confident	80 Å²	80	36 Å²	36	41%	0.41	22%	0.219	S	C	.	.	S	Bend	trans	-96.1	115.2	-173.1	-45.4	168.3	0	0	0	111.1	I189 P190 S213	I189-I215 HydrophobicContact CB-CD1 3.94Å; I189-I215 HydrophobicContact CG1-CD1 4.24Å; I189-I215 HydrophobicContact CG2-CD1 3.6Å; P190-I215 HydrophobicContact CG-CD1 3.7Å; P190-I215 HydrophobicContact CG-CG1 3.69Å; S213-I215 PolarHBondContact OG-N 3.48Å
216	S	62.6	Low	88	Confident	75 Å²	75	31.8 Å²	31.8	52%	0.524	19%	0.189	S	C	.	.			trans	65	158.4	174.9	86.5	0	0	0	0	116.1	S161 N218	S161-S216 WeakPolarHBondContact CB-O 3.11Å; S216-N218 PolarHBondContact O-N 3.48Å
217	S	69.4	Low	87.8	Confident	77 Å²	77	36.9 Å²	36.9	54%	0.538	21%	0.208	S	C	.	.	S	Bend	trans	-78	-1.5	-179.7	51.7	0	0	0	0	114.1
218	N	79.9	Confident	87.7	Confident	66 Å²	66	38.4 Å²	38.4	35%	0.353	21%	0.209	S	C	.	.			trans	-92	143.3	-171	-62.1	-26.7	0	0	0	111.4	S216	S216-N218 PolarHBondContact O-N 3.48Å
219	N	92.5	Very high	87.6	Confident	19 Å²	19	38.2 Å²	38.2	10%	0.102	21%	0.207	C	C	.	.			trans	-99.3	130.6	171	-50.9	-49.9	0	0	0	108.4	V147 T148 F149 Q150 I159 I160 S161 T164	V147-N219 HydrophobicContact CG1-CB 4.48Å; T148-N219 WeakPolarHBondContact O-CB 3.34Å; T148-N219 PolarHBondContact O-ND2 3Å; F149-N219 WeakPolarHBondContact CA-O 3.46Å; F149-N219 HydrophobicContact CD1-CB 3.52Å; F149-N219 HydrophobicContact CE1-CB 3.76Å; F149-N219 HydrophobicContact CG-CB 4.17Å; Q150-N219 PolarHBondContact N-O 3.37Å; I159-N219 CarbonylContact O-C 3.59Å; I159-N219 WeakPolarHBondContact O-CA 3.47Å; I160-N219 WeakPolarHBondContact CA-OD1 3.39Å; I160-N219 HydrophobicContact CG2-CB 4.2Å; S161-N219 PolarHBondContact N-OD1 2.89Å; T164-N219 WeakPolarHBondContact CB-OD1 3.32Å; T164-N219 VanDerWaalsContact OG1-CG 3.28Å; T164-N219 PolarHBondContact OG1-ND2 3.13Å; T164-N219 VanDerWaalsContact OG1-ND2 3.1Å; T164-N219 PolarHBondContact OG1-OD1 3.28Å
220	L	92.5	Very high	87.1	Confident	40 Å²	40	37 Å²	37	21%	0.209	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.5	179.3	-57.2	179.5	0	0	0	109.9	Q150 D152 T158 I159	Q150-L220 HydrophobicContact CB-CD2 4.2Å; Q150-L220 HydrophobicContact CG-CD2 4.48Å; D152-L220 HydrophobicContact CB-CB 4.43Å; D152-L220 HydrophobicContact CB-CD2 4.39Å; T158-L220 VanDerWaalsContact CA-O 3.31Å; T158-L220 WeakPolarHBondContact CA-O 3.4Å; T158-L220 WeakPolarHBondContact CG2-O 3.03Å; I159-L220 PolarHBondContact N-O 3.08Å; I159-L220 PolarHBondContact O-N 3.33Å
221	L	93.4	Very high	86.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	107.8	171.4	-170.6	71.5	0	0	0	108.2	I138 V140 F149 Q150 D152 T158 W225 I226 L231	I138-L221 HydrophobicContact CG2-CD2 3.73Å; V140-L221 HydrophobicContact CG2-CD1 4.29Å; V140-L221 HydrophobicContact CG2-CD2 4.27Å; F149-L221 HydrophobicContact CB-CB 3.71Å; F149-L221 HydrophobicContact CD1-CB 4.11Å; F149-L221 HydrophobicContact CD1-CD1 4.46Å; F149-L221 HydrophobicContact CG-CB 4.03Å; F149-L221 HydrophobicContact CG-CD1 4.32Å; Q150-L221 PolarHBondContact O-N 2.74Å; D152-L221 PolarHBondContact N-O 3.1Å; T158-L221 HydrophobicContact CG2-CD1 4.39Å; L221-W225 HydrophobicContact CD1-CB 3.61Å; L221-W225 HydrophobicContact CD1-CD2 4.25Å; L221-W225 HydrophobicContact CD1-CE3 3.68Å; L221-W225 HydrophobicContact CD1-CG 4.29Å; L221-W225 HydrophobicContact CG-CB 4.29Å; L221-I226 HydrophobicContact CD2-CG1 3.99Å; L221-I226 HydrophobicContact CG-CG1 3.98Å; L221-I226 WeakPolarHBondContact O-CD1 3.27Å; L221-L231 HydrophobicContact CD2-CD1 3.65Å
222	G	92.2	Very high	85.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.225	C	C	.	.			trans	-84.9	165.3	-177.2	0	0	0	0	0	113.6	S155 T158 E224 W225 I226	S155-G222 CarbonylContact O-C 3.48Å; S155-G222 WeakPolarHBondContact O-CA 3.45Å; T158-G222 PolarHBondContact OG1-N 2.92Å; G222-E224 PolarHBondContact O-N 3.07Å; G222-E224 VanDerWaalsContact O-N 3.09Å; G222-W225 PolarHBondContact O-N 3.44Å; G222-I226 WeakPolarHBondContact O-CG1 3.47Å; G222-I226 PolarHBondContact O-N 2.88Å
223	A	89.9	Confident	84.8	Confident	20 Å²	20	49.1 Å²	49.1	17%	0.165	26%	0.261	C	S	.	.	H	α-helix	trans	-48.5	-38.5	-177	0	0	0	0	0	113.6	S155 W225 I226 F227	S155-A223 PolarHBondContact O-N 2.83Å; A223-W225 PolarHBondContact O-N 3.16Å; A223-I226 PolarHBondContact O-N 2.72Å; A223-F227 WeakPolarHBondContact O-CB 3.38Å; A223-F227 PolarHBondContact O-N 3.32Å
224	E	92.3	Very high	83.8	Confident	45 Å²	45	53.3 Å²	53.3	21%	0.21	28%	0.28	C	S	.	.	H	α-helix	trans	-59.8	-46	178.1	-170.4	-166.8	154.9	0	0	112.4	D156 R157 G222 K228	D156-E224 PolarHBondContact O-N 3.22Å; R157-E224 IonicContact CZ-OE2 3.38Å; R157-E224 IonicContact NH1-OE2 2.83Å; R157-E224 PolarHBondContact NH1-OE2 3Å; G222-E224 PolarHBondContact O-N 3.07Å; G222-E224 VanDerWaalsContact O-N 3.09Å; E224-K228 HydrophobicContact CG-CD 4.28Å; E224-K228 WeakPolarHBondContact O-CB 3.38Å; E224-K228 WeakPolarHBondContact O-CG 3.49Å; E224-K228 PolarHBondContact O-N 3.48Å; E224-K228 VanDerWaalsContact O-N 3.12Å; E224-K228 IonicContact OE1-NZ 3.73Å; E224-K228 PolarHBondContact OE1-NZ 2.9Å
225	W	94.6	Very high	82.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-77.6	-35	179.8	-75.4	33.6	0	0	0	111.2	V140 I142 F149 T158 Y199 T209 C210 L221 G222 A223 F227 K228 L229	V140-W225 HydrophobicContact CG1-CE3 4.5Å; V140-W225 HydrophobicContact CG1-CZ3 4.4Å; I142-W225 HydrophobicContact CD1-CH2 3.93Å; I142-W225 HydrophobicContact CD1-CZ3 3.94Å; I142-W225 HydrophobicContact CG1-CH2 4Å; I142-W225 HydrophobicContact CG1-CZ3 3.91Å; F149-W225 HydrophobicContact CZ-CZ3 4.21Å; T158-W225 HydrophobicContact CG2-CD2 3.84Å; T158-W225 HydrophobicContact CG2-CE3 3.78Å; T158-W225 HydrophobicContact CG2-CG 4.44Å; T158-W225 HydrophobicContact CG2-CH2 4.13Å; T158-W225 HydrophobicContact CG2-CZ2 4.19Å; T158-W225 HydrophobicContact CG2-CZ3 3.93Å; T158-W225 WeakPolarHBondContact OG1-CB 3.46Å; Y199-W225 AromaticContact CD1-CD2 3.88Å; Y199-W225 HydrophobicContact CD1-CD2 3.88Å; Y199-W225 AromaticContact CD1-CE2 3.59Å; Y199-W225 HydrophobicContact CD1-CE3 4.01Å; Y199-W225 AromaticContact CD1-CH2 3.62Å; Y199-W225 HydrophobicContact CD1-CH2 3.62Å; Y199-W225 AromaticContact CD1-CZ2 3.46Å; Y199-W225 HydrophobicContact CD1-CZ2 3.46Å; Y199-W225 VanDerWaalsContact CD1-CZ2 3.46Å; Y199-W225 AromaticContact CD1-CZ3 3.89Å; Y199-W225 HydrophobicContact CD1-CZ3 3.89Å; Y199-W225 HydrophobicContact CD2-CD2 4.02Å; Y199-W225 AromaticContact CD2-CE3 3.83Å; Y199-W225 HydrophobicContact CD2-CE3 3.83Å; Y199-W225 HydrophobicContact CD2-CZ3 4.23Å; Y199-W225 AromaticContact CE1-CD2 3.76Å; Y199-W225 HydrophobicContact CE1-CD2 3.76Å; Y199-W225 AromaticContact CE1-CE2 3.41Å; Y199-W225 VanDerWaalsContact CE1-CE2 3.41Å; Y199-W225 HydrophobicContact CE1-CE3 4.34Å; Y199-W225 HydrophobicContact CE1-CG 4.17Å; Y199-W225 HydrophobicContact CE1-CH2 4.31Å; Y199-W225 AromaticContact CE1-CZ2 3.72Å; Y199-W225 HydrophobicContact CE1-CZ2 3.72Å; Y199-W225 AromaticContact CE1-NE1 3.64Å; Y199-W225 HydrophobicContact CE2-CB 4.35Å; Y199-W225 AromaticContact CE2-CD2 3.96Å; Y199-W225 HydrophobicContact CE2-CD2 3.96Å; Y199-W225 HydrophobicContact CE2-CE3 4.22Å; Y199-W225 HydrophobicContact CE2-CG 4.02Å; Y199-W225 AromaticContact CG-CD2 3.99Å; Y199-W225 HydrophobicContact CG-CD2 3.99Å; Y199-W225 AromaticContact CG-CE3 3.72Å; Y199-W225 HydrophobicContact CG-CE3 3.72Å; Y199-W225 AromaticContact CG-CH2 3.86Å; Y199-W225 HydrophobicContact CG-CH2 3.86Å; Y199-W225 HydrophobicContact CG-CZ2 4.12Å; Y199-W225 AromaticContact CG-CZ3 3.66Å; Y199-W225 HydrophobicContact CG-CZ3 3.66Å; Y199-W225 AromaticContact CZ-CD1 3.88Å; Y199-W225 AromaticContact CZ-CD2 3.81Å; Y199-W225 AromaticContact CZ-CE2 3.9Å; Y199-W225 AromaticContact CZ-CG 3.82Å; Y199-W225 AromaticContact CZ-NE1 3.94Å; T209-W225 PolarHBondContact O-NE1 3.46Å; T209-W225 VanDerWaalsContact O-NE1 3.16Å; C210-W225 HydrophobicContact CB-CH2 4.09Å; C210-W225 HydrophobicContact CB-CZ2 3.83Å; L221-W225 HydrophobicContact CD1-CB 3.61Å; L221-W225 HydrophobicContact CD1-CD2 4.25Å; L221-W225 HydrophobicContact CD1-CE3 3.68Å; L221-W225 HydrophobicContact CD1-CG 4.29Å; L221-W225 HydrophobicContact CG-CB 4.29Å; G222-W225 PolarHBondContact O-N 3.44Å; A223-W225 PolarHBondContact O-N 3.16Å; W225-F227 VanDerWaalsContact C-N 3.31Å; W225-F227 PolarHBondContact O-N 2.91Å; W225-K228 PolarHBondContact O-N 3.24Å; W225-L229 VanDerWaalsContact O-CB 3.28Å; W225-L229 WeakPolarHBondContact O-CB 3.48Å; W225-L229 VanDerWaalsContact O-CG 3.31Å; W225-L229 WeakPolarHBondContact O-CG 3.17Å; W225-L229 PolarHBondContact O-N 2.88Å
226	I	91.2	Very high	82.4	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-55.3	-49.9	173.3	-65.9	172.4	0	0	0	110	I151 T153 L221 G222 A223 G230 L231 Y232	I151-I226 HydrophobicContact CG2-CD1 3.86Å; T153-I226 HydrophobicContact CG2-CD1 3.94Å; L221-I226 HydrophobicContact CD2-CG1 3.99Å; L221-I226 HydrophobicContact CG-CG1 3.98Å; L221-I226 WeakPolarHBondContact O-CD1 3.27Å; G222-I226 WeakPolarHBondContact O-CG1 3.47Å; G222-I226 PolarHBondContact O-N 2.88Å; A223-I226 PolarHBondContact O-N 2.72Å; I226-G230 PolarHBondContact O-N 3.47Å; I226-L231 HydrophobicContact CG2-CB 3.88Å; I226-L231 PolarHBondContact O-N 2.66Å; I226-Y232 HydrophobicContact CB-CE2 4.28Å; I226-Y232 HydrophobicContact CG2-CD1 4.03Å; I226-Y232 HydrophobicContact CG2-CD2 3.85Å; I226-Y232 HydrophobicContact CG2-CE1 3.83Å; I226-Y232 HydrophobicContact CG2-CE2 3.65Å; I226-Y232 HydrophobicContact CG2-CG 4.03Å
227	F	89.8	Confident	82	Confident	151 Å²	151	54.1 Å²	54.1	66%	0.662	28%	0.283	S	S	*	.	H	α-helix	trans	-60.9	-51.1	177	179.6	-101.6	0	0	0	111.9	A223 W225 L229 G230 Y232	A223-F227 WeakPolarHBondContact O-CB 3.38Å; A223-F227 PolarHBondContact O-N 3.32Å; W225-F227 VanDerWaalsContact C-N 3.31Å; W225-F227 PolarHBondContact O-N 2.91Å; F227-L229 VanDerWaalsContact C-N 3.28Å; F227-L229 PolarHBondContact O-N 3.19Å; F227-G230 PolarHBondContact O-N 2.79Å; F227-Y232 HydrophobicContact CB-CD2 4.27Å; F227-Y232 HydrophobicContact CB-CE2 4.03Å; F227-Y232 HydrophobicContact CD2-CD2 4.33Å
228	K	91.2	Very high	81.4	Confident	78 Å²	78	56.2 Å²	56.2	34%	0.339	29%	0.288	S	S	.	.	H	α-helix	trans	-66.3	-26.8	-176.4	-76.7	175.7	177.2	177.8	0	114	Y199 V206 E224 W225 G230	Y199-K228 HydrophobicContact CE2-CB 4.43Å; Y199-K228 WeakPolarHBondContact OH-CD 3.38Å; V206-K228 HydrophobicContact CG1-CB 4.15Å; V206-K228 HydrophobicContact CG1-CD 4.01Å; V206-K228 HydrophobicContact CG1-CG 4.38Å; V206-K228 HydrophobicContact CG2-CB 4.39Å; V206-K228 WeakPolarHBondContact CG2-O 3.4Å; E224-K228 HydrophobicContact CG-CD 4.28Å; E224-K228 WeakPolarHBondContact O-CB 3.38Å; E224-K228 WeakPolarHBondContact O-CG 3.49Å; E224-K228 PolarHBondContact O-N 3.48Å; E224-K228 VanDerWaalsContact O-N 3.12Å; E224-K228 IonicContact OE1-NZ 3.73Å; E224-K228 PolarHBondContact OE1-NZ 2.9Å; W225-K228 PolarHBondContact O-N 3.24Å; K228-G230 VanDerWaalsContact C-N 3.32Å
229	L	90.1	Very high	80.3	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-1.8	175.5	-70.5	174.8	0	0	0	113.3	V140 Y199 F201 H204 W225 F227 L231	V140-L229 HydrophobicContact CG1-CD1 4.07Å; V140-L229 HydrophobicContact CG2-CD1 4.05Å; Y199-L229 HydrophobicContact CD2-CD1 4.15Å; Y199-L229 HydrophobicContact CD2-CD2 3.79Å; Y199-L229 HydrophobicContact CD2-CG 4.02Å; Y199-L229 HydrophobicContact CE2-CD1 4.38Å; Y199-L229 HydrophobicContact CE2-CD2 3.96Å; Y199-L229 HydrophobicContact CE2-CG 3.91Å; F201-L229 HydrophobicContact CB-CB 4.49Å; F201-L229 HydrophobicContact CB-CD1 4.02Å; F201-L229 HydrophobicContact CB-CD2 3.9Å; F201-L229 HydrophobicContact CB-CG 4.36Å; H204-L229 HydrophobicContact CB-CD2 4.32Å; W225-L229 VanDerWaalsContact O-CB 3.28Å; W225-L229 WeakPolarHBondContact O-CB 3.48Å; W225-L229 VanDerWaalsContact O-CG 3.31Å; W225-L229 WeakPolarHBondContact O-CG 3.17Å; W225-L229 PolarHBondContact O-N 2.88Å; F227-L229 VanDerWaalsContact C-N 3.28Å; F227-L229 PolarHBondContact O-N 3.19Å; L229-L231 VanDerWaalsContact C-N 3.31Å; L229-L231 HydrophobicContact CB-CD1 4.09Å; L229-L231 HydrophobicContact CB-CG 3.82Å; L229-L231 HydrophobicContact CD1-CD1 4.22Å; L229-L231 PolarHBondContact O-N 3.28Å
230	G	85.4	Confident	78.4	Confident	18 Å²	18	56 Å²	56	19%	0.186	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	28.1	-178.2	0	0	0	0	0	113.3	I226 F227 K228	I226-G230 PolarHBondContact O-N 3.47Å; F227-G230 PolarHBondContact O-N 2.79Å; K228-G230 VanDerWaalsContact C-N 3.32Å
231	L	85.2	Confident	76.1	Confident	10 Å²	10	58.4 Å²	58.4	5%	0.052	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-79.8	-19.5	-174.3	-66.7	178.1	0	0	0	113.6	I138 F201 L221 I226 L229 D233 Q234 L239	I138-L231 HydrophobicContact CD1-CD1 3.68Å; I138-L231 HydrophobicContact CD1-CD2 3.77Å; I138-L231 HydrophobicContact CD1-CG 4.41Å; F201-L231 HydrophobicContact CD1-CD2 3.56Å; F201-L231 HydrophobicContact CE1-CD2 3.65Å; F201-L231 HydrophobicContact CG-CD2 4.3Å; F201-L231 HydrophobicContact CZ-CD2 4.47Å; L221-L231 HydrophobicContact CD2-CD1 3.65Å; I226-L231 HydrophobicContact CG2-CB 3.88Å; I226-L231 PolarHBondContact O-N 2.66Å; L229-L231 VanDerWaalsContact C-N 3.31Å; L229-L231 HydrophobicContact CB-CD1 4.09Å; L229-L231 HydrophobicContact CB-CG 3.82Å; L229-L231 HydrophobicContact CD1-CD1 4.22Å; L229-L231 PolarHBondContact O-N 3.28Å; L231-D233 PolarHBondContact O-N 2.79Å; L231-Q234 PolarHBondContact O-N 3.21Å; L231-L239 HydrophobicContact CD2-CD1 4.23Å; L231-L239 HydrophobicContact CD2-CD2 4.06Å
232	Y	78.6	Confident	73.7	Confident	119 Å²	119	65 Å²	65	47%	0.467	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-64.5	-27.8	174.2	-76.7	-59.4	0	0	0	112.9	T153 I226 F227	T153-Y232 HydrophobicContact CG2-CE1 4.11Å; I226-Y232 HydrophobicContact CB-CE2 4.28Å; I226-Y232 HydrophobicContact CG2-CD1 4.03Å; I226-Y232 HydrophobicContact CG2-CD2 3.85Å; I226-Y232 HydrophobicContact CG2-CE1 3.83Å; I226-Y232 HydrophobicContact CG2-CE2 3.65Å; I226-Y232 HydrophobicContact CG2-CG 4.03Å; F227-Y232 HydrophobicContact CB-CD2 4.27Å; F227-Y232 HydrophobicContact CB-CE2 4.03Å; F227-Y232 HydrophobicContact CD2-CD2 4.33Å
233	D	71.3	Confident	71.1	Confident	141 Å²	141	70.8 Å²	70.8	75%	0.754	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-93.2	4	-177.6	-55.2	-46.3	0	0	0	112.7	L231	L231-D233 PolarHBondContact O-N 2.79Å
234	Q	69.2	Low	68.5	Low	90 Å²	90	75.9 Å²	75.9	42%	0.421	39%	0.391	S	S	.	.	S	Bend	trans	-106.7	131.2	-178.8	-64.5	-65.8	-42.3	0	0	110.5	L231 L236 L239	L231-Q234 PolarHBondContact O-N 3.21Å; Q234-L236 PolarHBondContact O-N 3.34Å; Q234-L236 VanDerWaalsContact O-N 3.08Å; Q234-L239 HydrophobicContact CB-CD1 4.48Å; Q234-L239 HydrophobicContact CB-CD2 4.24Å
235	P	59.7	Low	66	Low	74 Å²	74	77.7 Å²	77.7	48%	0.481	41%	0.406	S	S	.	.			trans	-57.5	118.6	170	-20.7	31.2	0	0	0	109.7	N237 N238	P235-N237 PolarHBondContact O-N 3.11Å; P235-N238 WeakPolarHBondContact O-CB 3.5Å; P235-N238 PolarHBondContact O-N 3.18Å
236	L	60.1	Low	63.4	Low	87 Å²	87	83.8 Å²	83.8	46%	0.455	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-55.7	-25.6	-178.3	-89.8	134.2	0	0	0	113.6	R136 I151 Q234 N238 L239	R136-L236 HydrophobicContact CB-CD2 4.4Å; R136-L236 HydrophobicContact CG-CD2 4.44Å; I151-L236 HydrophobicContact CD1-CD2 3.52Å; Q234-L236 PolarHBondContact O-N 3.34Å; Q234-L236 VanDerWaalsContact O-N 3.08Å; L236-N238 PolarHBondContact O-N 3.41Å; L236-L239 HydrophobicContact CD2-CD1 4.39Å; L236-L239 HydrophobicContact CG-CD1 4.36Å; L236-L239 PolarHBondContact O-N 3.09Å
237	N	54.6	Low	60.8	Low	95 Å²	95	90.2 Å²	90.2	51%	0.508	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-66.7	-22.2	175.8	-67.2	-11.2	0	0	0	113.1	P235 L239	P235-N237 PolarHBondContact O-N 3.11Å; N237-L239 VanDerWaalsContact C-N 3.34Å
238	N	56.2	Low	58.3	Low	121 Å²	121	90.6 Å²	90.6	65%	0.647	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-87.5	-3.3	179	-65	-9.5	0	0	0	113	P235 L236	P235-N238 WeakPolarHBondContact O-CB 3.5Å; P235-N238 PolarHBondContact O-N 3.18Å; L236-N238 PolarHBondContact O-N 3.41Å
239	L	56.4	Low	55.6	Low	17 Å²	17	96.2 Å²	96.2	9%	0.089	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-96.4	-4.6	-172.2	-60.6	173.8	0	0	0	113.7	I138 I151 F201 L231 Q234 L236 N237	I138-L239 HydrophobicContact CD1-CB 4.5Å; I138-L239 HydrophobicContact CD1-CD1 4.33Å; I138-L239 HydrophobicContact CD1-CD2 4.3Å; I151-L239 HydrophobicContact CD1-CD1 4.44Å; F201-L239 HydrophobicContact CE1-CD2 3.55Å; F201-L239 HydrophobicContact CZ-CD2 3.47Å; F201-L239 VanDerWaalsContact CZ-CD2 3.47Å; L231-L239 HydrophobicContact CD2-CD1 4.23Å; L231-L239 HydrophobicContact CD2-CD2 4.06Å; Q234-L239 HydrophobicContact CB-CD1 4.48Å; Q234-L239 HydrophobicContact CB-CD2 4.24Å; L236-L239 HydrophobicContact CD2-CD1 4.39Å; L236-L239 HydrophobicContact CG-CD1 4.36Å; L236-L239 PolarHBondContact O-N 3.09Å; N237-L239 VanDerWaalsContact C-N 3.34Å
240	Q	53.5	Low	52.9	Low	65 Å²	65	100.4 Å²	100.4	30%	0.304	53%	0.527	S	S	.	.			trans	-87.4	118.5	175.6	-104.6	179.6	-32.7	0	0	110.9
241	S	42.8	Very low	50.3	Low	90 Å²	90	107.3 Å²	107.3	63%	0.629	56%	0.559	S	S	*	*	S	Bend	trans	-85.3	-1.6	-179	48	0	0	0	0	115.5
242	D	42.8	Very low	47.6	Very low	137 Å²	137	111.7 Å²	111.7	73%	0.733	58%	0.581	S	S	*	*			trans	-137.2	15.2	-161.3	-63.6	-62.3	0	0	0	116.8
243	L	37.5	Very low	45.2	Very low	122 Å²	122	111.4 Å²	111.4	64%	0.639	60%	0.595	S	S	*	*			trans	-87.5	114.7	170.2	-73.1	171.2	0	0	0	110.3
244	Q	36.4	Very low	43.3	Very low	128 Å²	128	108.1 Å²	108.1	60%	0.598	58%	0.584	S	S	*	*			trans	-63.9	134.7	178.6	-68.5	-90.5	-58.4	0	0	110	E246	Q244-E246 HydrophobicContact CB-CG 4.12Å; Q244-E246 PolarHBondContact O-N 3.42Å
245	P	38.8	Very low	41.4	Very low	83 Å²	83	109.2 Å²	109.2	54%	0.539	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.7	-8.4	-177	-22	32.2	0	0	0	115.7
246	E	39.9	Very low	40.2	Very low	127 Å²	127	114.7 Å²	114.7	59%	0.593	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-29.7	-173	-15.8	-73.6	161.3	0	0	112.7	Q244	Q244-E246 HydrophobicContact CB-CG 4.12Å; Q244-E246 PolarHBondContact O-N 3.42Å
247	D	37.9	Very low	39	Very low	140 Å²	140	114 Å²	114	75%	0.749	61%	0.614	S	S	*	*	S	Bend	trans	-87.3	-16.9	-173.6	-70.7	-39.3	0	0	0	113.7	R249	D247-R249 VanDerWaalsContact C-N 3.33Å
248	E	37.6	Very low	37.9	Very low	158 Å²	158	116 Å²	116	74%	0.738	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-76.3	-18.7	175.5	-79.8	-169	146.9	0	0	113.4
249	R	33.5	Very low	36.9	Very low	196 Å²	196	113.8 Å²	113.8	74%	0.74	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-85.1	-12	-172.5	-73.6	-179.2	173	177.7	-0.4	114.7	D247	D247-R249 VanDerWaalsContact C-N 3.33Å
250	A	32.8	Very low	36	Very low	91 Å²	91	115.2 Å²	115.2	75%	0.752	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-87.9	-4.9	-176.6	0	0	0	0	0	114.8
251	L	32.4	Very low	35.4	Very low	162 Å²	162	114.6 Å²	114.6	85%	0.848	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-111.8	9.7	-178.8	-125.6	78.8	0	0	0	114.4	C253	L251-C253 PolarHBondContact O-N 2.88Å; L251-C253 VanDerWaalsContact O-N 3.13Å
252	I	28.4	Very low	35.4	Very low	103 Å²	103	114.3 Å²	114.3	53%	0.528	63%	0.632	S	S	.	*			trans	-87.6	83.1	-175.3	-52.7	176.4	0	0	0	109.2
253	C	27.9	Very low	35.5	Very low	112 Å²	112	112.7 Å²	112.7	76%	0.757	63%	0.631	S	S	*	*			trans	-74.7	127.2	163.5	-77.2	0	0	0	0	110.1	L251	L251-C253 PolarHBondContact O-N 2.88Å; L251-C253 VanDerWaalsContact O-N 3.13Å
254	S	30.5	Very low	36.3	Very low	73 Å²	73	109.5 Å²	109.5	51%	0.51	61%	0.614	S	S	.	*			trans	51.4	111.2	160.8	40	0	0	0	0	118	E256	S254-E256 PolarHBondContact O-N 2.83Å
255	P	30.3	Very low	37.2	Very low	113 Å²	113	103.5 Å²	103.5	73%	0.734	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	2.5	-173.8	-21.3	31.8	0	0	0	118.3
256	E	33.4	Very low	38.3	Very low	189 Å²	189	104.7 Å²	104.7	88%	0.883	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-6.5	-172.9	-68.4	177.1	167.5	0	0	113.6	S254	S254-E256 PolarHBondContact O-N 2.83Å
257	I	36.3	Very low	39.6	Very low	73 Å²	73	105.2 Å²	105.2	37%	0.374	58%	0.583	S	S	.	*			trans	-118.6	38.3	-178.7	-45.4	-177.9	0	0	0	110.8	A259 E462	I257-A259 PolarHBondContact O-N 2.97Å; I257-A259 VanDerWaalsContact O-N 3.14Å; I257-E462 WeakPolarHBondContact CG2-OE1 3.41Å; I257-E462 WeakPolarHBondContact CG2-OE2 3.39Å
258	H	31.5	Very low	40.8	Very low	137 Å²	137	103.2 Å²	103.2	63%	0.634	57%	0.566	S	S	*	*	S	Bend	trans	-77.6	100.5	171.4	-92.4	-78.4	0	0	0	110.3
259	A	33.8	Very low	42.3	Very low	73 Å²	73	96.2 Å²	96.2	60%	0.603	53%	0.533	S	S	*	.			trans	57.3	82.1	164.1	0	0	0	0	0	115.1	I257 S261 N264	I257-A259 PolarHBondContact O-N 2.97Å; I257-A259 VanDerWaalsContact O-N 3.14Å; A259-S261 PolarHBondContact O-N 3.2Å; A259-N264 PolarHBondContact O-ND2 2.98Å
260	L	37.8	Very low	44.1	Very low	48 Å²	48	89.5 Å²	89.5	25%	0.251	51%	0.508	S	S	.	.			trans	-65	90.7	152.2	-79.1	168.6	0	0	0	108.1	L125 N264 A265 Y268	L125-L260 HydrophobicContact CD1-CB 3.61Å; L125-L260 HydrophobicContact CD1-CD1 4.1Å; L125-L260 HydrophobicContact CD1-CG 4.46Å; L260-N264 WeakPolarHBondContact CA-OD1 3.31Å; L260-N264 WeakPolarHBondContact CB-OD1 3.49Å; L260-N264 WeakPolarHBondContact CD2-OD1 3.48Å; L260-A265 HydrophobicContact CB-CB 4.45Å; L260-A265 HydrophobicContact CD2-CB 4.45Å; L260-Y268 HydrophobicContact CD2-CD2 4.49Å; L260-Y268 HydrophobicContact CD2-CG 4.17Å
261	S	41.7	Very low	45.9	Very low	51 Å²	51	95.4 Å²	95.4	36%	0.357	51%	0.511	S	S	.	.			trans	-62.2	155.2	165.4	59	0	0	0	0	108.7	A259 S263 N264 A265	A259-S261 PolarHBondContact O-N 3.2Å; S261-S263 WeakPolarHBondContact CB-OG 3.35Å; S261-S263 PolarHBondContact O-N 3.33Å; S261-S263 PolarHBondContact OG-OG 3.37Å; S261-N264 PolarHBondContact N-ND2 2.91Å; S261-N264 PolarHBondContact N-OD1 3Å; S261-N264 PolarHBondContact O-N 3.15Å; S261-N264 PolarHBondContact O-OD1 3.32Å; S261-N264 PolarHBondContact OG-N 3.19Å; S261-A265 PolarHBondContact O-N 3.4Å; S261-A265 VanDerWaalsContact O-N 3.16Å
262	A	42.9	Very low	47.8	Very low	85 Å²	85	94.5 Å²	94.5	70%	0.702	50%	0.496	S	S	*	.	H	α-helix	trans	-50.7	-27.6	172.4	0	0	0	0	0	112.3
263	S	43.4	Very low	49.9	Very low	102 Å²	102	90.4 Å²	90.4	71%	0.713	47%	0.474	S	S	*	.	H	α-helix	trans	-72.4	-25.4	177.1	52.5	0	0	0	0	115.9	S261	S261-S263 WeakPolarHBondContact CB-OG 3.35Å; S261-S263 PolarHBondContact O-N 3.33Å; S261-S263 PolarHBondContact OG-OG 3.37Å
264	N	55.8	Low	52.1	Low	55 Å²	55	88.7 Å²	88.7	29%	0.294	46%	0.462	S	S	.	.	H	α-helix	trans	-107	-13.2	179.4	66.5	11.6	0	0	0	113.4	A259 L260 S261 R266 E267 Y268	A259-N264 PolarHBondContact O-ND2 2.98Å; L260-N264 WeakPolarHBondContact CA-OD1 3.31Å; L260-N264 WeakPolarHBondContact CB-OD1 3.49Å; L260-N264 WeakPolarHBondContact CD2-OD1 3.48Å; S261-N264 PolarHBondContact N-ND2 2.91Å; S261-N264 PolarHBondContact N-OD1 3Å; S261-N264 PolarHBondContact O-N 3.15Å; S261-N264 PolarHBondContact O-OD1 3.32Å; S261-N264 PolarHBondContact OG-N 3.19Å; N264-R266 VanDerWaalsContact C-N 3.35Å; N264-R266 PolarHBondContact O-N 3.49Å; N264-E267 PolarHBondContact O-N 3.05Å; N264-Y268 PolarHBondContact O-N 3.3Å
265	A	54.6	Low	54	Low	2 Å²	2	88.6 Å²	88.6	2%	0.017	45%	0.454	C	S	.	.	H	α-helix	trans	-66.7	-35.8	179.3	0	0	0	0	0	112.8	V123 L260 S261 Y268 V269	V123-A265 HydrophobicContact CB-CB 3.65Å; V123-A265 HydrophobicContact CG1-CB 4.18Å; V123-A265 HydrophobicContact CG2-CB 4.11Å; L260-A265 HydrophobicContact CB-CB 4.45Å; L260-A265 HydrophobicContact CD2-CB 4.45Å; S261-A265 PolarHBondContact O-N 3.4Å; S261-A265 VanDerWaalsContact O-N 3.16Å; A265-Y268 PolarHBondContact O-N 2.85Å; A265-V269 WeakPolarHBondContact O-CG2 3.18Å; A265-V269 PolarHBondContact O-N 3.12Å
266	R	61.4	Low	56.1	Low	109 Å²	109	83.3 Å²	83.3	41%	0.411	42%	0.419	S	S	.	.	H	α-helix	trans	-58.1	-52.7	170.5	-176.1	-179.2	178.4	156.6	4.2	110.7	N264 Y268 V269 Y270	N264-R266 VanDerWaalsContact C-N 3.35Å; N264-R266 PolarHBondContact O-N 3.49Å; R266-Y268 VanDerWaalsContact C-N 3.3Å; R266-Y268 PolarHBondContact O-N 2.96Å; R266-V269 PolarHBondContact O-N 3.42Å; R266-Y270 HydrophobicContact CG-CD2 3.49Å; R266-Y270 VanDerWaalsContact CG-CD2 3.49Å; R266-Y270 HydrophobicContact CG-CE2 3.49Å; R266-Y270 VanDerWaalsContact CG-CE2 3.49Å; R266-Y270 VanDerWaalsContact NE-CE2 3.34Å; R266-Y270 PolarHBondContact NH2-OH 3.28Å; R266-Y270 WeakPolarHBondContact O-CB 3.44Å; R266-Y270 WeakPolarHBondContact O-CD2 3.45Å; R266-Y270 PolarHBondContact O-N 3.06Å
267	E	66.8	Low	58	Low	137 Å²	137	74.7 Å²	74.7	64%	0.64	38%	0.379	S	S	*	.	H	α-helix	trans	-63.6	-37.7	-177.5	-169.7	164.9	-170.8	0	0	111.9	N264 R271	N264-E267 PolarHBondContact O-N 3.05Å; E267-R271 WeakPolarHBondContact O-CB 3.48Å; E267-R271 PolarHBondContact O-N 3.46Å
268	Y	65	Low	59.6	Low	99 Å²	99	72.8 Å²	72.8	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-58.4	-52.1	172.4	178.7	-92.8	0	0	0	111.9	L260 N264 A265 R266 R271 R272	L260-Y268 HydrophobicContact CD2-CD2 4.49Å; L260-Y268 HydrophobicContact CD2-CG 4.17Å; N264-Y268 PolarHBondContact O-N 3.3Å; A265-Y268 PolarHBondContact O-N 2.85Å; R266-Y268 VanDerWaalsContact C-N 3.3Å; R266-Y268 PolarHBondContact O-N 2.96Å; Y268-R271 PolarHBondContact O-N 3.1Å; Y268-R272 WeakPolarHBondContact O-CB 3.5Å; Y268-R272 PolarHBondContact O-N 3.4Å
269	V	67.1	Low	61.5	Low	10 Å²	10	72.3 Å²	72.3	6%	0.061	38%	0.375	C	S	.	.	H	α-helix	trans	-64.6	-46.6	-179	175.6	0	0	0	0	111	V123 A265 R266 R271 R272 Y273 W469 F483	V123-V269 HydrophobicContact CG2-CG2 3.76Å; A265-V269 WeakPolarHBondContact O-CG2 3.18Å; A265-V269 PolarHBondContact O-N 3.12Å; R266-V269 PolarHBondContact O-N 3.42Å; V269-R271 VanDerWaalsContact C-N 3.28Å; V269-R271 PolarHBondContact O-N 2.97Å; V269-R272 PolarHBondContact O-N 2.85Å; V269-Y273 HydrophobicContact CG1-CD2 4.17Å; V269-Y273 PolarHBondContact O-N 3.39Å; V269-W469 HydrophobicContact CG1-CZ2 4.25Å; V269-F483 HydrophobicContact CG1-CE2 4.31Å; V269-F483 HydrophobicContact CG1-CZ 4.46Å
270	Y	71.4	Confident	63.7	Low	55 Å²	55	72 Å²	72	22%	0.216	37%	0.368	C	S	.	.	H	α-helix	trans	-59.4	-38.5	177.2	-91	-101.5	0	0	0	112.3	V121 R266 P274 C277 G484	V121-Y270 HydrophobicContact CG2-CE2 4.23Å; R266-Y270 HydrophobicContact CG-CD2 3.49Å; R266-Y270 VanDerWaalsContact CG-CD2 3.49Å; R266-Y270 HydrophobicContact CG-CE2 3.49Å; R266-Y270 VanDerWaalsContact CG-CE2 3.49Å; R266-Y270 VanDerWaalsContact NE-CE2 3.34Å; R266-Y270 PolarHBondContact NH2-OH 3.28Å; R266-Y270 WeakPolarHBondContact O-CB 3.44Å; R266-Y270 WeakPolarHBondContact O-CD2 3.45Å; R266-Y270 PolarHBondContact O-N 3.06Å; Y270-P274 VanDerWaalsContact O-CA 3.32Å; Y270-P274 WeakPolarHBondContact O-CA 3.35Å; Y270-P274 WeakPolarHBondContact O-CB 3.45Å; Y270-C277 HydrophobicContact CD1-CB 3.75Å; Y270-C277 HydrophobicContact CD2-CB 4.2Å; Y270-C277 HydrophobicContact CE1-CB 3.94Å; Y270-C277 HydrophobicContact CE2-CB 4.37Å; Y270-C277 HydrophobicContact CG-CB 3.92Å; Y270-G484 PolarHBondContact OH-OXT 3.37Å
271	R	72.3	Confident	66	Low	215 Å²	215	71.6 Å²	71.6	81%	0.811	37%	0.366	S	S	*	.	H	α-helix	trans	-75.1	-32.8	179	-166.8	176.8	-172.2	177.5	2.8	112.4	E267 Y268 V269	E267-R271 WeakPolarHBondContact O-CB 3.48Å; E267-R271 PolarHBondContact O-N 3.46Å; Y268-R271 PolarHBondContact O-N 3.1Å; V269-R271 VanDerWaalsContact C-N 3.28Å; V269-R271 PolarHBondContact O-N 2.97Å
272	R	71.2	Confident	68.2	Low	143 Å²	143	69.3 Å²	69.3	54%	0.54	35%	0.351	S	S	.	.	H	α-helix	trans	-82.3	-33.4	-177.2	-168.1	84.3	177.1	98.2	0.5	112.3	Y268 V269	Y268-R272 WeakPolarHBondContact O-CB 3.5Å; Y268-R272 PolarHBondContact O-N 3.4Å; V269-R272 PolarHBondContact O-N 2.85Å
273	Y	72.1	Confident	70.5	Confident	17 Å²	17	68.4 Å²	68.4	7%	0.067	33%	0.332	C	S	.	.			trans	-135.3	54.6	-174	-47.3	-77.1	0	0	0	112.7	V269 E275 I276 C277 W469	V269-Y273 HydrophobicContact CG1-CD2 4.17Å; V269-Y273 PolarHBondContact O-N 3.39Å; Y273-E275 PolarHBondContact O-N 3.01Å; Y273-E275 VanDerWaalsContact O-N 3.14Å; Y273-I276 HydrophobicContact CD1-CD1 4.48Å; Y273-I276 HydrophobicContact CG-CD1 4.13Å; Y273-I276 WeakPolarHBondContact O-CG1 3.43Å; Y273-I276 PolarHBondContact O-N 3.06Å; Y273-C277 PolarHBondContact O-N 2.96Å; Y273-C277 VanDerWaalsContact O-N 3.15Å; Y273-C277 PolarHBondContact O-SG 3.29Å; Y273-W469 HydrophobicContact CD2-CZ2 4.41Å; Y273-W469 AromaticContact CD2-NE1 3.46Å; Y273-W469 AromaticContact CE1-NE1 3.81Å; Y273-W469 AromaticContact CE2-CD1 3.59Å; Y273-W469 AromaticContact CE2-NE1 2.94Å; Y273-W469 AromaticContact CZ-CD1 3.4Å; Y273-W469 AromaticContact CZ-NE1 3.16Å; Y273-W469 VanDerWaalsContact OH-CD1 3.25Å
274	P	74.3	Confident	72.8	Confident	76 Å²	76	63.7 Å²	63.7	49%	0.494	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.3	-173.9	25.6	-35.7	0	0	0	113.7	Y270 C277	Y270-P274 VanDerWaalsContact O-CA 3.32Å; Y270-P274 WeakPolarHBondContact O-CA 3.35Å; Y270-P274 WeakPolarHBondContact O-CB 3.45Å; P274-C277 CarbonylContact O-C 3.6Å
275	E	70.3	Confident	74.4	Confident	72 Å²	72	67.1 Å²	67.1	34%	0.336	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-28.3	-176.8	67.1	-67.4	158.5	0	0	114.7	Y273 R477	Y273-E275 PolarHBondContact O-N 3.01Å; Y273-E275 VanDerWaalsContact O-N 3.14Å; E275-R477 HydrophobicContact CG-CG 3.83Å; E275-R477 VanDerWaalsContact CG-NE 3.27Å; E275-R477 IonicContact OE1-CZ 2.92Å; E275-R477 IonicContact OE1-NE 3.2Å; E275-R477 PolarHBondContact OE1-NE 3.09Å; E275-R477 VanDerWaalsContact OE1-NE 3.08Å; E275-R477 IonicContact OE1-NH2 3.95Å; E275-R477 PolarHBondContact OE1-NH2 2.97Å; E275-R477 IonicContact OE2-NH2 2.81Å
276	I	75	Confident	76	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.005	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-26	174.3	60.1	-173.2	0	0	0	111.2	Y273 S278 L476 R477 T482 F483	Y273-I276 HydrophobicContact CD1-CD1 4.48Å; Y273-I276 HydrophobicContact CG-CD1 4.13Å; Y273-I276 WeakPolarHBondContact O-CG1 3.43Å; Y273-I276 PolarHBondContact O-N 3.06Å; I276-S278 VanDerWaalsContact C-N 3.26Å; I276-S278 PolarHBondContact O-N 3.48Å; I276-L476 HydrophobicContact CD1-CD1 4.4Å; I276-L476 HydrophobicContact CG2-CB 4Å; I276-R477 HydrophobicContact CG2-CB 4.02Å; I276-T482 WeakPolarHBondContact O-CA 3.42Å; I276-F483 HydrophobicContact CB-CD1 4.19Å; I276-F483 HydrophobicContact CB-CE1 3.61Å; I276-F483 HydrophobicContact CB-CZ 4.26Å; I276-F483 HydrophobicContact CD1-CE1 3.52Å; I276-F483 HydrophobicContact CD1-CZ 3.73Å; I276-F483 HydrophobicContact CG1-CD1 4.41Å; I276-F483 HydrophobicContact CG1-CE1 3.41Å; I276-F483 VanDerWaalsContact CG1-CE1 3.41Å; I276-F483 HydrophobicContact CG1-CZ 3.6Å; I276-F483 PolarHBondContact O-N 3.39Å
277	C	72.5	Confident	77.4	Confident	8 Å²	8	69.4 Å²	69.4	5%	0.054	33%	0.329	C	S	.	.	S	Bend	trans	-87.3	54.9	172.4	-57.6	0	0	0	0	111.9	Y270 Y273 P274 F483	Y270-C277 HydrophobicContact CD1-CB 3.75Å; Y270-C277 HydrophobicContact CD2-CB 4.2Å; Y270-C277 HydrophobicContact CE1-CB 3.94Å; Y270-C277 HydrophobicContact CE2-CB 4.37Å; Y270-C277 HydrophobicContact CG-CB 3.92Å; Y273-C277 PolarHBondContact O-N 2.96Å; Y273-C277 VanDerWaalsContact O-N 3.15Å; Y273-C277 PolarHBondContact O-SG 3.29Å; P274-C277 CarbonylContact O-C 3.6Å; C277-F483 WeakPolarHBondContact CA-O 3.49Å; C277-F483 WeakPolarHBondContact SG-CE2 3.2Å; C277-F483 WeakPolarHBondContact SG-CZ 3.5Å
278	S	71.3	Confident	78.8	Confident	34 Å²	34	68.2 Å²	68.2	24%	0.238	32%	0.322	C	S	.	.			trans	-104.6	142.8	-178.3	-175.8	0	0	0	0	111.6	I276 S280	I276-S278 VanDerWaalsContact C-N 3.26Å; I276-S278 PolarHBondContact O-N 3.48Å; S278-S280 WeakPolarHBondContact CB-OG 3.34Å; S278-S280 PolarHBondContact O-N 3.37Å; S278-S280 WeakPolarHBondContact OG-CB 3.43Å; S278-S280 PolarHBondContact OG-N 2.63Å; S278-S280 PolarHBondContact OG-OG 2.69Å
279	D	71	Confident	80.3	Confident	126 Å²	126	63.5 Å²	63.5	67%	0.674	30%	0.303	S	S	*	.	S	Bend	trans	-70.3	-9.5	166.8	-81	-41.6	0	0	0	112.8	K119	K119-D279 IonicContact NZ-OD1 2.76Å; K119-D279 PolarHBondContact NZ-OD1 3.16Å
280	S	80.6	Confident	81.7	Confident	66 Å²	66	66.1 Å²	66.1	46%	0.462	32%	0.322	S	S	.	.	S	Bend	trans	-75.3	142.9	174	66.6	0	0	0	0	111.7	S278 G282 T482	S278-S280 WeakPolarHBondContact CB-OG 3.34Å; S278-S280 PolarHBondContact O-N 3.37Å; S278-S280 WeakPolarHBondContact OG-CB 3.43Å; S278-S280 PolarHBondContact OG-N 2.63Å; S278-S280 PolarHBondContact OG-OG 2.69Å; S280-G282 PolarHBondContact O-N 3.05Å; S280-T482 PolarHBondContact O-OG1 3.3Å
281	L	85.8	Confident	82.9	Confident	40 Å²	40	64.1 Å²	64.1	21%	0.209	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-66.9	123.5	171.8	-175.7	68.6	0	0	0	109.8	V327 D394 L397 Q398	L281-V327 HydrophobicContact CD2-CG2 3.35Å; L281-D394 HydrophobicContact CD1-CB 4.15Å; L281-L397 HydrophobicContact CD1-CB 4.02Å; L281-L397 HydrophobicContact CD2-CB 4.19Å; L281-Q398 HydrophobicContact CD1-CG 3.77Å; L281-Q398 HydrophobicContact CG-CG 4.41Å
282	G	87.2	Confident	84.1	Confident	4 Å²	4	62.7 Å²	62.7	4%	0.041	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-64.1	167.1	173.4	0	0	0	0	0	113.2	S280 Q398 D480 T482	S280-G282 PolarHBondContact O-N 3.05Å; G282-Q398 WeakPolarHBondContact O-CA 3.44Å; G282-D480 CarbonylContact C-O 3.56Å; G282-D480 WeakPolarHBondContact CA-O 3.44Å; G282-T482 PolarHBondContact N-OG1 3.26Å
283	H	91.8	Very high	85.3	Confident	65 Å²	65	58.7 Å²	58.7	30%	0.301	30%	0.298	S	S	.	.			trans	-141.5	90.6	179	-176.5	-179.5	0	0	0	110.5	K285 Q398 E400 R422 D480	H283-K285 WeakPolarHBondContact O-CG 3.28Å; H283-K285 PolarHBondContact O-N 3.2Å; H283-Q398 CarbonylContact C-O 3.57Å; H283-Q398 WeakPolarHBondContact CA-O 3.07Å; H283-E400 IonicContact CE1-OE2 2.69Å; H283-E400 IonicContact NE2-OE2 3.75Å; H283-E400 PolarHBondContact NE2-OE2 3.03Å; H283-R422 PolarHBondContact CE1-NH2 3.41Å; H283-R422 VanDerWaalsContact CG-NH2 3.27Å; H283-R422 PolarHBondContact ND1-NH2 3.22Å; H283-R422 PolarHBondContact NE2-NH2 3.06Å; H283-D480 PolarHBondContact N-O 3.22Å; H283-D480 WeakPolarHBondContact O-CB 3.43Å
284	C	91.8	Very high	86.5	Confident	3 Å²	3	63 Å²	63	2%	0.02	32%	0.315	C	S	.	.			trans	-43.7	112	177.7	-178.9	0	0	0	0	112	Q398 I399 W479 F481	C284-Q398 WeakPolarHBondContact CB-O 3.47Å; C284-Q398 PolarHBondContact N-O 2.81Å; C284-I399 HydrophobicContact CB-CG1 4.28Å; C284-W479 CarbonylContact C-O 3.59Å; C284-W479 WeakPolarHBondContact CA-O 3.39Å; C284-F481 HydrophobicContact CB-CE2 3.94Å; C284-F481 HydrophobicContact CB-CZ 3.85Å
285	K	88.2	Confident	87.5	Confident	128 Å²	128	65.6 Å²	65.6	56%	0.557	33%	0.331	S	S	*	.	S	Bend	trans	-82.1	-22.1	-173.2	-70.8	175.5	-177.6	142.7	0	114.1	H283 W479 D480	H283-K285 WeakPolarHBondContact O-CG 3.28Å; H283-K285 PolarHBondContact O-N 3.2Å; K285-W479 PolarHBondContact N-O 3.37Å; K285-D480 HydrophobicContact CD-CB 3.87Å; K285-D480 VanDerWaalsContact CE-CB 3.49Å; K285-D480 VanDerWaalsContact CE-CG 3.41Å; K285-D480 WeakPolarHBondContact CE-OD2 3.25Å; K285-D480 HydrophobicContact CG-CB 3.9Å; K285-D480 IonicContact NZ-OD1 3.08Å; K285-D480 PolarHBondContact NZ-OD1 3.13Å; K285-D480 IonicContact NZ-OD2 2.62Å
286	F	88.8	Confident	88.6	Confident	133 Å²	133	67.7 Å²	67.7	58%	0.583	35%	0.345	S	S	*	.	S	Bend	trans	-105.6	-12.4	-167.7	-64.6	-76.1	0	0	0	114.7	N478 W479	F286-N478 HydrophobicContact CE2-CB 4.38Å; F286-N478 VanDerWaalsContact CE2-O 3.31Å; F286-N478 WeakPolarHBondContact CE2-O 3.32Å; F286-W479 HydrophobicContact CB-CD2 4.22Å; F286-W479 HydrophobicContact CB-CE3 3.94Å; F286-W479 HydrophobicContact CB-CH2 4.1Å; F286-W479 HydrophobicContact CB-CZ2 4.36Å; F286-W479 HydrophobicContact CB-CZ3 3.86Å; F286-W479 HydrophobicContact CD2-CB 4.15Å; F286-W479 AromaticContact CD2-CD1 3.82Å; F286-W479 AromaticContact CD2-CD2 3.57Å; F286-W479 HydrophobicContact CD2-CD2 3.57Å; F286-W479 AromaticContact CD2-CE2 3.85Å; F286-W479 HydrophobicContact CD2-CE3 4.05Å; F286-W479 AromaticContact CD2-CG 3.58Å; F286-W479 HydrophobicContact CD2-CG 3.58Å; F286-W479 AromaticContact CD2-NE1 3.98Å; F286-W479 HydrophobicContact CE2-CB 4.46Å; F286-W479 AromaticContact CE2-CD1 3.88Å; F286-W479 HydrophobicContact CE2-CD2 4.39Å; F286-W479 AromaticContact CE2-CG 4Å; F286-W479 HydrophobicContact CE2-CG 4Å; F286-W479 HydrophobicContact CG-CD2 4.29Å; F286-W479 HydrophobicContact CG-CE3 4.47Å
287	A	90.9	Very high	89.6	Confident	25 Å²	25	68.8 Å²	68.8	21%	0.207	35%	0.354	C	S	.	.			trans	-139.5	140.7	-177	0	0	0	0	0	112.1	I437 W479	A287-I437 HydrophobicContact CB-CD1 3.74Å; A287-I437 HydrophobicContact CB-CG1 3.76Å; A287-W479 HydrophobicContact CB-CZ3 4.49Å
288	K	95.3	Very high	90.8	Very high	113 Å²	113	75.1 Å²	75.1	49%	0.491	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	139.6	165.1	-59.3	-165.2	-175.8	-166.6	0	109.5	E400	K288-E400 CarbonylContact C-O 3.55Å; K288-E400 WeakPolarHBondContact CA-O 3.21Å; K288-E400 WeakPolarHBondContact CB-O 3.33Å; K288-E400 HydrophobicContact CD-CG 4.2Å; K288-E400 VanDerWaalsContact CE-OE1 3.3Å; K288-E400 WeakPolarHBondContact CE-OE1 3.43Å; K288-E400 HydrophobicContact CG-CB 4.27Å; K288-E400 HydrophobicContact CG-CG 4.45Å; K288-E400 IonicContact NZ-OE1 3.58Å; K288-E400 PolarHBondContact NZ-OE1 2.89Å; K288-E400 IonicContact NZ-OE2 2.82Å
289	A	96.8	Very high	92	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.8	171.4	0	0	0	0	0	109.6	I399 E400 V401 S402 L423 I433	A289-I399 HydrophobicContact CB-CG2 3.86Å; A289-E400 PolarHBondContact N-O 3.28Å; A289-V401 HydrophobicContact CB-CG2 4.33Å; A289-V401 WeakPolarHBondContact O-CA 3.39Å; A289-S402 PolarHBondContact O-N 3.5Å; A289-L423 HydrophobicContact CB-CB 4.22Å; A289-L423 HydrophobicContact CB-CD1 4.06Å; A289-L423 HydrophobicContact CB-CD2 4.03Å; A289-L423 HydrophobicContact CB-CG 4.34Å; A289-I433 HydrophobicContact CB-CD1 4.34Å; A289-I433 HydrophobicContact CB-CG2 3.93Å
290	S	96.6	Very high	93.2	Very high	65 Å²	65	72.5 Å²	72.5	46%	0.455	37%	0.371	S	S	.	.			trans	-118.4	133	171.3	-65.6	0	0	0	0	109.4	S402	S290-S402 WeakPolarHBondContact OG-CB 3.48Å; S290-S402 PolarHBondContact OG-OG 3.3Å; S290-S402 VanDerWaalsContact OG-OG 3.05Å
291	L	97.2	Very high	94.1	Very high	13 Å²	13	74 Å²	74	7%	0.068	37%	0.369	C	S	.	.			trans	-105.9	129.3	-179.4	-60.6	-179.7	0	0	0	108.8	L364 S405 L408 L409 V427 I433	L291-L364 HydrophobicContact CB-CD2 3.78Å; L291-L364 HydrophobicContact CD1-CD1 4.41Å; L291-S405 PolarHBondContact N-OG 3.3Å; L291-S405 PolarHBondContact O-OG 3.09Å; L291-L408 HydrophobicContact CB-CD1 4.03Å; L291-L409 HydrophobicContact CD1-CD1 3.89Å; L291-L409 HydrophobicContact CD1-CD2 3.62Å; L291-L409 HydrophobicContact CD1-CG 3.81Å; L291-V427 HydrophobicContact CD1-CG1 4.04Å; L291-V427 HydrophobicContact CD2-CG1 3.84Å; L291-I433 HydrophobicContact CD2-CD1 3.92Å
292	R	96.5	Very high	94.6	Very high	185 Å²	185	77.6 Å²	77.6	70%	0.698	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-101.5	128.8	177.9	-64.1	-177.2	-177	-174	1	109.1	L364 E365	R292-L364 CarbonylContact O-C 3.54Å; R292-L364 WeakPolarHBondContact O-CA 3.23Å; R292-L364 WeakPolarHBondContact O-CD2 3.19Å; R292-E365 HydrophobicContact CB-CB 4.23Å; R292-E365 PolarHBondContact O-N 2.9Å
293	L	97.4	Very high	95.1	Very high	58 Å²	58	81.9 Å²	81.9	30%	0.304	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-82.2	151.5	169.9	-71.9	172.4	0	0	0	109.7	A297 W336 L360 A363 L364 L408	L293-A297 HydrophobicContact CB-CB 3.89Å; L293-A297 HydrophobicContact CD2-CB 4.04Å; L293-A297 HydrophobicContact CG-CB 4.38Å; L293-W336 HydrophobicContact CD1-CZ2 3.83Å; L293-W336 HydrophobicContact CD2-CH2 3.8Å; L293-W336 HydrophobicContact CD2-CZ2 3.72Å; L293-W336 HydrophobicContact CG-CZ2 4.47Å; L293-L360 HydrophobicContact CD2-CD1 4.46Å; L293-A363 HydrophobicContact CD2-CB 4.07Å; L293-L364 HydrophobicContact CD2-CD2 4.07Å; L293-L408 HydrophobicContact CD1-CD1 4.4Å; L293-L408 HydrophobicContact CD1-CD2 3.81Å; L293-L408 HydrophobicContact CD2-CD1 4.19Å; L293-L408 HydrophobicContact CD2-CD2 4.23Å; L293-L408 HydrophobicContact CG-CD1 4.01Å; L293-L408 HydrophobicContact CG-CD2 4.22Å
294	R	96.8	Very high	95.3	Very high	109 Å²	109	84 Å²	84	41%	0.411	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-62.2	150.2	166.7	-65	-173.3	-65.1	-154.5	1.1	109.9	D296 A297 D362 A363 E365	R294-D296 WeakPolarHBondContact CB-OD1 3.31Å; R294-D296 PolarHBondContact O-N 3.35Å; R294-A297 HydrophobicContact CB-CB 4.42Å; R294-A297 WeakPolarHBondContact O-CB 3.35Å; R294-A297 PolarHBondContact O-N 2.94Å; R294-D362 PolarHBondContact NE-O 2.79Å; R294-D362 PolarHBondContact NH1-O 3.05Å; R294-D362 VanDerWaalsContact NH1-O 3.11Å; R294-D362 VanDerWaalsContact NH2-C 3.27Å; R294-D362 PolarHBondContact NH2-O 3.11Å; R294-A363 PolarHBondContact N-O 3.3Å; R294-E365 HydrophobicContact CG-CG 3.91Å
295	P	95.1	Very high	95.4	Very high	130 Å²	130	88.8 Å²	88.8	84%	0.844	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.2	-176.5	-28.3	35.6	0	0	0	115.2
296	D	94.8	Very high	95.7	Very high	116 Å²	116	88.8 Å²	88.8	62%	0.62	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	4	-178.2	64.6	-30.3	0	0	0	113.8	R294 Q298	R294-D296 WeakPolarHBondContact CB-OD1 3.31Å; R294-D296 PolarHBondContact O-N 3.35Å; D296-Q298 PolarHBondContact O-N 3.03Å; D296-Q298 PolarHBondContact O-NE2 3.43Å
297	A	96.3	Very high	95.8	Very high	23 Å²	23	84 Å²	84	19%	0.19	43%	0.428	C	S	.	.			trans	-59	129.1	-176.2	0	0	0	0	0	112.1	L293 R294 A363	L293-A297 HydrophobicContact CB-CB 3.89Å; L293-A297 HydrophobicContact CD2-CB 4.04Å; L293-A297 HydrophobicContact CG-CB 4.38Å; R294-A297 HydrophobicContact CB-CB 4.42Å; R294-A297 WeakPolarHBondContact O-CB 3.35Å; R294-A297 PolarHBondContact O-N 2.94Å; A297-A363 HydrophobicContact CB-CB 4.03Å
298	Q	96.1	Very high	95.8	Very high	142 Å²	142	86.9 Å²	86.9	66%	0.664	45%	0.445	S	S	*	.			trans	-105.4	144.2	173	-62.1	-56.1	-51.2	0	0	110.3	D296 V300 W336	D296-Q298 PolarHBondContact O-N 3.03Å; D296-Q298 PolarHBondContact O-NE2 3.43Å; Q298-V300 PolarHBondContact O-N 3Å; Q298-W336 WeakPolarHBondContact O-CH2 3.39Å
299	P	97.2	Very high	95.7	Very high	68 Å²	68	91.7 Å²	91.7	44%	0.442	46%	0.461	S	S	.	.			trans	-55.7	133.8	175.5	-24.4	33.6	0	0	0	113.4	A335 W336	P299-A335 HydrophobicContact CB-CB 3.68Å; P299-A335 WeakPolarHBondContact CB-O 3.15Å; P299-A335 HydrophobicContact CG-CB 3.98Å; P299-W336 VanDerWaalsContact CA-CE2 3.5Å; P299-W336 VanDerWaalsContact CA-CZ2 3.46Å; P299-W336 HydrophobicContact CB-CD2 4.23Å; P299-W336 HydrophobicContact CB-CG 4.46Å; P299-W336 HydrophobicContact CB-CZ2 4.25Å; P299-W336 HydrophobicContact CG-CZ2 4.35Å
300	V	97.1	Very high	95.5	Very high	37 Å²	37	95.8 Å²	95.8	22%	0.224	50%	0.495	C	S	.	.			trans	-117.1	114.2	176.1	-175.1	0	0	0	0	109.5	Q298 R302 W336 A337	Q298-V300 PolarHBondContact O-N 3Å; V300-R302 HydrophobicContact CG1-CG 4.11Å; V300-W336 HydrophobicContact CB-CE3 4.25Å; V300-W336 HydrophobicContact CB-CZ3 4.09Å; V300-W336 HydrophobicContact CG2-CZ3 4.07Å; V300-W336 VanDerWaalsContact N-CE3 3.32Å; V300-W336 WeakPolarHBondContact O-CA 3.22Å; V300-A337 PolarHBondContact O-N 2.92Å
301	F	97.8	Very high	95.2	Very high	96 Å²	96	94.7 Å²	94.7	42%	0.421	49%	0.486	S	S	.	.	B	Isolated β-bridge	trans	-106.8	112.3	173.2	-168.3	-77.3	0	0	0	110	S334 A337 N412 L417	F301-S334 WeakPolarHBondContact CD2-O 3.34Å; F301-A337 HydrophobicContact CD1-CB 4.35Å; F301-A337 HydrophobicContact CD2-CB 3.45Å; F301-A337 VanDerWaalsContact CD2-CB 3.45Å; F301-A337 HydrophobicContact CE1-CB 4.37Å; F301-A337 HydrophobicContact CE2-CB 3.48Å; F301-A337 VanDerWaalsContact CE2-CB 3.48Å; F301-A337 HydrophobicContact CG-CB 3.92Å; F301-A337 HydrophobicContact CZ-CB 3.97Å; F301-N412 VanDerWaalsContact CE1-ND2 3.26Å; F301-N412 WeakPolarHBondContact CE1-ND2 3.4Å; F301-N412 WeakPolarHBondContact CZ-ND2 3.44Å; F301-L417 HydrophobicContact CE2-CD1 3.93Å; F301-L417 HydrophobicContact CE2-CD2 4.13Å; F301-L417 HydrophobicContact CZ-CD1 4.24Å; F301-L417 HydrophobicContact CZ-CD2 3.91Å
302	R	97.7	Very high	95.1	Very high	116 Å²	116	95.6 Å²	95.6	44%	0.438	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-98.3	139.8	175.5	-62.8	-57.2	-169.7	-178.8	0.4	110.9	V300 A337 T358 N412	V300-R302 HydrophobicContact CG1-CG 4.11Å; R302-A337 WeakPolarHBondContact CB-O 3.22Å; R302-A337 PolarHBondContact N-O 3.12Å; R302-T358 PolarHBondContact NE-O 3.35Å; R302-T358 PolarHBondContact NH2-O 3.29Å; R302-N412 PolarHBondContact O-ND2 3.21Å
303	P	96.8	Very high	95	Very high	95 Å²	95	90.8 Å²	90.8	62%	0.617	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-67.5	153.1	176.3	29.9	-35.1	0	0	0	110.8
304	K	96.3	Very high	94.8	Very high	109 Å²	109	92.4 Å²	92.4	47%	0.474	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-55.9	149.6	173.1	63	173.8	-179.6	177.7	0	111.8	N412 T413 H414	K304-N412 HydrophobicContact CB-CB 4.49Å; K304-N412 PolarHBondContact N-ND2 3.27Å; K304-T413 WeakPolarHBondContact CD-O 3.33Å; K304-H414 HydrophobicContact CD-CB 4.22Å
305	R	94.8	Very high	94.8	Very high	104 Å²	104	87.2 Å²	87.2	39%	0.392	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-85.8	148.3	167.1	-76	176.5	179.3	154.2	4.4	110.6	V307 P339 D355	R305-V307 PolarHBondContact O-N 2.9Å; R305-P339 HydrophobicContact CB-CB 4.5Å; R305-P339 HydrophobicContact CG-CB 3.88Å; R305-P339 HydrophobicContact CG-CG 4.45Å; R305-D355 IonicContact CZ-OD2 3.9Å; R305-D355 IonicContact NH1-OD2 2.8Å; R305-D355 PolarHBondContact NH1-OD2 2.93Å; R305-D355 IonicContact NH2-OD2 3.18Å; R305-D355 PolarHBondContact NH2-OD2 2.79Å
306	P	93.1	Very high	94.9	Very high	128 Å²	128	85 Å²	85	83%	0.831	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-57.9	133.9	167.3	-21.2	32.8	0	0	0	110.3
307	V	92.3	Very high	95	Very high	31 Å²	31	82.3 Å²	82.3	19%	0.188	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-100.3	126.4	171.8	177.7	0	0	0	0	107.4	R305 Y309 V311 V312 V315 H414	R305-V307 PolarHBondContact O-N 2.9Å; V307-Y309 PolarHBondContact O-N 3.3Å; V307-V311 HydrophobicContact CG1-CG2 3.63Å; V307-V312 HydrophobicContact CB-CG2 4.14Å; V307-V312 HydrophobicContact CG1-CG2 3.81Å; V307-V315 HydrophobicContact CG1-CG2 3.97Å; V307-H414 WeakPolarHBondContact CG2-ND1 3.43Å
308	P	90.9	Very high	94.9	Very high	87 Å²	87	82.7 Å²	82.7	57%	0.565	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-55.5	134.5	177.7	-24.6	32.7	0	0	0	111.2	A310 V311 V312	P308-A310 PolarHBondContact O-N 3.02Å; P308-V311 HydrophobicContact CB-CG2 4.13Å; P308-V311 HydrophobicContact CG-CG2 4.28Å; P308-V311 VanDerWaalsContact O-CG2 3.28Å; P308-V311 WeakPolarHBondContact O-CG2 3.31Å; P308-V311 PolarHBondContact O-N 3.32Å; P308-V312 PolarHBondContact O-N 2.84Å
309	Y	91.6	Very high	94.9	Very high	213 Å²	213	76 Å²	76	84%	0.835	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-51.3	-39.2	-173.6	-176.6	-99	0	0	0	113.2	V307 V311 V312	V307-Y309 PolarHBondContact O-N 3.3Å; Y309-V311 PolarHBondContact O-N 2.91Å; Y309-V312 PolarHBondContact O-N 3.14Å
310	A	92.2	Very high	94.9	Very high	86 Å²	86	76 Å²	76	71%	0.711	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-63.7	-22.6	-179.8	0	0	0	0	0	114.9	P308	P308-A310 PolarHBondContact O-N 3.02Å
311	V	91	Very high	94.8	Very high	43 Å²	43	78.7 Å²	78.7	26%	0.261	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-107.8	-4.9	-178.3	-56.3	0	0	0	0	113.3	V307 P308 Y309 L314 V315	V307-V311 HydrophobicContact CG1-CG2 3.63Å; P308-V311 HydrophobicContact CB-CG2 4.13Å; P308-V311 HydrophobicContact CG-CG2 4.28Å; P308-V311 VanDerWaalsContact O-CG2 3.28Å; P308-V311 WeakPolarHBondContact O-CG2 3.31Å; P308-V311 PolarHBondContact O-N 3.32Å; Y309-V311 PolarHBondContact O-N 2.91Å; V311-L314 WeakPolarHBondContact O-CB 3.34Å; V311-L314 PolarHBondContact O-N 2.9Å; V311-L314 VanDerWaalsContact O-N 3.11Å; V311-V315 HydrophobicContact CG2-CG2 4.45Å; V311-V315 WeakPolarHBondContact O-CG2 3.03Å; V311-V315 PolarHBondContact O-N 3.43Å
312	V	94.5	Very high	94.7	Very high	31 Å²	31	74.5 Å²	74.5	19%	0.188	40%	0.396	C	S	.	.	H	α-helix	trans	-51.7	-51.3	179	166.9	0	0	0	0	112.1	V307 P308 Y309 L314 V315 E316	V307-V312 HydrophobicContact CB-CG2 4.14Å; V307-V312 HydrophobicContact CG1-CG2 3.81Å; P308-V312 PolarHBondContact O-N 2.84Å; Y309-V312 PolarHBondContact O-N 3.14Å; V312-L314 VanDerWaalsContact C-N 3.25Å; V312-L314 PolarHBondContact O-N 3.33Å; V312-V315 PolarHBondContact O-N 2.82Å; V312-V315 VanDerWaalsContact O-N 3.09Å; V312-E316 HydrophobicContact CG1-CG 4.28Å; V312-E316 WeakPolarHBondContact O-CG 3.32Å; V312-E316 PolarHBondContact O-N 3.19Å
313	P	95.2	Very high	94.7	Very high	84 Å²	84	71.7 Å²	71.7	55%	0.545	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-33.4	-179.5	-23.6	34.6	0	0	0	113.5	A317	P313-A317 VanDerWaalsContact O-CB 3.29Å; P313-A317 WeakPolarHBondContact O-CB 3.1Å; P313-A317 PolarHBondContact O-N 2.99Å
314	L	94.3	Very high	94.6	Very high	92 Å²	92	75.6 Å²	75.6	48%	0.482	40%	0.396	S	S	.	.	H	α-helix	trans	-72.4	-37.5	178.3	-62.5	176.9	0	0	0	111.5	V311 V312 E318 L350	V311-L314 WeakPolarHBondContact O-CB 3.34Å; V311-L314 PolarHBondContact O-N 2.9Å; V311-L314 VanDerWaalsContact O-N 3.11Å; V312-L314 VanDerWaalsContact C-N 3.25Å; V312-L314 PolarHBondContact O-N 3.33Å; L314-E318 WeakPolarHBondContact O-CB 3.49Å; L314-E318 PolarHBondContact O-N 3.3Å; L314-E318 VanDerWaalsContact O-N 3.15Å; L314-L350 HydrophobicContact CB-CD1 3.47Å; L314-L350 VanDerWaalsContact CB-CD1 3.47Å; L314-L350 HydrophobicContact CB-CG 4.18Å
315	V	95.9	Very high	94.5	Very high	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-68.2	-45.5	176.2	174.2	0	0	0	0	110.6	V307 V311 V312 E318 L319 L340 A342 L350 L352	V307-V315 HydrophobicContact CG1-CG2 3.97Å; V311-V315 HydrophobicContact CG2-CG2 4.45Å; V311-V315 WeakPolarHBondContact O-CG2 3.03Å; V311-V315 PolarHBondContact O-N 3.43Å; V312-V315 PolarHBondContact O-N 2.82Å; V312-V315 VanDerWaalsContact O-N 3.09Å; V315-E318 PolarHBondContact O-N 3.43Å; V315-L319 HydrophobicContact CG1-CD1 4.14Å; V315-L319 HydrophobicContact CG1-CG 4.42Å; V315-L319 WeakPolarHBondContact O-CG 3.26Å; V315-L319 PolarHBondContact O-N 3.18Å; V315-L340 HydrophobicContact CG1-CD2 3.48Å; V315-L340 VanDerWaalsContact CG1-CD2 3.48Å; V315-A342 HydrophobicContact CG2-CB 3.83Å; V315-L350 HydrophobicContact CB-CD1 4.46Å; V315-L350 HydrophobicContact CG2-CD1 3.62Å; V315-L352 HydrophobicContact CB-CD2 4.47Å; V315-L352 HydrophobicContact CG1-CD1 4.32Å; V315-L352 HydrophobicContact CG1-CD2 4.02Å; V315-L352 HydrophobicContact CG2-CD2 4.18Å
316	E	97	Very high	94.5	Very high	83 Å²	83	70.3 Å²	70.3	39%	0.388	39%	0.387	S	S	.	.	H	α-helix	trans	-61	-45.8	177.6	-69.8	-177.4	160.3	0	0	111.5	V312 E318 L319 D320 H414	V312-E316 HydrophobicContact CG1-CG 4.28Å; V312-E316 WeakPolarHBondContact O-CG 3.32Å; V312-E316 PolarHBondContact O-N 3.19Å; E316-E318 VanDerWaalsContact C-N 3.28Å; E316-E318 PolarHBondContact O-N 3.15Å; E316-L319 PolarHBondContact O-N 2.94Å; E316-D320 PolarHBondContact O-N 2.88Å; E316-H414 IonicContact OE1-CD2 3.87Å; E316-H414 IonicContact OE1-NE2 3.56Å
317	A	96	Very high	94.6	Very high	60 Å²	60	64.2 Å²	64.2	50%	0.496	35%	0.347	S	S	.	.	H	α-helix	trans	-60.2	-37.1	176.2	0	0	0	0	0	112.9	P313 R321	P313-A317 VanDerWaalsContact O-CB 3.29Å; P313-A317 WeakPolarHBondContact O-CB 3.1Å; P313-A317 PolarHBondContact O-N 2.99Å; A317-R321 WeakPolarHBondContact O-CB 3.36Å; A317-R321 PolarHBondContact O-N 3.38Å
318	E	95	Very high	94.9	Very high	32 Å²	32	62.8 Å²	62.8	15%	0.15	34%	0.339	C	S	.	.	H	α-helix	trans	-75.4	-36.3	177.8	-177.3	58.6	-170.7	0	0	112.3	L314 V315 E316 R321 L322 L352	L314-E318 WeakPolarHBondContact O-CB 3.49Å; L314-E318 PolarHBondContact O-N 3.3Å; L314-E318 VanDerWaalsContact O-N 3.15Å; V315-E318 PolarHBondContact O-N 3.43Å; E316-E318 VanDerWaalsContact C-N 3.28Å; E316-E318 PolarHBondContact O-N 3.15Å; E318-R321 PolarHBondContact O-N 2.94Å; E318-R321 IonicContact OE1-CZ 2.93Å; E318-R321 IonicContact OE1-NE 3.08Å; E318-R321 PolarHBondContact OE1-NE 3Å; E318-R321 IonicContact OE1-NH2 2.87Å; E318-R321 PolarHBondContact OE1-NH2 3.43Å; E318-R321 WeakPolarHBondContact OE2-CD 3.28Å; E318-R321 IonicContact OE2-CZ 3.93Å; E318-R321 IonicContact OE2-NE 3.12Å; E318-R321 PolarHBondContact OE2-NE 3.01Å; E318-R321 IonicContact OE2-NH2 2.66Å; E318-L322 HydrophobicContact CG-CD1 4.38Å; E318-L322 WeakPolarHBondContact O-CB 3.49Å; E318-L322 VanDerWaalsContact O-CG 3.28Å; E318-L322 WeakPolarHBondContact O-CG 3.47Å; E318-L322 PolarHBondContact O-N 3.18Å; E318-L352 HydrophobicContact CB-CD1 3.89Å; E318-L352 HydrophobicContact CB-CG 4.15Å; E318-L352 HydrophobicContact CG-CD1 3.68Å; E318-L352 HydrophobicContact CG-CG 3.61Å
319	L	97	Very high	95.2	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-59.7	-46.3	170.1	-72.6	170.9	0	0	0	111	V315 E316 R321 L322 E323 I328 L352 L411 T413 Y418	V315-L319 HydrophobicContact CG1-CD1 4.14Å; V315-L319 HydrophobicContact CG1-CG 4.42Å; V315-L319 WeakPolarHBondContact O-CG 3.26Å; V315-L319 PolarHBondContact O-N 3.18Å; E316-L319 PolarHBondContact O-N 2.94Å; L319-R321 VanDerWaalsContact C-N 3.32Å; L319-R321 PolarHBondContact O-N 2.89Å; L319-L322 PolarHBondContact O-N 2.88Å; L319-E323 WeakPolarHBondContact O-CB 3.46Å; L319-E323 PolarHBondContact O-N 3.37Å; L319-I328 HydrophobicContact CD2-CD1 3.78Å; L319-L352 HydrophobicContact CD2-CD1 3.67Å; L319-L352 HydrophobicContact CG-CD1 3.7Å; L319-L411 HydrophobicContact CD2-CD2 4.35Å; L319-T413 HydrophobicContact CD1-CG2 4.11Å; L319-T413 HydrophobicContact CD2-CG2 4.06Å; L319-Y418 HydrophobicContact CD1-CE2 4.14Å; L319-Y418 HydrophobicContact CD2-CD2 4.37Å; L319-Y418 HydrophobicContact CD2-CE2 4.41Å
320	D	97	Very high	95.5	Very high	69 Å²	69	56 Å²	56	37%	0.369	31%	0.31	S	S	.	.	H	α-helix	trans	-61.4	-39.8	176.5	-78.8	-9.5	0	0	0	112	E316 K324	E316-D320 PolarHBondContact O-N 2.88Å; D320-K324 WeakPolarHBondContact O-CB 3.26Å; D320-K324 VanDerWaalsContact O-CG 3.24Å; D320-K324 WeakPolarHBondContact O-CG 3.43Å; D320-K324 PolarHBondContact O-N 3.29Å
321	R	95.2	Very high	95.8	Very high	93 Å²	93	53.2 Å²	53.2	35%	0.351	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-47.3	176	-169.7	-168.3	72.4	87	2.2	111.2	A317 E318 L319 E323 K324 L325	A317-R321 WeakPolarHBondContact O-CB 3.36Å; A317-R321 PolarHBondContact O-N 3.38Å; E318-R321 PolarHBondContact O-N 2.94Å; E318-R321 IonicContact OE1-CZ 2.93Å; E318-R321 IonicContact OE1-NE 3.08Å; E318-R321 PolarHBondContact OE1-NE 3Å; E318-R321 IonicContact OE1-NH2 2.87Å; E318-R321 PolarHBondContact OE1-NH2 3.43Å; E318-R321 WeakPolarHBondContact OE2-CD 3.28Å; E318-R321 IonicContact OE2-CZ 3.93Å; E318-R321 IonicContact OE2-NE 3.12Å; E318-R321 PolarHBondContact OE2-NE 3.01Å; E318-R321 IonicContact OE2-NH2 2.66Å; L319-R321 VanDerWaalsContact C-N 3.32Å; L319-R321 PolarHBondContact O-N 2.89Å; R321-E323 VanDerWaalsContact C-N 3.34Å; R321-K324 PolarHBondContact O-N 3.14Å; R321-L325 HydrophobicContact CG-CD1 4.31Å; R321-L325 WeakPolarHBondContact O-CG 3.4Å; R321-L325 PolarHBondContact O-N 3.39Å
322	L	95.4	Very high	96.1	Very high	7 Å²	7	59.3 Å²	59.3	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-37.3	179	-68.4	174.8	0	0	0	111.8	E318 L319 L325 G326 V327 I328 L352 L397	E318-L322 HydrophobicContact CG-CD1 4.38Å; E318-L322 WeakPolarHBondContact O-CB 3.49Å; E318-L322 VanDerWaalsContact O-CG 3.28Å; E318-L322 WeakPolarHBondContact O-CG 3.47Å; E318-L322 PolarHBondContact O-N 3.18Å; L319-L322 PolarHBondContact O-N 2.88Å; L322-L325 PolarHBondContact O-N 3.44Å; L322-G326 PolarHBondContact O-N 2.91Å; L322-V327 HydrophobicContact CB-CB 4.24Å; L322-V327 HydrophobicContact CD2-CB 4.09Å; L322-V327 HydrophobicContact CD2-CG1 4.06Å; L322-V327 HydrophobicContact CD2-CG2 4.2Å; L322-V327 WeakPolarHBondContact O-CB 3.23Å; L322-V327 PolarHBondContact O-N 3.15Å; L322-I328 HydrophobicContact CB-CD1 3.73Å; L322-I328 HydrophobicContact CB-CG1 3.8Å; L322-I328 HydrophobicContact CD1-CD1 4.45Å; L322-I328 PolarHBondContact O-N 2.94Å; L322-L352 HydrophobicContact CD1-CB 4.39Å; L322-L352 HydrophobicContact CD1-CD1 4.27Å; L322-L397 HydrophobicContact CD2-CD1 4.4Å
323	E	96.9	Very high	96.2	Very high	58 Å²	58	66 Å²	66	27%	0.271	34%	0.339	S	S	.	.	H	α-helix	trans	-64.8	-45.7	174.3	-176.6	165.4	-128.9	0	0	110.9	L319 R321 L325 G326 I328 K330	L319-E323 WeakPolarHBondContact O-CB 3.46Å; L319-E323 PolarHBondContact O-N 3.37Å; R321-E323 VanDerWaalsContact C-N 3.34Å; E323-L325 VanDerWaalsContact C-N 3.3Å; E323-L325 PolarHBondContact O-N 2.91Å; E323-G326 PolarHBondContact O-N 3.44Å; E323-I328 HydrophobicContact CB-CG1 4.14Å; E323-K330 WeakPolarHBondContact OE1-CD 3.47Å; E323-K330 VanDerWaalsContact OE1-CG 3.29Å; E323-K330 WeakPolarHBondContact OE1-CG 3.13Å; E323-K330 PolarHBondContact OE1-N 3.41Å; E323-K330 IonicContact OE1-NZ 2.69Å; E323-K330 WeakPolarHBondContact OE2-CE 3.35Å; E323-K330 IonicContact OE2-NZ 3.75Å; E323-K330 PolarHBondContact OE2-NZ 3.11Å
324	K	95.9	Very high	96.3	Very high	177 Å²	177	62.2 Å²	62.2	77%	0.77	31%	0.314	S	S	*	.	H	α-helix	trans	-62.1	-33.8	175.9	-75.3	169.3	-175.3	168.5	0	113.5	D320 R321 G326	D320-K324 WeakPolarHBondContact O-CB 3.26Å; D320-K324 VanDerWaalsContact O-CG 3.24Å; D320-K324 WeakPolarHBondContact O-CG 3.43Å; D320-K324 PolarHBondContact O-N 3.29Å; R321-K324 PolarHBondContact O-N 3.14Å; K324-G326 PolarHBondContact O-N 2.75Å
325	L	93.3	Very high	96.4	Very high	73 Å²	73	59.2 Å²	59.2	38%	0.382	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-2.2	174.9	-69.6	176	0	0	0	113.2	R321 L322 E323 V327	R321-L325 HydrophobicContact CG-CD1 4.31Å; R321-L325 WeakPolarHBondContact O-CG 3.4Å; R321-L325 PolarHBondContact O-N 3.39Å; L322-L325 PolarHBondContact O-N 3.44Å; E323-L325 VanDerWaalsContact C-N 3.3Å; E323-L325 PolarHBondContact O-N 2.91Å; L325-V327 HydrophobicContact CB-CG2 4.04Å; L325-V327 PolarHBondContact O-N 3.19Å
326	G	95.1	Very high	96.5	Very high	29 Å²	29	59.8 Å²	59.8	30%	0.299	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	10.8	-177.1	0	0	0	0	0	114.1	L322 E323 K324 I328 N421	L322-G326 PolarHBondContact O-N 2.91Å; E323-G326 PolarHBondContact O-N 3.44Å; K324-G326 PolarHBondContact O-N 2.75Å; G326-I328 VanDerWaalsContact C-N 3.33Å; G326-N421 WeakPolarHBondContact O-CB 3.15Å; G326-N421 PolarHBondContact O-ND2 3.28Å
327	V	96.1	Very high	96.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.288	C	S	.	.	S	Bend	trans	-68.1	-37.6	177.9	175.8	0	0	0	0	111	L281 L322 L325 L397 Y420 N421 R422	L281-V327 HydrophobicContact CD2-CG2 3.35Å; L322-V327 HydrophobicContact CB-CB 4.24Å; L322-V327 HydrophobicContact CD2-CB 4.09Å; L322-V327 HydrophobicContact CD2-CG1 4.06Å; L322-V327 HydrophobicContact CD2-CG2 4.2Å; L322-V327 WeakPolarHBondContact O-CB 3.23Å; L322-V327 PolarHBondContact O-N 3.15Å; L325-V327 HydrophobicContact CB-CG2 4.04Å; L325-V327 PolarHBondContact O-N 3.19Å; V327-L397 HydrophobicContact CG1-CD1 4.19Å; V327-L397 HydrophobicContact CG1-CD2 3.9Å; V327-L397 HydrophobicContact CG1-CG 4.49Å; V327-Y420 HydrophobicContact CG1-CD1 4.01Å; V327-Y420 HydrophobicContact CG1-CE1 4.15Å; V327-N421 PolarHBondContact O-N 3.22Å; V327-R422 HydrophobicContact CB-CG 4.4Å; V327-R422 HydrophobicContact CG1-CB 4.23Å; V327-R422 HydrophobicContact CG1-CG 4.34Å; V327-R422 HydrophobicContact CG2-CG 4.26Å
328	I	97.6	Very high	96.6	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	161.4	176.1	63.8	-178.3	0	0	0	111.2	L319 L322 E323 G326 Y418 R419 Y420	L319-I328 HydrophobicContact CD2-CD1 3.78Å; L322-I328 HydrophobicContact CB-CD1 3.73Å; L322-I328 HydrophobicContact CB-CG1 3.8Å; L322-I328 HydrophobicContact CD1-CD1 4.45Å; L322-I328 PolarHBondContact O-N 2.94Å; E323-I328 HydrophobicContact CB-CG1 4.14Å; G326-I328 VanDerWaalsContact C-N 3.33Å; I328-Y418 HydrophobicContact CB-CD1 4.46Å; I328-Y418 HydrophobicContact CD1-CD1 3.56Å; I328-Y418 HydrophobicContact CD1-CE1 4.16Å; I328-Y418 HydrophobicContact CD1-CG 4.02Å; I328-Y418 HydrophobicContact CG1-CD1 3.96Å; I328-R419 CarbonylContact C-O 3.53Å; I328-R419 WeakPolarHBondContact CA-O 3.5Å; I328-Y420 HydrophobicContact CG2-CD1 3.48Å; I328-Y420 VanDerWaalsContact CG2-CD1 3.48Å; I328-Y420 HydrophobicContact CG2-CE1 3.59Å; I328-Y420 HydrophobicContact CG2-CG 3.98Å
329	S	98	Very high	96.7	Very high	47 Å²	47	52.1 Å²	52.1	33%	0.329	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	140.8	171.5	-58.8	0	0	0	0	111	Y418 R419 N421	S329-Y418 CarbonylContact O-C 3.59Å; S329-Y418 WeakPolarHBondContact O-CA 3.32Å; S329-R419 PolarHBondContact N-O 2.88Å; S329-R419 PolarHBondContact O-N 2.88Å; S329-N421 PolarHBondContact OG-ND2 3.18Å
330	K	98	Very high	96.7	Very high	110 Å²	110	52.5 Å²	52.5	48%	0.478	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	138.5	173.4	-77	166.4	-176.9	144.9	0	111.5	E323 Y418	E323-K330 WeakPolarHBondContact OE1-CD 3.47Å; E323-K330 VanDerWaalsContact OE1-CG 3.29Å; E323-K330 WeakPolarHBondContact OE1-CG 3.13Å; E323-K330 PolarHBondContact OE1-N 3.41Å; E323-K330 IonicContact OE1-NZ 2.69Å; E323-K330 WeakPolarHBondContact OE2-CE 3.35Å; E323-K330 IonicContact OE2-NZ 3.75Å; E323-K330 PolarHBondContact OE2-NZ 3.11Å; K330-Y418 HydrophobicContact CD-CE1 4.16Å; K330-Y418 WeakPolarHBondContact CE-OH 3.49Å; K330-Y418 HydrophobicContact CG-CD1 3.85Å; K330-Y418 HydrophobicContact CG-CE1 3.42Å; K330-Y418 VanDerWaalsContact CG-CE1 3.42Å
331	V	97.8	Very high	96.6	Very high	28 Å²	28	51.3 Å²	51.3	17%	0.17	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	147.4	174.3	-64.4	0	0	0	0	110.2	T410 L417 R419	V331-T410 HydrophobicContact CG2-CG2 4.29Å; V331-L417 HydrophobicContact CG2-CB 3.79Å; V331-L417 PolarHBondContact N-O 3.47Å; V331-L417 WeakPolarHBondContact O-CB 3.24Å; V331-R419 HydrophobicContact CG1-CB 3.86Å; V331-R419 HydrophobicContact CG2-CB 4.28Å
332	N	96.5	Very high	96.4	Very high	171 Å²	171	48.9 Å²	48.9	91%	0.914	26%	0.258	S	S	*	.	S	Bend	trans	-91.1	-14.8	-179.2	-65.1	-29.8	0	0	0	113
333	Y	96.7	Very high	96	Very high	171 Å²	171	52 Å²	52	67%	0.671	28%	0.277	S	S	*	.			trans	-151.9	145.5	-175.8	178.8	-95.1	0	0	0	110.9
334	S	96.7	Very high	95.5	Very high	5 Å²	5	58.5 Å²	58.5	4%	0.035	30%	0.299	C	S	.	.			trans	-160.6	141	168.1	-177.9	0	0	0	0	109.3	F301 W336 E407 T410	F301-S334 WeakPolarHBondContact CD2-O 3.34Å; S334-W336 VanDerWaalsContact C-N 3.28Å; S334-W336 WeakPolarHBondContact CB-O 3.49Å; S334-W336 PolarHBondContact OG-N 3.48Å; S334-W336 PolarHBondContact OG-O 3.43Å; S334-E407 PolarHBondContact OG-O 3.01Å; S334-T410 WeakPolarHBondContact OG-CB 3.36Å; S334-T410 PolarHBondContact OG-OG1 3.37Å
335	A	97.3	Very high	94.7	Very high	28 Å²	28	51.9 Å²	51.9	23%	0.231	27%	0.27	C	S	.	.	S	Bend	trans	-74.6	-23.1	171.1	0	0	0	0	0	112.3	P299 E407	P299-A335 HydrophobicContact CB-CB 3.68Å; P299-A335 WeakPolarHBondContact CB-O 3.15Å; P299-A335 HydrophobicContact CG-CB 3.98Å; A335-E407 PolarHBondContact N-OE1 2.68Å
336	W	97.9	Very high	93.7	Very high	12 Å²	12	54.6 Å²	54.6	5%	0.045	28%	0.275	C	S	.	.			trans	-107.2	142.9	178	-63.8	87.4	0	0	0	110.6	L293 Q298 P299 V300 S334 L360 A363 L408 T410	L293-W336 HydrophobicContact CD1-CZ2 3.83Å; L293-W336 HydrophobicContact CD2-CH2 3.8Å; L293-W336 HydrophobicContact CD2-CZ2 3.72Å; L293-W336 HydrophobicContact CG-CZ2 4.47Å; Q298-W336 WeakPolarHBondContact O-CH2 3.39Å; P299-W336 VanDerWaalsContact CA-CE2 3.5Å; P299-W336 VanDerWaalsContact CA-CZ2 3.46Å; P299-W336 HydrophobicContact CB-CD2 4.23Å; P299-W336 HydrophobicContact CB-CG 4.46Å; P299-W336 HydrophobicContact CB-CZ2 4.25Å; P299-W336 HydrophobicContact CG-CZ2 4.35Å; V300-W336 HydrophobicContact CB-CE3 4.25Å; V300-W336 HydrophobicContact CB-CZ3 4.09Å; V300-W336 HydrophobicContact CG2-CZ3 4.07Å; V300-W336 VanDerWaalsContact N-CE3 3.32Å; V300-W336 WeakPolarHBondContact O-CA 3.22Å; S334-W336 VanDerWaalsContact C-N 3.28Å; S334-W336 WeakPolarHBondContact CB-O 3.49Å; S334-W336 PolarHBondContact OG-N 3.48Å; S334-W336 PolarHBondContact OG-O 3.43Å; W336-L360 HydrophobicContact CD2-CD1 4.5Å; W336-L360 HydrophobicContact CE3-CD1 3.95Å; W336-L360 HydrophobicContact CZ3-CD1 4.04Å; W336-A363 HydrophobicContact CH2-CB 3.51Å; W336-A363 HydrophobicContact CZ3-CB 3.78Å; W336-L408 HydrophobicContact CD2-CD2 4.09Å; W336-L408 HydrophobicContact CG-CD2 4.07Å; W336-L408 HydrophobicContact CZ2-CD2 4.25Å; W336-T410 WeakPolarHBondContact O-CB 3.34Å
337	A	97.9	Very high	92.9	Very high	6 Å²	6	56.2 Å²	56.2	5%	0.05	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-160.9	135.4	165	0	0	0	0	0	112.2	V300 F301 R302 T410 N412 L417	V300-A337 PolarHBondContact O-N 2.92Å; F301-A337 HydrophobicContact CD1-CB 4.35Å; F301-A337 HydrophobicContact CD2-CB 3.45Å; F301-A337 VanDerWaalsContact CD2-CB 3.45Å; F301-A337 HydrophobicContact CE1-CB 4.37Å; F301-A337 HydrophobicContact CE2-CB 3.48Å; F301-A337 VanDerWaalsContact CE2-CB 3.48Å; F301-A337 HydrophobicContact CG-CB 3.92Å; F301-A337 HydrophobicContact CZ-CB 3.97Å; R302-A337 WeakPolarHBondContact CB-O 3.22Å; R302-A337 PolarHBondContact N-O 3.12Å; A337-T410 CarbonylContact C-O 3.56Å; A337-T410 WeakPolarHBondContact CA-O 3.48Å; A337-T410 HydrophobicContact CB-CG2 4.33Å; A337-N412 HydrophobicContact CB-CB 4.08Å; A337-L417 HydrophobicContact CB-CD2 4.49Å
338	A	97.9	Very high	92	Very high	4 Å²	4	57.6 Å²	57.6	3%	0.033	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	144.7	171	0	0	0	0	0	110.7	A354 F356 T410 L411 N412	A338-A354 HydrophobicContact CB-CB 4.2Å; A338-F356 HydrophobicContact CB-CD1 3.6Å; A338-F356 HydrophobicContact CB-CE1 3.85Å; A338-F356 HydrophobicContact CB-CG 4.38Å; A338-T410 PolarHBondContact N-O 3.17Å; A338-L411 CarbonylContact O-C 3.6Å; A338-L411 WeakPolarHBondContact O-CA 3.24Å; A338-N412 PolarHBondContact O-N 3.12Å
339	P	97.5	Very high	91.3	Very high	4 Å²	4	63 Å²	63	3%	0.026	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	145.5	178.9	29.1	-29.7	0	0	0	111.2	R305 D355	R305-P339 HydrophobicContact CB-CB 4.5Å; R305-P339 HydrophobicContact CG-CB 3.88Å; R305-P339 HydrophobicContact CG-CG 4.45Å; P339-D355 HydrophobicContact CG-CB 4.01Å; P339-D355 PolarHBondContact O-N 2.85Å
340	L	96.6	Very high	90.8	Very high	10 Å²	10	61.6 Å²	61.6	5%	0.052	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	139.6	172.6	175.4	68.6	0	0	0	112	V315 L352 L411 N412 T413	V315-L340 HydrophobicContact CG1-CD2 3.48Å; V315-L340 VanDerWaalsContact CG1-CD2 3.48Å; L340-L352 HydrophobicContact CD1-CB 3.71Å; L340-L352 HydrophobicContact CD1-CD1 4.31Å; L340-L352 HydrophobicContact CD1-CD2 3.99Å; L340-L352 HydrophobicContact CD1-CG 4.18Å; L340-L352 HydrophobicContact CD2-CD2 4.41Å; L340-L411 HydrophobicContact CB-CD1 3.75Å; L340-L411 HydrophobicContact CB-CD2 4.48Å; L340-L411 HydrophobicContact CB-CG 4.23Å; L340-L411 HydrophobicContact CD1-CD1 4.13Å; L340-L411 HydrophobicContact CD1-CD2 3.83Å; L340-L411 HydrophobicContact CD1-CG 4.43Å; L340-N412 PolarHBondContact N-O 3.37Å; L340-N412 VanDerWaalsContact N-O 3.13Å; L340-T413 HydrophobicContact CB-CG2 4.25Å; L340-T413 HydrophobicContact CD2-CG2 4.15Å
341	V	93.7	Very high	90.4	Very high	43 Å²	43	60.9 Å²	60.9	26%	0.261	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121.3	169.4	-178.1	0	0	0	0	108.4	V343 C353 D355	V341-V343 HydrophobicContact CG1-CG2 4.06Å; V341-C353 HydrophobicContact CB-CB 4.43Å; V341-C353 PolarHBondContact N-O 3.25Å; V341-C353 PolarHBondContact O-N 2.89Å; V341-D355 HydrophobicContact CG2-CB 3.91Å
342	A	91.6	Very high	90.1	Very high	43 Å²	43	60.2 Å²	60.2	36%	0.355	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.4	173.9	0	0	0	0	0	109.3	V315 L350 L352	V315-A342 HydrophobicContact CG2-CB 3.83Å; A342-L350 HydrophobicContact CB-CD1 4.4Å; A342-L352 HydrophobicContact CB-CD2 3.93Å
343	V	87.9	Confident	89.9	Confident	72 Å²	72	53.3 Å²	53.3	44%	0.436	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.5	175.4	-177	0	0	0	0	108.5	V341 L350 R351	V341-V343 HydrophobicContact CG1-CG2 4.06Å; V343-L350 CarbonylContact O-C 3.48Å; V343-L350 WeakPolarHBondContact O-CA 3.43Å; V343-R351 PolarHBondContact N-O 2.97Å; V343-R351 PolarHBondContact O-N 3.18Å
344	R	85.3	Confident	89.8	Confident	195 Å²	195	45.4 Å²	45.4	74%	0.736	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.2	176.3	-162.7	171	-175.1	-167.9	-2.5	109.8	L350	R344-L350 HydrophobicContact CB-CD2 4.31Å; R344-L350 HydrophobicContact CG-CD2 4.46Å
345	K	79.3	Confident	89.7	Confident	38 Å²	38	46.8 Å²	46.8	17%	0.165	23%	0.232	C	C	.	.			trans	-73.1	157.9	167.6	-68.1	-174.4	178.8	-178.5	0	109.1	D347 G348 R349 R351 D394	K345-D347 VanDerWaalsContact C-N 3.25Å; K345-D347 WeakPolarHBondContact CB-OD1 3.39Å; K345-D347 PolarHBondContact O-N 3.08Å; K345-G348 PolarHBondContact O-N 3.4Å; K345-R349 WeakPolarHBondContact CB-O 3.2Å; K345-R349 PolarHBondContact N-O 3.32Å; K345-R351 HydrophobicContact CG-CB 4.19Å; K345-D394 IonicContact NZ-OD1 2.69Å; K345-D394 PolarHBondContact NZ-OD1 3.24Å
346	R	71.8	Confident	89.7	Confident	129 Å²	129	45.6 Å²	45.6	49%	0.487	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-35.4	179.7	-70.9	179.2	172.7	-155.2	-6.1	112.8	T115 G348	T115-R346 PolarHBondContact O-NE 3.42Å; T115-R346 VanDerWaalsContact O-NE 3.16Å; T115-R346 VanDerWaalsContact OG1-CZ 3.31Å; T115-R346 PolarHBondContact OG1-NE 3.37Å; T115-R346 PolarHBondContact OG1-NH2 3.36Å; R346-G348 PolarHBondContact O-N 2.99Å; R346-G348 VanDerWaalsContact O-N 3.09Å
347	D	78	Confident	89.5	Confident	63 Å²	63	48.3 Å²	48.3	34%	0.337	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	2.9	174.4	66.2	11.2	0	0	0	114.3	T118 K345 R349	T118-D347 HydrophobicContact CG2-CB 4.28Å; K345-D347 VanDerWaalsContact C-N 3.25Å; K345-D347 WeakPolarHBondContact CB-OD1 3.39Å; K345-D347 PolarHBondContact O-N 3.08Å; D347-R349 VanDerWaalsContact C-N 3.3Å; D347-R349 PolarHBondContact O-N 3.5Å; D347-R349 VanDerWaalsContact OD1-CB 3.28Å; D347-R349 WeakPolarHBondContact OD1-CB 3.28Å; D347-R349 PolarHBondContact OD1-N 2.98Å; D347-R349 IonicContact OD1-NE 2.68Å; D347-R349 IonicContact OD2-CZ 2.83Å; D347-R349 IonicContact OD2-NE 3.38Å; D347-R349 PolarHBondContact OD2-NE 3.47Å; D347-R349 IonicContact OD2-NH2 3.54Å; D347-R349 PolarHBondContact OD2-NH2 2.73Å
348	G	77.9	Confident	89.3	Confident	29 Å²	29	49.7 Å²	49.7	30%	0.299	25%	0.25	S	S	.	.	S	Bend	trans	86.8	-12	178.4	0	0	0	0	0	114.7	K345 R346	K345-G348 PolarHBondContact O-N 3.4Å; R346-G348 PolarHBondContact O-N 2.99Å; R346-G348 VanDerWaalsContact O-N 3.09Å
349	R	82.8	Confident	89.1	Confident	116 Å²	116	49.8 Å²	49.8	44%	0.438	25%	0.252	S	S	.	.			trans	-69.7	160.8	175.3	-63	-174.8	-69.4	167.5	-3.3	110.9	K345 D347	K345-R349 WeakPolarHBondContact CB-O 3.2Å; K345-R349 PolarHBondContact N-O 3.32Å; D347-R349 VanDerWaalsContact C-N 3.3Å; D347-R349 PolarHBondContact O-N 3.5Å; D347-R349 VanDerWaalsContact OD1-CB 3.28Å; D347-R349 WeakPolarHBondContact OD1-CB 3.28Å; D347-R349 PolarHBondContact OD1-N 2.98Å; D347-R349 IonicContact OD1-NE 2.68Å; D347-R349 IonicContact OD2-CZ 2.83Å; D347-R349 IonicContact OD2-NE 3.38Å; D347-R349 PolarHBondContact OD2-NE 3.47Å; D347-R349 IonicContact OD2-NH2 3.54Å; D347-R349 PolarHBondContact OD2-NH2 2.73Å
350	L	87.9	Confident	89	Confident	17 Å²	17	50 Å²	50	9%	0.089	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	141.5	172.7	-66.7	-177.7	0	0	0	110.8	L314 V315 A342 V343 R344 L352	L314-L350 HydrophobicContact CB-CD1 3.47Å; L314-L350 VanDerWaalsContact CB-CD1 3.47Å; L314-L350 HydrophobicContact CB-CG 4.18Å; V315-L350 HydrophobicContact CB-CD1 4.46Å; V315-L350 HydrophobicContact CG2-CD1 3.62Å; A342-L350 HydrophobicContact CB-CD1 4.4Å; V343-L350 CarbonylContact O-C 3.48Å; V343-L350 WeakPolarHBondContact O-CA 3.43Å; R344-L350 HydrophobicContact CB-CD2 4.31Å; R344-L350 HydrophobicContact CG-CD2 4.46Å; L350-L352 HydrophobicContact CB-CD2 4.42Å
351	R	88.4	Confident	89	Confident	95 Å²	95	50.6 Å²	50.6	36%	0.358	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	109.5	161.6	-174	-178.3	-83.6	164.5	-2.4	107.2	V343 K345	V343-R351 PolarHBondContact N-O 2.97Å; V343-R351 PolarHBondContact O-N 3.18Å; K345-R351 HydrophobicContact CG-CB 4.19Å
352	L	92.4	Very high	89.1	Confident	13 Å²	13	53.5 Å²	53.5	7%	0.068	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.4	172.9	-60.1	-171.1	0	0	0	109.1	V315 E318 L319 L322 L340 A342 L350	V315-L352 HydrophobicContact CB-CD2 4.47Å; V315-L352 HydrophobicContact CG1-CD1 4.32Å; V315-L352 HydrophobicContact CG1-CD2 4.02Å; V315-L352 HydrophobicContact CG2-CD2 4.18Å; E318-L352 HydrophobicContact CB-CD1 3.89Å; E318-L352 HydrophobicContact CB-CG 4.15Å; E318-L352 HydrophobicContact CG-CD1 3.68Å; E318-L352 HydrophobicContact CG-CG 3.61Å; L319-L352 HydrophobicContact CD2-CD1 3.67Å; L319-L352 HydrophobicContact CG-CD1 3.7Å; L322-L352 HydrophobicContact CD1-CB 4.39Å; L322-L352 HydrophobicContact CD1-CD1 4.27Å; L340-L352 HydrophobicContact CD1-CB 3.71Å; L340-L352 HydrophobicContact CD1-CD1 4.31Å; L340-L352 HydrophobicContact CD1-CD2 3.99Å; L340-L352 HydrophobicContact CD1-CG 4.18Å; L340-L352 HydrophobicContact CD2-CD2 4.41Å; A342-L352 HydrophobicContact CB-CD2 3.93Å; L350-L352 HydrophobicContact CB-CD2 4.42Å
353	C	91.8	Very high	89.4	Confident	26 Å²	26	51.7 Å²	51.7	18%	0.176	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	152.4	177.4	-59.8	0	0	0	0	109.2	V341	V341-C353 HydrophobicContact CB-CB 4.43Å; V341-C353 PolarHBondContact N-O 3.25Å; V341-C353 PolarHBondContact O-N 2.89Å
354	A	94.2	Very high	89.8	Confident	5 Å²	5	48.3 Å²	48.3	4%	0.041	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.4	169.3	0	0	0	0	0	108.7	A338 F356 L411 Y420	A338-A354 HydrophobicContact CB-CB 4.2Å; A354-F356 VanDerWaalsContact C-N 3.25Å; A354-F356 HydrophobicContact CB-CD1 4.33Å; A354-F356 HydrophobicContact CB-CD2 3.87Å; A354-F356 HydrophobicContact CB-CE1 3.87Å; A354-F356 HydrophobicContact CB-CE2 3.37Å; A354-F356 HydrophobicContact CB-CG 4.34Å; A354-F356 HydrophobicContact CB-CZ 3.37Å; A354-F356 PolarHBondContact O-N 3.45Å; A354-L411 HydrophobicContact CB-CD1 3.67Å; A354-Y420 HydrophobicContact CB-CE2 4.15Å
355	D	95.5	Very high	90.4	Very high	35 Å²	35	42.7 Å²	42.7	19%	0.187	22%	0.217	C	C	.	.			trans	-82.6	72.6	178.7	-167.8	-6.2	0	0	0	111.5	R305 P339 V341 S357 T358	R305-D355 IonicContact CZ-OD2 3.9Å; R305-D355 IonicContact NH1-OD2 2.8Å; R305-D355 PolarHBondContact NH1-OD2 2.93Å; R305-D355 IonicContact NH2-OD2 3.18Å; R305-D355 PolarHBondContact NH2-OD2 2.79Å; P339-D355 HydrophobicContact CG-CB 4.01Å; P339-D355 PolarHBondContact O-N 2.85Å; V341-D355 HydrophobicContact CG2-CB 3.91Å; D355-S357 PolarHBondContact O-N 2.69Å; D355-S357 WeakPolarHBondContact OD1-CB 3.34Å; D355-S357 PolarHBondContact OD1-N 3.36Å; D355-S357 PolarHBondContact OD1-OG 2.82Å; D355-T358 HydrophobicContact CB-CG2 4.33Å; D355-T358 PolarHBondContact O-N 3.02Å; D355-T358 PolarHBondContact O-OG1 2.71Å; D355-T358 WeakPolarHBondContact OD2-CG2 3.33Å
356	F	96.7	Very high	91	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.009	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-67	-13.9	179.4	-64.6	-61	0	0	0	113.5	A338 A354 T358 G359 L360 N361 L409 Y420 P424 V427	A338-F356 HydrophobicContact CB-CD1 3.6Å; A338-F356 HydrophobicContact CB-CE1 3.85Å; A338-F356 HydrophobicContact CB-CG 4.38Å; A354-F356 VanDerWaalsContact C-N 3.25Å; A354-F356 HydrophobicContact CB-CD1 4.33Å; A354-F356 HydrophobicContact CB-CD2 3.87Å; A354-F356 HydrophobicContact CB-CE1 3.87Å; A354-F356 HydrophobicContact CB-CE2 3.37Å; A354-F356 HydrophobicContact CB-CG 4.34Å; A354-F356 HydrophobicContact CB-CZ 3.37Å; A354-F356 PolarHBondContact O-N 3.45Å; F356-T358 PolarHBondContact O-N 2.93Å; F356-G359 PolarHBondContact O-N 2.98Å; F356-L360 HydrophobicContact CB-CB 4.2Å; F356-L360 HydrophobicContact CB-CD2 4.41Å; F356-L360 HydrophobicContact CD1-CB 3.9Å; F356-L360 HydrophobicContact CD1-CD2 3.37Å; F356-L360 HydrophobicContact CD1-CG 4.25Å; F356-L360 HydrophobicContact CE1-CD2 3.73Å; F356-L360 HydrophobicContact CG-CB 4.47Å; F356-L360 HydrophobicContact CG-CD2 3.99Å; F356-L360 PolarHBondContact O-N 2.62Å; F356-N361 WeakPolarHBondContact O-CB 3.3Å; F356-N361 PolarHBondContact O-N 2.93Å; F356-L409 HydrophobicContact CE1-CD2 3.95Å; F356-L409 HydrophobicContact CE2-CD2 4.12Å; F356-L409 HydrophobicContact CZ-CB 4.28Å; F356-L409 HydrophobicContact CZ-CD2 3.64Å; F356-Y420 HydrophobicContact CZ-CD2 4.4Å; F356-P424 HydrophobicContact CE2-CB 4.12Å; F356-P424 HydrophobicContact CE2-CG 3.5Å; F356-P424 VanDerWaalsContact CE2-CG 3.5Å; F356-P424 HydrophobicContact CZ-CG 3.83Å; F356-V427 HydrophobicContact CD2-CG2 3.52Å; F356-V427 HydrophobicContact CE2-CG2 3.54Å; F356-V427 HydrophobicContact CG-CG2 4.23Å; F356-V427 HydrophobicContact CZ-CG2 4.29Å
357	S	94.6	Very high	92	Very high	70 Å²	70	42.1 Å²	42.1	49%	0.49	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-61.6	-25.2	174.2	79.9	0	0	0	0	112.3	D355 G359	D355-S357 PolarHBondContact O-N 2.69Å; D355-S357 WeakPolarHBondContact OD1-CB 3.34Å; D355-S357 PolarHBondContact OD1-N 3.36Å; D355-S357 PolarHBondContact OD1-OG 2.82Å; S357-G359 PolarHBondContact O-N 2.76Å
358	T	92.7	Very high	92.6	Very high	35 Å²	35	47.8 Å²	47.8	22%	0.215	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-76.8	-0.2	-177.1	61	0	0	0	0	114.5	R302 D355 F356	R302-T358 PolarHBondContact NE-O 3.35Å; R302-T358 PolarHBondContact NH2-O 3.29Å; D355-T358 HydrophobicContact CB-CG2 4.33Å; D355-T358 PolarHBondContact O-N 3.02Å; D355-T358 PolarHBondContact O-OG1 2.71Å; D355-T358 WeakPolarHBondContact OD2-CG2 3.33Å; F356-T358 PolarHBondContact O-N 2.93Å
359	G	93.7	Very high	93.3	Very high	6 Å²	6	49.5 Å²	49.5	6%	0.062	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	178	-51.1	174.1	0	0	0	0	0	114.9	F356 S357 N361 D362 A363	F356-G359 PolarHBondContact O-N 2.98Å; S357-G359 PolarHBondContact O-N 2.76Å; G359-N361 PolarHBondContact O-N 2.77Å; G359-D362 PolarHBondContact O-N 2.85Å; G359-A363 PolarHBondContact O-N 3.1Å
360	L	97.1	Very high	93.7	Very high	8 Å²	8	48.6 Å²	48.6	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-45.5	-174.3	178.3	65.8	0	0	0	111.9	L293 W336 F356 D362 A363 L364 L408 L409	L293-L360 HydrophobicContact CD2-CD1 4.46Å; W336-L360 HydrophobicContact CD2-CD1 4.5Å; W336-L360 HydrophobicContact CE3-CD1 3.95Å; W336-L360 HydrophobicContact CZ3-CD1 4.04Å; F356-L360 HydrophobicContact CB-CB 4.2Å; F356-L360 HydrophobicContact CB-CD2 4.41Å; F356-L360 HydrophobicContact CD1-CB 3.9Å; F356-L360 HydrophobicContact CD1-CD2 3.37Å; F356-L360 HydrophobicContact CD1-CG 4.25Å; F356-L360 HydrophobicContact CE1-CD2 3.73Å; F356-L360 HydrophobicContact CG-CB 4.47Å; F356-L360 HydrophobicContact CG-CD2 3.99Å; F356-L360 PolarHBondContact O-N 2.62Å; L360-D362 PolarHBondContact O-N 2.89Å; L360-A363 PolarHBondContact O-N 2.9Å; L360-L364 HydrophobicContact CD1-CD1 4.21Å; L360-L364 HydrophobicContact CD1-CD2 4.16Å; L360-L364 HydrophobicContact CD1-CG 3.93Å; L360-L364 HydrophobicContact CD2-CD1 4.17Å; L360-L364 HydrophobicContact CG-CD1 3.8Å; L360-L364 HydrophobicContact CG-CG 4Å; L360-L364 WeakPolarHBondContact O-CG 3.46Å; L360-L364 PolarHBondContact O-N 3.27Å; L360-L408 HydrophobicContact CD1-CB 3.85Å; L360-L408 HydrophobicContact CD2-CB 4.39Å; L360-L408 WeakPolarHBondContact CD2-O 3.47Å; L360-L409 HydrophobicContact CD2-CD2 3.73Å
361	N	96.9	Very high	93.8	Very high	23 Å²	23	51.1 Å²	51.1	12%	0.123	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-36.3	-178	-79	-16.3	0	0	0	111.6	F356 G359 G426 V427 K428	F356-N361 WeakPolarHBondContact O-CB 3.3Å; F356-N361 PolarHBondContact O-N 2.93Å; G359-N361 PolarHBondContact O-N 2.77Å; N361-G426 PolarHBondContact ND2-O 3.34Å; N361-G426 PolarHBondContact OD1-O 3.23Å; N361-V427 WeakPolarHBondContact OD1-CA 3.28Å; N361-K428 HydrophobicContact CB-CB 4.27Å; N361-K428 HydrophobicContact CB-CD 4.31Å; N361-K428 HydrophobicContact CB-CG 4.35Å; N361-K428 WeakPolarHBondContact O-CD 3.49Å; N361-K428 WeakPolarHBondContact O-CE 3.29Å; N361-K428 PolarHBondContact O-NZ 3.12Å; N361-K428 PolarHBondContact OD1-N 2.56Å
362	D	95.7	Very high	93.7	Very high	103 Å²	103	47.9 Å²	47.9	55%	0.551	26%	0.257	S	S	*	.	H	α-helix	trans	-64.3	-49	174.1	-69.2	-25.4	0	0	0	110.1	R294 G359 L360 L364	R294-D362 PolarHBondContact NE-O 2.79Å; R294-D362 PolarHBondContact NH1-O 3.05Å; R294-D362 VanDerWaalsContact NH1-O 3.11Å; R294-D362 VanDerWaalsContact NH2-C 3.27Å; R294-D362 PolarHBondContact NH2-O 3.11Å; G359-D362 PolarHBondContact O-N 2.85Å; L360-D362 PolarHBondContact O-N 2.89Å; D362-L364 VanDerWaalsContact C-N 3.27Å; D362-L364 PolarHBondContact O-N 2.83Å
363	A	96.9	Very high	93.4	Very high	6 Å²	6	50 Å²	50	5%	0.05	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-21.5	-177.1	0	0	0	0	0	115.8	L293 R294 A297 W336 G359 L360	L293-A363 HydrophobicContact CD2-CB 4.07Å; R294-A363 PolarHBondContact N-O 3.3Å; A297-A363 HydrophobicContact CB-CB 4.03Å; W336-A363 HydrophobicContact CH2-CB 3.51Å; W336-A363 HydrophobicContact CZ3-CB 3.78Å; G359-A363 PolarHBondContact O-N 3.1Å; L360-A363 PolarHBondContact O-N 2.9Å
364	L	97.2	Very high	92.8	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-76.5	152.7	-179.7	-74.5	175.6	0	0	0	112.7	L291 R292 L293 L360 D362 L408 V427 K428	L291-L364 HydrophobicContact CB-CD2 3.78Å; L291-L364 HydrophobicContact CD1-CD1 4.41Å; R292-L364 CarbonylContact O-C 3.54Å; R292-L364 WeakPolarHBondContact O-CA 3.23Å; R292-L364 WeakPolarHBondContact O-CD2 3.19Å; L293-L364 HydrophobicContact CD2-CD2 4.07Å; L360-L364 HydrophobicContact CD1-CD1 4.21Å; L360-L364 HydrophobicContact CD1-CD2 4.16Å; L360-L364 HydrophobicContact CD1-CG 3.93Å; L360-L364 HydrophobicContact CD2-CD1 4.17Å; L360-L364 HydrophobicContact CG-CD1 3.8Å; L360-L364 HydrophobicContact CG-CG 4Å; L360-L364 WeakPolarHBondContact O-CG 3.46Å; L360-L364 PolarHBondContact O-N 3.27Å; D362-L364 VanDerWaalsContact C-N 3.27Å; D362-L364 PolarHBondContact O-N 2.83Å; L364-L408 HydrophobicContact CD2-CD1 4.2Å; L364-V427 HydrophobicContact CD1-CG1 3.75Å; L364-K428 WeakPolarHBondContact O-CE 3.43Å; L364-K428 PolarHBondContact O-NZ 2.86Å
365	E	96.5	Very high	92.2	Very high	77 Å²	77	56.7 Å²	56.7	36%	0.36	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-79.5	138.3	158	-66.7	-179.2	174.3	0	0	108.8	R292 R294 H367 S429	R292-E365 HydrophobicContact CB-CB 4.23Å; R292-E365 PolarHBondContact O-N 2.9Å; R294-E365 HydrophobicContact CG-CG 3.91Å; E365-H367 PolarHBondContact O-N 3.15Å; E365-S429 PolarHBondContact O-OG 3.24Å
366	M	93.4	Very high	91.5	Very high	99 Å²	99	59.1 Å²	59.1	49%	0.488	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-71.5	127.1	176.2	-174.3	68.5	-176.4	0	0	109.2	Q368 K428	M366-Q368 PolarHBondContact O-N 3.44Å; M366-K428 VanDerWaalsContact CE-O 3.27Å; M366-K428 WeakPolarHBondContact CE-O 3.34Å; M366-K428 HydrophobicContact SD-CB 4.17Å; M366-K428 HydrophobicContact SD-CD 4.08Å; M366-K428 HydrophobicContact SD-CG 3.99Å; M366-K428 VanDerWaalsContact SD-O 3.42Å
367	H	92.4	Very high	91	Very high	56 Å²	56	60.8 Å²	60.8	26%	0.259	32%	0.324	S	S	.	.			trans	-72	96.1	169.8	-170.5	90.1	0	0	0	109.3	E365 Y369 S429 G432 I433 Q436	E365-H367 PolarHBondContact O-N 3.15Å; H367-Y369 PolarHBondContact O-N 3.09Å; H367-S429 PolarHBondContact N-OG 3.47Å; H367-G432 VanDerWaalsContact CD2-C 3.46Å; H367-I433 HydrophobicContact CB-CG1 4.02Å; H367-Q436 PolarHBondContact CE1-OE1 3.29Å; H367-Q436 PolarHBondContact NE2-OE1 3Å
368	Q	89.1	Confident	90.3	Very high	181 Å²	181	62.1 Å²	62.1	85%	0.846	32%	0.322	S	S	*	.			trans	-77.9	101.1	179.2	-65.3	-174.7	1.7	0	0	109.4	M366	M366-Q368 PolarHBondContact O-N 3.44Å
369	Y	93.6	Very high	89.9	Confident	66 Å²	66	64.3 Å²	64.3	26%	0.259	34%	0.338	S	S	.	.			trans	-129	135.1	169.6	-171.8	-90.4	0	0	0	108.2	H367 L371 Q435 Q436 D439	H367-Y369 PolarHBondContact O-N 3.09Å; Y369-L371 PolarHBondContact O-N 3.16Å; Y369-Q435 HydrophobicContact CD1-CB 3.93Å; Y369-Q435 HydrophobicContact CD1-CG 3.82Å; Y369-Q435 HydrophobicContact CE1-CB 4.24Å; Y369-Q435 HydrophobicContact CE1-CG 3.75Å; Y369-Q436 HydrophobicContact CD1-CB 4.08Å; Y369-Q436 HydrophobicContact CD2-CB 3.64Å; Y369-Q436 HydrophobicContact CD2-CG 3.79Å; Y369-Q436 HydrophobicContact CE1-CB 4.17Å; Y369-Q436 HydrophobicContact CE2-CB 3.72Å; Y369-Q436 HydrophobicContact CE2-CG 3.6Å; Y369-Q436 HydrophobicContact CG-CB 3.83Å; Y369-Q436 HydrophobicContact CG-CG 4.49Å; Y369-D439 WeakPolarHBondContact CE1-OD2 3.42Å; Y369-D439 VanDerWaalsContact CZ-OD2 3.31Å; Y369-D439 WeakPolarHBondContact OH-CB 3.39Å; Y369-D439 PolarHBondContact OH-OD2 2.69Å
370	P	90.6	Very high	89.2	Confident	96 Å²	96	66.8 Å²	66.8	62%	0.623	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-64.4	131.6	-177.8	27.3	-34.4	0	0	0	110.4
371	L	90.6	Very high	88.5	Confident	70 Å²	70	68.2 Å²	68.2	37%	0.366	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-88.7	142.5	166.1	-59.9	-179.3	0	0	0	108.2	Y369 T373 Q435 Y451 L452	Y369-L371 PolarHBondContact O-N 3.16Å; L371-T373 PolarHBondContact O-N 3.16Å; L371-Q435 HydrophobicContact CD2-CB 3.62Å; L371-Q435 HydrophobicContact CD2-CG 3.67Å; L371-Y451 HydrophobicContact CB-CE2 4.24Å; L371-L452 HydrophobicContact CD2-CD2 3.85Å
372	P	86.4	Confident	87.7	Confident	27 Å²	27	73.4 Å²	73.4	18%	0.175	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-55.1	137	174.8	-24.5	33.4	0	0	0	111.1	D376 I377 A450	P372-D376 HydrophobicContact CB-CB 4.4Å; P372-I377 HydrophobicContact CB-CD1 4.31Å; P372-I377 HydrophobicContact CB-CG1 3.93Å; P372-A450 WeakPolarHBondContact CG-O 3.45Å
373	T	85.7	Confident	87	Confident	57 Å²	57	70.7 Å²	70.7	35%	0.35	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-76.6	159.2	171.5	83.8	0	0	0	0	109.9	L371 E375 D376 I377	L371-T373 PolarHBondContact O-N 3.16Å; T373-E375 VanDerWaalsContact CB-OE2 3.26Å; T373-E375 WeakPolarHBondContact CB-OE2 3.31Å; T373-E375 PolarHBondContact O-N 3.39Å; T373-E375 PolarHBondContact OG1-N 2.84Å; T373-E375 PolarHBondContact OG1-OE2 3.42Å; T373-D376 PolarHBondContact N-OD2 3.1Å; T373-D376 WeakPolarHBondContact O-CB 3.29Å; T373-D376 PolarHBondContact O-N 3.02Å; T373-D376 PolarHBondContact OG1-N 3.16Å; T373-D376 PolarHBondContact OG1-OD2 3.48Å; T373-I377 WeakPolarHBondContact O-CG1 3.27Å; T373-I377 PolarHBondContact O-N 2.77Å; T373-I377 VanDerWaalsContact O-N 3.07Å
374	P	79.9	Confident	86.1	Confident	51 Å²	51	71.2 Å²	71.2	33%	0.331	39%	0.39	S	S	.	.	H	α-helix	trans	-52.4	-38.6	172.1	-27.6	36.5	0	0	0	112.5	I377 F378	P374-I377 PolarHBondContact O-N 2.88Å; P374-F378 HydrophobicContact CB-CD2 4.26Å; P374-F378 HydrophobicContact CB-CE2 3.96Å; P374-F378 WeakPolarHBondContact O-CB 3.27Å; P374-F378 WeakPolarHBondContact O-CD2 3.36Å; P374-F378 WeakPolarHBondContact O-CG 3.37Å; P374-F378 PolarHBondContact O-N 3.23Å
375	E	81.9	Confident	85	Confident	122 Å²	122	72.5 Å²	72.5	57%	0.57	40%	0.398	S	S	*	.	H	α-helix	trans	-62.3	-42.2	176.8	-60.4	73.5	-160.1	0	0	112.2	T373 I377 F378 S379	T373-E375 VanDerWaalsContact CB-OE2 3.26Å; T373-E375 WeakPolarHBondContact CB-OE2 3.31Å; T373-E375 PolarHBondContact O-N 3.39Å; T373-E375 PolarHBondContact OG1-N 2.84Å; T373-E375 PolarHBondContact OG1-OE2 3.42Å; E375-I377 VanDerWaalsContact C-N 3.34Å; E375-F378 PolarHBondContact O-N 2.69Å; E375-S379 VanDerWaalsContact O-CB 3.31Å; E375-S379 WeakPolarHBondContact O-CB 3.38Å; E375-S379 PolarHBondContact O-N 3.05Å
376	D	80.8	Confident	83.9	Confident	86 Å²	86	69.3 Å²	69.3	46%	0.46	38%	0.383	S	S	.	.	H	α-helix	trans	-61	-45.7	175.6	-63	-33.9	0	0	0	110.8	P372 T373 S379 T380	P372-D376 HydrophobicContact CB-CB 4.4Å; T373-D376 PolarHBondContact N-OD2 3.1Å; T373-D376 WeakPolarHBondContact O-CB 3.29Å; T373-D376 PolarHBondContact O-N 3.02Å; T373-D376 PolarHBondContact OG1-N 3.16Å; T373-D376 PolarHBondContact OG1-OD2 3.48Å; D376-S379 PolarHBondContact O-N 3.15Å; D376-S379 PolarHBondContact O-OG 2.88Å; D376-T380 PolarHBondContact O-N 2.76Å; D376-T380 PolarHBondContact O-OG1 2.99Å
377	I	84.4	Confident	83.1	Confident	37 Å²	37	66.5 Å²	66.5	19%	0.19	37%	0.369	C	S	.	.	H	α-helix	trans	-60.6	-53.6	177.1	-62.2	172.2	0	0	0	109.7	P372 T373 P374 E375 S379 T380 L381 V449 Y451	P372-I377 HydrophobicContact CB-CD1 4.31Å; P372-I377 HydrophobicContact CB-CG1 3.93Å; T373-I377 WeakPolarHBondContact O-CG1 3.27Å; T373-I377 PolarHBondContact O-N 2.77Å; T373-I377 VanDerWaalsContact O-N 3.07Å; P374-I377 PolarHBondContact O-N 2.88Å; E375-I377 VanDerWaalsContact C-N 3.34Å; I377-S379 VanDerWaalsContact C-N 3.28Å; I377-S379 PolarHBondContact O-N 3.01Å; I377-T380 PolarHBondContact O-N 3.13Å; I377-T380 VanDerWaalsContact O-N 3.1Å; I377-L381 HydrophobicContact CG2-CD1 3.8Å; I377-L381 HydrophobicContact CG2-CG 4.29Å; I377-L381 WeakPolarHBondContact O-CG 3.45Å; I377-L381 PolarHBondContact O-N 3.17Å; I377-V449 HydrophobicContact CB-CG1 4.27Å; I377-V449 HydrophobicContact CG1-CG1 3.85Å; I377-V449 HydrophobicContact CG2-CG1 4.12Å; I377-Y451 HydrophobicContact CD1-CD2 4.04Å; I377-Y451 HydrophobicContact CD1-CG 4.31Å
378	F	79.9	Confident	82.3	Confident	98 Å²	98	64.2 Å²	64.2	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-61.6	-35.3	-179.1	-70.9	-52.8	0	0	0	113	A75 P374 E375 T380 L381 N382	A75-F378 HydrophobicContact CB-CE1 4.42Å; A75-F378 HydrophobicContact CB-CZ 3.88Å; P374-F378 HydrophobicContact CB-CD2 4.26Å; P374-F378 HydrophobicContact CB-CE2 3.96Å; P374-F378 WeakPolarHBondContact O-CB 3.27Å; P374-F378 WeakPolarHBondContact O-CD2 3.36Å; P374-F378 WeakPolarHBondContact O-CG 3.37Å; P374-F378 PolarHBondContact O-N 3.23Å; E375-F378 PolarHBondContact O-N 2.69Å; F378-T380 VanDerWaalsContact C-N 3.26Å; F378-T380 PolarHBondContact O-N 3.05Å; F378-L381 PolarHBondContact O-N 2.65Å; F378-N382 WeakPolarHBondContact O-CB 3.37Å; F378-N382 PolarHBondContact O-N 2.67Å
379	S	84.5	Confident	81.8	Confident	80 Å²	80	58 Å²	58	56%	0.559	33%	0.33	S	S	*	.	H	α-helix	trans	-61.1	-37.7	177.1	78.9	0	0	0	0	111.9	E375 D376 I377	E375-S379 VanDerWaalsContact O-CB 3.31Å; E375-S379 WeakPolarHBondContact O-CB 3.38Å; E375-S379 PolarHBondContact O-N 3.05Å; D376-S379 PolarHBondContact O-N 3.15Å; D376-S379 PolarHBondContact O-OG 2.88Å; I377-S379 VanDerWaalsContact C-N 3.28Å; I377-S379 PolarHBondContact O-N 3.01Å
380	T	79.8	Confident	81.3	Confident	58 Å²	58	55 Å²	55	36%	0.356	32%	0.318	S	S	.	.	H	α-helix	trans	-76.7	-36.3	178.4	-54.2	0	0	0	0	111.9	D376 I377 F378 N382 V449 V458	D376-T380 PolarHBondContact O-N 2.76Å; D376-T380 PolarHBondContact O-OG1 2.99Å; I377-T380 PolarHBondContact O-N 3.13Å; I377-T380 VanDerWaalsContact O-N 3.1Å; F378-T380 VanDerWaalsContact C-N 3.26Å; F378-T380 PolarHBondContact O-N 3.05Å; T380-N382 VanDerWaalsContact C-N 3.29Å; T380-N382 PolarHBondContact O-N 2.83Å; T380-V449 HydrophobicContact CG2-CG2 3.25Å; T380-V458 HydrophobicContact CG2-CG1 4.47Å
381	L	83.2	Confident	80.7	Confident	38 Å²	38	52.6 Å²	52.6	20%	0.199	30%	0.3	C	S	.	.	H	α-helix	trans	-73	-21	177.7	-61.3	180	0	0	0	113.1	I377 F378 G383 G384 F387 T456 V458	I377-L381 HydrophobicContact CG2-CD1 3.8Å; I377-L381 HydrophobicContact CG2-CG 4.29Å; I377-L381 WeakPolarHBondContact O-CG 3.45Å; I377-L381 PolarHBondContact O-N 3.17Å; F378-L381 PolarHBondContact O-N 2.65Å; L381-G383 PolarHBondContact O-N 3.11Å; L381-G384 PolarHBondContact O-N 3.45Å; L381-F387 HydrophobicContact CB-CE1 4.18Å; L381-F387 HydrophobicContact CD2-CD1 4.14Å; L381-F387 HydrophobicContact CD2-CE1 3.95Å; L381-T456 HydrophobicContact CD2-CG2 3.73Å; L381-V458 HydrophobicContact CD2-CB 4.06Å; L381-V458 HydrophobicContact CD2-CG1 4.02Å
382	N	80.1	Confident	80.2	Confident	133 Å²	133	49.4 Å²	49.4	71%	0.711	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	131.9	-173.1	-176.4	35.5	0	0	0	113.2	F378 T380 G384	F378-N382 WeakPolarHBondContact O-CB 3.37Å; F378-N382 PolarHBondContact O-N 2.67Å; T380-N382 VanDerWaalsContact C-N 3.29Å; T380-N382 PolarHBondContact O-N 2.83Å; N382-G384 PolarHBondContact O-N 3.06Å
383	G	79.5	Confident	79.5	Confident	46 Å²	46	49.2 Å²	49.2	47%	0.474	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	-3.2	-177.1	0	0	0	0	0	114.3	L381	L381-G383 PolarHBondContact O-N 3.11Å
384	G	78.7	Confident	79.2	Confident	17 Å²	17	48.2 Å²	48.2	18%	0.175	28%	0.275	C	S	.	.			trans	-64.6	145.7	166.4	0	0	0	0	0	111.3	L381 N382 F387	L381-G384 PolarHBondContact O-N 3.45Å; N382-G384 PolarHBondContact O-N 3.06Å; G384-F387 WeakPolarHBondContact O-CZ 3.4Å
385	T	74.8	Confident	79.5	Confident	28 Å²	28	45.9 Å²	45.9	17%	0.172	26%	0.26	C	S	.	.			trans	-124.2	-48.3	177.7	77.4	0	0	0	0	108.8	L126 P128 F387 G459 K460	L126-T385 CarbonylContact C-O 3.58Å; L126-T385 VanDerWaalsContact CB-O 3.29Å; L126-T385 WeakPolarHBondContact CB-O 3.32Å; L126-T385 CarbonylContact O-C 3.46Å; P128-T385 HydrophobicContact CB-CG2 4.2Å; P128-T385 HydrophobicContact CG-CG2 3.65Å; T385-F387 WeakPolarHBondContact O-CD2 3.48Å; T385-F387 WeakPolarHBondContact O-CE2 3.38Å; T385-G459 PolarHBondContact N-O 2.96Å; T385-K460 PolarHBondContact OG1-O 3.27Å
386	V	71.7	Confident	80	Confident	9 Å²	9	41 Å²	41	6%	0.055	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	131.7	176.1	-173.5	0	0	0	0	109.8	L125 V458 G459 E462 H465	L125-V386 HydrophobicContact CD2-CG1 4Å; L125-V386 HydrophobicContact CD2-CG2 4.27Å; V386-V458 WeakPolarHBondContact O-CA 3.37Å; V386-G459 PolarHBondContact N-O 2.72Å; V386-G459 PolarHBondContact O-N 2.99Å; V386-E462 HydrophobicContact CG2-CB 4.44Å; V386-H465 HydrophobicContact CB-CB 3.95Å; V386-H465 HydrophobicContact CG1-CB 3.93Å; V386-H465 PolarHBondContact O-CD2 3.29Å
387	F	77.8	Confident	80.6	Confident	41 Å²	41	37.5 Å²	37.5	18%	0.18	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.7	-179	-58.9	-97.4	0	0	0	110.9	L126 L381 G384 T385 T456 V457 V458	L126-F387 HydrophobicContact CB-CD2 4.01Å; L126-F387 HydrophobicContact CB-CE2 4.39Å; L126-F387 HydrophobicContact CD1-CD2 3.6Å; L126-F387 HydrophobicContact CD1-CE2 3.99Å; L126-F387 HydrophobicContact CD1-CG 4.38Å; L126-F387 HydrophobicContact CG-CD2 4.25Å; L381-F387 HydrophobicContact CB-CE1 4.18Å; L381-F387 HydrophobicContact CD2-CD1 4.14Å; L381-F387 HydrophobicContact CD2-CE1 3.95Å; G384-F387 WeakPolarHBondContact O-CZ 3.4Å; T385-F387 WeakPolarHBondContact O-CD2 3.48Å; T385-F387 WeakPolarHBondContact O-CE2 3.38Å; F387-T456 HydrophobicContact CD1-CG2 4.22Å; F387-V457 CarbonylContact C-O 3.44Å; F387-V457 VanDerWaalsContact CA-O 3.28Å; F387-V457 WeakPolarHBondContact CA-O 3.4Å; F387-V458 HydrophobicContact CD1-CB 3.84Å; F387-V458 HydrophobicContact CD1-CG2 3.67Å; F387-V458 HydrophobicContact CE1-CB 3.93Å; F387-V458 HydrophobicContact CE1-CG2 3.31Å; F387-V458 HydrophobicContact CZ-CG2 3.91Å
388	S	76.2	Confident	81.1	Confident	8 Å²	8	35.8 Å²	35.8	6%	0.056	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	128.3	167	-66.8	0	0	0	0	108.9	T456 V457 H465	S388-T456 CarbonylContact O-C 3.45Å; S388-T456 WeakPolarHBondContact O-CA 3.24Å; S388-V457 PolarHBondContact N-O 2.81Å; S388-V457 PolarHBondContact O-N 2.79Å; S388-H465 PolarHBondContact N-NE2 3.32Å; S388-H465 PolarHBondContact OG-CE1 3.08Å; S388-H465 PolarHBondContact OG-NE2 3.01Å; S388-H465 VanDerWaalsContact OG-NE2 3.13Å
389	Q	79	Confident	81.8	Confident	50 Å²	50	31.1 Å²	31.1	23%	0.234	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.4	175.8	-171.6	172.6	0.1	0	0	108.9	D454 V455	Q389-D454 PolarHBondContact NE2-OD1 3.21Å; Q389-V455 CarbonylContact C-O 3.37Å; Q389-V455 WeakPolarHBondContact CA-O 3.47Å
390	I	81.8	Confident	82.4	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.7	175.1	-54.8	104	0	0	0	108.1	F392 V455 V457 W469 F472 F483	I390-F392 HydrophobicContact CG2-CE1 4.45Å; I390-F392 HydrophobicContact CG2-CZ 4.4Å; I390-V455 HydrophobicContact CB-CB 4.31Å; I390-V455 HydrophobicContact CD1-CB 4.02Å; I390-V455 HydrophobicContact CD1-CG1 3.85Å; I390-V455 WeakPolarHBondContact CD1-O 3.46Å; I390-V455 PolarHBondContact N-O 3.45Å; I390-V455 PolarHBondContact O-N 3.36Å; I390-V457 HydrophobicContact CD1-CG2 3.82Å; I390-W469 HydrophobicContact CD1-CH2 4.29Å; I390-W469 HydrophobicContact CD1-CZ3 3.71Å; I390-W469 HydrophobicContact CG1-CH2 3.81Å; I390-W469 HydrophobicContact CG1-CZ3 3.73Å; I390-F472 HydrophobicContact CD1-CD1 4.23Å; I390-F472 HydrophobicContact CD1-CE1 3.27Å; I390-F472 HydrophobicContact CD1-CZ 3.76Å; I390-F472 HydrophobicContact CG1-CE1 3.93Å; I390-F472 HydrophobicContact CG1-CZ 4.47Å; I390-F483 HydrophobicContact CG2-CB 3.71Å; I390-F483 HydrophobicContact CG2-CD1 3.7Å; I390-F483 HydrophobicContact CG2-CD2 4.18Å; I390-F483 HydrophobicContact CG2-CE1 4.29Å; I390-F483 HydrophobicContact CG2-CG 3.62Å
391	D	78.1	Confident	83.2	Confident	46 Å²	46	25.6 Å²	25.6	25%	0.246	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	109.4	175	177.3	16.8	0	0	0	109.1	S393 F483	D391-S393 PolarHBondContact O-N 3.48Å; D391-F483 VanDerWaalsContact O-CB 3.28Å; D391-F483 WeakPolarHBondContact O-CB 3.46Å
392	F	80.3	Confident	83.9	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.018	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-73.6	124.2	-178.3	-71.2	-75.9	0	0	0	111.9	I390 D394 A395 M438 D453 V455 L476 F481 T482 F483	I390-F392 HydrophobicContact CG2-CE1 4.45Å; I390-F392 HydrophobicContact CG2-CZ 4.4Å; F392-D394 PolarHBondContact O-N 3.2Å; F392-D394 VanDerWaalsContact O-N 3.16Å; F392-A395 HydrophobicContact CB-CB 3.54Å; F392-A395 PolarHBondContact O-N 3.41Å; F392-M438 HydrophobicContact CD1-CE 4.48Å; F392-M438 HydrophobicContact CD2-CE 3.68Å; F392-M438 HydrophobicContact CE1-CE 4.15Å; F392-M438 HydrophobicContact CE2-CE 3.24Å; F392-M438 HydrophobicContact CE2-SD 3.89Å; F392-M438 HydrophobicContact CG-CE 4.28Å; F392-M438 HydrophobicContact CZ-CE 3.51Å; F392-M438 HydrophobicContact CZ-SD 4.08Å; F392-D453 WeakPolarHBondContact CD2-O 3.42Å; F392-V455 HydrophobicContact CE2-CB 4.36Å; F392-V455 HydrophobicContact CE2-CG2 3.59Å; F392-V455 HydrophobicContact CZ-CG2 4.3Å; F392-L476 HydrophobicContact CE1-CD2 3.73Å; F392-L476 HydrophobicContact CZ-CD2 3.66Å; F392-F481 HydrophobicContact CD1-CB 4.34Å; F392-F481 HydrophobicContact CD1-CD1 4.26Å; F392-F481 HydrophobicContact CE1-CB 3.81Å; F392-F481 HydrophobicContact CE1-CD1 4.21Å; F392-F481 HydrophobicContact CE1-CG 4.25Å; F392-T482 WeakPolarHBondContact CD1-O 3.28Å; F392-F483 HydrophobicContact CD1-CB 4.37Å
393	S	70.9	Confident	84.6	Confident	23 Å²	23	23.4 Å²	23.4	16%	0.161	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	118.3	174.2	-80.2	0	0	0	0	110.8	D391 A395 Q398 G484	D391-S393 PolarHBondContact O-N 3.48Å; S393-A395 PolarHBondContact O-N 3.25Å; S393-A395 VanDerWaalsContact O-N 3.15Å; S393-Q398 PolarHBondContact O-NE2 2.98Å; S393-G484 VanDerWaalsContact OG-CA 3.32Å; S393-G484 WeakPolarHBondContact OG-CA 3.26Å; S393-G484 PolarHBondContact OG-N 3.43Å
394	D	80.3	Confident	85.3	Confident	36 Å²	36	28.2 Å²	28.2	19%	0.193	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	43.4	-179.4	-61.9	-49	0	0	0	112.3	L281 K345 F392 Y396 L397	L281-D394 HydrophobicContact CD1-CB 4.15Å; K345-D394 IonicContact NZ-OD1 2.69Å; K345-D394 PolarHBondContact NZ-OD1 3.24Å; F392-D394 PolarHBondContact O-N 3.2Å; F392-D394 VanDerWaalsContact O-N 3.16Å; D394-Y396 PolarHBondContact O-N 3.47Å; D394-Y396 VanDerWaalsContact O-N 3.09Å; D394-L397 HydrophobicContact CB-CB 4.37Å; D394-L397 HydrophobicContact CB-CD1 4.08Å; D394-L397 HydrophobicContact CB-CG 4.39Å; D394-L397 WeakPolarHBondContact O-CA 3.3Å; D394-L397 WeakPolarHBondContact O-CB 3.46Å; D394-L397 PolarHBondContact O-N 3.09Å
395	A	86.5	Confident	86.2	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.008	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-33.2	-58.7	-168.6	0	0	0	0	0	115.9	F392 S393 L397 Q398 F434 D453	F392-A395 HydrophobicContact CB-CB 3.54Å; F392-A395 PolarHBondContact O-N 3.41Å; S393-A395 PolarHBondContact O-N 3.25Å; S393-A395 VanDerWaalsContact O-N 3.15Å; A395-L397 VanDerWaalsContact C-N 3.28Å; A395-L397 PolarHBondContact O-N 3.19Å; A395-Q398 WeakPolarHBondContact O-CB 3.49Å; A395-Q398 PolarHBondContact O-N 3.03Å; A395-Q398 VanDerWaalsContact O-N 3.1Å; A395-F434 HydrophobicContact CB-CE1 4.44Å; A395-F434 HydrophobicContact CB-CE2 3.85Å; A395-F434 HydrophobicContact CB-CZ 3.58Å; A395-F434 WeakPolarHBondContact O-CE2 3.16Å; A395-D453 HydrophobicContact CB-CB 3.66Å
396	Y	92	Very high	87.3	Confident	19 Å²	19	27.8 Å²	27.8	8%	0.075	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-61.7	-33.1	-177.9	-63.1	-86.6	0	0	0	113.4	D394 Q398 I399 L423 F425 A430 F434	D394-Y396 PolarHBondContact O-N 3.47Å; D394-Y396 VanDerWaalsContact O-N 3.09Å; Y396-Q398 PolarHBondContact O-N 3.42Å; Y396-Q398 VanDerWaalsContact O-N 3.11Å; Y396-I399 PolarHBondContact O-N 3.03Å; Y396-L423 CarbonylContact C-O 3.58Å; Y396-L423 VanDerWaalsContact CB-O 3.24Å; Y396-L423 WeakPolarHBondContact CB-O 3.39Å; Y396-L423 HydrophobicContact CD1-CD2 4.03Å; Y396-L423 VanDerWaalsContact O-O 3.13Å; Y396-F425 AromaticContact CD2-CD1 3.54Å; Y396-F425 HydrophobicContact CD2-CD1 3.54Å; Y396-F425 AromaticContact CD2-CE1 3.25Å; Y396-F425 HydrophobicContact CD2-CE1 3.25Å; Y396-F425 HydrophobicContact CD2-CE2 4.48Å; Y396-F425 HydrophobicContact CD2-CG 4.31Å; Y396-F425 AromaticContact CD2-CZ 3.76Å; Y396-F425 HydrophobicContact CD2-CZ 3.76Å; Y396-F425 AromaticContact CE2-CD1 3.91Å; Y396-F425 HydrophobicContact CE2-CD1 3.91Å; Y396-F425 AromaticContact CE2-CE1 3.7Å; Y396-F425 HydrophobicContact CE2-CE1 3.7Å; Y396-F425 HydrophobicContact CG-CD1 4.5Å; Y396-F425 HydrophobicContact CG-CE1 4.38Å; Y396-A430 HydrophobicContact CD1-CB 3.89Å; Y396-A430 HydrophobicContact CE1-CB 3.91Å; Y396-A430 WeakPolarHBondContact CE1-O 3.13Å; Y396-F434 HydrophobicContact CD1-CB 3.85Å; Y396-F434 AromaticContact CD1-CD2 3.58Å; Y396-F434 HydrophobicContact CD1-CD2 3.58Å; Y396-F434 HydrophobicContact CD1-CE2 4.46Å; Y396-F434 AromaticContact CD1-CG 3.93Å; Y396-F434 HydrophobicContact CD1-CG 3.93Å; Y396-F434 HydrophobicContact CE1-CB 3.42Å; Y396-F434 VanDerWaalsContact CE1-CB 3.42Å; Y396-F434 AromaticContact CE1-CD2 3.87Å; Y396-F434 HydrophobicContact CE1-CD2 3.87Å; Y396-F434 AromaticContact CE1-CG 3.72Å; Y396-F434 HydrophobicContact CE1-CG 3.72Å; Y396-F434 HydrophobicContact CG-CD2 4.11Å
397	L	93.8	Very high	88.4	Confident	14 Å²	14	30.7 Å²	30.7	7%	0.073	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-68.9	-8.3	179.7	-59.9	-175.8	0	0	0	112.9	L281 L322 V327 D394 A395 I399 Y420 R422 F425	L281-L397 HydrophobicContact CD1-CB 4.02Å; L281-L397 HydrophobicContact CD2-CB 4.19Å; L322-L397 HydrophobicContact CD2-CD1 4.4Å; V327-L397 HydrophobicContact CG1-CD1 4.19Å; V327-L397 HydrophobicContact CG1-CD2 3.9Å; V327-L397 HydrophobicContact CG1-CG 4.49Å; D394-L397 HydrophobicContact CB-CB 4.37Å; D394-L397 HydrophobicContact CB-CD1 4.08Å; D394-L397 HydrophobicContact CB-CG 4.39Å; D394-L397 WeakPolarHBondContact O-CA 3.3Å; D394-L397 WeakPolarHBondContact O-CB 3.46Å; D394-L397 PolarHBondContact O-N 3.09Å; A395-L397 VanDerWaalsContact C-N 3.28Å; A395-L397 PolarHBondContact O-N 3.19Å; L397-I399 VanDerWaalsContact C-N 3.31Å; L397-Y420 HydrophobicContact CD2-CE1 4.47Å; L397-R422 HydrophobicContact CB-CB 4.42Å; L397-R422 HydrophobicContact CD2-CB 4.38Å; L397-R422 WeakPolarHBondContact O-CB 3.37Å; L397-R422 VanDerWaalsContact O-CD 3.27Å; L397-R422 WeakPolarHBondContact O-CD 3.41Å; L397-R422 WeakPolarHBondContact O-CG 3.47Å; L397-F425 HydrophobicContact CG-CE2 4.27Å
398	Q	93.5	Very high	89.4	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-79.8	-15.1	173	-55	-171.5	40	0	0	112.3	L281 G282 H283 C284 S393 A395 Y396 F481 T482	L281-Q398 HydrophobicContact CD1-CG 3.77Å; L281-Q398 HydrophobicContact CG-CG 4.41Å; G282-Q398 WeakPolarHBondContact O-CA 3.44Å; H283-Q398 CarbonylContact C-O 3.57Å; H283-Q398 WeakPolarHBondContact CA-O 3.07Å; C284-Q398 WeakPolarHBondContact CB-O 3.47Å; C284-Q398 PolarHBondContact N-O 2.81Å; S393-Q398 PolarHBondContact O-NE2 2.98Å; A395-Q398 WeakPolarHBondContact O-CB 3.49Å; A395-Q398 PolarHBondContact O-N 3.03Å; A395-Q398 VanDerWaalsContact O-N 3.1Å; Y396-Q398 PolarHBondContact O-N 3.42Å; Y396-Q398 VanDerWaalsContact O-N 3.11Å; Q398-F481 HydrophobicContact CB-CD1 4.01Å; Q398-F481 HydrophobicContact CB-CE1 3.95Å; Q398-F481 VanDerWaalsContact OE1-CD1 3.26Å; Q398-T482 PolarHBondContact NE2-O 3.06Å
399	I	95.6	Very high	90.4	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-93.8	124.8	179.5	-60.8	161.8	0	0	0	109.8	C284 A289 Y396 L397 R422 L423 F434 I437 F481	C284-I399 HydrophobicContact CB-CG1 4.28Å; A289-I399 HydrophobicContact CB-CG2 3.86Å; Y396-I399 PolarHBondContact O-N 3.03Å; L397-I399 VanDerWaalsContact C-N 3.31Å; I399-R422 CarbonylContact O-C 3.45Å; I399-R422 WeakPolarHBondContact O-CA 3.32Å; I399-L423 HydrophobicContact CB-CB 4.24Å; I399-L423 HydrophobicContact CD1-CD2 4.25Å; I399-L423 PolarHBondContact O-N 3.36Å; I399-F434 HydrophobicContact CD1-CD2 3.34Å; I399-F434 HydrophobicContact CD1-CE2 3.78Å; I399-F434 HydrophobicContact CD1-CG 4.29Å; I399-I437 HydrophobicContact CD1-CD1 3.57Å; I399-I437 HydrophobicContact CG1-CD1 4Å; I399-I437 HydrophobicContact CG2-CD1 3.96Å; I399-F481 HydrophobicContact CG1-CZ 4.26Å
400	E	97	Very high	91.3	Very high	23 Å²	23	26.6 Å²	26.6	11%	0.107	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	142.2	173.5	-174.3	178.1	155.6	0	0	111.8	H283 K288 A289 R406 R422	H283-E400 IonicContact CE1-OE2 2.69Å; H283-E400 IonicContact NE2-OE2 3.75Å; H283-E400 PolarHBondContact NE2-OE2 3.03Å; K288-E400 CarbonylContact C-O 3.55Å; K288-E400 WeakPolarHBondContact CA-O 3.21Å; K288-E400 WeakPolarHBondContact CB-O 3.33Å; K288-E400 HydrophobicContact CD-CG 4.2Å; K288-E400 VanDerWaalsContact CE-OE1 3.3Å; K288-E400 WeakPolarHBondContact CE-OE1 3.43Å; K288-E400 HydrophobicContact CG-CB 4.27Å; K288-E400 HydrophobicContact CG-CG 4.45Å; K288-E400 IonicContact NZ-OE1 3.58Å; K288-E400 PolarHBondContact NZ-OE1 2.89Å; K288-E400 IonicContact NZ-OE2 2.82Å; A289-E400 PolarHBondContact N-O 3.28Å; E400-R406 IonicContact OE1-NH2 3.58Å; E400-R406 PolarHBondContact OE1-NH2 3.07Å; E400-R422 IonicContact OE2-NH1 3.68Å
401	V	97.6	Very high	92	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	137.9	173.5	175.8	0	0	0	0	109.6	A289 S405 R406 L409 N421 R422 L423	A289-V401 HydrophobicContact CB-CG2 4.33Å; A289-V401 WeakPolarHBondContact O-CA 3.39Å; V401-S405 VanDerWaalsContact CG1-CB 3.45Å; V401-R406 HydrophobicContact CB-CG 4.12Å; V401-R406 HydrophobicContact CG1-CG 3.95Å; V401-R406 PolarHBondContact O-NE 3.19Å; V401-L409 HydrophobicContact CB-CD1 4.26Å; V401-L409 HydrophobicContact CG1-CD1 3.82Å; V401-L409 HydrophobicContact CG2-CD1 3.64Å; V401-N421 PolarHBondContact N-O 3.06Å; V401-R422 VanDerWaalsContact CG2-C 3.44Å; V401-L423 HydrophobicContact CG2-CB 4.13Å
402	S	96.8	Very high	93	Very high	10 Å²	10	25.1 Å²	25.1	7%	0.07	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-61.7	148	176.3	85.7	0	0	0	0	111.3	A289 S290 E404 S405 R406	A289-S402 PolarHBondContact O-N 3.5Å; S290-S402 WeakPolarHBondContact OG-CB 3.48Å; S290-S402 PolarHBondContact OG-OG 3.3Å; S290-S402 VanDerWaalsContact OG-OG 3.05Å; S402-E404 WeakPolarHBondContact CB-OE2 3.14Å; S402-E404 PolarHBondContact O-N 3.29Å; S402-E404 VanDerWaalsContact O-N 3.12Å; S402-E404 PolarHBondContact OG-OE2 3.22Å; S402-S405 PolarHBondContact O-N 3.37Å; S402-R406 WeakPolarHBondContact O-CG 3.37Å; S402-R406 PolarHBondContact O-N 3.31Å; S402-R406 VanDerWaalsContact O-N 3.17Å
403	E	94.9	Very high	93.8	Very high	114 Å²	114	25.1 Å²	25.1	53%	0.533	12%	0.122	S	C	.	.	H	α-helix	trans	-53	-39.4	-173.2	-68.6	-66.2	167	0	0	112.7	S405 R406	E403-S405 VanDerWaalsContact C-N 3.28Å; E403-S405 PolarHBondContact O-N 3.32Å; E403-R406 PolarHBondContact O-N 2.66Å; E403-R406 IonicContact OE1-CZ 2.77Å; E403-R406 IonicContact OE1-NH1 3.25Å; E403-R406 PolarHBondContact OE1-NH1 2.87Å; E403-R406 IonicContact OE1-NH2 3.14Å; E403-R406 PolarHBondContact OE1-NH2 2.99Å; E403-R406 VanDerWaalsContact OE1-NH2 3.12Å; E403-R406 IonicContact OE2-CZ 3.82Å; E403-R406 IonicContact OE2-NE 3.72Å; E403-R406 IonicContact OE2-NH1 2.8Å; E403-R406 PolarHBondContact OE2-NH1 3.45Å
404	E	94.7	Very high	95	Very high	147 Å²	147	26.2 Å²	26.2	69%	0.687	13%	0.125	S	C	*	.	H	α-helix	trans	-67.3	-30	-178.9	-48.4	77.5	-167.9	0	0	112.3	S402	S402-E404 WeakPolarHBondContact CB-OE2 3.14Å; S402-E404 PolarHBondContact O-N 3.29Å; S402-E404 VanDerWaalsContact O-N 3.12Å; S402-E404 PolarHBondContact OG-OE2 3.22Å
405	S	97.2	Very high	95.7	Very high	4 Å²	4	27 Å²	27	3%	0.028	13%	0.133	C	C	.	.	H	α-helix	trans	-90.1	-16.9	-178.2	-66.7	0	0	0	0	113.2	L291 V401 S402 E403 E407 L408	L291-S405 PolarHBondContact N-OG 3.3Å; L291-S405 PolarHBondContact O-OG 3.09Å; V401-S405 VanDerWaalsContact CG1-CB 3.45Å; S402-S405 PolarHBondContact O-N 3.37Å; E403-S405 VanDerWaalsContact C-N 3.28Å; E403-S405 PolarHBondContact O-N 3.32Å; S405-E407 VanDerWaalsContact C-N 3.32Å; S405-E407 PolarHBondContact O-N 3.45Å; S405-L408 WeakPolarHBondContact O-CB 3.16Å; S405-L408 PolarHBondContact O-N 3.08Å
406	R	96.8	Very high	96.2	Very high	32 Å²	32	28.6 Å²	28.6	12%	0.121	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-39.8	-177.4	-67.1	-178.1	-174	165.9	2.6	111.9	E400 V401 S402 E403 L408 L409 R419	E400-R406 IonicContact OE1-NH2 3.58Å; E400-R406 PolarHBondContact OE1-NH2 3.07Å; V401-R406 HydrophobicContact CB-CG 4.12Å; V401-R406 HydrophobicContact CG1-CG 3.95Å; V401-R406 PolarHBondContact O-NE 3.19Å; S402-R406 WeakPolarHBondContact O-CG 3.37Å; S402-R406 PolarHBondContact O-N 3.31Å; S402-R406 VanDerWaalsContact O-N 3.17Å; E403-R406 PolarHBondContact O-N 2.66Å; E403-R406 IonicContact OE1-CZ 2.77Å; E403-R406 IonicContact OE1-NH1 3.25Å; E403-R406 PolarHBondContact OE1-NH1 2.87Å; E403-R406 IonicContact OE1-NH2 3.14Å; E403-R406 PolarHBondContact OE1-NH2 2.99Å; E403-R406 VanDerWaalsContact OE1-NH2 3.12Å; E403-R406 IonicContact OE2-CZ 3.82Å; E403-R406 IonicContact OE2-NE 3.72Å; E403-R406 IonicContact OE2-NH1 2.8Å; E403-R406 PolarHBondContact OE2-NH1 3.45Å; R406-L408 PolarHBondContact O-N 3.12Å; R406-L409 PolarHBondContact O-N 2.83Å; R406-R419 HydrophobicContact CB-CG 4.02Å; R406-R419 WeakPolarHBondContact O-CD 3.17Å; R406-R419 WeakPolarHBondContact O-CG 3.18Å
407	E	95.7	Very high	96.5	Very high	70 Å²	70	28.9 Å²	28.9	33%	0.327	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-57.1	-38.3	-179.4	-175.5	177.1	-178.3	0	0	112.3	S334 A335 S405 L409 T410	S334-E407 PolarHBondContact OG-O 3.01Å; A335-E407 PolarHBondContact N-OE1 2.68Å; S405-E407 VanDerWaalsContact C-N 3.32Å; S405-E407 PolarHBondContact O-N 3.45Å; E407-L409 PolarHBondContact O-N 3.06Å; E407-T410 PolarHBondContact O-N 2.69Å; E407-T410 PolarHBondContact O-OG1 2.93Å
408	L	97.8	Very high	96.7	Very high	14 Å²	14	28.5 Å²	28.5	7%	0.073	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-60.3	-30.4	178.9	-51.7	-176	0	0	0	112.1	L291 L293 W336 L360 L364 S405 R406 T410	L291-L408 HydrophobicContact CB-CD1 4.03Å; L293-L408 HydrophobicContact CD1-CD1 4.4Å; L293-L408 HydrophobicContact CD1-CD2 3.81Å; L293-L408 HydrophobicContact CD2-CD1 4.19Å; L293-L408 HydrophobicContact CD2-CD2 4.23Å; L293-L408 HydrophobicContact CG-CD1 4.01Å; L293-L408 HydrophobicContact CG-CD2 4.22Å; W336-L408 HydrophobicContact CD2-CD2 4.09Å; W336-L408 HydrophobicContact CG-CD2 4.07Å; W336-L408 HydrophobicContact CZ2-CD2 4.25Å; L360-L408 HydrophobicContact CD1-CB 3.85Å; L360-L408 HydrophobicContact CD2-CB 4.39Å; L360-L408 WeakPolarHBondContact CD2-O 3.47Å; L364-L408 HydrophobicContact CD2-CD1 4.2Å; S405-L408 WeakPolarHBondContact O-CB 3.16Å; S405-L408 PolarHBondContact O-N 3.08Å; R406-L408 PolarHBondContact O-N 3.12Å; L408-T410 VanDerWaalsContact C-N 3.3Å; L408-T410 PolarHBondContact O-N 3.38Å
409	L	98	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-97	42.1	-174.9	-57.2	173.7	0	0	0	112.1	L291 F356 L360 V401 R406 E407 Y420 P424 V427	L291-L409 HydrophobicContact CD1-CD1 3.89Å; L291-L409 HydrophobicContact CD1-CD2 3.62Å; L291-L409 HydrophobicContact CD1-CG 3.81Å; F356-L409 HydrophobicContact CE1-CD2 3.95Å; F356-L409 HydrophobicContact CE2-CD2 4.12Å; F356-L409 HydrophobicContact CZ-CB 4.28Å; F356-L409 HydrophobicContact CZ-CD2 3.64Å; L360-L409 HydrophobicContact CD2-CD2 3.73Å; V401-L409 HydrophobicContact CB-CD1 4.26Å; V401-L409 HydrophobicContact CG1-CD1 3.82Å; V401-L409 HydrophobicContact CG2-CD1 3.64Å; R406-L409 PolarHBondContact O-N 2.83Å; E407-L409 PolarHBondContact O-N 3.06Å; L409-Y420 HydrophobicContact CB-CD2 4.46Å; L409-Y420 WeakPolarHBondContact O-CD2 3.01Å; L409-Y420 PolarHBondContact O-N 3.34Å; L409-P424 HydrophobicContact CD1-CG 4.24Å; L409-P424 HydrophobicContact CD2-CG 3.98Å; L409-V427 HydrophobicContact CD2-CG2 3.47Å; L409-V427 VanDerWaalsContact CD2-CG2 3.47Å
410	T	98	Very high	97	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	135	174.9	-59.9	0	0	0	0	110.9	V331 S334 W336 A337 A338 E407 L408 L417 Y418	V331-T410 HydrophobicContact CG2-CG2 4.29Å; S334-T410 WeakPolarHBondContact OG-CB 3.36Å; S334-T410 PolarHBondContact OG-OG1 3.37Å; W336-T410 WeakPolarHBondContact O-CB 3.34Å; A337-T410 CarbonylContact C-O 3.56Å; A337-T410 WeakPolarHBondContact CA-O 3.48Å; A337-T410 HydrophobicContact CB-CG2 4.33Å; A338-T410 PolarHBondContact N-O 3.17Å; E407-T410 PolarHBondContact O-N 2.69Å; E407-T410 PolarHBondContact O-OG1 2.93Å; L408-T410 VanDerWaalsContact C-N 3.3Å; L408-T410 PolarHBondContact O-N 3.38Å; T410-L417 HydrophobicContact CG2-CB 4.16Å; T410-L417 HydrophobicContact CG2-CD2 4.45Å; T410-Y418 CarbonylContact C-O 3.58Å; T410-Y418 WeakPolarHBondContact CA-O 3.47Å
411	L	97.4	Very high	97.1	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	125.7	-179.7	-178.2	62.2	0	0	0	110.1	L319 A338 L340 A354 T413 L417 Y418 Y420	L319-L411 HydrophobicContact CD2-CD2 4.35Å; A338-L411 CarbonylContact O-C 3.6Å; A338-L411 WeakPolarHBondContact O-CA 3.24Å; L340-L411 HydrophobicContact CB-CD1 3.75Å; L340-L411 HydrophobicContact CB-CD2 4.48Å; L340-L411 HydrophobicContact CB-CG 4.23Å; L340-L411 HydrophobicContact CD1-CD1 4.13Å; L340-L411 HydrophobicContact CD1-CD2 3.83Å; L340-L411 HydrophobicContact CD1-CG 4.43Å; A354-L411 HydrophobicContact CB-CD1 3.67Å; L411-T413 HydrophobicContact CD2-CG2 3.76Å; L411-T413 HydrophobicContact CG-CG2 3.7Å; L411-L417 WeakPolarHBondContact O-CA 3.29Å; L411-Y418 PolarHBondContact N-O 3.38Å; L411-Y418 PolarHBondContact O-N 2.83Å; L411-Y420 HydrophobicContact CB-CE2 4.23Å; L411-Y420 HydrophobicContact CD2-CE2 4.32Å
412	N	97.6	Very high	97	Very high	16 Å²	16	33 Å²	33	9%	0.086	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	109.7	174.7	-159.8	-17.1	0	0	0	110.5	F301 R302 K304 A337 A338 L340 L417	F301-N412 VanDerWaalsContact CE1-ND2 3.26Å; F301-N412 WeakPolarHBondContact CE1-ND2 3.4Å; F301-N412 WeakPolarHBondContact CZ-ND2 3.44Å; R302-N412 PolarHBondContact O-ND2 3.21Å; K304-N412 HydrophobicContact CB-CB 4.49Å; K304-N412 PolarHBondContact N-ND2 3.27Å; A337-N412 HydrophobicContact CB-CB 4.08Å; A338-N412 PolarHBondContact O-N 3.12Å; L340-N412 PolarHBondContact N-O 3.37Å; L340-N412 VanDerWaalsContact N-O 3.13Å; N412-L417 HydrophobicContact CB-CD2 3.94Å
413	T	97.4	Very high	97	Very high	4 Å²	4	32.6 Å²	32.6	3%	0.025	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	171.7	-177	79.2	0	0	0	0	111.3	K304 L319 L340 L411 C415 G416 Y418	K304-T413 WeakPolarHBondContact CD-O 3.33Å; L319-T413 HydrophobicContact CD1-CG2 4.11Å; L319-T413 HydrophobicContact CD2-CG2 4.06Å; L340-T413 HydrophobicContact CB-CG2 4.25Å; L340-T413 HydrophobicContact CD2-CG2 4.15Å; L411-T413 HydrophobicContact CD2-CG2 3.76Å; L411-T413 HydrophobicContact CG-CG2 3.7Å; T413-C415 PolarHBondContact O-N 3.31Å; T413-C415 PolarHBondContact OG1-N 3.38Å; T413-C415 VanDerWaalsContact OG1-N 3.08Å; T413-G416 WeakPolarHBondContact CB-O 3.33Å; T413-G416 PolarHBondContact N-O 3.05Å; T413-G416 PolarHBondContact O-N 3.42Å; T413-G416 PolarHBondContact OG1-N 2.88Å; T413-G416 PolarHBondContact OG1-O 3.27Å; T413-Y418 HydrophobicContact CG2-CD2 3.71Å; T413-Y418 HydrophobicContact CG2-CE2 4.16Å; T413-Y418 WeakPolarHBondContact OG1-CE2 3.47Å
414	H	95.7	Very high	97	Very high	46 Å²	46	27.2 Å²	27.2	21%	0.213	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.4	171.5	61	-76.6	0	0	0	113.6	K304 V307 E316	K304-H414 HydrophobicContact CD-CB 4.22Å; V307-H414 WeakPolarHBondContact CG2-ND1 3.43Å; E316-H414 IonicContact OE1-CD2 3.87Å; E316-H414 IonicContact OE1-NE2 3.56Å
415	C	95.7	Very high	96.7	Very high	53 Å²	53	22.4 Å²	22.4	36%	0.358	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	4	179.5	-44.5	0	0	0	0	113.7	T413 Y418	T413-C415 PolarHBondContact O-N 3.31Å; T413-C415 PolarHBondContact OG1-N 3.38Å; T413-C415 VanDerWaalsContact OG1-N 3.08Å; C415-Y418 HydrophobicContact CB-CE2 4.22Å
416	G	97	Very high	96.5	Very high	34 Å²	34	24.6 Å²	24.6	35%	0.351	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	115.7	-167.6	-175.4	0	0	0	0	0	113.5	T413	T413-G416 WeakPolarHBondContact CB-O 3.33Å; T413-G416 PolarHBondContact N-O 3.05Å; T413-G416 PolarHBondContact O-N 3.42Å; T413-G416 PolarHBondContact OG1-N 2.88Å; T413-G416 PolarHBondContact OG1-O 3.27Å
417	L	98.2	Very high	96.4	Very high	25 Å²	25	23.2 Å²	23.2	13%	0.131	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	135.6	-178.9	-57.8	-179.5	0	0	0	111.1	F301 V331 A337 T410 L411 N412	F301-L417 HydrophobicContact CE2-CD1 3.93Å; F301-L417 HydrophobicContact CE2-CD2 4.13Å; F301-L417 HydrophobicContact CZ-CD1 4.24Å; F301-L417 HydrophobicContact CZ-CD2 3.91Å; V331-L417 HydrophobicContact CG2-CB 3.79Å; V331-L417 PolarHBondContact N-O 3.47Å; V331-L417 WeakPolarHBondContact O-CB 3.24Å; A337-L417 HydrophobicContact CB-CD2 4.49Å; T410-L417 HydrophobicContact CG2-CB 4.16Å; T410-L417 HydrophobicContact CG2-CD2 4.45Å; L411-L417 WeakPolarHBondContact O-CA 3.29Å; N412-L417 HydrophobicContact CB-CD2 3.94Å
418	Y	98.3	Very high	96.3	Very high	6 Å²	6	22.7 Å²	22.7	2%	0.024	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.2	173.1	-68.2	-99.7	0	0	0	108.9	L319 I328 S329 K330 T410 L411 T413 C415	L319-Y418 HydrophobicContact CD1-CE2 4.14Å; L319-Y418 HydrophobicContact CD2-CD2 4.37Å; L319-Y418 HydrophobicContact CD2-CE2 4.41Å; I328-Y418 HydrophobicContact CB-CD1 4.46Å; I328-Y418 HydrophobicContact CD1-CD1 3.56Å; I328-Y418 HydrophobicContact CD1-CE1 4.16Å; I328-Y418 HydrophobicContact CD1-CG 4.02Å; I328-Y418 HydrophobicContact CG1-CD1 3.96Å; S329-Y418 CarbonylContact O-C 3.59Å; S329-Y418 WeakPolarHBondContact O-CA 3.32Å; K330-Y418 HydrophobicContact CD-CE1 4.16Å; K330-Y418 WeakPolarHBondContact CE-OH 3.49Å; K330-Y418 HydrophobicContact CG-CD1 3.85Å; K330-Y418 HydrophobicContact CG-CE1 3.42Å; K330-Y418 VanDerWaalsContact CG-CE1 3.42Å; T410-Y418 CarbonylContact C-O 3.58Å; T410-Y418 WeakPolarHBondContact CA-O 3.47Å; L411-Y418 PolarHBondContact N-O 3.38Å; L411-Y418 PolarHBondContact O-N 2.83Å; T413-Y418 HydrophobicContact CG2-CD2 3.71Å; T413-Y418 HydrophobicContact CG2-CE2 4.16Å; T413-Y418 WeakPolarHBondContact OG1-CE2 3.47Å; C415-Y418 HydrophobicContact CB-CE2 4.22Å
419	R	97.8	Very high	96.2	Very high	63 Å²	63	22.1 Å²	22.1	24%	0.238	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.4	176.2	-171.1	179.8	-68.1	172.4	-2.4	109.7	I328 S329 V331 R406	I328-R419 CarbonylContact C-O 3.53Å; I328-R419 WeakPolarHBondContact CA-O 3.5Å; S329-R419 PolarHBondContact N-O 2.88Å; S329-R419 PolarHBondContact O-N 2.88Å; V331-R419 HydrophobicContact CG1-CB 3.86Å; V331-R419 HydrophobicContact CG2-CB 4.28Å; R406-R419 HydrophobicContact CB-CG 4.02Å; R406-R419 WeakPolarHBondContact O-CD 3.17Å; R406-R419 WeakPolarHBondContact O-CG 3.18Å
420	Y	97.8	Very high	96	Very high	5 Å²	5	22.2 Å²	22.2	2%	0.02	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	132	172.6	-78.9	-81.2	0	0	0	111.4	V327 I328 A354 F356 L397 L409 L411 R422 P424	V327-Y420 HydrophobicContact CG1-CD1 4.01Å; V327-Y420 HydrophobicContact CG1-CE1 4.15Å; I328-Y420 HydrophobicContact CG2-CD1 3.48Å; I328-Y420 VanDerWaalsContact CG2-CD1 3.48Å; I328-Y420 HydrophobicContact CG2-CE1 3.59Å; I328-Y420 HydrophobicContact CG2-CG 3.98Å; A354-Y420 HydrophobicContact CB-CE2 4.15Å; F356-Y420 HydrophobicContact CZ-CD2 4.4Å; L397-Y420 HydrophobicContact CD2-CE1 4.47Å; L409-Y420 HydrophobicContact CB-CD2 4.46Å; L409-Y420 WeakPolarHBondContact O-CD2 3.01Å; L409-Y420 PolarHBondContact O-N 3.34Å; L411-Y420 HydrophobicContact CB-CE2 4.23Å; L411-Y420 HydrophobicContact CD2-CE2 4.32Å; Y420-R422 WeakPolarHBondContact CB-O 3.2Å; Y420-P424 HydrophobicContact CD1-CB 3.82Å; Y420-P424 HydrophobicContact CD1-CG 4.32Å; Y420-P424 HydrophobicContact CD2-CB 3.91Å; Y420-P424 HydrophobicContact CD2-CG 3.87Å; Y420-P424 HydrophobicContact CE1-CB 3.78Å; Y420-P424 HydrophobicContact CE2-CB 3.88Å; Y420-P424 HydrophobicContact CE2-CG 4.24Å; Y420-P424 HydrophobicContact CG-CB 3.9Å; Y420-P424 HydrophobicContact CG-CG 3.92Å
421	N	97.6	Very high	95.8	Very high	20 Å²	20	24.2 Å²	24.2	11%	0.107	14%	0.142	C	C	.	.	S	Bend	trans	-98.1	-12.3	169.8	-55.1	-41.3	0	0	0	112	G326 V327 S329 V401	G326-N421 WeakPolarHBondContact O-CB 3.15Å; G326-N421 PolarHBondContact O-ND2 3.28Å; V327-N421 PolarHBondContact O-N 3.22Å; S329-N421 PolarHBondContact OG-ND2 3.18Å; V401-N421 PolarHBondContact N-O 3.06Å
422	R	96.6	Very high	95.6	Very high	30 Å²	30	24.4 Å²	24.4	11%	0.113	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-120.4	156.7	177.8	-57.2	-65.4	-171.6	-119	4.7	110.3	H283 V327 L397 I399 E400 V401 Y420 P424	H283-R422 PolarHBondContact CE1-NH2 3.41Å; H283-R422 VanDerWaalsContact CG-NH2 3.27Å; H283-R422 PolarHBondContact ND1-NH2 3.22Å; H283-R422 PolarHBondContact NE2-NH2 3.06Å; V327-R422 HydrophobicContact CB-CG 4.4Å; V327-R422 HydrophobicContact CG1-CB 4.23Å; V327-R422 HydrophobicContact CG1-CG 4.34Å; V327-R422 HydrophobicContact CG2-CG 4.26Å; L397-R422 HydrophobicContact CB-CB 4.42Å; L397-R422 HydrophobicContact CD2-CB 4.38Å; L397-R422 WeakPolarHBondContact O-CB 3.37Å; L397-R422 VanDerWaalsContact O-CD 3.27Å; L397-R422 WeakPolarHBondContact O-CD 3.41Å; L397-R422 WeakPolarHBondContact O-CG 3.47Å; I399-R422 CarbonylContact O-C 3.45Å; I399-R422 WeakPolarHBondContact O-CA 3.32Å; E400-R422 IonicContact OE2-NH1 3.68Å; V401-R422 VanDerWaalsContact CG2-C 3.44Å; Y420-R422 WeakPolarHBondContact CB-O 3.2Å; R422-P424 WeakPolarHBondContact O-CD 3.42Å; R422-P424 VanDerWaalsContact O-N 3.17Å
423	L	96.4	Very high	95.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.143	C	C	.	.			trans	-69.1	109.2	-175.7	-179.8	63.2	0	0	0	110.1	A289 Y396 I399 V401 A430 I433	A289-L423 HydrophobicContact CB-CB 4.22Å; A289-L423 HydrophobicContact CB-CD1 4.06Å; A289-L423 HydrophobicContact CB-CD2 4.03Å; A289-L423 HydrophobicContact CB-CG 4.34Å; Y396-L423 CarbonylContact C-O 3.58Å; Y396-L423 VanDerWaalsContact CB-O 3.24Å; Y396-L423 WeakPolarHBondContact CB-O 3.39Å; Y396-L423 HydrophobicContact CD1-CD2 4.03Å; Y396-L423 VanDerWaalsContact O-O 3.13Å; I399-L423 HydrophobicContact CB-CB 4.24Å; I399-L423 HydrophobicContact CD1-CD2 4.25Å; I399-L423 PolarHBondContact O-N 3.36Å; V401-L423 HydrophobicContact CG2-CB 4.13Å; L423-A430 HydrophobicContact CD1-CB 3.98Å; L423-A430 HydrophobicContact CD2-CB 3.89Å; L423-A430 HydrophobicContact CG-CB 3.95Å; L423-I433 HydrophobicContact CD2-CB 4.49Å; L423-I433 HydrophobicContact CD2-CG2 4.21Å
424	P	94.6	Very high	95.3	Very high	2 Å²	2	24 Å²	24	1%	0.013	14%	0.142	C	C	.	.			trans	-80.8	157.3	-178.2	33.5	-33.3	0	0	0	111.3	F356 L409 Y420 R422 V427	F356-P424 HydrophobicContact CE2-CB 4.12Å; F356-P424 HydrophobicContact CE2-CG 3.5Å; F356-P424 VanDerWaalsContact CE2-CG 3.5Å; F356-P424 HydrophobicContact CZ-CG 3.83Å; L409-P424 HydrophobicContact CD1-CG 4.24Å; L409-P424 HydrophobicContact CD2-CG 3.98Å; Y420-P424 HydrophobicContact CD1-CB 3.82Å; Y420-P424 HydrophobicContact CD1-CG 4.32Å; Y420-P424 HydrophobicContact CD2-CB 3.91Å; Y420-P424 HydrophobicContact CD2-CG 3.87Å; Y420-P424 HydrophobicContact CE1-CB 3.78Å; Y420-P424 HydrophobicContact CE2-CB 3.88Å; Y420-P424 HydrophobicContact CE2-CG 4.24Å; Y420-P424 HydrophobicContact CG-CB 3.9Å; Y420-P424 HydrophobicContact CG-CG 3.92Å; R422-P424 WeakPolarHBondContact O-CD 3.42Å; R422-P424 VanDerWaalsContact O-N 3.17Å; P424-V427 HydrophobicContact CG-CG2 3.84Å
425	F	89.6	Confident	95.3	Very high	45 Å²	45	21.9 Å²	21.9	20%	0.197	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	154	166.2	-61.9	-94.8	0	0	0	111.1	Y396 L397	Y396-F425 AromaticContact CD2-CD1 3.54Å; Y396-F425 HydrophobicContact CD2-CD1 3.54Å; Y396-F425 AromaticContact CD2-CE1 3.25Å; Y396-F425 HydrophobicContact CD2-CE1 3.25Å; Y396-F425 HydrophobicContact CD2-CE2 4.48Å; Y396-F425 HydrophobicContact CD2-CG 4.31Å; Y396-F425 AromaticContact CD2-CZ 3.76Å; Y396-F425 HydrophobicContact CD2-CZ 3.76Å; Y396-F425 AromaticContact CE2-CD1 3.91Å; Y396-F425 HydrophobicContact CE2-CD1 3.91Å; Y396-F425 AromaticContact CE2-CE1 3.7Å; Y396-F425 HydrophobicContact CE2-CE1 3.7Å; Y396-F425 HydrophobicContact CG-CD1 4.5Å; Y396-F425 HydrophobicContact CG-CE1 4.38Å; L397-F425 HydrophobicContact CG-CE2 4.27Å
426	G	91.6	Very high	95.3	Very high	50 Å²	50	23 Å²	23	52%	0.515	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	-8.7	175.7	0	0	0	0	0	115.1	N361	N361-G426 PolarHBondContact ND2-O 3.34Å; N361-G426 PolarHBondContact OD1-O 3.23Å
427	V	95.2	Very high	95.2	Very high	3 Å²	3	22 Å²	22	2%	0.018	12%	0.118	C	C	.	.			trans	-77.2	126.2	170.7	-178.7	0	0	0	0	109.1	L291 F356 N361 L364 L409 P424 S429 A430	L291-V427 HydrophobicContact CD1-CG1 4.04Å; L291-V427 HydrophobicContact CD2-CG1 3.84Å; F356-V427 HydrophobicContact CD2-CG2 3.52Å; F356-V427 HydrophobicContact CE2-CG2 3.54Å; F356-V427 HydrophobicContact CG-CG2 4.23Å; F356-V427 HydrophobicContact CZ-CG2 4.29Å; N361-V427 WeakPolarHBondContact OD1-CA 3.28Å; L364-V427 HydrophobicContact CD1-CG1 3.75Å; L409-V427 HydrophobicContact CD2-CG2 3.47Å; L409-V427 VanDerWaalsContact CD2-CG2 3.47Å; P424-V427 HydrophobicContact CG-CG2 3.84Å; V427-S429 PolarHBondContact O-N 3.38Å; V427-S429 VanDerWaalsContact O-N 3.15Å; V427-A430 HydrophobicContact CB-CB 4.17Å; V427-A430 VanDerWaalsContact O-CB 3.29Å; V427-A430 WeakPolarHBondContact O-CB 3.27Å; V427-A430 PolarHBondContact O-N 3.04Å
428	K	94.6	Very high	95	Very high	60 Å²	60	20.8 Å²	20.8	26%	0.261	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-31.8	-173.4	72.5	171.7	-174.1	-165	0	114.2	N361 L364 M366 A430 P431	N361-K428 HydrophobicContact CB-CB 4.27Å; N361-K428 HydrophobicContact CB-CD 4.31Å; N361-K428 HydrophobicContact CB-CG 4.35Å; N361-K428 WeakPolarHBondContact O-CD 3.49Å; N361-K428 WeakPolarHBondContact O-CE 3.29Å; N361-K428 PolarHBondContact O-NZ 3.12Å; N361-K428 PolarHBondContact OD1-N 2.56Å; L364-K428 WeakPolarHBondContact O-CE 3.43Å; L364-K428 PolarHBondContact O-NZ 2.86Å; M366-K428 VanDerWaalsContact CE-O 3.27Å; M366-K428 WeakPolarHBondContact CE-O 3.34Å; M366-K428 HydrophobicContact SD-CB 4.17Å; M366-K428 HydrophobicContact SD-CD 4.08Å; M366-K428 HydrophobicContact SD-CG 3.99Å; M366-K428 VanDerWaalsContact SD-O 3.42Å; K428-A430 VanDerWaalsContact C-N 3.34Å; K428-P431 WeakPolarHBondContact O-CD 3.22Å
429	S	94.9	Very high	94.7	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.014	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-9.7	-178.8	-60.9	0	0	0	0	113	E365 H367 V427 G432 I433	E365-S429 PolarHBondContact O-OG 3.24Å; H367-S429 PolarHBondContact N-OG 3.47Å; V427-S429 PolarHBondContact O-N 3.38Å; V427-S429 VanDerWaalsContact O-N 3.15Å; S429-G432 PolarHBondContact O-N 3.03Å; S429-I433 VanDerWaalsContact O-CG1 3.3Å; S429-I433 WeakPolarHBondContact O-CG1 3.37Å; S429-I433 PolarHBondContact O-N 3.42Å; S429-I433 VanDerWaalsContact O-N 3.14Å
430	A	94.3	Very high	94.6	Very high	2 Å²	2	23.1 Å²	23.1	2%	0.017	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-45.6	-175.9	0	0	0	0	0	113.7	Y396 L423 V427 K428 G432 I433 F434	Y396-A430 HydrophobicContact CD1-CB 3.89Å; Y396-A430 HydrophobicContact CE1-CB 3.91Å; Y396-A430 WeakPolarHBondContact CE1-O 3.13Å; L423-A430 HydrophobicContact CD1-CB 3.98Å; L423-A430 HydrophobicContact CD2-CB 3.89Å; L423-A430 HydrophobicContact CG-CB 3.95Å; V427-A430 HydrophobicContact CB-CB 4.17Å; V427-A430 VanDerWaalsContact O-CB 3.29Å; V427-A430 WeakPolarHBondContact O-CB 3.27Å; V427-A430 PolarHBondContact O-N 3.04Å; K428-A430 VanDerWaalsContact C-N 3.34Å; A430-G432 PolarHBondContact O-N 3.28Å; A430-I433 PolarHBondContact O-N 3.27Å; A430-F434 WeakPolarHBondContact O-CB 3.1Å; A430-F434 PolarHBondContact O-N 3.17Å
431	P	93.1	Very high	94.4	Very high	42 Å²	42	23 Å²	23	27%	0.273	13%	0.132	S	C	.	.	H	α-helix	trans	-59.1	-43.8	179.7	-26	36.3	0	0	0	113.1	K428 F434 Q435 L452	K428-P431 WeakPolarHBondContact O-CD 3.22Å; P431-F434 PolarHBondContact O-N 3.03Å; P431-Q435 WeakPolarHBondContact O-CB 3.45Å; P431-Q435 PolarHBondContact O-N 3.1Å; P431-L452 HydrophobicContact CB-CD1 4.38Å; P431-L452 HydrophobicContact CB-CD2 3.69Å; P431-L452 WeakPolarHBondContact O-CD2 3.44Å
432	G	94.5	Very high	94.2	Very high	5 Å²	5	23 Å²	23	5%	0.052	13%	0.132	C	C	.	.	H	α-helix	trans	-66.4	-40.9	178.5	0	0	0	0	0	112.8	H367 S429 A430 Q436	H367-G432 VanDerWaalsContact CD2-C 3.46Å; S429-G432 PolarHBondContact O-N 3.03Å; A430-G432 PolarHBondContact O-N 3.28Å; G432-Q436 WeakPolarHBondContact O-CB 3.05Å; G432-Q436 PolarHBondContact O-N 2.97Å; G432-Q436 VanDerWaalsContact O-N 3.09Å
433	I	95.2	Very high	94	Very high	12 Å²	12	25 Å²	25	6%	0.062	16%	0.155	C	C	.	.	H	α-helix	trans	-63.4	-44.4	175.4	-67.3	166.9	0	0	0	110.3	A289 L291 H367 L423 S429 A430 Q436 I437	A289-I433 HydrophobicContact CB-CD1 4.34Å; A289-I433 HydrophobicContact CB-CG2 3.93Å; L291-I433 HydrophobicContact CD2-CD1 3.92Å; H367-I433 HydrophobicContact CB-CG1 4.02Å; L423-I433 HydrophobicContact CD2-CB 4.49Å; L423-I433 HydrophobicContact CD2-CG2 4.21Å; S429-I433 VanDerWaalsContact O-CG1 3.3Å; S429-I433 WeakPolarHBondContact O-CG1 3.37Å; S429-I433 PolarHBondContact O-N 3.42Å; S429-I433 VanDerWaalsContact O-N 3.14Å; A430-I433 PolarHBondContact O-N 3.27Å; I433-Q436 PolarHBondContact O-N 3.28Å; I433-I437 HydrophobicContact CG2-CD1 3.96Å; I433-I437 WeakPolarHBondContact O-CG1 3.44Å; I433-I437 PolarHBondContact O-N 3.45Å; I433-I437 VanDerWaalsContact O-N 3.11Å
434	F	93.7	Very high	93.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-45.7	-179.2	-164.3	-86.6	0	0	0	111.8	A395 Y396 I399 A430 P431 Q436 I437 M438 L452 D453 F481	A395-F434 HydrophobicContact CB-CE1 4.44Å; A395-F434 HydrophobicContact CB-CE2 3.85Å; A395-F434 HydrophobicContact CB-CZ 3.58Å; A395-F434 WeakPolarHBondContact O-CE2 3.16Å; Y396-F434 HydrophobicContact CD1-CB 3.85Å; Y396-F434 AromaticContact CD1-CD2 3.58Å; Y396-F434 HydrophobicContact CD1-CD2 3.58Å; Y396-F434 HydrophobicContact CD1-CE2 4.46Å; Y396-F434 AromaticContact CD1-CG 3.93Å; Y396-F434 HydrophobicContact CD1-CG 3.93Å; Y396-F434 HydrophobicContact CE1-CB 3.42Å; Y396-F434 VanDerWaalsContact CE1-CB 3.42Å; Y396-F434 AromaticContact CE1-CD2 3.87Å; Y396-F434 HydrophobicContact CE1-CD2 3.87Å; Y396-F434 AromaticContact CE1-CG 3.72Å; Y396-F434 HydrophobicContact CE1-CG 3.72Å; Y396-F434 HydrophobicContact CG-CD2 4.11Å; I399-F434 HydrophobicContact CD1-CD2 3.34Å; I399-F434 HydrophobicContact CD1-CE2 3.78Å; I399-F434 HydrophobicContact CD1-CG 4.29Å; A430-F434 WeakPolarHBondContact O-CB 3.1Å; A430-F434 PolarHBondContact O-N 3.17Å; P431-F434 PolarHBondContact O-N 3.03Å; F434-Q436 VanDerWaalsContact C-N 3.33Å; F434-Q436 PolarHBondContact O-N 3.44Å; F434-I437 PolarHBondContact O-N 3.36Å; F434-M438 HydrophobicContact CD1-CE 4.38Å; F434-M438 HydrophobicContact CD1-CG 3.76Å; F434-M438 HydrophobicContact CE1-CE 3.31Å; F434-M438 HydrophobicContact CE1-CG 3.45Å; F434-M438 VanDerWaalsContact CE1-CG 3.45Å; F434-M438 HydrophobicContact CE1-SD 4.21Å; F434-M438 HydrophobicContact CE2-CE 4.08Å; F434-M438 HydrophobicContact CZ-CE 3.1Å; F434-M438 HydrophobicContact CZ-CG 4.2Å; F434-M438 HydrophobicContact CZ-SD 4.49Å; F434-M438 WeakPolarHBondContact O-CG 3.42Å; F434-M438 PolarHBondContact O-N 2.9Å; F434-L452 VanDerWaalsContact CE1-C 3.5Å; F434-L452 WeakPolarHBondContact CE1-O 3.33Å; F434-D453 HydrophobicContact CE1-CB 4.3Å; F434-F481 HydrophobicContact CE2-CE1 4.39Å
435	Q	94.1	Very high	93.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-45.4	175.7	-172.7	70.4	51.9	0	0	111.2	Y369 L371 P431 I437 M438 D439 A450 L452	Y369-Q435 HydrophobicContact CD1-CB 3.93Å; Y369-Q435 HydrophobicContact CD1-CG 3.82Å; Y369-Q435 HydrophobicContact CE1-CB 4.24Å; Y369-Q435 HydrophobicContact CE1-CG 3.75Å; L371-Q435 HydrophobicContact CD2-CB 3.62Å; L371-Q435 HydrophobicContact CD2-CG 3.67Å; P431-Q435 WeakPolarHBondContact O-CB 3.45Å; P431-Q435 PolarHBondContact O-N 3.1Å; Q435-I437 VanDerWaalsContact C-N 3.28Å; Q435-I437 PolarHBondContact O-N 2.83Å; Q435-M438 PolarHBondContact O-N 2.96Å; Q435-D439 PolarHBondContact NE2-OD1 2.92Å; Q435-D439 WeakPolarHBondContact O-CB 3.22Å; Q435-D439 PolarHBondContact O-N 2.81Å; Q435-A450 PolarHBondContact NE2-O 2.98Å; Q435-L452 HydrophobicContact CB-CD2 4.32Å
436	Q	95.6	Very high	93.8	Very high	78 Å²	78	35.3 Å²	35.3	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-59.1	-41	177.9	-177.8	176	-2.2	0	0	112.3	H367 Y369 G432 I433 F434 T440	H367-Q436 PolarHBondContact CE1-OE1 3.29Å; H367-Q436 PolarHBondContact NE2-OE1 3Å; Y369-Q436 HydrophobicContact CD1-CB 4.08Å; Y369-Q436 HydrophobicContact CD2-CB 3.64Å; Y369-Q436 HydrophobicContact CD2-CG 3.79Å; Y369-Q436 HydrophobicContact CE1-CB 4.17Å; Y369-Q436 HydrophobicContact CE2-CB 3.72Å; Y369-Q436 HydrophobicContact CE2-CG 3.6Å; Y369-Q436 HydrophobicContact CG-CB 3.83Å; Y369-Q436 HydrophobicContact CG-CG 4.49Å; G432-Q436 WeakPolarHBondContact O-CB 3.05Å; G432-Q436 PolarHBondContact O-N 2.97Å; G432-Q436 VanDerWaalsContact O-N 3.09Å; I433-Q436 PolarHBondContact O-N 3.28Å; F434-Q436 VanDerWaalsContact C-N 3.33Å; F434-Q436 PolarHBondContact O-N 3.44Å; Q436-T440 WeakPolarHBondContact O-CB 3.47Å; Q436-T440 PolarHBondContact O-N 3.25Å; Q436-T440 VanDerWaalsContact O-N 3.1Å; Q436-T440 PolarHBondContact O-OG1 3.24Å
437	I	95	Very high	93.7	Very high	12 Å²	12	33.7 Å²	33.7	6%	0.062	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-45.6	176.9	-74.1	165.2	0	0	0	110.5	A287 I399 I433 F434 Q435 T440 L441 W479 F481	A287-I437 HydrophobicContact CB-CD1 3.74Å; A287-I437 HydrophobicContact CB-CG1 3.76Å; I399-I437 HydrophobicContact CD1-CD1 3.57Å; I399-I437 HydrophobicContact CG1-CD1 4Å; I399-I437 HydrophobicContact CG2-CD1 3.96Å; I433-I437 HydrophobicContact CG2-CD1 3.96Å; I433-I437 WeakPolarHBondContact O-CG1 3.44Å; I433-I437 PolarHBondContact O-N 3.45Å; I433-I437 VanDerWaalsContact O-N 3.11Å; F434-I437 PolarHBondContact O-N 3.36Å; Q435-I437 VanDerWaalsContact C-N 3.28Å; Q435-I437 PolarHBondContact O-N 2.83Å; I437-T440 WeakPolarHBondContact O-CB 3.36Å; I437-T440 PolarHBondContact O-N 2.77Å; I437-L441 WeakPolarHBondContact O-CB 3.16Å; I437-L441 PolarHBondContact O-N 3.01Å; I437-W479 HydrophobicContact CG2-CE3 4.35Å; I437-W479 HydrophobicContact CG2-CZ3 3.9Å; I437-F481 HydrophobicContact CG2-CE2 4.08Å; I437-F481 HydrophobicContact CG2-CZ 3.86Å
438	M	93.7	Very high	93.6	Very high	0 Å²	0	34 Å²	34	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-44.1	179.3	-74.2	-58.7	175.6	0	0	112.5	F392 F434 Q435 T440 L441 I442 A450 V455 F481	F392-M438 HydrophobicContact CD1-CE 4.48Å; F392-M438 HydrophobicContact CD2-CE 3.68Å; F392-M438 HydrophobicContact CE1-CE 4.15Å; F392-M438 HydrophobicContact CE2-CE 3.24Å; F392-M438 HydrophobicContact CE2-SD 3.89Å; F392-M438 HydrophobicContact CG-CE 4.28Å; F392-M438 HydrophobicContact CZ-CE 3.51Å; F392-M438 HydrophobicContact CZ-SD 4.08Å; F434-M438 HydrophobicContact CD1-CE 4.38Å; F434-M438 HydrophobicContact CD1-CG 3.76Å; F434-M438 HydrophobicContact CE1-CE 3.31Å; F434-M438 HydrophobicContact CE1-CG 3.45Å; F434-M438 VanDerWaalsContact CE1-CG 3.45Å; F434-M438 HydrophobicContact CE1-SD 4.21Å; F434-M438 HydrophobicContact CE2-CE 4.08Å; F434-M438 HydrophobicContact CZ-CE 3.1Å; F434-M438 HydrophobicContact CZ-CG 4.2Å; F434-M438 HydrophobicContact CZ-SD 4.49Å; F434-M438 WeakPolarHBondContact O-CG 3.42Å; F434-M438 PolarHBondContact O-N 2.9Å; Q435-M438 PolarHBondContact O-N 2.96Å; M438-T440 PolarHBondContact O-N 2.76Å; M438-L441 WeakPolarHBondContact O-CB 3.46Å; M438-L441 PolarHBondContact O-N 2.76Å; M438-L441 VanDerWaalsContact O-N 3.11Å; M438-L441 HydrophobicContact SD-CD1 4.48Å; M438-I442 WeakPolarHBondContact O-CG1 3.28Å; M438-I442 PolarHBondContact O-N 2.79Å; M438-A450 HydrophobicContact CB-CB 3.77Å; M438-V455 HydrophobicContact SD-CG2 4.49Å; M438-F481 HydrophobicContact CE-CD1 4.1Å; M438-F481 HydrophobicContact CE-CE1 3.82Å; M438-F481 HydrophobicContact CE-CZ 4.1Å
439	D	93.9	Very high	93.4	Very high	41 Å²	41	31.8 Å²	31.8	22%	0.219	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-38	174.4	-76.8	6	0	0	0	111.9	Y369 Q435 A443	Y369-D439 WeakPolarHBondContact CE1-OD2 3.42Å; Y369-D439 VanDerWaalsContact CZ-OD2 3.31Å; Y369-D439 WeakPolarHBondContact OH-CB 3.39Å; Y369-D439 PolarHBondContact OH-OD2 2.69Å; Q435-D439 PolarHBondContact NE2-OD1 2.92Å; Q435-D439 WeakPolarHBondContact O-CB 3.22Å; Q435-D439 PolarHBondContact O-N 2.81Å; D439-A443 WeakPolarHBondContact O-CB 3.49Å; D439-A443 PolarHBondContact O-N 3.41Å
440	T	94.5	Very high	93.2	Very high	77 Å²	77	31.8 Å²	31.8	47%	0.472	20%	0.198	S	C	.	.	H	α-helix	trans	-68.8	-40.5	175.6	-53.3	0	0	0	0	111.3	Q436 I437 M438 A443 W479	Q436-T440 WeakPolarHBondContact O-CB 3.47Å; Q436-T440 PolarHBondContact O-N 3.25Å; Q436-T440 VanDerWaalsContact O-N 3.1Å; Q436-T440 PolarHBondContact O-OG1 3.24Å; I437-T440 WeakPolarHBondContact O-CB 3.36Å; I437-T440 PolarHBondContact O-N 2.77Å; M438-T440 PolarHBondContact O-N 2.76Å; T440-A443 WeakPolarHBondContact O-CB 3.37Å; T440-A443 PolarHBondContact O-N 3Å; T440-W479 HydrophobicContact CG2-CH2 3.68Å; T440-W479 HydrophobicContact CG2-CZ2 3.89Å
441	L	93.4	Very high	93	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-63.7	-41	178	-176.8	153.7	0	0	0	111.6	I437 M438 F472 E475 L476 W479 F481	I437-L441 WeakPolarHBondContact O-CB 3.16Å; I437-L441 PolarHBondContact O-N 3.01Å; M438-L441 WeakPolarHBondContact O-CB 3.46Å; M438-L441 PolarHBondContact O-N 2.76Å; M438-L441 VanDerWaalsContact O-N 3.11Å; M438-L441 HydrophobicContact SD-CD1 4.48Å; L441-F472 HydrophobicContact CD2-CD2 4.25Å; L441-F472 HydrophobicContact CD2-CE2 3.76Å; L441-E475 HydrophobicContact CD2-CB 4.41Å; L441-L476 HydrophobicContact CD1-CD2 4.04Å; L441-L476 HydrophobicContact CD2-CD2 3.95Å; L441-W479 HydrophobicContact CB-CD2 4.27Å; L441-W479 HydrophobicContact CB-CZ2 4.36Å; L441-W479 HydrophobicContact CD1-CB 3.94Å; L441-W479 HydrophobicContact CD1-CD2 4.02Å; L441-W479 HydrophobicContact CD1-CE3 4.36Å; L441-W479 HydrophobicContact CD1-CG 3.85Å; L441-W479 HydrophobicContact CG-CD2 4.23Å; L441-W479 HydrophobicContact CG-CG 4.2Å; L441-F481 HydrophobicContact CD1-CD2 3.49Å; L441-F481 VanDerWaalsContact CD1-CD2 3.49Å; L441-F481 HydrophobicContact CD1-CE2 3.78Å; L441-F481 HydrophobicContact CD1-CG 4.4Å
442	I	93.6	Very high	92.8	Very high	19 Å²	19	33.2 Å²	33.2	10%	0.097	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1.2	-178.6	73.1	175.5	0	0	0	113.5	M438 G444 L445 V448 A450 F472	M438-I442 WeakPolarHBondContact O-CG1 3.28Å; M438-I442 PolarHBondContact O-N 2.79Å; I442-G444 PolarHBondContact O-N 2.96Å; I442-L445 VanDerWaalsContact O-CB 3.32Å; I442-L445 WeakPolarHBondContact O-CB 3.5Å; I442-L445 PolarHBondContact O-N 2.98Å; I442-V448 HydrophobicContact CB-CB 4.34Å; I442-V448 HydrophobicContact CB-CG1 4.07Å; I442-V448 HydrophobicContact CD1-CG1 4.48Å; I442-V448 HydrophobicContact CG2-CB 4.47Å; I442-V448 HydrophobicContact CG2-CG1 3.67Å; I442-A450 HydrophobicContact CD1-CB 3.78Å; I442-F472 HydrophobicContact CG2-CD2 4.3Å; I442-F472 HydrophobicContact CG2-CE2 3.93Å
443	A	93.6	Very high	92.3	Very high	72 Å²	72	35.3 Å²	35.3	60%	0.595	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	124.4	-176.7	0	0	0	0	0	111.3	D439 T440 L445	D439-A443 WeakPolarHBondContact O-CB 3.49Å; D439-A443 PolarHBondContact O-N 3.41Å; T440-A443 WeakPolarHBondContact O-CB 3.37Å; T440-A443 PolarHBondContact O-N 3Å; A443-L445 VanDerWaalsContact C-N 3.33Å
444	G	92.2	Very high	91.8	Very high	67 Å²	67	36.4 Å²	36.4	69%	0.691	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.7	-3.2	-177.6	0	0	0	0	0	115.2	I442 H446	I442-G444 PolarHBondContact O-N 2.96Å; G444-H446 PolarHBondContact O-N 3.42Å
445	L	92.5	Very high	91.5	Very high	30 Å²	30	36.4 Å²	36.4	16%	0.157	22%	0.215	C	C	.	.			trans	-92.4	87.9	175.9	-54.9	-178.4	0	0	0	110.7	I442 A443 G447 V448 P471 F472 E475	I442-L445 VanDerWaalsContact O-CB 3.32Å; I442-L445 WeakPolarHBondContact O-CB 3.5Å; I442-L445 PolarHBondContact O-N 2.98Å; A443-L445 VanDerWaalsContact C-N 3.33Å; L445-G447 PolarHBondContact O-N 3.09Å; L445-V448 HydrophobicContact CB-CB 4.15Å; L445-V448 HydrophobicContact CB-CG2 3.68Å; L445-V448 HydrophobicContact CD1-CG2 4.42Å; L445-V448 PolarHBondContact O-N 3.33Å; L445-P471 HydrophobicContact CD2-CB 3.9Å; L445-P471 HydrophobicContact CD2-CG 4.16Å; L445-F472 HydrophobicContact CD1-CB 3.84Å; L445-F472 HydrophobicContact CD1-CD2 3.81Å; L445-F472 HydrophobicContact CD1-CG 4.32Å; L445-E475 HydrophobicContact CD1-CG 4.4Å
446	H	91.1	Very high	91.2	Very high	167 Å²	167	37.9 Å²	37.9	77%	0.773	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	131.4	175.4	-63.8	-69.5	0	0	0	111.3	G444 I468	G444-H446 PolarHBondContact O-N 3.42Å; H446-I468 WeakPolarHBondContact O-CD1 3.05Å; H446-I468 WeakPolarHBondContact O-CG1 3.41Å; H446-I468 WeakPolarHBondContact O-CG2 3.49Å
447	G	90.2	Very high	90.8	Very high	15 Å²	15	34.2 Å²	34.2	16%	0.155	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	15	-174.5	0	0	0	0	0	113.7	L445 V457 V458	L445-G447 PolarHBondContact O-N 3.09Å; G447-V457 CarbonylContact O-C 3.57Å; G447-V457 WeakPolarHBondContact O-CA 3.37Å; G447-V458 VanDerWaalsContact O-CG1 3.28Å; G447-V458 WeakPolarHBondContact O-CG1 3.41Å; G447-V458 PolarHBondContact O-N 2.95Å
448	V	92.8	Very high	90.3	Very high	10 Å²	10	34 Å²	34	6%	0.061	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.7	166.3	-169.9	0	0	0	0	108.6	I442 L445 V455 T456 V457 I468 F472	I442-V448 HydrophobicContact CB-CB 4.34Å; I442-V448 HydrophobicContact CB-CG1 4.07Å; I442-V448 HydrophobicContact CD1-CG1 4.48Å; I442-V448 HydrophobicContact CG2-CB 4.47Å; I442-V448 HydrophobicContact CG2-CG1 3.67Å; L445-V448 HydrophobicContact CB-CB 4.15Å; L445-V448 HydrophobicContact CB-CG2 3.68Å; L445-V448 HydrophobicContact CD1-CG2 4.42Å; L445-V448 PolarHBondContact O-N 3.33Å; V448-V455 HydrophobicContact CG1-CG1 3.6Å; V448-T456 CarbonylContact C-O 3.47Å; V448-T456 WeakPolarHBondContact CA-O 3.47Å; V448-V457 HydrophobicContact CG1-CG2 4.29Å; V448-V457 HydrophobicContact CG2-CG2 4.2Å; V448-I468 HydrophobicContact CG2-CG2 3.5Å; V448-F472 HydrophobicContact CG1-CD2 3.96Å; V448-F472 HydrophobicContact CG1-CE2 4Å; V448-F472 HydrophobicContact CG2-CB 4.35Å; V448-F472 HydrophobicContact CG2-CD2 4.4Å; V448-F472 HydrophobicContact CG2-CG 4.4Å
449	V	90.1	Very high	89.7	Confident	14 Å²	14	34.1 Å²	34.1	9%	0.085	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.3	175.9	-175.8	0	0	0	0	108.4	I377 T380 V455 T456	I377-V449 HydrophobicContact CB-CG1 4.27Å; I377-V449 HydrophobicContact CG1-CG1 3.85Å; I377-V449 HydrophobicContact CG2-CG1 4.12Å; T380-V449 HydrophobicContact CG2-CG2 3.25Å; V449-V455 CarbonylContact O-C 3.17Å; V449-V455 WeakPolarHBondContact O-CA 3.34Å; V449-T456 PolarHBondContact N-O 3.28Å; V449-T456 PolarHBondContact O-N 2.9Å
450	A	91.1	Very high	89.2	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	130.5	172.2	0	0	0	0	0	109.8	P372 Q435 M438 I442 V455	P372-A450 WeakPolarHBondContact CG-O 3.45Å; Q435-A450 PolarHBondContact NE2-O 2.98Å; M438-A450 HydrophobicContact CB-CB 3.77Å; I442-A450 HydrophobicContact CD1-CB 3.78Å; A450-V455 HydrophobicContact CB-CG2 3.78Å
451	Y	88.4	Confident	88.4	Confident	52 Å²	52	39 Å²	39	20%	0.204	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	102.2	164.7	-179.3	-87.9	0	0	0	107.4	H78 L371 I377 D453 D454	H78-Y451 AromaticContact CE1-CD1 3.99Å; H78-Y451 AromaticContact CE1-CE1 3.07Å; H78-Y451 WeakPolarHBondContact CE1-CE1 3.22Å; H78-Y451 AromaticContact CE1-CZ 3.43Å; H78-Y451 VanDerWaalsContact CE1-CZ 3.43Å; H78-Y451 PolarHBondContact CE1-OH 3.03Å; H78-Y451 AromaticContact ND1-CE1 3.91Å; H78-Y451 AromaticContact ND1-CZ 3.93Å; H78-Y451 AromaticContact NE2-CD1 3.99Å; H78-Y451 AromaticContact NE2-CE1 3.44Å; H78-Y451 WeakPolarHBondContact NE2-CE1 3.36Å; L371-Y451 HydrophobicContact CB-CE2 4.24Å; I377-Y451 HydrophobicContact CD1-CD2 4.04Å; I377-Y451 HydrophobicContact CD1-CG 4.31Å; Y451-D453 PolarHBondContact O-N 2.82Å; Y451-D454 PolarHBondContact N-O 3.42Å; Y451-D454 WeakPolarHBondContact O-CB 3.28Å; Y451-D454 PolarHBondContact O-N 3.33Å
452	L	88.8	Confident	87.5	Confident	23 Å²	23	40.5 Å²	40.5	12%	0.12	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	-122.3	-170	-55.2	178	0	0	0	110.9	L371 P431 F434 Q435	L371-L452 HydrophobicContact CD2-CD2 3.85Å; P431-L452 HydrophobicContact CB-CD1 4.38Å; P431-L452 HydrophobicContact CB-CD2 3.69Å; P431-L452 WeakPolarHBondContact O-CD2 3.44Å; F434-L452 VanDerWaalsContact CE1-C 3.5Å; F434-L452 WeakPolarHBondContact CE1-O 3.33Å; Q435-L452 HydrophobicContact CB-CD2 4.32Å
453	D	85.4	Confident	86.7	Confident	48 Å²	48	45.8 Å²	45.8	26%	0.257	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-9.7	179.5	50.9	-30.4	0	0	0	114.5	F392 A395 F434 Y451	F392-D453 WeakPolarHBondContact CD2-O 3.42Å; A395-D453 HydrophobicContact CB-CB 3.66Å; F434-D453 HydrophobicContact CE1-CB 4.3Å; Y451-D453 PolarHBondContact O-N 2.82Å
454	D	84.7	Confident	86.3	Confident	35 Å²	35	44.3 Å²	44.3	19%	0.187	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	111.4	174.7	-78	-55.3	0	0	0	110.7	Q389 Y451	Q389-D454 PolarHBondContact NE2-OD1 3.21Å; Y451-D454 PolarHBondContact N-O 3.42Å; Y451-D454 WeakPolarHBondContact O-CB 3.28Å; Y451-D454 PolarHBondContact O-N 3.33Å
455	V	87.6	Confident	86	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.5	172.7	-179.2	0	0	0	0	110.4	Q389 I390 F392 M438 V448 V449 A450 F472	Q389-V455 CarbonylContact C-O 3.37Å; Q389-V455 WeakPolarHBondContact CA-O 3.47Å; I390-V455 HydrophobicContact CB-CB 4.31Å; I390-V455 HydrophobicContact CD1-CB 4.02Å; I390-V455 HydrophobicContact CD1-CG1 3.85Å; I390-V455 WeakPolarHBondContact CD1-O 3.46Å; I390-V455 PolarHBondContact N-O 3.45Å; I390-V455 PolarHBondContact O-N 3.36Å; F392-V455 HydrophobicContact CE2-CB 4.36Å; F392-V455 HydrophobicContact CE2-CG2 3.59Å; F392-V455 HydrophobicContact CZ-CG2 4.3Å; M438-V455 HydrophobicContact SD-CG2 4.49Å; V448-V455 HydrophobicContact CG1-CG1 3.6Å; V449-V455 CarbonylContact O-C 3.17Å; V449-V455 WeakPolarHBondContact O-CA 3.34Å; A450-V455 HydrophobicContact CB-CG2 3.78Å; V455-F472 HydrophobicContact CB-CZ 4.4Å; V455-F472 HydrophobicContact CG1-CE1 4.39Å; V455-F472 HydrophobicContact CG1-CE2 3.97Å; V455-F472 HydrophobicContact CG1-CZ 3.61Å
456	T	87.6	Confident	85.4	Confident	32 Å²	32	42.7 Å²	42.7	20%	0.196	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	128.1	177.4	-58.4	0	0	0	0	110.5	L381 F387 S388 V448 V449	L381-T456 HydrophobicContact CD2-CG2 3.73Å; F387-T456 HydrophobicContact CD1-CG2 4.22Å; S388-T456 CarbonylContact O-C 3.45Å; S388-T456 WeakPolarHBondContact O-CA 3.24Å; V448-T456 CarbonylContact C-O 3.47Å; V448-T456 WeakPolarHBondContact CA-O 3.47Å; V449-T456 PolarHBondContact N-O 3.28Å; V449-T456 PolarHBondContact O-N 2.9Å
457	V	87	Confident	85.2	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.9	170	-177.9	0	0	0	0	108.7	F387 S388 I390 G447 V448 H465 I468 W469 F472	F387-V457 CarbonylContact C-O 3.44Å; F387-V457 VanDerWaalsContact CA-O 3.28Å; F387-V457 WeakPolarHBondContact CA-O 3.4Å; S388-V457 PolarHBondContact N-O 2.81Å; S388-V457 PolarHBondContact O-N 2.79Å; I390-V457 HydrophobicContact CD1-CG2 3.82Å; G447-V457 CarbonylContact O-C 3.57Å; G447-V457 WeakPolarHBondContact O-CA 3.37Å; V448-V457 HydrophobicContact CG1-CG2 4.29Å; V448-V457 HydrophobicContact CG2-CG2 4.2Å; V457-H465 PolarHBondContact O-NE2 3.35Å; V457-I468 HydrophobicContact CG1-CB 4.16Å; V457-I468 HydrophobicContact CG1-CG2 3.75Å; V457-W469 HydrophobicContact CB-CE3 4.27Å; V457-W469 HydrophobicContact CG2-CE3 3.89Å; V457-W469 HydrophobicContact CG2-CZ3 4.18Å; V457-F472 HydrophobicContact CG2-CD1 3.73Å; V457-F472 HydrophobicContact CG2-CE1 4.04Å; V457-F472 HydrophobicContact CG2-CG 4.27Å
458	V	84.4	Confident	85.2	Confident	7 Å²	7	37.9 Å²	37.9	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134	-175.3	58.7	0	0	0	0	111.5	T380 L381 V386 F387 G447 I468	T380-V458 HydrophobicContact CG2-CG1 4.47Å; L381-V458 HydrophobicContact CD2-CB 4.06Å; L381-V458 HydrophobicContact CD2-CG1 4.02Å; V386-V458 WeakPolarHBondContact O-CA 3.37Å; F387-V458 HydrophobicContact CD1-CB 3.84Å; F387-V458 HydrophobicContact CD1-CG2 3.67Å; F387-V458 HydrophobicContact CE1-CB 3.93Å; F387-V458 HydrophobicContact CE1-CG2 3.31Å; F387-V458 HydrophobicContact CZ-CG2 3.91Å; G447-V458 VanDerWaalsContact O-CG1 3.28Å; G447-V458 WeakPolarHBondContact O-CG1 3.41Å; G447-V458 PolarHBondContact O-N 2.95Å; V458-I468 WeakPolarHBondContact O-CD1 3.44Å
459	G	80.3	Confident	84.9	Confident	4 Å²	4	38 Å²	38	4%	0.041	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	150.9	174.2	0	0	0	0	0	112.2	T385 V386 T461	T385-G459 PolarHBondContact N-O 2.96Å; V386-G459 PolarHBondContact N-O 2.72Å; V386-G459 PolarHBondContact O-N 2.99Å; G459-T461 VanDerWaalsContact C-N 3.33Å
460	K	83.2	Confident	84.6	Confident	154 Å²	154	41 Å²	41	67%	0.67	23%	0.226	S	C	*	.	S	Bend	trans	-76.1	-21.7	178.9	-59.9	-172.3	178.1	176.9	0	113.8	T385	T385-K460 PolarHBondContact OG1-O 3.27Å
461	T	77.9	Confident	84.7	Confident	65 Å²	65	43.3 Å²	43.3	40%	0.399	24%	0.241	S	C	.	.	S	Bend	trans	-140.6	168.8	173	76.1	0	0	0	0	107.7	G459 E463 A464 H465	G459-T461 VanDerWaalsContact C-N 3.33Å; T461-E463 VanDerWaalsContact C-N 3.31Å; T461-E463 WeakPolarHBondContact CB-OE2 3.45Å; T461-E463 PolarHBondContact O-N 2.77Å; T461-E463 PolarHBondContact OG1-N 2.83Å; T461-E463 PolarHBondContact OG1-OE2 3.02Å; T461-A464 PolarHBondContact O-N 2.8Å; T461-A464 PolarHBondContact OG1-N 3.18Å; T461-H465 WeakPolarHBondContact O-CB 3.48Å; T461-H465 PolarHBondContact O-N 3.22Å
462	E	74.5	Confident	84.8	Confident	35 Å²	35	40.8 Å²	40.8	16%	0.164	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-37.6	176.5	-172.8	171.9	168.4	0	0	111.8	I257 V386 H465 N466	I257-E462 WeakPolarHBondContact CG2-OE1 3.41Å; I257-E462 WeakPolarHBondContact CG2-OE2 3.39Å; V386-E462 HydrophobicContact CG2-CB 4.44Å; E462-H465 PolarHBondContact O-N 3.42Å; E462-N466 WeakPolarHBondContact O-CB 3.21Å; E462-N466 VanDerWaalsContact O-CG 3.29Å; E462-N466 PolarHBondContact O-N 2.96Å; E462-N466 PolarHBondContact O-ND2 2.81Å
463	E	78.4	Confident	84.8	Confident	131 Å²	131	39.9 Å²	39.9	61%	0.612	23%	0.227	S	C	*	.	H	α-helix	trans	-64.7	-44	176.4	-56.6	73.6	-160	0	0	111.4	T461 G467	T461-E463 VanDerWaalsContact C-N 3.31Å; T461-E463 WeakPolarHBondContact CB-OE2 3.45Å; T461-E463 PolarHBondContact O-N 2.77Å; T461-E463 PolarHBondContact OG1-N 2.83Å; T461-E463 PolarHBondContact OG1-OE2 3.02Å; E463-G467 PolarHBondContact O-N 2.69Å
464	A	84.6	Confident	85	Confident	41 Å²	41	43.5 Å²	43.5	34%	0.339	24%	0.24	S	C	.	.	H	α-helix	trans	-64.4	-43.3	176.7	0	0	0	0	0	111.3	T461 G467 I468	T461-A464 PolarHBondContact O-N 2.8Å; T461-A464 PolarHBondContact OG1-N 3.18Å; A464-G467 PolarHBondContact O-N 2.92Å; A464-I468 WeakPolarHBondContact O-CD1 3.44Å; A464-I468 WeakPolarHBondContact O-CG1 3.48Å; A464-I468 PolarHBondContact O-N 3.29Å; A464-I468 VanDerWaalsContact O-N 3.14Å
465	H	85.5	Confident	85.3	Confident	7 Å²	7	44.6 Å²	44.6	3%	0.032	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-49.4	176.5	-178.8	-80.8	0	0	0	111.6	V386 S388 V457 T461 E462 G467 I468 W469	V386-H465 HydrophobicContact CB-CB 3.95Å; V386-H465 HydrophobicContact CG1-CB 3.93Å; V386-H465 PolarHBondContact O-CD2 3.29Å; S388-H465 PolarHBondContact N-NE2 3.32Å; S388-H465 PolarHBondContact OG-CE1 3.08Å; S388-H465 PolarHBondContact OG-NE2 3.01Å; S388-H465 VanDerWaalsContact OG-NE2 3.13Å; V457-H465 PolarHBondContact O-NE2 3.35Å; T461-H465 WeakPolarHBondContact O-CB 3.48Å; T461-H465 PolarHBondContact O-N 3.22Å; E462-H465 PolarHBondContact O-N 3.42Å; H465-G467 VanDerWaalsContact C-N 3.27Å; H465-G467 PolarHBondContact O-N 2.87Å; H465-I468 PolarHBondContact O-N 2.93Å; H465-W469 WeakPolarHBondContact O-CB 3.22Å; H465-W469 PolarHBondContact O-N 3Å
466	N	79.9	Confident	85.5	Confident	55 Å²	55	44.6 Å²	44.6	29%	0.294	24%	0.244	S	C	.	.	H	α-helix	trans	-61.5	-35.2	176.8	-75.2	-33	0	0	0	112.6	E462 I468 W469 T470	E462-N466 WeakPolarHBondContact O-CB 3.21Å; E462-N466 VanDerWaalsContact O-CG 3.29Å; E462-N466 PolarHBondContact O-N 2.96Å; E462-N466 PolarHBondContact O-ND2 2.81Å; N466-I468 VanDerWaalsContact C-N 3.28Å; N466-I468 PolarHBondContact O-N 2.93Å; N466-W469 PolarHBondContact O-N 3.32Å; N466-T470 WeakPolarHBondContact O-CB 2.97Å; N466-T470 PolarHBondContact O-N 3.4Å; N466-T470 PolarHBondContact O-OG1 3.15Å
467	G	87.1	Confident	85.5	Confident	48 Å²	48	49 Å²	49	50%	0.495	26%	0.257	S	S	.	.	H	α-helix	trans	-64.3	-27.9	173.7	0	0	0	0	0	114	E463 A464 H465 P471	E463-G467 PolarHBondContact O-N 2.69Å; A464-G467 PolarHBondContact O-N 2.92Å; H465-G467 VanDerWaalsContact C-N 3.27Å; H465-G467 PolarHBondContact O-N 2.87Å; G467-P471 WeakPolarHBondContact O-CD 3.29Å; G467-P471 WeakPolarHBondContact O-CG 3.38Å
468	I	89.4	Confident	85.7	Confident	34 Å²	34	52 Å²	52	17%	0.174	27%	0.274	C	S	.	.	H	α-helix	trans	-88	-40.6	174.9	-61.4	160.1	0	0	0	110.8	H446 V448 V457 V458 A464 H465 N466 T470 P471 F472	H446-I468 WeakPolarHBondContact O-CD1 3.05Å; H446-I468 WeakPolarHBondContact O-CG1 3.41Å; H446-I468 WeakPolarHBondContact O-CG2 3.49Å; V448-I468 HydrophobicContact CG2-CG2 3.5Å; V457-I468 HydrophobicContact CG1-CB 4.16Å; V457-I468 HydrophobicContact CG1-CG2 3.75Å; V458-I468 WeakPolarHBondContact O-CD1 3.44Å; A464-I468 WeakPolarHBondContact O-CD1 3.44Å; A464-I468 WeakPolarHBondContact O-CG1 3.48Å; A464-I468 PolarHBondContact O-N 3.29Å; A464-I468 VanDerWaalsContact O-N 3.14Å; H465-I468 PolarHBondContact O-N 2.93Å; N466-I468 VanDerWaalsContact C-N 3.28Å; N466-I468 PolarHBondContact O-N 2.93Å; I468-T470 VanDerWaalsContact C-N 3.3Å; I468-T470 PolarHBondContact O-N 3.42Å; I468-P471 WeakPolarHBondContact O-CD 3.49Å; I468-P471 VanDerWaalsContact O-CG 3.26Å; I468-P471 WeakPolarHBondContact O-CG 3.29Å; I468-F472 WeakPolarHBondContact O-CB 3.43Å; I468-F472 PolarHBondContact O-N 3.3Å; I468-F472 VanDerWaalsContact O-N 3.16Å
469	W	86.8	Confident	86	Confident	13 Å²	13	52.9 Å²	52.9	5%	0.049	28%	0.276	C	S	.	.	H	α-helix	trans	-60.9	-38.3	178.7	179.8	-89.6	0	0	0	112.4	V269 Y273 I390 V457 H465 N466 F472 S473 F483	V269-W469 HydrophobicContact CG1-CZ2 4.25Å; Y273-W469 HydrophobicContact CD2-CZ2 4.41Å; Y273-W469 AromaticContact CD2-NE1 3.46Å; Y273-W469 AromaticContact CE1-NE1 3.81Å; Y273-W469 AromaticContact CE2-CD1 3.59Å; Y273-W469 AromaticContact CE2-NE1 2.94Å; Y273-W469 AromaticContact CZ-CD1 3.4Å; Y273-W469 AromaticContact CZ-NE1 3.16Å; Y273-W469 VanDerWaalsContact OH-CD1 3.25Å; I390-W469 HydrophobicContact CD1-CH2 4.29Å; I390-W469 HydrophobicContact CD1-CZ3 3.71Å; I390-W469 HydrophobicContact CG1-CH2 3.81Å; I390-W469 HydrophobicContact CG1-CZ3 3.73Å; V457-W469 HydrophobicContact CB-CE3 4.27Å; V457-W469 HydrophobicContact CG2-CE3 3.89Å; V457-W469 HydrophobicContact CG2-CZ3 4.18Å; H465-W469 WeakPolarHBondContact O-CB 3.22Å; H465-W469 PolarHBondContact O-N 3Å; N466-W469 PolarHBondContact O-N 3.32Å; W469-F472 HydrophobicContact CE3-CD1 4.22Å; W469-F472 HydrophobicContact CZ3-CD1 4.28Å; W469-F472 HydrophobicContact CZ3-CE1 4.3Å; W469-F472 PolarHBondContact O-N 2.9Å; W469-S473 WeakPolarHBondContact O-CB 3.33Å; W469-S473 PolarHBondContact O-N 3.18Å; W469-S473 PolarHBondContact O-OG 2.63Å; W469-F483 HydrophobicContact CH2-CZ 4.16Å; W469-F483 HydrophobicContact CZ2-CZ 4.16Å
470	T	85.2	Confident	86.5	Confident	76 Å²	76	55.5 Å²	55.5	47%	0.466	29%	0.289	S	S	.	.	H	α-helix	trans	-60.7	-53.2	-178.6	-58.7	0	0	0	0	113.4	N466 I468 S473 K474	N466-T470 WeakPolarHBondContact O-CB 2.97Å; N466-T470 PolarHBondContact O-N 3.4Å; N466-T470 PolarHBondContact O-OG1 3.15Å; I468-T470 VanDerWaalsContact C-N 3.3Å; I468-T470 PolarHBondContact O-N 3.42Å; T470-S473 PolarHBondContact O-OG 3.13Å; T470-K474 PolarHBondContact O-N 3.26Å
471	P	91.8	Very high	86.8	Confident	49 Å²	49	48.2 Å²	48.2	32%	0.318	26%	0.257	S	S	.	.	H	α-helix	trans	-66.4	-36.7	173.9	25.3	-33.3	0	0	0	112.3	L445 G467 I468 K474 E475	L445-P471 HydrophobicContact CD2-CB 3.9Å; L445-P471 HydrophobicContact CD2-CG 4.16Å; G467-P471 WeakPolarHBondContact O-CD 3.29Å; G467-P471 WeakPolarHBondContact O-CG 3.38Å; I468-P471 WeakPolarHBondContact O-CD 3.49Å; I468-P471 VanDerWaalsContact O-CG 3.26Å; I468-P471 WeakPolarHBondContact O-CG 3.29Å; P471-K474 WeakPolarHBondContact O-CB 3.46Å; P471-K474 PolarHBondContact O-N 2.71Å; P471-E475 PolarHBondContact O-N 3Å
472	F	91.7	Very high	87.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.9	-49.7	176.7	174.7	-112.4	0	0	0	113.1	I390 L441 I442 L445 V448 V455 V457 I468 W469 K474 E475 L476	I390-F472 HydrophobicContact CD1-CD1 4.23Å; I390-F472 HydrophobicContact CD1-CE1 3.27Å; I390-F472 HydrophobicContact CD1-CZ 3.76Å; I390-F472 HydrophobicContact CG1-CE1 3.93Å; I390-F472 HydrophobicContact CG1-CZ 4.47Å; L441-F472 HydrophobicContact CD2-CD2 4.25Å; L441-F472 HydrophobicContact CD2-CE2 3.76Å; I442-F472 HydrophobicContact CG2-CD2 4.3Å; I442-F472 HydrophobicContact CG2-CE2 3.93Å; L445-F472 HydrophobicContact CD1-CB 3.84Å; L445-F472 HydrophobicContact CD1-CD2 3.81Å; L445-F472 HydrophobicContact CD1-CG 4.32Å; V448-F472 HydrophobicContact CG1-CD2 3.96Å; V448-F472 HydrophobicContact CG1-CE2 4Å; V448-F472 HydrophobicContact CG2-CB 4.35Å; V448-F472 HydrophobicContact CG2-CD2 4.4Å; V448-F472 HydrophobicContact CG2-CG 4.4Å; V455-F472 HydrophobicContact CB-CZ 4.4Å; V455-F472 HydrophobicContact CG1-CE1 4.39Å; V455-F472 HydrophobicContact CG1-CE2 3.97Å; V455-F472 HydrophobicContact CG1-CZ 3.61Å; V457-F472 HydrophobicContact CG2-CD1 3.73Å; V457-F472 HydrophobicContact CG2-CE1 4.04Å; V457-F472 HydrophobicContact CG2-CG 4.27Å; I468-F472 WeakPolarHBondContact O-CB 3.43Å; I468-F472 PolarHBondContact O-N 3.3Å; I468-F472 VanDerWaalsContact O-N 3.16Å; W469-F472 HydrophobicContact CE3-CD1 4.22Å; W469-F472 HydrophobicContact CZ3-CD1 4.28Å; W469-F472 HydrophobicContact CZ3-CE1 4.3Å; W469-F472 PolarHBondContact O-N 2.9Å; F472-K474 PolarHBondContact O-N 2.78Å; F472-E475 PolarHBondContact O-N 2.85Å; F472-L476 HydrophobicContact CD1-CD1 4.16Å; F472-L476 HydrophobicContact CE1-CD1 3.45Å; F472-L476 VanDerWaalsContact CE1-CD1 3.45Å; F472-L476 HydrophobicContact CE1-CG 4Å; F472-L476 HydrophobicContact CE2-CD1 4.35Å; F472-L476 HydrophobicContact CE2-CD2 4.03Å; F472-L476 HydrophobicContact CE2-CG 4.02Å; F472-L476 HydrophobicContact CZ-CD1 3.58Å; F472-L476 HydrophobicContact CZ-CD2 3.81Å; F472-L476 HydrophobicContact CZ-CG 3.74Å; F472-L476 PolarHBondContact O-N 2.8Å
473	S	88	Confident	87.3	Confident	4 Å²	4	43.8 Å²	43.8	3%	0.028	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-32.7	175.9	56	0	0	0	0	112.7	W469 T470 R477	W469-S473 WeakPolarHBondContact O-CB 3.33Å; W469-S473 PolarHBondContact O-N 3.18Å; W469-S473 PolarHBondContact O-OG 2.63Å; T470-S473 PolarHBondContact O-OG 3.13Å; S473-R477 WeakPolarHBondContact O-CB 3.49Å; S473-R477 PolarHBondContact O-N 3.24Å; S473-R477 VanDerWaalsContact O-N 3.08Å
474	K	89.5	Confident	86.4	Confident	124 Å²	124	37.6 Å²	37.6	54%	0.539	20%	0.204	S	C	.	.	H	α-helix	trans	-65.2	-43.8	171.6	-174.2	-174.5	176.6	-170.6	0	111.5	T470 P471 F472 R477 N478	T470-K474 PolarHBondContact O-N 3.26Å; P471-K474 WeakPolarHBondContact O-CB 3.46Å; P471-K474 PolarHBondContact O-N 2.71Å; F472-K474 PolarHBondContact O-N 2.78Å; K474-R477 PolarHBondContact O-N 3.03Å; K474-N478 WeakPolarHBondContact O-CB 3.46Å; K474-N478 PolarHBondContact O-N 3.21Å; K474-N478 PolarHBondContact O-ND2 2.67Å; K474-N478 PolarHBondContact O-OD1 3.41Å
475	E	91.7	Very high	86.5	Confident	58 Å²	58	37.5 Å²	37.5	27%	0.271	20%	0.198	S	C	.	.	H	α-helix	trans	-64	-44.3	175.6	-69.5	-49.4	128.5	0	0	111.9	L441 L445 P471 F472 R477 N478 W479	L441-E475 HydrophobicContact CD2-CB 4.41Å; L445-E475 HydrophobicContact CD1-CG 4.4Å; P471-E475 PolarHBondContact O-N 3Å; F472-E475 PolarHBondContact O-N 2.85Å; E475-R477 VanDerWaalsContact C-N 3.28Å; E475-R477 PolarHBondContact O-N 2.93Å; E475-N478 PolarHBondContact O-N 3.11Å; E475-N478 VanDerWaalsContact O-N 3.13Å; E475-N478 PolarHBondContact OE1-ND2 2.87Å; E475-W479 WeakPolarHBondContact O-CB 3.44Å; E475-W479 PolarHBondContact O-N 3.26Å
476	L	90.8	Very high	86.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-53.2	-46.2	173.1	-70.5	-177.5	0	0	0	112.2	I276 F392 L441 F472 W479 D480 F481 F483	I276-L476 HydrophobicContact CD1-CD1 4.4Å; I276-L476 HydrophobicContact CG2-CB 4Å; F392-L476 HydrophobicContact CE1-CD2 3.73Å; F392-L476 HydrophobicContact CZ-CD2 3.66Å; L441-L476 HydrophobicContact CD1-CD2 4.04Å; L441-L476 HydrophobicContact CD2-CD2 3.95Å; F472-L476 HydrophobicContact CD1-CD1 4.16Å; F472-L476 HydrophobicContact CE1-CD1 3.45Å; F472-L476 VanDerWaalsContact CE1-CD1 3.45Å; F472-L476 HydrophobicContact CE1-CG 4Å; F472-L476 HydrophobicContact CE2-CD1 4.35Å; F472-L476 HydrophobicContact CE2-CD2 4.03Å; F472-L476 HydrophobicContact CE2-CG 4.02Å; F472-L476 HydrophobicContact CZ-CD1 3.58Å; F472-L476 HydrophobicContact CZ-CD2 3.81Å; F472-L476 HydrophobicContact CZ-CG 3.74Å; F472-L476 PolarHBondContact O-N 2.8Å; L476-W479 PolarHBondContact O-N 3.36Å; L476-D480 PolarHBondContact O-N 3.36Å; L476-F481 HydrophobicContact CD2-CB 4.13Å; L476-F481 PolarHBondContact O-N 3.03Å; L476-F483 HydrophobicContact CD1-CD1 4.03Å; L476-F483 HydrophobicContact CD1-CE1 3.7Å
477	R	88	Confident	86.9	Confident	123 Å²	123	38.2 Å²	38.2	46%	0.464	20%	0.201	S	C	.	.	H	α-helix	trans	-65.3	-43.2	177.3	-171.3	-166.1	-59.4	179.9	-2.1	112.5	E275 I276 S473 K474 E475 W479 D480	E275-R477 HydrophobicContact CG-CG 3.83Å; E275-R477 VanDerWaalsContact CG-NE 3.27Å; E275-R477 IonicContact OE1-CZ 2.92Å; E275-R477 IonicContact OE1-NE 3.2Å; E275-R477 PolarHBondContact OE1-NE 3.09Å; E275-R477 VanDerWaalsContact OE1-NE 3.08Å; E275-R477 IonicContact OE1-NH2 3.95Å; E275-R477 PolarHBondContact OE1-NH2 2.97Å; E275-R477 IonicContact OE2-NH2 2.81Å; I276-R477 HydrophobicContact CG2-CB 4.02Å; S473-R477 WeakPolarHBondContact O-CB 3.49Å; S473-R477 PolarHBondContact O-N 3.24Å; S473-R477 VanDerWaalsContact O-N 3.08Å; K474-R477 PolarHBondContact O-N 3.03Å; E475-R477 VanDerWaalsContact C-N 3.28Å; E475-R477 PolarHBondContact O-N 2.93Å; R477-W479 VanDerWaalsContact C-N 3.31Å; R477-W479 PolarHBondContact O-N 3.08Å; R477-D480 PolarHBondContact O-N 2.93Å
478	N	91	Very high	86.9	Confident	65 Å²	65	37.6 Å²	37.6	35%	0.348	18%	0.184	S	C	.	.	H	α-helix	trans	-60.4	-46.1	178.6	-70.3	-20.1	0	0	0	110.5	F286 K474 E475 D480	F286-N478 HydrophobicContact CE2-CB 4.38Å; F286-N478 VanDerWaalsContact CE2-O 3.31Å; F286-N478 WeakPolarHBondContact CE2-O 3.32Å; K474-N478 WeakPolarHBondContact O-CB 3.46Å; K474-N478 PolarHBondContact O-N 3.21Å; K474-N478 PolarHBondContact O-ND2 2.67Å; K474-N478 PolarHBondContact O-OD1 3.41Å; E475-N478 PolarHBondContact O-N 3.11Å; E475-N478 VanDerWaalsContact O-N 3.13Å; E475-N478 PolarHBondContact OE1-ND2 2.87Å; N478-D480 PolarHBondContact O-N 3.04Å
479	W	92	Very high	86.8	Confident	25 Å²	25	37.8 Å²	37.8	10%	0.095	19%	0.185	C	C	.	.	H	α-helix	trans	-74.7	-14.1	179.3	-73.5	64.9	0	0	0	113.1	C284 K285 F286 A287 I437 T440 L441 E475 L476 R477 F481	C284-W479 CarbonylContact C-O 3.59Å; C284-W479 WeakPolarHBondContact CA-O 3.39Å; K285-W479 PolarHBondContact N-O 3.37Å; F286-W479 HydrophobicContact CB-CD2 4.22Å; F286-W479 HydrophobicContact CB-CE3 3.94Å; F286-W479 HydrophobicContact CB-CH2 4.1Å; F286-W479 HydrophobicContact CB-CZ2 4.36Å; F286-W479 HydrophobicContact CB-CZ3 3.86Å; F286-W479 HydrophobicContact CD2-CB 4.15Å; F286-W479 AromaticContact CD2-CD1 3.82Å; F286-W479 AromaticContact CD2-CD2 3.57Å; F286-W479 HydrophobicContact CD2-CD2 3.57Å; F286-W479 AromaticContact CD2-CE2 3.85Å; F286-W479 HydrophobicContact CD2-CE3 4.05Å; F286-W479 AromaticContact CD2-CG 3.58Å; F286-W479 HydrophobicContact CD2-CG 3.58Å; F286-W479 AromaticContact CD2-NE1 3.98Å; F286-W479 HydrophobicContact CE2-CB 4.46Å; F286-W479 AromaticContact CE2-CD1 3.88Å; F286-W479 HydrophobicContact CE2-CD2 4.39Å; F286-W479 AromaticContact CE2-CG 4Å; F286-W479 HydrophobicContact CE2-CG 4Å; F286-W479 HydrophobicContact CG-CD2 4.29Å; F286-W479 HydrophobicContact CG-CE3 4.47Å; A287-W479 HydrophobicContact CB-CZ3 4.49Å; I437-W479 HydrophobicContact CG2-CE3 4.35Å; I437-W479 HydrophobicContact CG2-CZ3 3.9Å; T440-W479 HydrophobicContact CG2-CH2 3.68Å; T440-W479 HydrophobicContact CG2-CZ2 3.89Å; L441-W479 HydrophobicContact CB-CD2 4.27Å; L441-W479 HydrophobicContact CB-CZ2 4.36Å; L441-W479 HydrophobicContact CD1-CB 3.94Å; L441-W479 HydrophobicContact CD1-CD2 4.02Å; L441-W479 HydrophobicContact CD1-CE3 4.36Å; L441-W479 HydrophobicContact CD1-CG 3.85Å; L441-W479 HydrophobicContact CG-CD2 4.23Å; L441-W479 HydrophobicContact CG-CG 4.2Å; E475-W479 WeakPolarHBondContact O-CB 3.44Å; E475-W479 PolarHBondContact O-N 3.26Å; L476-W479 PolarHBondContact O-N 3.36Å; R477-W479 VanDerWaalsContact C-N 3.31Å; R477-W479 PolarHBondContact O-N 3.08Å; W479-F481 HydrophobicContact CB-CD2 3.71Å; W479-F481 HydrophobicContact CB-CE2 4.18Å; W479-F481 HydrophobicContact CE3-CE2 4.05Å
480	D	90.4	Very high	86.8	Confident	58 Å²	58	39.5 Å²	39.5	31%	0.31	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	32	-178.9	-148.3	56	0	0	0	113.5	G282 H283 K285 L476 R477 N478	G282-D480 CarbonylContact C-O 3.56Å; G282-D480 WeakPolarHBondContact CA-O 3.44Å; H283-D480 PolarHBondContact N-O 3.22Å; H283-D480 WeakPolarHBondContact O-CB 3.43Å; K285-D480 HydrophobicContact CD-CB 3.87Å; K285-D480 VanDerWaalsContact CE-CB 3.49Å; K285-D480 VanDerWaalsContact CE-CG 3.41Å; K285-D480 WeakPolarHBondContact CE-OD2 3.25Å; K285-D480 HydrophobicContact CG-CB 3.9Å; K285-D480 IonicContact NZ-OD1 3.08Å; K285-D480 PolarHBondContact NZ-OD1 3.13Å; K285-D480 IonicContact NZ-OD2 2.62Å; L476-D480 PolarHBondContact O-N 3.36Å; R477-D480 PolarHBondContact O-N 2.93Å; N478-D480 PolarHBondContact O-N 3.04Å
481	F	89.2	Confident	86.9	Confident	1 Å²	1	36.9 Å²	36.9	0%	0.004	17%	0.174	C	C	.	.			trans	-82.3	139	169.9	-82.4	-83.3	0	0	0	110.9	C284 F392 Q398 I399 F434 I437 M438 L441 L476 W479	C284-F481 HydrophobicContact CB-CE2 3.94Å; C284-F481 HydrophobicContact CB-CZ 3.85Å; F392-F481 HydrophobicContact CD1-CB 4.34Å; F392-F481 HydrophobicContact CD1-CD1 4.26Å; F392-F481 HydrophobicContact CE1-CB 3.81Å; F392-F481 HydrophobicContact CE1-CD1 4.21Å; F392-F481 HydrophobicContact CE1-CG 4.25Å; Q398-F481 HydrophobicContact CB-CD1 4.01Å; Q398-F481 HydrophobicContact CB-CE1 3.95Å; Q398-F481 VanDerWaalsContact OE1-CD1 3.26Å; I399-F481 HydrophobicContact CG1-CZ 4.26Å; F434-F481 HydrophobicContact CE2-CE1 4.39Å; I437-F481 HydrophobicContact CG2-CE2 4.08Å; I437-F481 HydrophobicContact CG2-CZ 3.86Å; M438-F481 HydrophobicContact CE-CD1 4.1Å; M438-F481 HydrophobicContact CE-CE1 3.82Å; M438-F481 HydrophobicContact CE-CZ 4.1Å; L441-F481 HydrophobicContact CD1-CD2 3.49Å; L441-F481 VanDerWaalsContact CD1-CD2 3.49Å; L441-F481 HydrophobicContact CD1-CE2 3.78Å; L441-F481 HydrophobicContact CD1-CG 4.4Å; L476-F481 HydrophobicContact CD2-CB 4.13Å; L476-F481 PolarHBondContact O-N 3.03Å; W479-F481 HydrophobicContact CB-CD2 3.71Å; W479-F481 HydrophobicContact CB-CE2 4.18Å; W479-F481 HydrophobicContact CE3-CE2 4.05Å
482	T	84.4	Confident	86.5	Confident	7 Å²	7	35.9 Å²	35.9	4%	0.043	16%	0.163	C	C	.	.			trans	-119.8	147.9	176.6	63.2	0	0	0	0	111.6	I276 S280 G282 F392 Q398	I276-T482 WeakPolarHBondContact O-CA 3.42Å; S280-T482 PolarHBondContact O-OG1 3.3Å; G282-T482 PolarHBondContact N-OG1 3.26Å; F392-T482 WeakPolarHBondContact CD1-O 3.28Å; Q398-T482 PolarHBondContact NE2-O 3.06Å
483	F	77.6	Confident	86.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-129.7	154.4	173.7	58.1	-94	0	0	0	110.4	V121 V269 I276 C277 I390 D391 F392 W469 L476	V121-F483 HydrophobicContact CG2-CD2 3.93Å; V121-F483 HydrophobicContact CG2-CE2 4.1Å; V269-F483 HydrophobicContact CG1-CE2 4.31Å; V269-F483 HydrophobicContact CG1-CZ 4.46Å; I276-F483 HydrophobicContact CB-CD1 4.19Å; I276-F483 HydrophobicContact CB-CE1 3.61Å; I276-F483 HydrophobicContact CB-CZ 4.26Å; I276-F483 HydrophobicContact CD1-CE1 3.52Å; I276-F483 HydrophobicContact CD1-CZ 3.73Å; I276-F483 HydrophobicContact CG1-CD1 4.41Å; I276-F483 HydrophobicContact CG1-CE1 3.41Å; I276-F483 VanDerWaalsContact CG1-CE1 3.41Å; I276-F483 HydrophobicContact CG1-CZ 3.6Å; I276-F483 PolarHBondContact O-N 3.39Å; C277-F483 WeakPolarHBondContact CA-O 3.49Å; C277-F483 WeakPolarHBondContact SG-CE2 3.2Å; C277-F483 WeakPolarHBondContact SG-CZ 3.5Å; I390-F483 HydrophobicContact CG2-CB 3.71Å; I390-F483 HydrophobicContact CG2-CD1 3.7Å; I390-F483 HydrophobicContact CG2-CD2 4.18Å; I390-F483 HydrophobicContact CG2-CE1 4.29Å; I390-F483 HydrophobicContact CG2-CG 3.62Å; D391-F483 VanDerWaalsContact O-CB 3.28Å; D391-F483 WeakPolarHBondContact O-CB 3.46Å; F392-F483 HydrophobicContact CD1-CB 4.37Å; W469-F483 HydrophobicContact CH2-CZ 4.16Å; W469-F483 HydrophobicContact CZ2-CZ 4.16Å; L476-F483 HydrophobicContact CD1-CD1 4.03Å; L476-F483 HydrophobicContact CD1-CE1 3.7Å
484	G	60.2	Low	85.9	Confident	2 Å²	2	42.1 Å²	42.1	2%	0.021	19%	0.19	C	C	.	.			trans	-111.1	0	-168.7	0	0	0	0	0	114.9	V121 Y270 S393	V121-G484 WeakPolarHBondContact CG2-O 3.46Å; Y270-G484 PolarHBondContact OH-OXT 3.37Å; S393-G484 VanDerWaalsContact OG-CA 3.32Å; S393-G484 WeakPolarHBondContact OG-CA 3.26Å; S393-G484 PolarHBondContact OG-N 3.43Å

Retrieved 484 of 484 residues in 689.4 ms (Link to these results)

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