A0A5K4F5L7_SCHMA Loading...

Spindle and centriole-associated protein 1

AlphaFold DB , UniProt , Accession A0A5K4F5L7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 552 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	66.4	Low	79.7	Confident	168 Å²	168	112.7 Å²	112.7	83%	0.828	59%	0.585	S	S	*	*				0	-65	0	-69.4	-58.3	-77.2	0	0	108.7	E3 L4 D5	M1-E3 VanDerWaalsContact C-N 3.33Å; M1-E3 PolarHBondContact O-N 3.37Å; M1-E3 VanDerWaalsContact O-N 3.17Å; M1-L4 WeakPolarHBondContact O-CA 3.29Å; M1-L4 VanDerWaalsContact O-CB 3.27Å; M1-L4 WeakPolarHBondContact O-CB 3.27Å; M1-L4 PolarHBondContact O-N 3.15Å; M1-D5 PolarHBondContact O-N 3.13Å
2	D	71.9	Confident	79.8	Confident	136 Å²	136	112.3 Å²	112.3	73%	0.727	58%	0.578	S	S	*	*	H	α-helix	trans	-52.8	-41.9	-176	-49.1	4.9	0	0	0	114.5	L4 D5 S6	D2-L4 VanDerWaalsContact C-N 3.35Å; D2-L4 PolarHBondContact O-N 3.06Å; D2-D5 PolarHBondContact O-N 2.82Å; D2-S6 WeakPolarHBondContact O-CB 3.28Å; D2-S6 PolarHBondContact O-N 2.91Å
3	E	77.1	Confident	80.1	Confident	164 Å²	164	110.9 Å²	110.9	77%	0.766	57%	0.568	S	S	*	*	H	α-helix	trans	-64.5	-35.9	174	-67.8	-178.6	151.3	0	0	113	M1 S6 L7	M1-E3 VanDerWaalsContact C-N 3.33Å; M1-E3 PolarHBondContact O-N 3.37Å; M1-E3 VanDerWaalsContact O-N 3.17Å; E3-S6 PolarHBondContact O-N 2.89Å; E3-L7 WeakPolarHBondContact O-CG 3.23Å; E3-L7 PolarHBondContact O-N 3.29Å
4	L	75.7	Confident	80.3	Confident	110 Å²	110	107.9 Å²	107.9	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-70.9	-41.6	176.9	-172.8	70.2	0	0	0	110.9	M1 D2 S6 L7 L8	M1-L4 WeakPolarHBondContact O-CA 3.29Å; M1-L4 VanDerWaalsContact O-CB 3.27Å; M1-L4 WeakPolarHBondContact O-CB 3.27Å; M1-L4 PolarHBondContact O-N 3.15Å; D2-L4 VanDerWaalsContact C-N 3.35Å; D2-L4 PolarHBondContact O-N 3.06Å; L4-S6 VanDerWaalsContact C-N 3.29Å; L4-S6 PolarHBondContact O-N 3.19Å; L4-L7 PolarHBondContact O-N 2.84Å; L4-L8 WeakPolarHBondContact O-CB 3.33Å; L4-L8 PolarHBondContact O-N 2.74Å
5	D	80.5	Confident	79.9	Confident	79 Å²	79	105.9 Å²	105.9	42%	0.422	55%	0.548	S	S	.	.	H	α-helix	trans	-65.9	-32.8	174.8	-72.8	-33.1	0	0	0	112	M1 D2 N9	M1-D5 PolarHBondContact O-N 3.13Å; D2-D5 PolarHBondContact O-N 2.82Å; D5-N9 WeakPolarHBondContact O-CB 3.5Å; D5-N9 PolarHBondContact O-N 3.5Å; D5-N9 PolarHBondContact O-ND2 2.67Å; D5-N9 VanDerWaalsContact O-ND2 3.09Å
6	S	84.7	Confident	79.7	Confident	70 Å²	70	104.9 Å²	104.9	49%	0.49	54%	0.54	S	S	.	.	H	α-helix	trans	-65.7	-48.3	172	-168.3	0	0	0	0	111.5	D2 E3 L4 L8 N9 E10	D2-S6 WeakPolarHBondContact O-CB 3.28Å; D2-S6 PolarHBondContact O-N 2.91Å; E3-S6 PolarHBondContact O-N 2.89Å; L4-S6 VanDerWaalsContact C-N 3.29Å; L4-S6 PolarHBondContact O-N 3.19Å; S6-L8 PolarHBondContact O-N 3.17Å; S6-N9 PolarHBondContact O-N 2.76Å; S6-E10 PolarHBondContact O-N 3.09Å
7	L	83.9	Confident	79.7	Confident	108 Å²	108	106 Å²	106	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-39.3	176.8	-72.9	170.2	0	0	0	112.3	E3 L4 N9 E10 L11	E3-L7 WeakPolarHBondContact O-CG 3.23Å; E3-L7 PolarHBondContact O-N 3.29Å; L4-L7 PolarHBondContact O-N 2.84Å; L7-N9 VanDerWaalsContact C-N 3.33Å; L7-N9 PolarHBondContact O-N 2.82Å; L7-E10 PolarHBondContact O-N 2.82Å; L7-L11 WeakPolarHBondContact O-CB 3.24Å; L7-L11 PolarHBondContact O-N 3.36Å
8	L	82.4	Confident	79.1	Confident	110 Å²	110	104.7 Å²	104.7	58%	0.576	53%	0.533	S	S	*	.	H	α-helix	trans	-65.7	-37.6	176.7	-160.1	73.4	0	0	0	111.3	L4 S6 H12	L4-L8 WeakPolarHBondContact O-CB 3.33Å; L4-L8 PolarHBondContact O-N 2.74Å; S6-L8 PolarHBondContact O-N 3.17Å; L8-H12 VanDerWaalsContact O-CB 3.32Å; L8-H12 WeakPolarHBondContact O-CB 3.39Å; L8-H12 PolarHBondContact O-N 3.13Å
9	N	84	Confident	78.3	Confident	95 Å²	95	104.5 Å²	104.5	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-66.7	-42.9	171.6	-91.6	-55.1	0	0	0	112.8	D5 S6 L7 H12 Q13	D5-N9 WeakPolarHBondContact O-CB 3.5Å; D5-N9 PolarHBondContact O-N 3.5Å; D5-N9 PolarHBondContact O-ND2 2.67Å; D5-N9 VanDerWaalsContact O-ND2 3.09Å; S6-N9 PolarHBondContact O-N 2.76Å; L7-N9 VanDerWaalsContact C-N 3.33Å; L7-N9 PolarHBondContact O-N 2.82Å; N9-H12 PolarHBondContact O-N 2.94Å; N9-Q13 WeakPolarHBondContact O-CB 3.14Å; N9-Q13 WeakPolarHBondContact O-CG 3.07Å; N9-Q13 PolarHBondContact O-N 2.78Å
10	E	86.9	Confident	77.8	Confident	118 Å²	118	105.5 Å²	105.5	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-62.9	-41.9	175.4	-77.6	-161	129.8	0	0	111.9	S6 L7 Q13 T14	S6-E10 PolarHBondContact O-N 3.09Å; L7-E10 PolarHBondContact O-N 2.82Å; E10-Q13 PolarHBondContact O-N 2.94Å; E10-T14 VanDerWaalsContact O-CB 3.27Å; E10-T14 WeakPolarHBondContact O-CB 3.49Å; E10-T14 PolarHBondContact O-N 3.38Å; E10-T14 PolarHBondContact O-OG1 2.79Å
11	L	82.9	Confident	77.3	Confident	82 Å²	82	107.6 Å²	107.6	43%	0.429	54%	0.541	S	S	.	.	H	α-helix	trans	-63.1	-43.5	174.5	-176	63	0	0	0	111.2	L7 T14 N15	L7-L11 WeakPolarHBondContact O-CB 3.24Å; L7-L11 PolarHBondContact O-N 3.36Å; L11-T14 PolarHBondContact O-N 3.32Å; L11-N15 WeakPolarHBondContact O-CB 3.15Å; L11-N15 PolarHBondContact O-N 3.29Å; L11-N15 PolarHBondContact O-ND2 2.75Å
12	H	81.5	Confident	76.3	Confident	107 Å²	107	103.2 Å²	103.2	50%	0.495	52%	0.521	S	S	.	.	H	α-helix	trans	-62.7	-45.9	176.3	-169	80.5	0	0	0	112	L8 N9 T14 N15 Q16	L8-H12 VanDerWaalsContact O-CB 3.32Å; L8-H12 WeakPolarHBondContact O-CB 3.39Å; L8-H12 PolarHBondContact O-N 3.13Å; N9-H12 PolarHBondContact O-N 2.94Å; H12-T14 VanDerWaalsContact C-N 3.33Å; H12-T14 PolarHBondContact O-N 2.77Å; H12-N15 PolarHBondContact O-N 3.11Å; H12-Q16 PolarHBondContact CD2-NE2 2.82Å; H12-Q16 VanDerWaalsContact CD2-NE2 3.32Å; H12-Q16 PolarHBondContact NE2-NE2 2.83Å; H12-Q16 WeakPolarHBondContact O-CG 3.26Å; H12-Q16 PolarHBondContact O-N 3.37Å
13	Q	83.9	Confident	75.1	Confident	95 Å²	95	101.7 Å²	101.7	44%	0.444	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-36.8	175.5	-72.8	-178.4	33.5	0	0	112.5	N9 E10 Q16 K17	N9-Q13 WeakPolarHBondContact O-CB 3.14Å; N9-Q13 WeakPolarHBondContact O-CG 3.07Å; N9-Q13 PolarHBondContact O-N 2.78Å; E10-Q13 PolarHBondContact O-N 2.94Å; Q13-Q16 PolarHBondContact O-N 3.46Å; Q13-K17 WeakPolarHBondContact O-CB 3.27Å; Q13-K17 VanDerWaalsContact O-CG 3.29Å; Q13-K17 WeakPolarHBondContact O-CG 3.28Å; Q13-K17 PolarHBondContact O-N 2.8Å
14	T	82.2	Confident	73.6	Confident	69 Å²	69	97.1 Å²	97.1	42%	0.423	50%	0.503	S	S	.	.	H	α-helix	trans	-68.6	-44.6	178	-59.8	0	0	0	0	110.7	E10 L11 H12 Q16 K17 I18	E10-T14 VanDerWaalsContact O-CB 3.27Å; E10-T14 WeakPolarHBondContact O-CB 3.49Å; E10-T14 PolarHBondContact O-N 3.38Å; E10-T14 PolarHBondContact O-OG1 2.79Å; L11-T14 PolarHBondContact O-N 3.32Å; H12-T14 VanDerWaalsContact C-N 3.33Å; H12-T14 PolarHBondContact O-N 2.77Å; T14-Q16 PolarHBondContact O-N 3.41Å; T14-K17 PolarHBondContact O-N 3.48Å; T14-I18 HydrophobicContact CG2-CD1 4.08Å; T14-I18 WeakPolarHBondContact O-CG1 3.48Å; T14-I18 PolarHBondContact O-N 2.69Å
15	N	74.4	Confident	71.9	Confident	78 Å²	78	97.5 Å²	97.5	42%	0.417	51%	0.505	S	S	.	.	H	α-helix	trans	-60.8	-42.4	172.1	-76.3	-28.8	0	0	0	112	L11 H12 K17 I18 L19	L11-N15 WeakPolarHBondContact O-CB 3.15Å; L11-N15 PolarHBondContact O-N 3.29Å; L11-N15 PolarHBondContact O-ND2 2.75Å; H12-N15 PolarHBondContact O-N 3.11Å; N15-K17 PolarHBondContact O-N 2.72Å; N15-I18 PolarHBondContact O-N 2.8Å; N15-L19 WeakPolarHBondContact O-CB 3.08Å; N15-L19 VanDerWaalsContact O-CG 3.27Å; N15-L19 WeakPolarHBondContact O-CG 3.5Å; N15-L19 PolarHBondContact O-N 3.47Å
16	Q	77.6	Confident	69.7	Low	89 Å²	89	97.9 Å²	97.9	42%	0.416	51%	0.507	S	S	.	.	H	α-helix	trans	-60.7	-42.6	172.6	-75.5	-169	10.5	0	0	112.5	H12 Q13 T14 L19 Q20	H12-Q16 PolarHBondContact CD2-NE2 2.82Å; H12-Q16 VanDerWaalsContact CD2-NE2 3.32Å; H12-Q16 PolarHBondContact NE2-NE2 2.83Å; H12-Q16 WeakPolarHBondContact O-CG 3.26Å; H12-Q16 PolarHBondContact O-N 3.37Å; Q13-Q16 PolarHBondContact O-N 3.46Å; T14-Q16 PolarHBondContact O-N 3.41Å; Q16-L19 PolarHBondContact O-N 2.76Å; Q16-Q20 WeakPolarHBondContact O-CB 3.42Å; Q16-Q20 VanDerWaalsContact O-CG 3.27Å; Q16-Q20 WeakPolarHBondContact O-CG 3.12Å; Q16-Q20 PolarHBondContact O-N 3.46Å
17	K	79	Confident	67.2	Low	124 Å²	124	99.3 Å²	99.3	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-39.8	176.5	-74.7	167.1	-174.5	166.3	0	112.1	Q13 T14 N15 Q20 K21	Q13-K17 WeakPolarHBondContact O-CB 3.27Å; Q13-K17 VanDerWaalsContact O-CG 3.29Å; Q13-K17 WeakPolarHBondContact O-CG 3.28Å; Q13-K17 PolarHBondContact O-N 2.8Å; T14-K17 PolarHBondContact O-N 3.48Å; N15-K17 PolarHBondContact O-N 2.72Å; K17-Q20 PolarHBondContact O-N 3.2Å; K17-K21 WeakPolarHBondContact O-CB 3.31Å; K17-K21 PolarHBondContact O-N 3.39Å
18	I	69.5	Low	64.7	Low	83 Å²	83	97 Å²	97	43%	0.426	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-47.4	174.6	-68.3	164.9	0	0	0	110.1	T14 N15 Q20 K21 N22	T14-I18 HydrophobicContact CG2-CD1 4.08Å; T14-I18 WeakPolarHBondContact O-CG1 3.48Å; T14-I18 PolarHBondContact O-N 2.69Å; N15-I18 PolarHBondContact O-N 2.8Å; I18-Q20 PolarHBondContact O-N 2.99Å; I18-K21 PolarHBondContact O-N 3.45Å; I18-N22 WeakPolarHBondContact O-CB 3.21Å; I18-N22 VanDerWaalsContact O-CG 3.23Å; I18-N22 PolarHBondContact O-N 3.1Å
19	L	62.6	Low	62.6	Low	101 Å²	101	93.7 Å²	93.7	53%	0.529	50%	0.496	S	S	.	.	H	α-helix	trans	-60.8	-43.4	176	-71.8	168.8	0	0	0	112	N15 Q16 N22 N23	N15-L19 WeakPolarHBondContact O-CB 3.08Å; N15-L19 VanDerWaalsContact O-CG 3.27Å; N15-L19 WeakPolarHBondContact O-CG 3.5Å; N15-L19 PolarHBondContact O-N 3.47Å; Q16-L19 PolarHBondContact O-N 2.76Å; L19-N22 PolarHBondContact O-N 3.07Å; L19-N23 VanDerWaalsContact O-CB 3.23Å; L19-N23 WeakPolarHBondContact O-CB 2.94Å; L19-N23 PolarHBondContact O-N 3.05Å; L19-N23 PolarHBondContact O-ND2 2.94Å
20	Q	68.5	Low	59.9	Low	123 Å²	123	97.5 Å²	97.5	58%	0.575	52%	0.516	S	S	*	.	H	α-helix	trans	-62.5	-42.4	174.9	-75.4	173.7	9.9	0	0	112	Q16 K17 I18 N23 A24	Q16-Q20 WeakPolarHBondContact O-CB 3.42Å; Q16-Q20 VanDerWaalsContact O-CG 3.27Å; Q16-Q20 WeakPolarHBondContact O-CG 3.12Å; Q16-Q20 PolarHBondContact O-N 3.46Å; K17-Q20 PolarHBondContact O-N 3.2Å; I18-Q20 PolarHBondContact O-N 2.99Å; Q20-N23 PolarHBondContact O-N 3.23Å; Q20-A24 VanDerWaalsContact O-CB 3.27Å; Q20-A24 WeakPolarHBondContact O-CB 3.39Å; Q20-A24 PolarHBondContact O-N 3.4Å
21	K	67.9	Low	57.3	Low	150 Å²	150	95 Å²	95	65%	0.652	51%	0.511	S	S	*	.	H	α-helix	trans	-66.6	-42.4	178	-167.6	176.5	-177.1	-177.7	0	111.7	K17 I18 A24 L25	K17-K21 WeakPolarHBondContact O-CB 3.31Å; K17-K21 PolarHBondContact O-N 3.39Å; I18-K21 PolarHBondContact O-N 3.45Å; K21-A24 PolarHBondContact O-N 3.27Å; K21-L25 HydrophobicContact CG-CD1 4.45Å; K21-L25 WeakPolarHBondContact O-CG 3.5Å; K21-L25 PolarHBondContact O-N 2.88Å
22	N	45	Very low	54.8	Low	76 Å²	76	92.8 Å²	92.8	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-64.4	-42.9	174.5	-69.4	-8.8	0	0	0	111	I18 L19 L25 N26	I18-N22 WeakPolarHBondContact O-CB 3.21Å; I18-N22 VanDerWaalsContact O-CG 3.23Å; I18-N22 PolarHBondContact O-N 3.1Å; L19-N22 PolarHBondContact O-N 3.07Å; N22-L25 PolarHBondContact O-N 2.85Å; N22-N26 WeakPolarHBondContact O-CB 3.36Å; N22-N26 VanDerWaalsContact O-CG 3.27Å; N22-N26 PolarHBondContact O-N 3.09Å; N22-N26 PolarHBondContact O-ND2 3.36Å
23	N	46.8	Very low	52.7	Low	105 Å²	105	91.2 Å²	91.2	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-67.8	-35.1	176.6	-70.9	-13.3	0	0	0	112.8	L19 Q20 N26 S27	L19-N23 VanDerWaalsContact O-CB 3.23Å; L19-N23 WeakPolarHBondContact O-CB 2.94Å; L19-N23 PolarHBondContact O-N 3.05Å; L19-N23 PolarHBondContact O-ND2 2.94Å; Q20-N23 PolarHBondContact O-N 3.23Å; N23-N26 CarbonylContact O-C 3.58Å; N23-N26 PolarHBondContact O-N 3.31Å; N23-S27 PolarHBondContact O-N 3.34Å
24	A	46	Very low	50.3	Low	67 Å²	67	90.4 Å²	90.4	55%	0.554	51%	0.505	S	S	*	.	H	α-helix	trans	-67	-39.2	174.9	0	0	0	0	0	111.9	Q20 K21 N26 S27	Q20-A24 VanDerWaalsContact O-CB 3.27Å; Q20-A24 WeakPolarHBondContact O-CB 3.39Å; Q20-A24 PolarHBondContact O-N 3.4Å; K21-A24 PolarHBondContact O-N 3.27Å; A24-N26 VanDerWaalsContact C-N 3.31Å; A24-S27 PolarHBondContact O-OG 3.43Å
25	L	40.6	Very low	48.1	Very low	118 Å²	118	92.1 Å²	92.1	62%	0.618	51%	0.511	S	S	*	.	H	α-helix	trans	-70.4	-28.1	170.8	-66.8	166.5	0	0	0	112.3	K21 N22 R263	K21-L25 HydrophobicContact CG-CD1 4.45Å; K21-L25 WeakPolarHBondContact O-CG 3.5Å; K21-L25 PolarHBondContact O-N 2.88Å; N22-L25 PolarHBondContact O-N 2.85Å; L25-R263 PolarHBondContact O-NH1 2.81Å; L25-R263 VanDerWaalsContact O-NH1 3.16Å
26	N	34.4	Very low	46.5	Very low	88 Å²	88	88.9 Å²	88.9	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-92.4	3.9	179.8	-72.2	-26.1	0	0	0	116	N22 N23 A24 S28 S29 R263	N22-N26 WeakPolarHBondContact O-CB 3.36Å; N22-N26 VanDerWaalsContact O-CG 3.27Å; N22-N26 PolarHBondContact O-N 3.09Å; N22-N26 PolarHBondContact O-ND2 3.36Å; N23-N26 CarbonylContact O-C 3.58Å; N23-N26 PolarHBondContact O-N 3.31Å; A24-N26 VanDerWaalsContact C-N 3.31Å; N26-S28 PolarHBondContact O-N 3.24Å; N26-S29 PolarHBondContact O-N 3.02Å; N26-R263 PolarHBondContact OD1-NH2 2.85Å
27	S	31.3	Very low	44.9	Very low	99 Å²	99	91 Å²	91	69%	0.692	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	27.9	-179.1	63.2	0	0	0	0	115.5	N23 A24	N23-S27 PolarHBondContact O-N 3.34Å; A24-S27 PolarHBondContact O-OG 3.43Å
28	S	32.1	Very low	43.5	Very low	59 Å²	59	86 Å²	86	41%	0.413	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.9	17.8	167.9	44.8	0	0	0	0	116.2	N26 R263	N26-S28 PolarHBondContact O-N 3.24Å; S28-R263 VanDerWaalsContact C-CD 3.48Å; S28-R263 VanDerWaalsContact C-NE 3.27Å; S28-R263 WeakPolarHBondContact O-CD 3.11Å; S28-R263 WeakPolarHBondContact O-CG 3.47Å; S28-R263 PolarHBondContact O-NE 2.88Å; S28-R263 PolarHBondContact OG-NH1 3.4Å
29	S	37.2	Very low	42.5	Very low	41 Å²	41	84.3 Å²	84.3	29%	0.287	48%	0.477	S	S	.	.			trans	-135	120.4	165	49.6	0	0	0	0	114.7	N26 C31 R263	N26-S29 PolarHBondContact O-N 3.02Å; S29-C31 PolarHBondContact O-N 2.89Å; S29-R263 PolarHBondContact OG-NE 3.25Å; S29-R263 VanDerWaalsContact OG-NE 3.13Å; S29-R263 PolarHBondContact OG-NH2 3.38Å
30	D	27	Very low	41.7	Very low	176 Å²	176	85.6 Å²	85.6	94%	0.941	48%	0.478	S	S	*	.			trans	-78.9	75.2	156.7	-61.8	-43.2	0	0	0	110
31	C	33.1	Very low	40.4	Very low	64 Å²	64	81.8 Å²	81.8	43%	0.432	46%	0.464	S	S	.	.			trans	-161	100.9	169.8	162.6	0	0	0	0	107.2	S29	S29-C31 PolarHBondContact O-N 2.89Å
32	S	30.8	Very low	38.8	Very low	37 Å²	37	82.2 Å²	82.2	26%	0.259	47%	0.473	S	S	.	.			trans	-79.7	166	170.2	26.1	0	0	0	0	111.5	N231 S232 V233	S32-N231 WeakPolarHBondContact CB-OD1 3.41Å; S32-N231 WeakPolarHBondContact OG-CA 3.16Å; S32-N231 WeakPolarHBondContact OG-CB 3.48Å; S32-N231 VanDerWaalsContact OG-CG 3.3Å; S32-N231 PolarHBondContact OG-OD1 2.86Å; S32-S232 VanDerWaalsContact C-C 3.46Å; S32-S232 CarbonylContact C-O 3.57Å; S32-S232 PolarHBondContact N-OG 3.41Å; S32-S232 CarbonylContact O-C 3.54Å; S32-S232 WeakPolarHBondContact O-CA 3.37Å; S32-S232 VanDerWaalsContact O-CB 3.26Å; S32-S232 WeakPolarHBondContact O-CB 3.42Å; S32-S232 VanDerWaalsContact O-O 3.07Å; S32-S232 PolarHBondContact O-OG 3.33Å; S32-S232 PolarHBondContact OG-N 3.2Å; S32-V233 PolarHBondContact O-N 2.95Å
33	S	36.6	Very low	38.2	Very low	74 Å²	74	85.9 Å²	85.9	52%	0.517	49%	0.485	S	S	.	.			trans	-150.1	96.6	-159.9	29.1	0	0	0	0	114.9	S232 T234	S33-S232 CarbonylContact C-O 3.55Å; S33-S232 WeakPolarHBondContact CA-O 3.46Å; S33-S232 PolarHBondContact N-O 2.93Å; S33-S232 VanDerWaalsContact N-O 3.07Å; S33-T234 WeakPolarHBondContact CB-OG1 3.44Å
34	T	33.7	Very low	37.3	Very low	78 Å²	78	92 Å²	92	48%	0.479	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-88.5	147.8	159.2	-42.8	0	0	0	0	111.6	S232 V233 T234	T34-S232 PolarHBondContact N-O 2.85Å; T34-S232 PolarHBondContact OG1-O 3.17Å; T34-V233 CarbonylContact O-C 3.59Å; T34-V233 VanDerWaalsContact O-C 3.31Å; T34-V233 VanDerWaalsContact O-CA 3.22Å; T34-V233 WeakPolarHBondContact O-CA 3.39Å; T34-V233 WeakPolarHBondContact O-CG1 3.37Å; T34-T234 CarbonylContact O-C 3.5Å; T34-T234 PolarHBondContact O-N 3.36Å
35	L	35.3	Very low	36.5	Very low	104 Å²	104	96.6 Å²	96.6	55%	0.545	51%	0.514	S	S	.	.			trans	-94.5	147.9	174.6	-82.9	74.6	0	0	0	112.7	T234	L35-T234 WeakPolarHBondContact CA-O 3.37Å; L35-T234 WeakPolarHBondContact CG-O 3.47Å
36	T	41.9	Very low	35.9	Very low	10 Å²	10	99.4 Å²	99.4	6%	0.061	52%	0.524	C	S	.	.			trans	-134.1	118.9	165.6	58	0	0	0	0	109.8	V38 V233 V235 S413 L414	T36-V38 PolarHBondContact O-N 3.44Å; T36-V233 HydrophobicContact CG2-CG1 4.18Å; T36-V235 WeakPolarHBondContact O-CG1 3.15Å; T36-V235 WeakPolarHBondContact O-CG2 3.21Å; T36-V235 VanDerWaalsContact OG1-CG2 3.24Å; T36-V235 WeakPolarHBondContact OG1-CG2 3.15Å; T36-S413 WeakPolarHBondContact CG2-O 3.47Å; T36-L414 CarbonylContact C-O 3.4Å
37	H	43.5	Very low	35.6	Very low	134 Å²	134	99.9 Å²	99.9	62%	0.62	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	122.1	-176.7	-158.1	-89.3	0	0	0	110.4	L414 T415 V416	H37-L414 PolarHBondContact N-O 3.05Å; H37-T415 WeakPolarHBondContact O-CA 3.49Å; H37-V416 PolarHBondContact O-N 3.48Å
38	V	49.5	Very low	35.5	Very low	20 Å²	20	102 Å²	102	12%	0.121	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	111.1	177.5	-173.5	0	0	0	0	109.5	T36 L392 V416	T36-V38 PolarHBondContact O-N 3.44Å; V38-L392 HydrophobicContact CB-CD2 4.15Å; V38-L392 HydrophobicContact CG1-CD2 3.57Å; V38-L392 HydrophobicContact CG1-CG 4.11Å; V38-V416 WeakPolarHBondContact CA-O 3.48Å
39	T	48.3	Very low	35.2	Very low	46 Å²	46	108.6 Å²	108.6	28%	0.282	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.3	122	174.6	34.6	0	0	0	0	110	V416 H417 E418	T39-V416 PolarHBondContact N-O 3.02Å; T39-V416 VanDerWaalsContact N-O 3.15Å; T39-H417 PolarHBondContact OG1-CE1 3.41Å; T39-H417 VanDerWaalsContact OG1-CE1 3.32Å; T39-H417 PolarHBondContact OG1-ND1 2.96Å; T39-E418 PolarHBondContact O-N 3.06Å
40	K	46.8	Very low	34.8	Very low	128 Å²	128	112.5 Å²	112.5	56%	0.557	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.4	131	166.1	-77.3	-171.6	170.6	-173.2	0	109.4	L392 E418	K40-L392 HydrophobicContact CG-CD2 4.48Å; K40-E418 VanDerWaalsContact CE-OE2 3.28Å; K40-E418 WeakPolarHBondContact CE-OE2 3.41Å
41	T	40.7	Very low	34.7	Very low	44 Å²	44	110.9 Å²	110.9	27%	0.27	57%	0.57	S	S	.	*			trans	-104.2	109.1	170	43.1	0	0	0	0	110	Q419 Y429	T41-Q419 PolarHBondContact OG1-OE1 3.17Å; T41-Y429 WeakPolarHBondContact CG2-OH 3.41Å; T41-Y429 PolarHBondContact OG1-OH 3.07Å; T41-Y429 VanDerWaalsContact OG1-OH 3.07Å
42	D	33.9	Very low	34.5	Very low	158 Å²	158	114.1 Å²	114.1	85%	0.845	59%	0.587	S	S	*	*			trans	-68.7	142.6	173.3	-82.2	-44.2	0	0	0	111.6	R44	D42-R44 PolarHBondContact O-N 2.8Å
43	K	32.2	Very low	34.2	Very low	154 Å²	154	119.3 Å²	119.3	67%	0.67	61%	0.612	S	S	*	*	S	Bend	trans	-76.7	91.1	-177.2	-67.4	179.3	-178.2	173.7	0	111.5	N420	K43-N420 WeakPolarHBondContact CE-OD1 3.15Å; K43-N420 PolarHBondContact NZ-OD1 3.46Å
44	R	28	Very low	33.6	Very low	234 Å²	234	120.5 Å²	120.5	88%	0.883	62%	0.62	S	S	*	*			trans	-160.7	70.8	160.1	-122	177.8	-172.3	-179.3	2.8	114.1	D42	D42-R44 PolarHBondContact O-N 2.8Å
45	I	29.8	Very low	33.2	Very low	162 Å²	162	127.5 Å²	127.5	83%	0.831	64%	0.638	S	S	*	*			trans	-134.4	71.8	155.4	-50.4	-179.7	0	0	0	107.7
46	E	28.1	Very low	32.8	Very low	177 Å²	177	131.4 Å²	131.4	83%	0.827	65%	0.653	S	S	*	*			trans	-91.9	121.9	159.9	-80.2	-177.7	141.5	0	0	108
47	S	28	Very low	32.2	Very low	99 Å²	99	141.6 Å²	141.6	69%	0.692	69%	0.692	S	S	*	*			trans	38.9	92.4	153.4	61	0	0	0	0	118.9
48	D	28.3	Very low	32	Very low	142 Å²	142	143.7 Å²	143.7	76%	0.759	70%	0.702	S	S	*	*			trans	-122.4	57.3	152.9	-97.2	-41.8	0	0	0	110.4	N50	D48-N50 PolarHBondContact O-N 2.96Å; D48-N50 PolarHBondContact OD1-ND2 3.14Å
49	Y	26.1	Very low	32.3	Very low	199 Å²	199	146.1 Å²	146.1	78%	0.78	72%	0.72	S	S	*	*			trans	-74	74.7	162.1	-88.1	-79.1	0	0	0	109.1	T51	Y49-T51 PolarHBondContact O-N 2.94Å
50	N	28.8	Very low	32.6	Very low	123 Å²	123	144.9 Å²	144.9	66%	0.658	72%	0.716	S	S	*	*			trans	-83.1	96.8	173.3	-79.6	-60.2	0	0	0	110.2	D48 V52	D48-N50 PolarHBondContact O-N 2.96Å; D48-N50 PolarHBondContact OD1-ND2 3.14Å; N50-V52 PolarHBondContact O-N 3.41Å
51	T	25.3	Very low	33.2	Very low	142 Å²	142	146.9 Å²	146.9	87%	0.871	73%	0.725	S	S	*	*			trans	-50.3	113.2	169.4	-53.3	0	0	0	0	111.1	Y49	Y49-T51 PolarHBondContact O-N 2.94Å
52	V	27.9	Very low	34.1	Very low	131 Å²	131	145.5 Å²	145.5	79%	0.794	72%	0.718	S	S	*	*			trans	-103.9	137	165.8	-179.1	0	0	0	0	108.8	N50	N50-V52 PolarHBondContact O-N 3.41Å
53	D	25.2	Very low	35.8	Very low	147 Å²	147	142.3 Å²	142.3	79%	0.786	70%	0.704	S	S	*	*			trans	-64.6	142.9	-162.4	-163.6	1.6	0	0	0	114.2	R55	D53-R55 PolarHBondContact O-N 3.29Å
54	S	24	Very low	37.4	Very low	99 Å²	99	139.1 Å²	139.1	69%	0.692	69%	0.693	S	S	*	*			trans	-86.4	92.6	-173.2	-67.2	0	0	0	0	112.4
55	R	25.9	Very low	38.7	Very low	225 Å²	225	134.7 Å²	134.7	85%	0.849	68%	0.677	S	S	*	*			trans	-164.4	137.3	151.2	-90.7	122.6	-158.1	-140.8	6.4	111.2	D53	D53-R55 PolarHBondContact O-N 3.29Å
56	Q	27.3	Very low	39.4	Very low	185 Å²	185	132 Å²	132	86%	0.864	66%	0.664	S	S	*	*			trans	79.6	75.3	175.1	-52.3	-178	-0.1	0	0	117.3
57	Y	28.9	Very low	39.8	Very low	225 Å²	225	126.2 Å²	126.2	88%	0.882	65%	0.651	S	S	*	*			trans	-125.2	119.9	150.5	-87.8	-84	0	0	0	110.5
58	Q	39.8	Very low	40	Very low	178 Å²	178	128.5 Å²	128.5	83%	0.832	66%	0.656	S	S	*	*			trans	-125.6	123	165.1	-70.4	-177	-5.6	0	0	106.6
59	S	54.5	Low	40.1	Very low	70 Å²	70	129.3 Å²	129.3	49%	0.49	66%	0.655	S	S	.	*	S	Bend	trans	61.9	98.5	-172.7	166.3	0	0	0	0	114.7
60	G	55.4	Low	40.4	Very low	20 Å²	20	125.1 Å²	125.1	21%	0.206	66%	0.655	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.9	157.3	165.4	0	0	0	0	0	112.6	F475	G60-F475 WeakPolarHBondContact O-CD1 3.49Å; G60-F475 WeakPolarHBondContact O-CE1 3.46Å
61	K	59.9	Low	40.3	Very low	170 Å²	170	125.4 Å²	125.4	74%	0.739	67%	0.666	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.3	133.4	161.5	-78.1	-171.8	175.1	-174.4	0	108.7
62	A	59.4	Low	40.6	Very low	15 Å²	15	121.4 Å²	121.4	12%	0.124	64%	0.644	C	S	.	*	P	Polyproline II helix	trans	-74.4	132.9	176.1	0	0	0	0	0	110.1	I449 A451 F461 F475	A62-I449 HydrophobicContact CB-CB 4.45Å; A62-I449 HydrophobicContact CB-CD1 3.85Å; A62-A451 HydrophobicContact CB-CB 4.23Å; A62-F461 HydrophobicContact CB-CD1 4.37Å; A62-F461 HydrophobicContact CB-CE1 4.18Å; A62-F475 HydrophobicContact CB-CE1 4.29Å
63	V	69.8	Low	40.7	Very low	91 Å²	91	121.4 Å²	121.4	55%	0.552	65%	0.645	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.9	126.4	-179.9	-180	0	0	0	0	109.3	I449 T450	V63-I449 WeakPolarHBondContact O-CA 3.4Å; V63-T450 PolarHBondContact O-N 3.24Å
64	I	65.9	Low	41	Very low	88 Å²	88	120 Å²	120	45%	0.451	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.6	129.1	171.2	-58.2	172.2	0	0	0	108.4	Y448 I449	I64-Y448 WeakPolarHBondContact CA-O 3.2Å; I64-I449 HydrophobicContact CG1-CG2 3.9Å
65	R	55.3	Low	41.4	Very low	140 Å²	140	119.2 Å²	119.2	53%	0.528	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.7	127.2	168.2	-70.5	-173.4	175.1	-172.9	0.5	109.4	Y448	R65-Y448 HydrophobicContact CB-CE1 4.24Å; R65-Y448 HydrophobicContact CB-CE2 4.21Å; R65-Y448 PolarHBondContact N-O 2.93Å; R65-Y448 PolarHBondContact O-N 3.06Å; R65-Y448 VanDerWaalsContact O-N 3.15Å
66	N	43.3	Very low	41.9	Very low	107 Å²	107	116.8 Å²	116.8	57%	0.572	62%	0.624	S	S	*	*			trans	-76.3	147.2	163.1	-65.5	-15.1	0	0	0	108.3	D68	N66-D68 VanDerWaalsContact C-N 3.33Å; N66-D68 PolarHBondContact O-N 2.86Å
67	G	37.3	Very low	42.5	Very low	54 Å²	54	111.9 Å²	111.9	56%	0.557	61%	0.61	S	S	*	*			trans	-78.9	75.5	-175.2	0	0	0	0	0	112.7	H69	G67-H69 PolarHBondContact O-N 3.32Å; G67-H69 VanDerWaalsContact O-N 3.16Å
68	D	31.7	Very low	43.2	Very low	148 Å²	148	103.3 Å²	103.3	79%	0.791	58%	0.581	S	S	*	*			trans	-78.2	98.7	-178.7	-66.2	-25.2	0	0	0	112	N66	N66-D68 VanDerWaalsContact C-N 3.33Å; N66-D68 PolarHBondContact O-N 2.86Å
69	H	31.5	Very low	43.3	Very low	158 Å²	158	99.2 Å²	99.2	73%	0.731	57%	0.565	S	S	*	*			trans	-103.1	74.4	170.9	-77.5	-52.4	0	0	0	112.2	G67	G67-H69 PolarHBondContact O-N 3.32Å; G67-H69 VanDerWaalsContact O-N 3.16Å
70	S	31.7	Very low	43.1	Very low	112 Å²	112	100.1 Å²	100.1	78%	0.783	57%	0.565	S	S	*	*			trans	-168.6	115.7	156	54.6	0	0	0	0	113.5
71	S	27	Very low	42.4	Very low	128 Å²	128	102.9 Å²	102.9	90%	0.895	57%	0.574	S	S	*	*			trans	-105	84.3	161.8	60.5	0	0	0	0	110.1
72	S	30.8	Very low	41.6	Very low	58 Å²	58	98.9 Å²	98.9	41%	0.406	56%	0.561	S	S	.	*	S	Bend	trans	-157.8	136.5	165.9	-168.3	0	0	0	0	111.1	Q74 Y241	S72-Q74 PolarHBondContact O-N 2.84Å; S72-Y241 WeakPolarHBondContact OG-CE1 3.24Å
73	T	30.6	Very low	41.3	Very low	132 Å²	132	104.2 Å²	104.2	81%	0.81	58%	0.581	S	S	*	*			trans	-57.7	115.8	-173.6	41.6	0	0	0	0	113.2
74	Q	31.3	Very low	39.8	Very low	118 Å²	118	106.1 Å²	106.1	55%	0.551	59%	0.586	S	S	*	*			trans	-87.7	145.5	168	-79.1	-84.1	-25.3	0	0	110.4	S72	S72-Q74 PolarHBondContact O-N 2.84Å
75	P	31.8	Very low	38.7	Very low	82 Å²	82	106.7 Å²	106.7	53%	0.532	59%	0.589	S	S	.	*			trans	-67.2	150.1	176.3	29.7	-34.9	0	0	0	111.4	S77 V78	P75-S77 PolarHBondContact O-N 2.84Å; P75-V78 HydrophobicContact CG-CG2 4.4Å; P75-V78 PolarHBondContact O-N 3.36Å
76	E	36.5	Very low	38.3	Very low	174 Å²	174	104.6 Å²	104.6	81%	0.813	59%	0.592	S	S	*	*	H	α-helix	trans	-54.5	-28.7	-166.7	-62.6	178.3	137.5	0	0	114.2	V78 N79 D80	E76-V78 VanDerWaalsContact C-N 3.32Å; E76-V78 PolarHBondContact O-N 3.45Å; E76-N79 PolarHBondContact O-N 3.43Å; E76-D80 PolarHBondContact O-N 2.86Å
77	S	40.3	Very low	38.2	Very low	82 Å²	82	102 Å²	102	57%	0.573	59%	0.591	S	S	*	*	H	α-helix	trans	-65	-24.1	177.7	57.6	0	0	0	0	115.6	P75	P75-S77 PolarHBondContact O-N 2.84Å
78	V	42.6	Very low	38	Very low	45 Å²	45	105 Å²	105	27%	0.273	59%	0.594	S	S	.	*	H	α-helix	trans	-85.5	-28.5	177.7	-178.4	0	0	0	0	110.9	P75 E76 D80 L81 N82	P75-V78 HydrophobicContact CG-CG2 4.4Å; P75-V78 PolarHBondContact O-N 3.36Å; E76-V78 VanDerWaalsContact C-N 3.32Å; E76-V78 PolarHBondContact O-N 3.45Å; V78-D80 VanDerWaalsContact C-N 3.32Å; V78-D80 PolarHBondContact O-N 3.17Å; V78-L81 PolarHBondContact O-N 2.97Å; V78-N82 PolarHBondContact O-N 2.92Å
79	N	42.5	Very low	38.1	Very low	92 Å²	92	104.7 Å²	104.7	49%	0.492	59%	0.592	S	S	.	*	H	α-helix	trans	-70.5	-31.4	176.9	-150.5	24.6	0	0	0	111.5	E76 K83	E76-N79 PolarHBondContact O-N 3.43Å; N79-K83 WeakPolarHBondContact O-CB 3.36Å; N79-K83 VanDerWaalsContact O-CG 3.27Å; N79-K83 WeakPolarHBondContact O-CG 3.37Å; N79-K83 PolarHBondContact O-N 2.99Å
80	D	49.9	Very low	38.2	Very low	89 Å²	89	104 Å²	104	48%	0.476	59%	0.593	S	S	.	*	H	α-helix	trans	-72.9	-35	172.1	-72	-20.2	0	0	0	112.7	E76 V78 K83 M84	E76-D80 PolarHBondContact O-N 2.86Å; V78-D80 VanDerWaalsContact C-N 3.32Å; V78-D80 PolarHBondContact O-N 3.17Å; D80-K83 PolarHBondContact O-N 2.92Å; D80-M84 WeakPolarHBondContact O-CB 3.43Å; D80-M84 VanDerWaalsContact O-CG 3.3Å; D80-M84 WeakPolarHBondContact O-CG 3.18Å; D80-M84 PolarHBondContact O-N 3.33Å
81	L	40.9	Very low	38.1	Very low	78 Å²	78	106.4 Å²	106.4	41%	0.408	59%	0.59	S	S	.	*	H	α-helix	trans	-64.9	-44.8	170.9	-85.6	166.1	0	0	0	111.8	V78 K83 M84 L85	V78-L81 PolarHBondContact O-N 2.97Å; L81-K83 PolarHBondContact O-N 3.25Å; L81-M84 PolarHBondContact O-N 3.32Å; L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 WeakPolarHBondContact O-CG 3.28Å; L81-L85 PolarHBondContact O-N 3.39Å
82	N	43.5	Very low	38.3	Very low	86 Å²	86	108.4 Å²	108.4	46%	0.46	59%	0.591	S	S	.	*	H	α-helix	trans	-64.5	-39.4	176	-75.4	-12	0	0	0	111.7	V78 M84 L85 T86	V78-N82 PolarHBondContact O-N 2.92Å; N82-M84 VanDerWaalsContact C-N 3.35Å; N82-M84 PolarHBondContact O-N 3.03Å; N82-L85 PolarHBondContact O-N 2.91Å; N82-T86 WeakPolarHBondContact O-CG2 3.36Å; N82-T86 PolarHBondContact O-N 2.95Å; N82-T86 PolarHBondContact O-OG1 3.09Å; N82-T86 VanDerWaalsContact O-OG1 3.06Å
83	K	52.5	Low	38.2	Very low	126 Å²	126	114.1 Å²	114.1	55%	0.548	61%	0.605	S	S	.	*	H	α-helix	trans	-61	-40.9	171.4	-77.3	171.2	-174.9	169.6	0	112.7	N79 D80 L81 T86 G87	N79-K83 WeakPolarHBondContact O-CB 3.36Å; N79-K83 VanDerWaalsContact O-CG 3.27Å; N79-K83 WeakPolarHBondContact O-CG 3.37Å; N79-K83 PolarHBondContact O-N 2.99Å; D80-K83 PolarHBondContact O-N 2.92Å; L81-K83 PolarHBondContact O-N 3.25Å; K83-T86 WeakPolarHBondContact CA-OG1 2.96Å; K83-T86 PolarHBondContact O-OG1 2.96Å; K83-T86 VanDerWaalsContact O-OG1 3.05Å; K83-G87 PolarHBondContact O-N 3.16Å
84	M	38.3	Very low	38	Very low	131 Å²	131	115.7 Å²	115.7	65%	0.645	61%	0.607	S	S	*	*	H	α-helix	trans	-65.7	-37.8	175.3	-75.4	-179.5	177	0	0	112.2	D80 L81 N82 G87	D80-M84 WeakPolarHBondContact O-CB 3.43Å; D80-M84 VanDerWaalsContact O-CG 3.3Å; D80-M84 WeakPolarHBondContact O-CG 3.18Å; D80-M84 PolarHBondContact O-N 3.33Å; L81-M84 PolarHBondContact O-N 3.32Å; N82-M84 VanDerWaalsContact C-N 3.35Å; N82-M84 PolarHBondContact O-N 3.03Å; M84-G87 PolarHBondContact O-N 3.31Å
85	L	43.3	Very low	38	Very low	100 Å²	100	117.5 Å²	117.5	52%	0.524	62%	0.615	S	S	.	*	H	α-helix	trans	-72.6	-42	177.9	-72.2	162.2	0	0	0	112.2	L81 N82 G87 L88	L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 WeakPolarHBondContact O-CG 3.28Å; L81-L85 PolarHBondContact O-N 3.39Å; N82-L85 PolarHBondContact O-N 2.91Å; L85-G87 PolarHBondContact O-N 2.88Å; L85-L88 HydrophobicContact CD2-CD1 4.46Å; L85-L88 WeakPolarHBondContact O-CB 3.45Å; L85-L88 PolarHBondContact O-N 2.75Å
86	T	47	Very low	37.7	Very low	97 Å²	97	119.8 Å²	119.8	60%	0.595	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-11.2	174.5	55	0	0	0	0	114	N82 K83	N82-T86 WeakPolarHBondContact O-CG2 3.36Å; N82-T86 PolarHBondContact O-N 2.95Å; N82-T86 PolarHBondContact O-OG1 3.09Å; N82-T86 VanDerWaalsContact O-OG1 3.06Å; K83-T86 WeakPolarHBondContact CA-OG1 2.96Å; K83-T86 PolarHBondContact O-OG1 2.96Å; K83-T86 VanDerWaalsContact O-OG1 3.05Å
87	G	40.2	Very low	37.4	Very low	53 Å²	53	118.6 Å²	118.6	55%	0.546	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.8	-7.1	171.6	0	0	0	0	0	114.6	K83 M84 L85	K83-G87 PolarHBondContact O-N 3.16Å; M84-G87 PolarHBondContact O-N 3.31Å; L85-G87 PolarHBondContact O-N 2.88Å
88	L	34.7	Very low	37	Very low	117 Å²	117	123.5 Å²	123.5	61%	0.613	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-16.8	-175.5	-61.6	172.8	0	0	0	113.5	L85 N90	L85-L88 HydrophobicContact CD2-CD1 4.46Å; L85-L88 WeakPolarHBondContact O-CB 3.45Å; L85-L88 PolarHBondContact O-N 2.75Å; L88-N90 PolarHBondContact O-N 3.46Å; L88-N90 VanDerWaalsContact O-N 3.13Å
89	D	33.6	Very low	36.3	Very low	141 Å²	141	129.1 Å²	129.1	75%	0.754	67%	0.668	S	S	*	*	S	Bend	trans	-82.4	25.5	-178.6	-69.9	-30.8	0	0	0	114.6
90	N	33	Very low	35.6	Very low	142 Å²	142	130.2 Å²	130.2	76%	0.759	68%	0.68	S	S	*	*			trans	-137.5	70.1	177.6	-83.2	-56.2	0	0	0	111.8	L88	L88-N90 PolarHBondContact O-N 3.46Å; L88-N90 VanDerWaalsContact O-N 3.13Å
91	F	30.8	Very low	34.8	Very low	163 Å²	163	135.6 Å²	135.6	72%	0.715	70%	0.702	S	S	*	*			trans	-130.3	73.7	168.5	-94.6	-90.5	0	0	0	111.5	Y93	F91-Y93 AromaticContact CD1-CD2 3.78Å; F91-Y93 HydrophobicContact CD1-CD2 3.78Å; F91-Y93 AromaticContact CD1-CE2 3.91Å; F91-Y93 HydrophobicContact CD1-CE2 3.91Å; F91-Y93 HydrophobicContact CE1-CD2 4.32Å; F91-Y93 AromaticContact CE1-CE2 3.98Å; F91-Y93 HydrophobicContact CE1-CE2 3.98Å; F91-Y93 PolarHBondContact O-N 2.87Å
92	D	30.4	Very low	34.2	Very low	171 Å²	171	136.2 Å²	136.2	91%	0.914	72%	0.718	S	S	*	*			trans	-70.4	102	158.4	-96.7	-28.4	0	0	0	108.6
93	Y	29	Very low	33.5	Very low	178 Å²	178	141.2 Å²	141.2	70%	0.698	73%	0.732	S	S	*	*			trans	-112.5	99.8	167.7	-108.2	-101.6	0	0	0	110.4	F91 H95	F91-Y93 AromaticContact CD1-CD2 3.78Å; F91-Y93 HydrophobicContact CD1-CD2 3.78Å; F91-Y93 AromaticContact CD1-CE2 3.91Å; F91-Y93 HydrophobicContact CD1-CE2 3.91Å; F91-Y93 HydrophobicContact CE1-CD2 4.32Å; F91-Y93 AromaticContact CE1-CE2 3.98Å; F91-Y93 HydrophobicContact CE1-CE2 3.98Å; F91-Y93 PolarHBondContact O-N 2.87Å; Y93-H95 AromaticContact CD1-CE1 3.78Å; Y93-H95 AromaticContact CD1-ND1 3.98Å; Y93-H95 PolarHBondContact O-N 3.11Å
94	L	26.6	Very low	32.5	Very low	164 Å²	164	142.9 Å²	142.9	86%	0.859	74%	0.74	S	S	*	*			trans	-67.4	126.2	160.4	-72.6	162.9	0	0	0	108.4
95	H	30.5	Very low	32	Very low	157 Å²	157	139.6 Å²	139.6	73%	0.727	74%	0.739	S	S	*	*			trans	-112.4	116.1	160.7	-91.3	18.6	0	0	0	108.8	Y93	Y93-H95 AromaticContact CD1-CE1 3.78Å; Y93-H95 AromaticContact CD1-ND1 3.98Å; Y93-H95 PolarHBondContact O-N 3.11Å
96	T	25.8	Very low	31.4	Very low	129 Å²	129	143.1 Å²	143.1	79%	0.791	75%	0.751	S	S	*	*			trans	-99.5	115.6	173.5	48.9	0	0	0	0	108.7
97	D	29.6	Very low	30.7	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	76%	0.762	S	S	*	*			trans	-133.7	114.7	164.2	-82.3	-52.2	0	0	0	108.6
98	E	32	Very low	29.9	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	77%	0.773	S	S	*	*			trans	169.5	93.2	130.7	-91.3	-174.6	-177.4	0	0	112.3
99	I	27.9	Very low	29.8	Very low	164 Å²	164	153.3 Å²	153.3	84%	0.841	79%	0.786	S	S	*	*				53.9	136.1	129.2	-61	175.8	0	0	0	120.4
100	P	28.4	Very low	29.6	Very low	114 Å²	114	152.7 Å²	152.7	74%	0.74	78%	0.782	S	S	*	*			trans	-114.7	154.2	-154.9	39.7	-27.6	0	0	0	116.1
101	Q	32.3	Very low	29.6	Very low	202 Å²	202	152.2 Å²	152.2	94%	0.944	78%	0.78	S	S	*	*			trans	-135.5	128.7	159.4	-70.8	-167.1	-4.1	0	0	113.9
102	A	29	Very low	29.7	Very low	91 Å²	91	152.3 Å²	152.3	75%	0.752	78%	0.782	S	S	*	*			trans	-36.5	152.8	176.4	0	0	0	0	0	118.6
103	Y	28.2	Very low	29.8	Very low	191 Å²	191	149.4 Å²	149.4	75%	0.749	78%	0.776	S	S	*	*				175	120.6	89.8	-147.5	-109.6	0	0	0	112.5
104	F	31.1	Very low	30	Very low	161 Å²	161	147.7 Å²	147.7	71%	0.706	77%	0.774	S	S	*	*			trans	57.6	145.4	156.8	-73.7	-129	0	0	0	119.4
105	G	29.2	Very low	30.3	Very low	62 Å²	62	150.7 Å²	150.7	64%	0.639	77%	0.774	S	S	*	*			cis	161.2	147.1	-4.9	0	0	0	0	0	112.5
106	F	29.3	Very low	30.3	Very low	174 Å²	174	146.5 Å²	146.5	76%	0.763	77%	0.773	S	S	*	*			trans	89.1	96.2	162.8	-61	-78.8	0	0	0	122.5
107	K	32.5	Very low	30.7	Very low	189 Å²	189	149.3 Å²	149.3	82%	0.822	78%	0.777	S	S	*	*				80.2	110.6	121	-76.7	-175.3	177.9	-176.1	0	122.3
108	L	24.4	Very low	30.9	Very low	151 Å²	151	146.5 Å²	146.5	79%	0.791	77%	0.769	S	S	*	*			trans	-58.6	152.7	146.4	-65.2	148	0	0	0	113.3
109	T	32.7	Very low	30.9	Very low	142 Å²	142	146.7 Å²	146.7	87%	0.871	77%	0.77	S	S	*	*			trans	-152.4	126.8	133.4	46.7	0	0	0	0	110.4
110	D	29.6	Very low	31.2	Very low	128 Å²	128	143.2 Å²	143.2	68%	0.684	77%	0.765	S	S	*	*			trans	-70.3	157.7	170.1	-56	-80.5	0	0	0	113
111	N	32.8	Very low	31.1	Very low	132 Å²	132	143.9 Å²	143.9	71%	0.706	77%	0.768	S	S	*	*				176.7	121.1	111.7	-91.5	-51.9	0	0	0	115.1
112	Q	31.8	Very low	31	Very low	165 Å²	165	140.3 Å²	140.3	77%	0.771	76%	0.762	S	S	*	*				60.9	140.7	127.8	-60.5	177.4	22.9	0	0	123.7
113	S	34.1	Very low	30.9	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	76%	0.76	S	S	*	*			trans	104.3	135.6	154.8	-50.7	0	0	0	0	116.6
114	E	33.3	Very low	30.9	Very low	142 Å²	142	144.4 Å²	144.4	66%	0.664	77%	0.768	S	S	*	*			cis	-168	150.9	-21.3	-135.5	-171.4	-145.1	0	0	108.9
115	R	30.9	Very low	30.7	Very low	227 Å²	227	143.8 Å²	143.8	86%	0.857	77%	0.767	S	S	*	*			trans	66	141.2	164.6	-53.1	170.5	-162.1	-158.6	-0.4	118.4
116	G	31.7	Very low	30.6	Very low	69 Å²	69	148.3 Å²	148.3	71%	0.711	78%	0.775	S	S	*	*			cis	171.6	171.3	-6.7	0	0	0	0	0	113.4
117	Q	34.6	Very low	30.5	Very low	188 Å²	188	146.3 Å²	146.3	88%	0.879	77%	0.772	S	S	*	*			trans	75.4	105.9	172	-59.5	174.4	5	0	0	116.5
118	S	34	Very low	30.1	Very low	91 Å²	91	143.7 Å²	143.7	64%	0.636	77%	0.773	S	S	*	*				81.9	129.4	53.3	74	0	0	0	0	113.4
119	H	30.8	Very low	30.4	Very low	187 Å²	187	141.9 Å²	141.9	87%	0.866	77%	0.772	S	S	*	*			cis	-152.1	-175.9	2.4	-87.4	-52.6	0	0	0	108
120	A	34.7	Very low	30	Very low	91 Å²	91	141.7 Å²	141.7	75%	0.752	77%	0.772	S	S	*	*			cis	-154.7	167.7	11.2	0	0	0	0	0	112.1
121	T	25.6	Very low	30.1	Very low	129 Å²	129	141.2 Å²	141.2	79%	0.791	78%	0.778	S	S	*	*			trans	-147.9	148.5	164.2	40.3	0	0	0	0	110.1
122	P	31.7	Very low	30	Very low	127 Å²	127	140.4 Å²	140.4	83%	0.825	78%	0.778	S	S	*	*			trans	-91.9	134.1	168.9	2.4	17.4	0	0	0	112.1
123	N	26.3	Very low	30.2	Very low	134 Å²	134	140.5 Å²	140.5	72%	0.717	78%	0.783	S	S	*	*			trans	-78.5	156.4	170.6	-81.9	-28.3	0	0	0	112.2
124	Y	27.5	Very low	30	Very low	233 Å²	233	141.4 Å²	141.4	91%	0.914	78%	0.78	S	S	*	*			trans	-126.2	122	145.9	-92.7	-84.6	0	0	0	110.1
125	H	27.4	Very low	30.2	Very low	148 Å²	148	144 Å²	144	69%	0.685	79%	0.791	S	S	*	*			trans	-82.6	146.1	172.1	-99.9	-105.3	0	0	0	110.4	N127	H125-N127 PolarHBondContact ND1-OD1 3.08Å
126	I	26.7	Very low	30.2	Very low	157 Å²	157	138.1 Å²	138.1	81%	0.805	79%	0.785	S	S	*	*			trans	-116	119.5	155.6	-61.9	177	0	0	0	106.5
127	N	27.2	Very low	30.2	Very low	132 Å²	132	142.7 Å²	142.7	71%	0.706	79%	0.788	S	S	*	*			trans	-103	122.3	173.5	-78.5	-2.7	0	0	0	109.3	H125	H125-N127 PolarHBondContact ND1-OD1 3.08Å
128	T	23.8	Very low	30	Very low	135 Å²	135	141.1 Å²	141.1	83%	0.828	79%	0.785	S	S	*	*			trans	-104.3	113.9	168.9	-19.9	0	0	0	0	108
129	S	30.6	Very low	29.9	Very low	112 Å²	112	140.2 Å²	140.2	78%	0.783	79%	0.791	S	S	*	*			trans	-133.6	110.1	173.6	-66.4	0	0	0	0	110.2
130	T	25.7	Very low	29.8	Very low	139 Å²	139	140 Å²	140	85%	0.853	80%	0.795	S	S	*	*			trans	-71.4	136.5	167.7	47.5	0	0	0	0	110.9
131	S	31.8	Very low	30	Very low	118 Å²	118	140.6 Å²	140.6	83%	0.825	79%	0.794	S	S	*	*			trans	-138.5	122.8	155.1	57.2	0	0	0	0	109.8
132	V	30.4	Very low	30.4	Very low	115 Å²	115	141.5 Å²	141.5	70%	0.697	80%	0.799	S	S	*	*			trans	-74.5	141.4	174.7	-179.4	0	0	0	0	108.7
133	D	36.3	Very low	30.6	Very low	166 Å²	166	140.2 Å²	140.2	89%	0.888	79%	0.785	S	S	*	*			trans	-145.8	127.2	146.9	-95.8	-40.6	0	0	0	110.1
134	N	28.5	Very low	31.3	Very low	129 Å²	129	140.2 Å²	140.2	69%	0.69	78%	0.78	S	S	*	*			trans	-88.1	139.9	174	-65.5	-72	0	0	0	108.7
135	H	37.6	Very low	32.1	Very low	197 Å²	197	133.3 Å²	133.3	91%	0.912	76%	0.764	S	S	*	*			trans	-155.9	148.9	136.8	-96.3	-55.5	0	0	0	112.1
136	S	30.8	Very low	33.5	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	76%	0.76	S	S	*	*			trans	-84.4	171.8	-156.4	-43.9	0	0	0	0	116.2
137	E	31.6	Very low	35.2	Very low	166 Å²	166	130 Å²	130	78%	0.776	75%	0.747	S	S	*	*			trans	91.5	112.2	149.1	-72.9	177.6	-156.2	0	0	121.4
138	N	30.9	Very low	37	Very low	154 Å²	154	130 Å²	130	82%	0.824	74%	0.743	S	S	*	*			trans	58.7	89.1	132	-60.2	-29.5	0	0	0	119.1
139	G	32.7	Very low	39.1	Very low	73 Å²	73	128.1 Å²	128.1	75%	0.753	73%	0.732	S	S	*	*			trans	-146.2	85.5	168.5	0	0	0	0	0	113.4	S141	G139-S141 PolarHBondContact O-N 3.41Å
140	L	29	Very low	40.7	Very low	181 Å²	181	129 Å²	129	95%	0.948	73%	0.725	S	S	*	*			trans	-63.2	118.1	172.4	-178	72	0	0	0	109.8
141	S	37.5	Very low	42.9	Very low	104 Å²	104	127.3 Å²	127.3	73%	0.727	71%	0.71	S	S	*	*			trans	-152.3	128.3	174.9	-80.3	0	0	0	0	113.1	G139 L143	G139-S141 PolarHBondContact O-N 3.41Å; S141-L143 PolarHBondContact O-N 3Å
142	T	33.6	Very low	44.8	Very low	149 Å²	149	124.6 Å²	124.6	91%	0.914	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-65.7	118.2	-169.4	-35.8	0	0	0	0	112.4
143	L	36.5	Very low	46.6	Very low	99 Å²	99	121.4 Å²	121.4	52%	0.518	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-74.8	133.1	172.6	-84.3	157.4	0	0	0	110.9	S141 K147	S141-L143 PolarHBondContact O-N 3Å; L143-K147 HydrophobicContact CD2-CD 3.85Å; L143-K147 HydrophobicContact CD2-CG 4.38Å
144	H	41.4	Very low	48.4	Very low	134 Å²	134	119.1 Å²	119.1	62%	0.62	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-61.8	136.8	179.1	-157.1	-90.8	0	0	0	110.6	N146 K147	H144-N146 VanDerWaalsContact C-N 3.26Å; H144-N146 PolarHBondContact O-N 3.26Å; H144-K147 PolarHBondContact O-N 2.85Å
145	P	44.1	Very low	50.8	Low	89 Å²	89	116.4 Å²	116.4	58%	0.578	65%	0.646	S	S	*	*	H	α-helix	trans	-48.8	-43.8	-171.2	-31.4	35.2	0	0	0	114.3	K147 Q148 T149	P145-K147 VanDerWaalsContact C-N 3.29Å; P145-K147 PolarHBondContact O-N 3.33Å; P145-Q148 PolarHBondContact O-N 2.9Å; P145-Q148 VanDerWaalsContact O-N 3.15Å; P145-T149 PolarHBondContact O-N 3.23Å; P145-T149 PolarHBondContact O-OG1 3Å
146	N	57.1	Low	52.6	Low	112 Å²	112	109.4 Å²	109.4	60%	0.599	62%	0.622	S	S	*	*	H	α-helix	trans	-58	-35.4	-179.6	-60.5	5.4	0	0	0	113.5	H144 T149 M150	H144-N146 VanDerWaalsContact C-N 3.26Å; H144-N146 PolarHBondContact O-N 3.26Å; N146-T149 PolarHBondContact O-N 3.44Å; N146-M150 WeakPolarHBondContact O-CG 3.36Å; N146-M150 PolarHBondContact O-N 3.38Å
147	K	62.3	Low	54.5	Low	122 Å²	122	110.4 Å²	110.4	53%	0.53	62%	0.615	S	S	.	*	H	α-helix	trans	-73.4	-34.7	-179.3	-170.1	166.7	177.2	-178.3	0	111.4	L143 H144 P145 L151	L143-K147 HydrophobicContact CD2-CD 3.85Å; L143-K147 HydrophobicContact CD2-CG 4.38Å; H144-K147 PolarHBondContact O-N 2.85Å; P145-K147 VanDerWaalsContact C-N 3.29Å; P145-K147 PolarHBondContact O-N 3.33Å; K147-L151 HydrophobicContact CG-CD1 4.48Å; K147-L151 VanDerWaalsContact O-CG 3.32Å; K147-L151 WeakPolarHBondContact O-CG 3.47Å; K147-L151 PolarHBondContact O-N 3.07Å
148	Q	65.2	Low	56.9	Low	132 Å²	132	108.4 Å²	108.4	62%	0.617	60%	0.601	S	S	*	*	H	α-helix	trans	-72.3	-36.6	174.6	-164.9	160.4	5.3	0	0	111.6	P145 L151 A152	P145-Q148 PolarHBondContact O-N 2.9Å; P145-Q148 VanDerWaalsContact O-N 3.15Å; Q148-L151 PolarHBondContact O-N 2.87Å; Q148-A152 WeakPolarHBondContact O-CB 3.4Å; Q148-A152 PolarHBondContact O-N 3.29Å
149	T	68.2	Low	59.2	Low	97 Å²	97	105.8 Å²	105.8	60%	0.595	58%	0.584	S	S	*	*	H	α-helix	trans	-61.5	-44.7	170.6	-52.9	0	0	0	0	112.1	P145 N146 A152 A153	P145-T149 PolarHBondContact O-N 3.23Å; P145-T149 PolarHBondContact O-OG1 3Å; N146-T149 PolarHBondContact O-N 3.44Å; T149-A152 PolarHBondContact O-N 3.24Å; T149-A153 WeakPolarHBondContact O-CB 3.28Å; T149-A153 PolarHBondContact O-N 3.43Å
150	M	63.8	Low	61.3	Low	130 Å²	130	106.6 Å²	106.6	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-65.7	-37.7	176.9	-70.8	-153.8	-45.7	0	0	113.2	N146 A153 K154	N146-M150 WeakPolarHBondContact O-CG 3.36Å; N146-M150 PolarHBondContact O-N 3.38Å; M150-A153 PolarHBondContact O-N 3.4Å; M150-K154 PolarHBondContact O-N 3.12Å
151	L	71.8	Confident	63.4	Low	103 Å²	103	103 Å²	103	54%	0.539	56%	0.555	S	S	.	*	H	α-helix	trans	-66.3	-40.5	175.5	-72.9	169.4	0	0	0	111.5	K147 Q148 K154 E155	K147-L151 HydrophobicContact CG-CD1 4.48Å; K147-L151 VanDerWaalsContact O-CG 3.32Å; K147-L151 WeakPolarHBondContact O-CG 3.47Å; K147-L151 PolarHBondContact O-N 3.07Å; Q148-L151 PolarHBondContact O-N 2.87Å; L151-K154 PolarHBondContact O-N 3.42Å; L151-E155 WeakPolarHBondContact O-CB 3.19Å; L151-E155 PolarHBondContact O-N 3.37Å
152	A	71.8	Confident	65.3	Low	62 Å²	62	101.9 Å²	101.9	51%	0.512	54%	0.541	S	S	.	.	H	α-helix	trans	-65.3	-37.2	174.4	0	0	0	0	0	112.6	Q148 T149 A156	Q148-A152 WeakPolarHBondContact O-CB 3.4Å; Q148-A152 PolarHBondContact O-N 3.29Å; T149-A152 PolarHBondContact O-N 3.24Å; A152-A156 WeakPolarHBondContact O-CB 3.37Å; A152-A156 PolarHBondContact O-N 3.26Å
153	A	69.2	Low	67.4	Low	47 Å²	47	99.3 Å²	99.3	39%	0.388	52%	0.521	S	S	.	.	H	α-helix	trans	-64.6	-47.8	175	0	0	0	0	0	111.9	T149 M150 E155 A156 E157	T149-A153 WeakPolarHBondContact O-CB 3.28Å; T149-A153 PolarHBondContact O-N 3.43Å; M150-A153 PolarHBondContact O-N 3.4Å; A153-E155 VanDerWaalsContact C-N 3.33Å; A153-E155 PolarHBondContact O-N 3.38Å; A153-A156 WeakPolarHBondContact O-CB 3.22Å; A153-A156 PolarHBondContact O-N 3.11Å; A153-A156 VanDerWaalsContact O-N 3.15Å; A153-E157 WeakPolarHBondContact O-CG 3.38Å; A153-E157 PolarHBondContact O-N 2.86Å
154	K	73.3	Confident	69.3	Low	118 Å²	118	100 Å²	100	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-61.9	-37.7	177	-76	-165.8	170.3	-158.7	0	113.4	M150 L151 R158	M150-K154 PolarHBondContact O-N 3.12Å; L151-K154 PolarHBondContact O-N 3.42Å; K154-R158 PolarHBondContact O-N 3.32Å; K154-R158 VanDerWaalsContact O-N 3.08Å
155	E	78.5	Confident	70.7	Confident	73 Å²	73	100.7 Å²	100.7	34%	0.341	52%	0.523	S	S	.	.	H	α-helix	trans	-70.6	-34.6	176	-179.1	55.8	-159.7	0	0	111.6	L151 A153 R158 Q159	L151-E155 WeakPolarHBondContact O-CB 3.19Å; L151-E155 PolarHBondContact O-N 3.37Å; A153-E155 VanDerWaalsContact C-N 3.33Å; A153-E155 PolarHBondContact O-N 3.38Å; E155-R158 PolarHBondContact O-N 2.85Å; E155-R158 IonicContact OE1-CZ 3.86Å; E155-R158 IonicContact OE1-NE 3.82Å; E155-R158 IonicContact OE1-NH2 3.61Å; E155-R158 PolarHBondContact OE1-NH2 3.25Å; E155-R158 IonicContact OE2-CZ 2.7Å; E155-R158 IonicContact OE2-NE 3.17Å; E155-R158 PolarHBondContact OE2-NE 2.8Å; E155-R158 IonicContact OE2-NH2 3.88Å; E155-R158 PolarHBondContact OE2-NH2 3.38Å; E155-Q159 WeakPolarHBondContact O-CB 3.31Å; E155-Q159 VanDerWaalsContact O-CG 3.24Å; E155-Q159 WeakPolarHBondContact O-CG 3.46Å; E155-Q159 PolarHBondContact O-N 3.26Å; E155-Q159 PolarHBondContact OE1-NE2 3.24Å
156	A	75.6	Confident	72.1	Confident	49 Å²	49	99.9 Å²	99.9	41%	0.405	52%	0.519	S	S	.	.	H	α-helix	trans	-67.2	-39.9	172.8	0	0	0	0	0	112.6	A152 A153 Q159 V160	A152-A156 WeakPolarHBondContact O-CB 3.37Å; A152-A156 PolarHBondContact O-N 3.26Å; A153-A156 WeakPolarHBondContact O-CB 3.22Å; A153-A156 PolarHBondContact O-N 3.11Å; A153-A156 VanDerWaalsContact O-N 3.15Å; A156-Q159 PolarHBondContact O-N 3.27Å; A156-V160 WeakPolarHBondContact O-CG2 3.27Å; A156-V160 PolarHBondContact O-N 2.9Å
157	E	71.2	Confident	72.5	Confident	125 Å²	125	99.6 Å²	99.6	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-58.3	-50.7	172.5	-72.8	168.4	168.8	0	0	110.8	A153 Q159 V160 D161	A153-E157 WeakPolarHBondContact O-CG 3.38Å; A153-E157 PolarHBondContact O-N 2.86Å; E157-Q159 VanDerWaalsContact C-N 3.3Å; E157-Q159 PolarHBondContact O-N 3.34Å; E157-V160 WeakPolarHBondContact O-CB 3.23Å; E157-V160 PolarHBondContact O-N 2.9Å; E157-D161 PolarHBondContact O-N 2.86Å; E157-D161 VanDerWaalsContact O-N 3.09Å
158	R	82.1	Confident	72.9	Confident	124 Å²	124	100.8 Å²	100.8	47%	0.468	52%	0.523	S	S	.	.	H	α-helix	trans	-56.4	-42.2	176.9	-166.6	-179	75.7	75.6	2.6	112.6	K154 E155 V160 D161 D162	K154-R158 PolarHBondContact O-N 3.32Å; K154-R158 VanDerWaalsContact O-N 3.08Å; E155-R158 PolarHBondContact O-N 2.85Å; E155-R158 IonicContact OE1-CZ 3.86Å; E155-R158 IonicContact OE1-NE 3.82Å; E155-R158 IonicContact OE1-NH2 3.61Å; E155-R158 PolarHBondContact OE1-NH2 3.25Å; E155-R158 IonicContact OE2-CZ 2.7Å; E155-R158 IonicContact OE2-NE 3.17Å; E155-R158 PolarHBondContact OE2-NE 2.8Å; E155-R158 IonicContact OE2-NH2 3.88Å; E155-R158 PolarHBondContact OE2-NH2 3.38Å; R158-V160 VanDerWaalsContact C-N 3.34Å; R158-V160 PolarHBondContact O-N 3.37Å; R158-D161 PolarHBondContact O-N 2.84Å; R158-D162 IonicContact CZ-OD2 3.35Å; R158-D162 IonicContact NH1-OD2 3.61Å; R158-D162 PolarHBondContact NH1-OD2 3.49Å; R158-D162 PolarHBondContact O-N 3.38Å
159	Q	79.5	Confident	72.9	Confident	99 Å²	99	97.7 Å²	97.7	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-67.9	-30.4	177.9	-73.6	172.4	14.5	0	0	113.2	E155 A156 E157 L163	E155-Q159 WeakPolarHBondContact O-CB 3.31Å; E155-Q159 VanDerWaalsContact O-CG 3.24Å; E155-Q159 WeakPolarHBondContact O-CG 3.46Å; E155-Q159 PolarHBondContact O-N 3.26Å; E155-Q159 PolarHBondContact OE1-NE2 3.24Å; A156-Q159 PolarHBondContact O-N 3.27Å; E157-Q159 VanDerWaalsContact C-N 3.3Å; E157-Q159 PolarHBondContact O-N 3.34Å; Q159-L163 WeakPolarHBondContact O-CB 3.49Å; Q159-L163 PolarHBondContact O-N 3.32Å
160	V	75.9	Confident	72.5	Confident	89 Å²	89	99.9 Å²	99.9	54%	0.539	51%	0.51	S	S	.	.	H	α-helix	trans	-70	-42.7	173.5	169.3	0	0	0	0	110.8	A156 E157 R158 L163 L164	A156-V160 WeakPolarHBondContact O-CG2 3.27Å; A156-V160 PolarHBondContact O-N 2.9Å; E157-V160 WeakPolarHBondContact O-CB 3.23Å; E157-V160 PolarHBondContact O-N 2.9Å; R158-V160 VanDerWaalsContact C-N 3.34Å; R158-V160 PolarHBondContact O-N 3.37Å; V160-L163 WeakPolarHBondContact O-CB 3.22Å; V160-L163 PolarHBondContact O-N 2.89Å; V160-L164 WeakPolarHBondContact O-CB 3.44Å; V160-L164 PolarHBondContact O-N 3.24Å
161	D	73.5	Confident	72.1	Confident	105 Å²	105	100.3 Å²	100.3	56%	0.561	51%	0.508	S	S	*	.	H	α-helix	trans	-66.5	-43.4	177.9	-74.6	-25.5	0	0	0	112.4	E157 R158 L163 L164 Y165	E157-D161 PolarHBondContact O-N 2.86Å; E157-D161 VanDerWaalsContact O-N 3.09Å; R158-D161 PolarHBondContact O-N 2.84Å; D161-L163 VanDerWaalsContact C-N 3.25Å; D161-L163 PolarHBondContact O-N 3.08Å; D161-L164 PolarHBondContact O-N 3.35Å; D161-L164 VanDerWaalsContact O-N 3.15Å; D161-Y165 WeakPolarHBondContact O-CB 3.33Å; D161-Y165 PolarHBondContact O-N 2.94Å
162	D	77.4	Confident	71.5	Confident	82 Å²	82	99.6 Å²	99.6	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-57.9	-39	173.6	-77.4	-20.2	0	0	0	111	R158 S166	R158-D162 IonicContact CZ-OD2 3.35Å; R158-D162 IonicContact NH1-OD2 3.61Å; R158-D162 PolarHBondContact NH1-OD2 3.49Å; R158-D162 PolarHBondContact O-N 3.38Å; D162-S166 WeakPolarHBondContact O-CB 3.19Å; D162-S166 PolarHBondContact O-N 3.2Å; D162-S166 PolarHBondContact O-OG 2.76Å
163	L	77	Confident	70.6	Confident	94 Å²	94	102.4 Å²	102.4	49%	0.492	51%	0.51	S	S	.	.	H	α-helix	trans	-68.1	-43.2	174.6	-110.7	163.4	0	0	0	112.5	Q159 V160 D161 Y165 S166 L167	Q159-L163 WeakPolarHBondContact O-CB 3.49Å; Q159-L163 PolarHBondContact O-N 3.32Å; V160-L163 WeakPolarHBondContact O-CB 3.22Å; V160-L163 PolarHBondContact O-N 2.89Å; D161-L163 VanDerWaalsContact C-N 3.25Å; D161-L163 PolarHBondContact O-N 3.08Å; L163-Y165 VanDerWaalsContact C-N 3.35Å; L163-S166 PolarHBondContact O-N 3.34Å; L163-L167 HydrophobicContact CD2-CD1 4.4Å; L163-L167 WeakPolarHBondContact O-CB 3.43Å; L163-L167 WeakPolarHBondContact O-CG 3.4Å; L163-L167 PolarHBondContact O-N 2.99Å
164	L	75.7	Confident	69.6	Low	115 Å²	115	104.6 Å²	104.6	60%	0.602	52%	0.516	S	S	*	.	H	α-helix	trans	-65.4	-40.6	-179.8	-148.3	82.4	0	0	0	111	V160 D161 K168	V160-L164 WeakPolarHBondContact O-CB 3.44Å; V160-L164 PolarHBondContact O-N 3.24Å; D161-L164 PolarHBondContact O-N 3.35Å; D161-L164 VanDerWaalsContact O-N 3.15Å; L164-K168 WeakPolarHBondContact O-CB 3.43Å; L164-K168 PolarHBondContact O-N 3.32Å
165	Y	72.2	Confident	68.4	Low	147 Å²	147	105.9 Å²	105.9	58%	0.576	52%	0.523	S	S	*	.	H	α-helix	trans	-61.9	-49.1	172.1	-175.2	-91.9	0	0	0	111.5	D161 L163 L167 K168 Q169	D161-Y165 WeakPolarHBondContact O-CB 3.33Å; D161-Y165 PolarHBondContact O-N 2.94Å; L163-Y165 VanDerWaalsContact C-N 3.35Å; Y165-L167 VanDerWaalsContact C-N 3.34Å; Y165-L167 PolarHBondContact O-N 3.07Å; Y165-K168 WeakPolarHBondContact O-CB 3.28Å; Y165-K168 PolarHBondContact O-N 2.8Å; Y165-K168 VanDerWaalsContact O-N 3.11Å; Y165-Q169 HydrophobicContact CD1-CG 4.06Å; Y165-Q169 HydrophobicContact CE1-CG 3.66Å; Y165-Q169 VanDerWaalsContact CZ-NE2 3.34Å; Y165-Q169 WeakPolarHBondContact O-CG 3.2Å; Y165-Q169 PolarHBondContact O-N 3.27Å; Y165-Q169 PolarHBondContact OH-NE2 2.84Å
166	S	73.8	Confident	66.6	Low	72 Å²	72	111.1 Å²	111.1	50%	0.503	55%	0.547	S	S	.	.	H	α-helix	trans	-59.7	-42.8	178.5	-59	0	0	0	0	112.2	D162 L163 Q169 F170	D162-S166 WeakPolarHBondContact O-CB 3.19Å; D162-S166 PolarHBondContact O-N 3.2Å; D162-S166 PolarHBondContact O-OG 2.76Å; L163-S166 PolarHBondContact O-N 3.34Å; S166-Q169 PolarHBondContact O-N 2.79Å; S166-F170 WeakPolarHBondContact O-CB 3.46Å; S166-F170 PolarHBondContact O-N 3.16Å
167	L	63.8	Low	64.7	Low	107 Å²	107	113.4 Å²	113.4	56%	0.56	56%	0.56	S	S	*	*	H	α-helix	trans	-64.7	-38.1	174.8	-76.1	167	0	0	0	112.2	L163 Y165 F170 K171	L163-L167 HydrophobicContact CD2-CD1 4.4Å; L163-L167 WeakPolarHBondContact O-CB 3.43Å; L163-L167 WeakPolarHBondContact O-CG 3.4Å; L163-L167 PolarHBondContact O-N 2.99Å; Y165-L167 VanDerWaalsContact C-N 3.34Å; Y165-L167 PolarHBondContact O-N 3.07Å; L167-F170 PolarHBondContact O-N 3.36Å; L167-K171 WeakPolarHBondContact O-CB 3.38Å; L167-K171 PolarHBondContact O-N 2.62Å
168	K	71.6	Confident	62.7	Low	146 Å²	146	115.2 Å²	115.2	64%	0.635	57%	0.574	S	S	*	*	H	α-helix	trans	-66.3	-42.8	176.8	-168.1	176.2	-178.5	-177.7	0	111.4	L164 Y165 K171 I172	L164-K168 WeakPolarHBondContact O-CB 3.43Å; L164-K168 PolarHBondContact O-N 3.32Å; Y165-K168 WeakPolarHBondContact O-CB 3.28Å; Y165-K168 PolarHBondContact O-N 2.8Å; Y165-K168 VanDerWaalsContact O-N 3.11Å; K168-K171 PolarHBondContact O-N 2.93Å; K168-I172 HydrophobicContact CG-CD1 4.34Å; K168-I172 WeakPolarHBondContact O-CG1 3.38Å; K168-I172 PolarHBondContact O-N 3.48Å
169	Q	66.4	Low	60.4	Low	67 Å²	67	114.9 Å²	114.9	31%	0.313	59%	0.591	S	S	.	*	H	α-helix	trans	-66.2	-41.4	174.7	-66	-65.5	16.3	0	0	112.1	Y165 S166 K171 I172 N173	Y165-Q169 HydrophobicContact CD1-CG 4.06Å; Y165-Q169 HydrophobicContact CE1-CG 3.66Å; Y165-Q169 VanDerWaalsContact CZ-NE2 3.34Å; Y165-Q169 WeakPolarHBondContact O-CG 3.2Å; Y165-Q169 PolarHBondContact O-N 3.27Å; Y165-Q169 PolarHBondContact OH-NE2 2.84Å; S166-Q169 PolarHBondContact O-N 2.79Å; Q169-K171 VanDerWaalsContact C-N 3.27Å; Q169-K171 PolarHBondContact O-N 3.07Å; Q169-I172 PolarHBondContact O-N 2.76Å; Q169-N173 PolarHBondContact O-N 3.13Å
170	F	58.4	Low	58	Low	143 Å²	143	113.6 Å²	113.6	63%	0.627	61%	0.605	S	S	*	*	H	α-helix	trans	-61.2	-36.5	173.4	-167.3	-98.7	0	0	0	112	S166 L167 N174	S166-F170 WeakPolarHBondContact O-CB 3.46Å; S166-F170 PolarHBondContact O-N 3.16Å; L167-F170 PolarHBondContact O-N 3.36Å; F170-N174 WeakPolarHBondContact CD1-ND2 3.31Å; F170-N174 VanDerWaalsContact CE1-ND2 3.28Å; F170-N174 WeakPolarHBondContact CE1-ND2 3.44Å; F170-N174 VanDerWaalsContact CZ-ND2 3.34Å; F170-N174 WeakPolarHBondContact CZ-ND2 3.19Å; F170-N174 PolarHBondContact O-N 3.36Å; F170-N174 PolarHBondContact O-ND2 2.84Å
171	K	54.9	Low	55.9	Low	139 Å²	139	114.5 Å²	114.5	60%	0.604	62%	0.621	S	S	*	*	H	α-helix	trans	-68.9	-36.5	174.7	-172.4	172.1	-177.4	178.3	0	113	L167 K168 Q169 H175	L167-K171 WeakPolarHBondContact O-CB 3.38Å; L167-K171 PolarHBondContact O-N 2.62Å; K168-K171 PolarHBondContact O-N 2.93Å; Q169-K171 VanDerWaalsContact C-N 3.27Å; Q169-K171 PolarHBondContact O-N 3.07Å; K171-H175 PolarHBondContact O-CD2 2.93Å; K171-H175 VanDerWaalsContact O-CD2 3.3Å
172	I	59.1	Low	53.9	Low	88 Å²	88	118.1 Å²	118.1	45%	0.451	64%	0.635	S	S	.	*	H	α-helix	trans	-67.7	-48.2	176.9	-69.8	163.1	0	0	0	110.4	K168 Q169 N174 H175	K168-I172 HydrophobicContact CG-CD1 4.34Å; K168-I172 WeakPolarHBondContact O-CG1 3.38Å; K168-I172 PolarHBondContact O-N 3.48Å; Q169-I172 PolarHBondContact O-N 2.76Å; I172-N174 PolarHBondContact O-N 2.92Å; I172-H175 PolarHBondContact O-N 3.17Å
173	N	53	Low	51.6	Low	121 Å²	121	121.8 Å²	121.8	65%	0.647	65%	0.654	S	S	*	*	H	α-helix	trans	-67.4	-19.7	-175.7	-67.3	-10	0	0	0	114.2	Q169	Q169-N173 PolarHBondContact O-N 3.13Å
174	N	48	Very low	49.3	Very low	94 Å²	94	125.8 Å²	125.8	50%	0.503	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.9	-1	178.6	-74.4	-70.2	0	0	0	114.6	F170 I172	F170-N174 WeakPolarHBondContact CD1-ND2 3.31Å; F170-N174 VanDerWaalsContact CE1-ND2 3.28Å; F170-N174 WeakPolarHBondContact CE1-ND2 3.44Å; F170-N174 VanDerWaalsContact CZ-ND2 3.34Å; F170-N174 WeakPolarHBondContact CZ-ND2 3.19Å; F170-N174 PolarHBondContact O-N 3.36Å; F170-N174 PolarHBondContact O-ND2 2.84Å; I172-N174 PolarHBondContact O-N 2.92Å
175	H	49.5	Very low	47.1	Very low	145 Å²	145	126.9 Å²	126.9	67%	0.671	68%	0.68	S	S	*	*			trans	-105.5	15.1	-175.7	-94.4	-54	0	0	0	115.1	K171 I172	K171-H175 PolarHBondContact O-CD2 2.93Å; K171-H175 VanDerWaalsContact O-CD2 3.3Å; I172-H175 PolarHBondContact O-N 3.17Å
176	Q	40.7	Very low	45.1	Very low	182 Å²	182	124.5 Å²	124.5	85%	0.85	68%	0.677	S	S	*	*	S	Bend	trans	-91.7	8.4	177.7	-75	-170.7	-15.5	0	0	115.1
177	S	34.2	Very low	42.9	Very low	97 Å²	97	129.3 Å²	129.3	68%	0.678	70%	0.695	S	S	*	*	S	Bend	trans	-126	121.7	177.7	49.6	0	0	0	0	114.2
178	D	31.1	Very low	41.3	Very low	163 Å²	163	129.5 Å²	129.5	87%	0.872	71%	0.705	S	S	*	*			trans	62.5	128.2	164.3	-81.1	-39.8	0	0	0	122.4
179	S	32.6	Very low	39.3	Very low	117 Å²	117	128.5 Å²	128.5	82%	0.818	71%	0.707	S	S	*	*			trans	-77.6	129.6	161.6	53.8	0	0	0	0	111.2
180	G	29.2	Very low	37.5	Very low	73 Å²	73	130.5 Å²	130.5	75%	0.753	73%	0.728	S	S	*	*			trans	150.9	136	159.3	0	0	0	0	0	115.6
181	A	31.2	Very low	36.1	Very low	107 Å²	107	129.9 Å²	129.9	88%	0.884	74%	0.736	S	S	*	*			trans	69.7	144.9	163.8	0	0	0	0	0	119
182	E	31.3	Very low	35.1	Very low	181 Å²	181	128.5 Å²	128.5	85%	0.846	74%	0.739	S	S	*	*			trans	-67.7	172.9	168.1	-59	163.5	119	0	0	111
183	L	29.2	Very low	33.7	Very low	160 Å²	160	130.5 Å²	130.5	84%	0.838	75%	0.751	S	S	*	*			trans	83.8	88.1	179.6	-52.7	164.3	0	0	0	115.8
184	L	28.7	Very low	32.7	Very low	178 Å²	178	131.8 Å²	131.8	93%	0.932	76%	0.758	S	S	*	*				-152.8	94.2	122.6	-98.5	-173.8	0	0	0	110.2
185	I	31.2	Very low	31.9	Very low	138 Å²	138	131.6 Å²	131.6	71%	0.708	76%	0.764	S	S	*	*			trans	-80.7	151.4	164	-75.7	168.6	0	0	0	108.2
186	N	29.3	Very low	30.9	Very low	97 Å²	97	131.8 Å²	131.8	52%	0.519	77%	0.768	S	S	.	*			trans	73.1	88.1	170.7	-60.9	-20	0	0	0	119.4	N189	N186-N189 WeakPolarHBondContact CB-O 3.4Å; N186-N189 PolarHBondContact ND2-O 3.05Å; N186-N189 PolarHBondContact OD1-O 2.88Å
187	I	28.5	Very low	30.5	Very low	173 Å²	173	127.3 Å²	127.3	89%	0.887	76%	0.757	S	S	*	*	S	Bend		-128.9	65.9	117.6	-53.3	-176.5	0	0	0	108.2
188	S	29.4	Very low	30.5	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	76%	0.757	S	S	*	*	S	Bend	trans	-167.8	44.3	161.2	-78.3	0	0	0	0	108.9
189	N	28.7	Very low	30.5	Very low	125 Å²	125	126.6 Å²	126.6	67%	0.668	74%	0.744	S	S	*	*			trans	172.8	109.6	170	-90.5	-30.2	0	0	0	108	N186	N186-N189 WeakPolarHBondContact CB-O 3.4Å; N186-N189 PolarHBondContact ND2-O 3.05Å; N186-N189 PolarHBondContact OD1-O 2.88Å
190	S	29.1	Very low	30.6	Very low	109 Å²	109	128.2 Å²	128.2	76%	0.762	74%	0.739	S	S	*	*			trans	-157.9	82	176.2	61.9	0	0	0	0	112.5
191	V	29.7	Very low	31	Very low	131 Å²	131	130.6 Å²	130.6	79%	0.794	73%	0.73	S	S	*	*			trans	-142.4	93	156.8	180	0	0	0	0	107.8
192	T	33.8	Very low	31.1	Very low	110 Å²	110	134.7 Å²	134.7	68%	0.675	72%	0.723	S	S	*	*			trans	47.4	150.4	142.3	68	0	0	0	0	121.2
193	D	29.4	Very low	31.2	Very low	130 Å²	130	132.7 Å²	132.7	70%	0.695	72%	0.718	S	S	*	*			cis	179.3	162.3	-25.8	-103	-43.6	0	0	0	106.4
194	N	31.6	Very low	31.3	Very low	147 Å²	147	129.4 Å²	129.4	79%	0.786	71%	0.709	S	S	*	*			trans	68.8	152.7	163.1	-55	-49.4	0	0	0	118.5
195	S	31.3	Very low	31.6	Very low	90 Å²	90	131.9 Å²	131.9	63%	0.629	71%	0.705	S	S	*	*			cis	-177.9	145.6	-36	-103.7	0	0	0	0	108.7
196	I	29.1	Very low	31.9	Very low	149 Å²	149	131.9 Å²	131.9	76%	0.764	71%	0.712	S	S	*	*			trans	71.6	114.5	149.1	-64.8	165.6	0	0	0	119.6
197	S	31.4	Very low	32.2	Very low	89 Å²	89	133.1 Å²	133.1	62%	0.622	73%	0.725	S	S	*	*			trans	52.3	145	139.2	88.6	0	0	0	0	121.4
198	D	34.2	Very low	32.5	Very low	127 Å²	127	129.6 Å²	129.6	68%	0.679	72%	0.716	S	S	*	*			cis	-164.6	146.5	37	-94.4	-55.7	0	0	0	114.6
199	I	31.1	Very low	32.9	Very low	118 Å²	118	131.2 Å²	131.2	61%	0.605	71%	0.711	S	S	*	*			trans	36.1	113.3	136.7	-38.9	166.1	0	0	0	121.3
200	H	35.7	Very low	33.1	Very low	150 Å²	150	133.4 Å²	133.4	69%	0.694	72%	0.715	S	S	*	*				170	112.8	111.9	-93.3	-71.5	0	0	0	110.1
201	Q	36.3	Very low	33.3	Very low	124 Å²	124	133 Å²	133	58%	0.579	71%	0.712	S	S	*	*				54.6	129.9	98.3	-63.9	-175.8	24.6	0	0	114.5
202	R	33.3	Very low	33.3	Very low	193 Å²	193	131.5 Å²	131.5	73%	0.728	71%	0.708	S	S	*	*			cis	-168.5	145.3	21	-127.9	177.3	-87.5	152.4	-9.3	110.6
203	N	33.1	Very low	33.2	Very low	138 Å²	138	132.9 Å²	132.9	74%	0.738	72%	0.716	S	S	*	*			trans	61.4	156.7	148.7	-59.5	-7	0	0	0	120.5
204	S	32.2	Very low	33	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	72%	0.72	S	S	*	*			cis	-175	153.4	-25.2	-82.3	0	0	0	0	108.8
205	R	35.1	Very low	33	Very low	230 Å²	230	131 Å²	131	87%	0.868	72%	0.719	S	S	*	*			trans	75.6	96.2	160	-65.6	168.3	-175.5	-156.3	-0.9	120.2
206	T	38	Very low	32.8	Very low	137 Å²	137	133.3 Å²	133.3	84%	0.84	73%	0.725	S	S	*	*				40.1	152.9	113.8	45.4	0	0	0	0	123
207	P	36	Very low	32.9	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	73%	0.731	S	S	*	*			trans	-119	171.4	-138.9	43.1	-34.1	0	0	0	116.1
208	S	34.6	Very low	32.8	Very low	99 Å²	99	141.2 Å²	141.2	69%	0.692	74%	0.738	S	S	*	*			trans	-160	116.3	162	171.4	0	0	0	0	114.3
209	Q	36.4	Very low	32.4	Very low	145 Å²	145	142.8 Å²	142.8	68%	0.678	74%	0.739	S	S	*	*			trans	63.5	123.8	142.1	-62.1	-168.8	42.5	0	0	122.9
210	K	34.4	Very low	32.3	Very low	170 Å²	170	145.2 Å²	145.2	74%	0.739	75%	0.753	S	S	*	*				86.5	118.6	128.4	-76.3	172.8	-179.4	156.5	0	121.7
211	S	32.6	Very low	31.9	Very low	100 Å²	100	142.5 Å²	142.5	70%	0.699	75%	0.747	S	S	*	*			trans	71	102.1	132.8	61.2	0	0	0	0	120.8
212	S	29.1	Very low	31.4	Very low	101 Å²	101	143.5 Å²	143.5	71%	0.706	76%	0.756	S	S	*	*				52	111	128.2	61.6	0	0	0	0	119.9
213	T	32.1	Very low	31.2	Very low	138 Å²	138	139.5 Å²	139.5	85%	0.847	76%	0.758	S	S	*	*				-165.5	144.1	108.2	12	0	0	0	0	114
214	T	26	Very low	30.9	Very low	126 Å²	126	137.8 Å²	137.8	77%	0.773	76%	0.757	S	S	*	*			trans	-31.7	133.5	164.2	-38.9	0	0	0	0	116.7
215	S	32	Very low	30.6	Very low	112 Å²	112	139.2 Å²	139.2	78%	0.783	76%	0.762	S	S	*	*				176.5	149.5	121.8	45.2	0	0	0	0	115.3
216	N	27	Very low	30.2	Very low	139 Å²	139	136.2 Å²	136.2	74%	0.743	76%	0.763	S	S	*	*			trans	-68.3	141.1	-173	-47.3	-65.8	0	0	0	115.8
217	Y	30	Very low	29.6	Very low	229 Å²	229	135 Å²	135	90%	0.898	76%	0.761	S	S	*	*			trans	-153.4	102.7	141.3	-81	-76	0	0	0	106.9
218	K	29.9	Very low	29.3	Very low	174 Å²	174	136.6 Å²	136.6	76%	0.757	76%	0.76	S	S	*	*				53.3	108	80.7	-86.9	-155.3	170.7	-177.3	0	116.1
219	F	25.8	Very low	28.9	Very low	161 Å²	161	138.6 Å²	138.6	71%	0.706	76%	0.764	S	S	*	*			trans	50.4	126.7	146.3	-68.5	-86.8	0	0	0	120.6	T221	F219-T221 HydrophobicContact CD1-CG2 4.33Å
220	D	29.6	Very low	28.6	Very low	168 Å²	168	138.3 Å²	138.3	90%	0.898	77%	0.766	S	S	*	*				-149.5	160.1	111.8	-97.3	-33.8	0	0	0	111.2
221	T	26.4	Very low	28.3	Very low	94 Å²	94	135.8 Å²	135.8	58%	0.577	76%	0.761	S	S	*	*			trans	-118.3	165.9	-161.8	46.2	0	0	0	0	114.9	F219	F219-T221 HydrophobicContact CD1-CG2 4.33Å
222	N	25.8	Very low	28.2	Very low	144 Å²	144	132.6 Å²	132.6	77%	0.77	74%	0.739	S	S	*	*			trans	75.6	123.8	167.4	-48	-35.7	0	0	0	115.3
223	S	28.4	Very low	28.3	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	72%	0.717	S	S	*	*				-168.7	147.7	55.9	-61	0	0	0	0	114
224	S	28	Very low	28.2	Very low	102 Å²	102	124.6 Å²	124.6	71%	0.713	69%	0.685	S	S	*	*			trans	61.3	97.9	142.9	-53.4	0	0	0	0	122.1
225	T	25.7	Very low	28.5	Very low	122 Å²	122	119.5 Å²	119.5	75%	0.748	65%	0.654	S	S	*	*				53.4	110.8	128.7	59.4	0	0	0	0	120.9
226	N	27.1	Very low	28.3	Very low	167 Å²	167	120.6 Å²	120.6	89%	0.893	65%	0.651	S	S	*	*				-155.8	134.7	114.8	-103.1	-22.2	0	0	0	111.2
227	S	25.2	Very low	28.5	Very low	113 Å²	113	117.6 Å²	117.6	79%	0.79	63%	0.634	S	S	*	*			trans	-90	132.6	-170.5	-58	0	0	0	0	112.5
228	I	28.7	Very low	28.3	Very low	155 Å²	155	114.4 Å²	114.4	80%	0.795	63%	0.633	S	S	*	*			trans	-121.6	114.5	161.9	-61.9	-179.9	0	0	0	108.1	N230	I228-N230 PolarHBondContact O-N 3.41Å
229	N	26.7	Very low	28.4	Very low	142 Å²	142	111.4 Å²	111.4	76%	0.759	63%	0.634	S	S	*	*			trans	-69.2	121	178.6	-79.3	-22.8	0	0	0	110.4
230	N	29.2	Very low	28.4	Very low	138 Å²	138	110.4 Å²	110.4	74%	0.738	64%	0.636	S	S	*	*			trans	-123.7	120.3	162.4	-89.6	-27	0	0	0	109.8	I228	I228-N230 PolarHBondContact O-N 3.41Å
231	N	28.6	Very low	28.3	Very low	118 Å²	118	109.7 Å²	109.7	63%	0.631	62%	0.622	S	S	*	*			trans	-78	148	-166.6	-80.3	-43.4	0	0	0	112.8	S32	S32-N231 WeakPolarHBondContact CB-OD1 3.41Å; S32-N231 WeakPolarHBondContact OG-CA 3.16Å; S32-N231 WeakPolarHBondContact OG-CB 3.48Å; S32-N231 VanDerWaalsContact OG-CG 3.3Å; S32-N231 PolarHBondContact OG-OD1 2.86Å
232	S	31.1	Very low	28.3	Very low	32 Å²	32	113.5 Å²	113.5	22%	0.224	64%	0.638	C	S	.	*			trans	-83.9	-177.6	-173.2	45.8	0	0	0	0	114.4	S32 S33 T34	S32-S232 VanDerWaalsContact C-C 3.46Å; S32-S232 CarbonylContact C-O 3.57Å; S32-S232 PolarHBondContact N-OG 3.41Å; S32-S232 CarbonylContact O-C 3.54Å; S32-S232 WeakPolarHBondContact O-CA 3.37Å; S32-S232 VanDerWaalsContact O-CB 3.26Å; S32-S232 WeakPolarHBondContact O-CB 3.42Å; S32-S232 VanDerWaalsContact O-O 3.07Å; S32-S232 PolarHBondContact O-OG 3.33Å; S32-S232 PolarHBondContact OG-N 3.2Å; S33-S232 CarbonylContact C-O 3.55Å; S33-S232 WeakPolarHBondContact CA-O 3.46Å; S33-S232 PolarHBondContact N-O 2.93Å; S33-S232 VanDerWaalsContact N-O 3.07Å; T34-S232 PolarHBondContact N-O 2.85Å; T34-S232 PolarHBondContact OG1-O 3.17Å
233	V	31.6	Very low	28.4	Very low	43 Å²	43	117 Å²	117	26%	0.261	64%	0.642	S	S	.	*	B	Isolated β-bridge	trans	-134.1	120.6	-160.6	-177.6	0	0	0	0	110.1	S32 T34 T36	S32-V233 PolarHBondContact O-N 2.95Å; T34-V233 CarbonylContact O-C 3.59Å; T34-V233 VanDerWaalsContact O-C 3.31Å; T34-V233 VanDerWaalsContact O-CA 3.22Å; T34-V233 WeakPolarHBondContact O-CA 3.39Å; T34-V233 WeakPolarHBondContact O-CG1 3.37Å; T36-V233 HydrophobicContact CG2-CG1 4.18Å
234	T	28.6	Very low	28.4	Very low	28 Å²	28	119 Å²	119	17%	0.172	65%	0.645	C	S	.	*	B	Isolated β-bridge	trans	-121.5	131.1	171.1	61.2	0	0	0	0	111.3	S33 T34 L35	S33-T234 WeakPolarHBondContact CB-OG1 3.44Å; T34-T234 CarbonylContact O-C 3.5Å; T34-T234 PolarHBondContact O-N 3.36Å; L35-T234 WeakPolarHBondContact CA-O 3.37Å; L35-T234 WeakPolarHBondContact CG-O 3.47Å
235	V	32.4	Very low	28.6	Very low	19 Å²	19	122.5 Å²	122.5	12%	0.115	65%	0.65	C	S	.	*			trans	-104.6	117.1	171	-169.2	0	0	0	0	109.6	T36 I237 L390	T36-V235 WeakPolarHBondContact O-CG1 3.15Å; T36-V235 WeakPolarHBondContact O-CG2 3.21Å; T36-V235 VanDerWaalsContact OG1-CG2 3.24Å; T36-V235 WeakPolarHBondContact OG1-CG2 3.15Å; V235-I237 HydrophobicContact CG1-CD1 4.48Å; V235-I237 HydrophobicContact CG1-CG1 3.78Å; V235-I237 PolarHBondContact O-N 3.22Å; V235-L390 WeakPolarHBondContact CG2-O 3.06Å
236	D	27.7	Very low	28.7	Very low	135 Å²	135	124.6 Å²	124.6	72%	0.722	65%	0.651	S	S	*	*			trans	-80.7	109	163.1	-73.9	-41.5	0	0	0	109.1
237	I	31.4	Very low	28.9	Very low	76 Å²	76	125.9 Å²	125.9	39%	0.39	65%	0.651	S	S	.	*			trans	-97.2	103.1	170	-59.3	177.4	0	0	0	107.4	V235 S239 L392	V235-I237 HydrophobicContact CG1-CD1 4.48Å; V235-I237 HydrophobicContact CG1-CG1 3.78Å; V235-I237 PolarHBondContact O-N 3.22Å; I237-S239 VanDerWaalsContact C-N 3.3Å; I237-S239 PolarHBondContact O-N 3.14Å; I237-L392 HydrophobicContact CD1-CD2 3.93Å
238	N	27.2	Very low	28.9	Very low	162 Å²	162	127.5 Å²	127.5	87%	0.866	65%	0.651	S	S	*	*			trans	-69.2	85.8	171.9	-109	-11.5	0	0	0	110.1	N240	N238-N240 PolarHBondContact O-N 2.78Å; N238-N240 VanDerWaalsContact O-N 3.16Å
239	S	31	Very low	29.1	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	65%	0.653	S	S	*	*			trans	-79.5	91.2	173.2	57.1	0	0	0	0	110.3	I237	I237-S239 VanDerWaalsContact C-N 3.3Å; I237-S239 PolarHBondContact O-N 3.14Å
240	N	25.3	Very low	29.1	Very low	139 Å²	139	131.3 Å²	131.3	74%	0.743	66%	0.662	S	S	*	*			trans	-125.9	64.1	179	-160.7	31.1	0	0	0	111.7	N238	N238-N240 PolarHBondContact O-N 2.78Å; N238-N240 VanDerWaalsContact O-N 3.16Å
241	Y	28.8	Very low	29.1	Very low	154 Å²	154	131.5 Å²	131.5	60%	0.604	66%	0.662	S	S	*	*			trans	-137.5	134.7	172	-73.1	-63.5	0	0	0	112.5	S72	S72-Y241 WeakPolarHBondContact OG-CE1 3.24Å
242	N	26.7	Very low	29.1	Very low	173 Å²	173	134.7 Å²	134.7	93%	0.925	67%	0.673	S	S	*	*			trans	-65.3	148.6	-173.9	-91.2	-33.9	0	0	0	113.2
243	Y	28	Very low	29	Very low	217 Å²	217	141.7 Å²	141.7	85%	0.851	70%	0.702	S	S	*	*			trans	-109	114.8	179	-140.5	-81.3	0	0	0	109.3
244	D	27.7	Very low	28.9	Very low	152 Å²	152	145.3 Å²	145.3	81%	0.813	72%	0.72	S	S	*	*			trans	-149.7	94.2	169.4	-109.9	-31.3	0	0	0	110.1
245	Q	31.3	Very low	29	Very low	176 Å²	176	149.5 Å²	149.5	82%	0.822	75%	0.745	S	S	*	*				-178.5	144.5	128.1	-98.6	164.5	51.7	0	0	112.6
246	H	27.6	Very low	29.1	Very low	166 Å²	166	153.8 Å²	153.8	77%	0.769	77%	0.768	S	S	*	*			trans	-56.1	131.6	-175.1	-66.1	-99.3	0	0	0	114.3
247	H	32.2	Very low	29.5	Very low	193 Å²	193	152.9 Å²	152.9	89%	0.894	76%	0.763	S	S	*	*			trans	-150	122	135.9	-106	-62.3	0	0	0	110.8	N249	H247-N249 PolarHBondContact O-N 3.18Å
248	D	26.1	Very low	29.7	Very low	148 Å²	148	157 Å²	157	79%	0.791	79%	0.785	S	S	*	*			trans	-64.2	114.6	179.4	-70.1	-76.4	0	0	0	112.3
249	N	31.4	Very low	30.1	Very low	156 Å²	156	154.9 Å²	154.9	83%	0.834	77%	0.773	S	S	*	*			trans	-154.2	117.8	150.7	-98.3	-48.8	0	0	0	110.3	H247 I251	H247-N249 PolarHBondContact O-N 3.18Å; N249-I251 PolarHBondContact O-N 2.95Å
250	K	27.3	Very low	30.6	Very low	220 Å²	220	153 Å²	153	96%	0.957	76%	0.757	S	S	*	*			trans	-65.4	102.1	178.6	-77.4	177	174.4	174.1	0	110.9
251	I	29.3	Very low	31	Very low	142 Å²	142	152 Å²	152	73%	0.728	76%	0.756	S	S	*	*			trans	-123.9	121	161.1	-60	-179.6	0	0	0	107	N249 Q253	N249-I251 PolarHBondContact O-N 2.95Å; I251-Q253 PolarHBondContact O-N 3.32Å
252	H	29.3	Very low	31.3	Very low	186 Å²	186	147.5 Å²	147.5	86%	0.861	75%	0.751	S	S	*	*			trans	-59.6	111.6	174.9	-83.2	-34.5	0	0	0	109.7	N254	H252-N254 PolarHBondContact O-N 2.9Å
253	Q	29	Very low	31.8	Very low	179 Å²	179	143.3 Å²	143.3	84%	0.836	72%	0.722	S	S	*	*			trans	-76.9	99.4	171.8	-67.7	179.9	-5.6	0	0	108.4	I251 T255	I251-Q253 PolarHBondContact O-N 3.32Å; Q253-T255 PolarHBondContact O-N 2.82Å; Q253-T255 VanDerWaalsContact O-N 3.09Å
254	N	28.6	Very low	32.7	Very low	119 Å²	119	138 Å²	138	64%	0.636	71%	0.708	S	S	*	*			trans	-63.7	109.5	168.7	-81.1	-0.9	0	0	0	109.1	H252 D256	H252-N254 PolarHBondContact O-N 2.9Å; N254-D256 PolarHBondContact O-N 3.47Å; N254-D256 VanDerWaalsContact O-N 3.14Å
255	T	30	Very low	33.7	Very low	116 Å²	116	136 Å²	136	71%	0.712	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-71	1.1	179.9	43.6	0	0	0	0	114.3	Q253 N257	Q253-T255 PolarHBondContact O-N 2.82Å; Q253-T255 VanDerWaalsContact O-N 3.09Å; T255-N257 VanDerWaalsContact C-N 3.3Å; T255-N257 PolarHBondContact O-N 2.82Å
256	D	35.7	Very low	34.7	Very low	109 Å²	109	134.4 Å²	134.4	58%	0.583	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-76.6	-12.5	-172.4	-57	-35.8	0	0	0	114.4	N254 L258	N254-D256 PolarHBondContact O-N 3.47Å; N254-D256 VanDerWaalsContact O-N 3.14Å; D256-L258 PolarHBondContact O-N 3.48Å
257	N	35.4	Very low	36.3	Very low	116 Å²	116	129.1 Å²	129.1	62%	0.62	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-75.9	1.2	-176.6	-73.5	-33	0	0	0	114.7	T255 N259 V260	T255-N257 VanDerWaalsContact C-N 3.3Å; T255-N257 PolarHBondContact O-N 2.82Å; N257-N259 VanDerWaalsContact C-N 3.34Å; N257-V260 VanDerWaalsContact O-CG2 3.22Å; N257-V260 WeakPolarHBondContact O-CG2 3.45Å
258	L	36.4	Very low	37.4	Very low	163 Å²	163	125.8 Å²	125.8	85%	0.853	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-85.7	-2.6	176.1	-91.7	151	0	0	0	113.9	D256	D256-L258 PolarHBondContact O-N 3.48Å
259	N	34.9	Very low	38.6	Very low	117 Å²	117	119.6 Å²	119.6	63%	0.626	61%	0.613	S	S	*	*			trans	-114.4	29.4	-174.8	-126.6	-5.9	0	0	0	113.4	N257 T261 A262	N257-N259 VanDerWaalsContact C-N 3.34Å; N259-T261 PolarHBondContact O-N 3.44Å; N259-A262 HydrophobicContact CB-CB 4.38Å; N259-A262 VanDerWaalsContact O-CB 3.23Å; N259-A262 WeakPolarHBondContact O-CB 3.43Å; N259-A262 PolarHBondContact O-N 2.91Å
260	V	40.5	Very low	39.4	Very low	73 Å²	73	120.2 Å²	120.2	44%	0.442	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.7	-23.1	-176.4	-166.3	0	0	0	0	112.8	N257 L390	N257-V260 VanDerWaalsContact O-CG2 3.22Å; N257-V260 WeakPolarHBondContact O-CG2 3.45Å; V260-L390 HydrophobicContact CG1-CD1 3.88Å; V260-L390 HydrophobicContact CG1-CD2 3.71Å; V260-L390 HydrophobicContact CG1-CG 4.48Å
261	T	34.3	Very low	40.3	Very low	116 Å²	116	114.5 Å²	114.5	71%	0.712	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	4.7	177.4	48.2	0	0	0	0	114.1	N259 R263	N259-T261 PolarHBondContact O-N 3.44Å; T261-R263 PolarHBondContact O-N 3.37Å
262	A	35.7	Very low	40.6	Very low	60 Å²	60	112.9 Å²	112.9	50%	0.496	57%	0.573	S	S	.	*	S	Bend	trans	-68.3	89.8	176.4	0	0	0	0	0	111.4	N259 L264	N259-A262 HydrophobicContact CB-CB 4.38Å; N259-A262 VanDerWaalsContact O-CB 3.23Å; N259-A262 WeakPolarHBondContact O-CB 3.43Å; N259-A262 PolarHBondContact O-N 2.91Å; A262-L264 PolarHBondContact O-N 3.06Å
263	R	37.8	Very low	41	Very low	85 Å²	85	109.9 Å²	109.9	32%	0.321	56%	0.562	S	S	.	*			trans	-31	114.1	178.9	-84.9	170.4	165.2	173.9	6.7	114	L25 N26 S28 S29 T261 Q265	L25-R263 PolarHBondContact O-NH1 2.81Å; L25-R263 VanDerWaalsContact O-NH1 3.16Å; N26-R263 PolarHBondContact OD1-NH2 2.85Å; S28-R263 VanDerWaalsContact C-CD 3.48Å; S28-R263 VanDerWaalsContact C-NE 3.27Å; S28-R263 WeakPolarHBondContact O-CD 3.11Å; S28-R263 WeakPolarHBondContact O-CG 3.47Å; S28-R263 PolarHBondContact O-NE 2.88Å; S28-R263 PolarHBondContact OG-NH1 3.4Å; S29-R263 PolarHBondContact OG-NE 3.25Å; S29-R263 VanDerWaalsContact OG-NE 3.13Å; S29-R263 PolarHBondContact OG-NH2 3.38Å; T261-R263 PolarHBondContact O-N 3.37Å; R263-Q265 VanDerWaalsContact C-N 3.3Å; R263-Q265 PolarHBondContact O-N 3.29Å
264	L	46.5	Very low	41.3	Very low	107 Å²	107	104.1 Å²	104.1	56%	0.56	54%	0.54	S	S	*	.			trans	-63.6	79	171.5	-74.3	169.5	0	0	0	111.6	A262 R266 Y357 H369	A262-L264 PolarHBondContact O-N 3.06Å; L264-R266 PolarHBondContact O-N 3.41Å; L264-Y357 HydrophobicContact CB-CE1 4.13Å; L264-Y357 HydrophobicContact CD2-CD1 4.14Å; L264-Y357 HydrophobicContact CD2-CE1 4Å; L264-H369 WeakPolarHBondContact CD2-CE1 3.41Å
265	Q	48.7	Very low	41.6	Very low	109 Å²	109	104.5 Å²	104.5	51%	0.509	55%	0.549	S	S	.	.			trans	-69.8	101.7	174.7	-64.9	-169.6	3.4	0	0	110.1	R263 H267	R263-Q265 VanDerWaalsContact C-N 3.3Å; R263-Q265 PolarHBondContact O-N 3.29Å; Q265-H267 WeakPolarHBondContact CB-NE2 3.29Å; Q265-H267 PolarHBondContact O-CD2 3.14Å
266	R	52.2	Low	41.9	Very low	143 Å²	143	105 Å²	105	54%	0.54	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	127.6	165.4	-75.8	-178.5	175.9	153.5	0.3	108.6	L264 Y357	L264-R266 PolarHBondContact O-N 3.41Å; R266-Y357 HydrophobicContact CG-CE1 3.7Å; R266-Y357 HydrophobicContact CG-CE2 4.37Å; R266-Y357 PolarHBondContact NE-OH 2.93Å
267	H	60.9	Low	41.7	Very low	55 Å²	55	110.1 Å²	110.1	26%	0.255	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.4	139.8	175.9	-64	-69.7	0	0	0	111.2	Q265 F356	Q265-H267 WeakPolarHBondContact CB-NE2 3.29Å; Q265-H267 PolarHBondContact O-CD2 3.14Å; H267-F356 HydrophobicContact CB-CD1 4.33Å; H267-F356 HydrophobicContact CB-CD2 4.31Å; H267-F356 HydrophobicContact CB-CE1 3.71Å; H267-F356 HydrophobicContact CB-CE2 3.67Å; H267-F356 HydrophobicContact CB-CZ 3.33Å; H267-F356 PolarHBondContact N-O 3.05Å; H267-F356 WeakPolarHBondContact O-CD1 3.32Å; H267-F356 WeakPolarHBondContact O-CE1 3.27Å; H267-F356 PolarHBondContact O-N 3.47Å
268	N	56.1	Low	41.4	Very low	122 Å²	122	110.4 Å²	110.4	65%	0.652	56%	0.562	S	S	*	*			trans	-103.9	129.8	169.5	-94.9	-53.8	0	0	0	109.6	K270 D355	N268-K270 PolarHBondContact O-N 2.91Å; N268-D355 PolarHBondContact OD1-OD1 3.17Å
269	A	50.6	Low	41.4	Very low	18 Å²	18	110.7 Å²	110.7	15%	0.149	56%	0.559	C	S	.	*			trans	-71.4	112.7	179	0	0	0	0	0	110.4	R271 I330 F342 F356	A269-R271 PolarHBondContact O-N 2.76Å; A269-I330 HydrophobicContact CB-CG2 3.98Å; A269-F342 HydrophobicContact CB-CD1 4.43Å; A269-F342 HydrophobicContact CB-CE1 3.99Å; A269-F356 HydrophobicContact CB-CE1 4.16Å
270	K	48.4	Very low	41.3	Very low	170 Å²	170	113.1 Å²	113.1	74%	0.739	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.2	121.7	176.1	-74	-175.9	177.3	179.1	0	109.9	N268	N268-K270 PolarHBondContact O-N 2.91Å
271	R	46.1	Very low	41.1	Very low	100 Å²	100	116.4 Å²	116.4	38%	0.377	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.4	138.8	167.5	-74	-178.8	172.8	-149.3	-9.3	110.2	A269 I273 I330	A269-R271 PolarHBondContact O-N 2.76Å; R271-I273 HydrophobicContact CB-CG1 4.44Å; R271-I330 HydrophobicContact CG-CD1 3.83Å
272	I	35.5	Very low	41.1	Very low	108 Å²	108	118.2 Å²	118.2	55%	0.554	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.7	105.2	163.9	-57.5	176.1	0	0	0	107.5
273	I	38.2	Very low	41.1	Very low	122 Å²	122	121.9 Å²	121.9	63%	0.626	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-91.4	134.4	177.5	-52.6	177.6	0	0	0	107.9	R271	R271-I273 HydrophobicContact CB-CG1 4.44Å
274	P	35.6	Very low	41.1	Very low	58 Å²	58	123.4 Å²	123.4	38%	0.377	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-65.3	147.8	170.9	-9.2	22.9	0	0	0	111.3	N276	P274-N276 PolarHBondContact O-N 2.81Å
275	P	34.9	Very low	40.6	Very low	128 Å²	128	123.7 Å²	123.7	83%	0.831	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-65.7	133	169.8	28.4	-33.1	0	0	0	110.4
276	N	35.4	Very low	40.1	Very low	126 Å²	126	125.2 Å²	125.2	67%	0.674	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-78.2	140.9	173.9	-160.2	41.5	0	0	0	109.8	P274 D278	P274-N276 PolarHBondContact O-N 2.81Å; N276-D278 PolarHBondContact ND2-OD1 2.99Å; N276-D278 PolarHBondContact ND2-OD2 3.35Å
277	Y	32	Very low	39.3	Very low	216 Å²	216	127.7 Å²	127.7	85%	0.847	68%	0.676	S	S	*	*			trans	-122.5	91.6	175.2	-143.8	-82.7	0	0	0	109
278	D	29.4	Very low	38.5	Very low	123 Å²	123	132.3 Å²	132.3	66%	0.658	70%	0.697	S	S	*	*			trans	-86.5	122	176.7	-63.5	-59	0	0	0	110.5	N276	N276-D278 PolarHBondContact ND2-OD1 2.99Å; N276-D278 PolarHBondContact ND2-OD2 3.35Å
279	Q	35.4	Very low	37.9	Very low	168 Å²	168	128.3 Å²	128.3	79%	0.785	68%	0.684	S	S	*	*			trans	-163.1	111	149.1	-116	162	76.7	0	0	111.4
280	I	32.3	Very low	37.9	Very low	168 Å²	168	132.8 Å²	132.8	86%	0.862	71%	0.712	S	S	*	*			trans	-97.6	134.4	173.9	-62.6	166.8	0	0	0	107.4
281	N	36.8	Very low	38	Very low	143 Å²	143	129.8 Å²	129.8	77%	0.765	71%	0.708	S	S	*	*			trans	-143.7	116.6	168.8	-96.6	-38.4	0	0	0	113
282	N	34.4	Very low	38.4	Very low	153 Å²	153	131.5 Å²	131.5	82%	0.818	72%	0.72	S	S	*	*			trans	11.5	125	163.6	-68.1	-16.8	0	0	0	121.6
283	V	36.2	Very low	39.2	Very low	137 Å²	137	130.2 Å²	130.2	83%	0.83	71%	0.714	S	S	*	*			trans	-93.4	148.9	159.1	177.2	0	0	0	0	109.7
284	S	38.1	Very low	40.1	Very low	117 Å²	117	129.4 Å²	129.4	82%	0.818	71%	0.711	S	S	*	*			trans	-122.6	141.1	166.3	-67.5	0	0	0	0	110.4
285	S	34.8	Very low	41.6	Very low	114 Å²	114	131.4 Å²	131.4	80%	0.797	72%	0.718	S	S	*	*			trans	-90.7	145.3	-159.6	-40	0	0	0	0	114.7
286	T	39.6	Very low	43.1	Very low	140 Å²	140	128.4 Å²	128.4	86%	0.859	70%	0.7	S	S	*	*			trans	-142.7	151.1	150.7	39.8	0	0	0	0	110.9
287	E	35.5	Very low	44.5	Very low	196 Å²	196	127.2 Å²	127.2	92%	0.916	69%	0.692	S	S	*	*			trans	-88	120.8	-154.6	-54.1	169.7	131.3	0	0	114.1
288	Q	43	Very low	46.3	Very low	152 Å²	152	122 Å²	122	71%	0.71	68%	0.678	S	S	*	*			trans	-142.2	148.7	161	-67.3	-166.9	-7.2	0	0	110.9
289	G	43.7	Very low	48.3	Very low	37 Å²	37	120.9 Å²	120.9	38%	0.381	67%	0.672	S	S	.	*			trans	-67.7	158.3	-157.4	0	0	0	0	0	117	T291 Q292 L293	G289-T291 VanDerWaalsContact C-N 3.3Å; G289-T291 PolarHBondContact O-N 3.49Å; G289-Q292 PolarHBondContact O-N 3.07Å; G289-Q292 VanDerWaalsContact O-N 3.13Å; G289-L293 PolarHBondContact O-N 3.07Å; G289-L293 VanDerWaalsContact O-N 3.15Å
290	P	50.2	Low	50.1	Low	112 Å²	112	117.6 Å²	117.6	73%	0.727	66%	0.66	S	S	*	*	H	α-helix	trans	-62	-28.7	-158.7	-25	34.6	0	0	0	116
291	T	51	Low	51.6	Low	108 Å²	108	114.1 Å²	114.1	66%	0.663	64%	0.643	S	S	*	*	H	α-helix	trans	-95.5	-17.3	-176.5	46	0	0	0	0	113.9	G289	G289-T291 VanDerWaalsContact C-N 3.3Å; G289-T291 PolarHBondContact O-N 3.49Å
292	Q	53.9	Low	53.2	Low	135 Å²	135	110 Å²	110	63%	0.631	63%	0.625	S	S	*	*	H	α-helix	trans	-88.2	-39.3	173.7	-68.7	-174.9	4	0	0	110.9	G289 L294 N295 S296	G289-Q292 PolarHBondContact O-N 3.07Å; G289-Q292 VanDerWaalsContact O-N 3.13Å; Q292-L294 VanDerWaalsContact C-N 3.31Å; Q292-L294 PolarHBondContact O-N 3.36Å; Q292-N295 PolarHBondContact O-N 2.83Å; Q292-N295 VanDerWaalsContact O-N 3.17Å; Q292-S296 PolarHBondContact O-N 2.7Å
293	L	53.3	Low	54.7	Low	81 Å²	81	105.6 Å²	105.6	42%	0.424	61%	0.606	S	S	.	*	H	α-helix	trans	-59.4	-41.2	175.1	-164.5	76	0	0	0	111.8	G289 S296 M297	G289-L293 PolarHBondContact O-N 3.07Å; G289-L293 VanDerWaalsContact O-N 3.15Å; L293-S296 PolarHBondContact O-N 2.9Å; L293-M297 HydrophobicContact CD1-CE 4.39Å; L293-M297 HydrophobicContact CD2-CE 4.1Å; L293-M297 HydrophobicContact CD2-SD 4.41Å; L293-M297 HydrophobicContact CG-CE 4.1Å; L293-M297 HydrophobicContact CG-SD 4.19Å; L293-M297 VanDerWaalsContact O-CB 3.28Å; L293-M297 WeakPolarHBondContact O-CB 3.34Å; L293-M297 VanDerWaalsContact O-CG 3.29Å; L293-M297 WeakPolarHBondContact O-CG 3.38Å; L293-M297 PolarHBondContact O-N 3.3Å
294	L	57.2	Low	56	Low	106 Å²	106	104.1 Å²	104.1	56%	0.555	59%	0.59	S	S	*	*	H	α-helix	trans	-64.5	-39	175.6	-82.5	171.3	0	0	0	113.1	Q292 L298	Q292-L294 VanDerWaalsContact C-N 3.31Å; Q292-L294 PolarHBondContact O-N 3.36Å; L294-L298 VanDerWaalsContact O-CB 3.24Å; L294-L298 WeakPolarHBondContact O-CB 3.33Å; L294-L298 VanDerWaalsContact O-CG 3.23Å; L294-L298 WeakPolarHBondContact O-CG 3.19Å; L294-L298 PolarHBondContact O-N 3.09Å
295	N	65.9	Low	56.9	Low	100 Å²	100	105 Å²	105	54%	0.535	59%	0.585	S	S	.	*	H	α-helix	trans	-73.5	-37.3	178.2	-79.6	-16.8	0	0	0	112.2	Q292 N299	Q292-N295 PolarHBondContact O-N 2.83Å; Q292-N295 VanDerWaalsContact O-N 3.17Å; N295-N299 VanDerWaalsContact O-CB 3.27Å; N295-N299 WeakPolarHBondContact O-CB 3.43Å; N295-N299 PolarHBondContact O-N 3.13Å; N295-N299 PolarHBondContact O-ND2 3.05Å
296	S	66.2	Low	58.3	Low	65 Å²	65	104.4 Å²	104.4	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-64.3	-49.5	170.1	-72.5	0	0	0	0	110.9	Q292 L293 L298 N299 D300	Q292-S296 PolarHBondContact O-N 2.7Å; L293-S296 PolarHBondContact O-N 2.9Å; S296-L298 VanDerWaalsContact C-N 3.3Å; S296-L298 PolarHBondContact O-N 3.04Å; S296-N299 PolarHBondContact O-N 3.09Å; S296-N299 VanDerWaalsContact O-N 3.09Å; S296-D300 WeakPolarHBondContact O-CB 3.23Å; S296-D300 VanDerWaalsContact O-CG 3.25Å; S296-D300 PolarHBondContact O-N 2.85Å
297	M	64.9	Low	59.2	Low	101 Å²	101	105.6 Å²	105.6	50%	0.498	58%	0.577	S	S	.	*	H	α-helix	trans	-60.1	-36.1	176.3	-75.4	-178.5	168.8	0	0	112.9	L293 L301	L293-M297 HydrophobicContact CD1-CE 4.39Å; L293-M297 HydrophobicContact CD2-CE 4.1Å; L293-M297 HydrophobicContact CD2-SD 4.41Å; L293-M297 HydrophobicContact CG-CE 4.1Å; L293-M297 HydrophobicContact CG-SD 4.19Å; L293-M297 VanDerWaalsContact O-CB 3.28Å; L293-M297 WeakPolarHBondContact O-CB 3.34Å; L293-M297 VanDerWaalsContact O-CG 3.29Å; L293-M297 WeakPolarHBondContact O-CG 3.38Å; L293-M297 PolarHBondContact O-N 3.3Å; M297-L301 WeakPolarHBondContact O-CA 3.22Å; M297-L301 WeakPolarHBondContact O-CB 3.21Å; M297-L301 WeakPolarHBondContact O-CD1 3.24Å; M297-L301 WeakPolarHBondContact O-CG 3.26Å; M297-L301 PolarHBondContact O-N 3.29Å
298	L	71.3	Confident	60.1	Low	105 Å²	105	102.8 Å²	102.8	55%	0.55	56%	0.563	S	S	.	*	H	α-helix	trans	-73	-34.5	174.4	-77.5	168.7	0	0	0	112.7	L294 S296 S302	L294-L298 VanDerWaalsContact O-CB 3.24Å; L294-L298 WeakPolarHBondContact O-CB 3.33Å; L294-L298 VanDerWaalsContact O-CG 3.23Å; L294-L298 WeakPolarHBondContact O-CG 3.19Å; L294-L298 PolarHBondContact O-N 3.09Å; S296-L298 VanDerWaalsContact C-N 3.3Å; S296-L298 PolarHBondContact O-N 3.04Å; L298-S302 WeakPolarHBondContact O-CB 3.38Å; L298-S302 PolarHBondContact O-N 3.31Å; L298-S302 PolarHBondContact O-OG 3.02Å
299	N	70.2	Confident	60	Low	101 Å²	101	97 Å²	97	54%	0.54	55%	0.545	S	S	.	.	H	α-helix	trans	-72.7	-41.6	175.6	-75.7	-26.1	0	0	0	111.6	N295 S296 S302 S303	N295-N299 VanDerWaalsContact O-CB 3.27Å; N295-N299 WeakPolarHBondContact O-CB 3.43Å; N295-N299 PolarHBondContact O-N 3.13Å; N295-N299 PolarHBondContact O-ND2 3.05Å; S296-N299 PolarHBondContact O-N 3.09Å; S296-N299 VanDerWaalsContact O-N 3.09Å; N299-S302 WeakPolarHBondContact CA-OG 3.22Å; N299-S302 PolarHBondContact O-N 2.88Å; N299-S302 PolarHBondContact O-OG 2.92Å; N299-S303 VanDerWaalsContact O-CB 3.28Å; N299-S303 WeakPolarHBondContact O-CB 3.22Å; N299-S303 PolarHBondContact O-N 2.89Å; N299-S303 PolarHBondContact O-OG 3.37Å
300	D	73.2	Confident	60.1	Low	99 Å²	99	99 Å²	99	53%	0.529	56%	0.558	S	S	.	*	H	α-helix	trans	-66.3	-47.8	174.2	-66.6	-26.1	0	0	0	109.8	S296 S302 S303 E304	S296-D300 WeakPolarHBondContact O-CB 3.23Å; S296-D300 VanDerWaalsContact O-CG 3.25Å; S296-D300 PolarHBondContact O-N 2.85Å; D300-S302 VanDerWaalsContact C-N 3.33Å; D300-S302 PolarHBondContact O-N 3.47Å; D300-S303 CarbonylContact O-C 3.53Å; D300-S303 PolarHBondContact O-N 3.46Å; D300-S303 VanDerWaalsContact O-N 3.13Å; D300-E304 WeakPolarHBondContact O-CB 3.17Å; D300-E304 WeakPolarHBondContact O-CG 3.44Å; D300-E304 PolarHBondContact O-N 3.32Å
301	L	64.6	Low	59.8	Low	95 Å²	95	103.5 Å²	103.5	50%	0.497	57%	0.566	S	S	.	*	H	α-helix	trans	-60.5	-38.4	171.2	-78.6	166.7	0	0	0	112.1	M297 S303 L305	M297-L301 WeakPolarHBondContact O-CA 3.22Å; M297-L301 WeakPolarHBondContact O-CB 3.21Å; M297-L301 WeakPolarHBondContact O-CD1 3.24Å; M297-L301 WeakPolarHBondContact O-CG 3.26Å; M297-L301 PolarHBondContact O-N 3.29Å; L301-S303 VanDerWaalsContact C-N 3.31Å; L301-L305 VanDerWaalsContact O-CB 3.27Å; L301-L305 WeakPolarHBondContact O-CB 3.39Å; L301-L305 PolarHBondContact O-N 3.42Å
302	S	70.4	Confident	59.8	Low	57 Å²	57	101.7 Å²	101.7	40%	0.399	56%	0.555	S	S	.	*	H	α-helix	trans	-69	-33.2	176.4	78.8	0	0	0	0	111.9	L298 N299 D300 S306	L298-S302 WeakPolarHBondContact O-CB 3.38Å; L298-S302 PolarHBondContact O-N 3.31Å; L298-S302 PolarHBondContact O-OG 3.02Å; N299-S302 WeakPolarHBondContact CA-OG 3.22Å; N299-S302 PolarHBondContact O-N 2.88Å; N299-S302 PolarHBondContact O-OG 2.92Å; D300-S302 VanDerWaalsContact C-N 3.33Å; D300-S302 PolarHBondContact O-N 3.47Å; S302-S306 VanDerWaalsContact O-CB 3.26Å; S302-S306 WeakPolarHBondContact O-CB 3.42Å; S302-S306 PolarHBondContact O-N 3.43Å; S302-S306 PolarHBondContact O-OG 3.43Å
303	S	66.1	Low	60.1	Low	59 Å²	59	101.8 Å²	101.8	41%	0.413	56%	0.56	S	S	.	*	H	α-helix	trans	-74.3	-43.5	177.9	-61.4	0	0	0	0	110.1	N299 D300 L301 S306 Q307	N299-S303 VanDerWaalsContact O-CB 3.28Å; N299-S303 WeakPolarHBondContact O-CB 3.22Å; N299-S303 PolarHBondContact O-N 2.89Å; N299-S303 PolarHBondContact O-OG 3.37Å; D300-S303 CarbonylContact O-C 3.53Å; D300-S303 PolarHBondContact O-N 3.46Å; D300-S303 VanDerWaalsContact O-N 3.13Å; L301-S303 VanDerWaalsContact C-N 3.31Å; S303-S306 CarbonylContact O-C 3.58Å; S303-S306 WeakPolarHBondContact O-CB 3.39Å; S303-S306 PolarHBondContact O-N 2.9Å; S303-S306 VanDerWaalsContact O-N 3.11Å; S303-Q307 WeakPolarHBondContact O-CB 3.4Å; S303-Q307 PolarHBondContact O-N 2.86Å
304	E	63.2	Low	60.8	Low	106 Å²	106	101.1 Å²	101.1	50%	0.495	56%	0.56	S	S	.	*	H	α-helix	trans	-63.9	-40.2	169.8	-72.6	-170.2	150.4	0	0	111.6	D300 S306 Q307 H308 G309	D300-E304 WeakPolarHBondContact O-CB 3.17Å; D300-E304 WeakPolarHBondContact O-CG 3.44Å; D300-E304 PolarHBondContact O-N 3.32Å; E304-S306 PolarHBondContact O-N 2.89Å; E304-Q307 PolarHBondContact O-N 3.18Å; E304-H308 CarbonylContact O-C 3.57Å; E304-H308 WeakPolarHBondContact O-CA 3.27Å; E304-H308 WeakPolarHBondContact O-CB 3.27Å; E304-H308 PolarHBondContact O-N 3.33Å; E304-G309 PolarHBondContact O-N 2.9Å
305	L	58	Low	61.5	Low	135 Å²	135	101.9 Å²	101.9	71%	0.707	56%	0.556	S	S	*	*	H	α-helix	trans	-71.2	-13.5	172.2	-119.9	70.8	0	0	0	113.5	L301 G309	L301-L305 VanDerWaalsContact O-CB 3.27Å; L301-L305 WeakPolarHBondContact O-CB 3.39Å; L301-L305 PolarHBondContact O-N 3.42Å; L305-G309 WeakPolarHBondContact O-CA 3.37Å; L305-G309 PolarHBondContact O-N 3.48Å
306	S	62.9	Low	62.4	Low	102 Å²	102	97.9 Å²	97.9	71%	0.713	54%	0.538	S	S	*	.	H	α-helix	trans	-93.2	-35	173.3	-61.9	0	0	0	0	111.9	S302 S303 E304	S302-S306 VanDerWaalsContact O-CB 3.26Å; S302-S306 WeakPolarHBondContact O-CB 3.42Å; S302-S306 PolarHBondContact O-N 3.43Å; S302-S306 PolarHBondContact O-OG 3.43Å; S303-S306 CarbonylContact O-C 3.58Å; S303-S306 WeakPolarHBondContact O-CB 3.39Å; S303-S306 PolarHBondContact O-N 2.9Å; S303-S306 VanDerWaalsContact O-N 3.11Å; E304-S306 PolarHBondContact O-N 2.89Å
307	Q	58.9	Low	63.6	Low	165 Å²	165	99.2 Å²	99.2	77%	0.771	54%	0.537	S	S	*	.	H	α-helix	trans	-99.3	-35.2	-171.3	-164.5	173.2	62.9	0	0	112.1	S303 E304	S303-Q307 WeakPolarHBondContact O-CB 3.4Å; S303-Q307 PolarHBondContact O-N 2.86Å; E304-Q307 PolarHBondContact O-N 3.18Å
308	H	53.7	Low	65	Low	137 Å²	137	94.4 Å²	94.4	63%	0.634	51%	0.513	S	S	*	.	S	Bend	trans	-101.9	28.8	158.4	-57.2	-27.4	0	0	0	111.3	E304 A310	E304-H308 CarbonylContact O-C 3.57Å; E304-H308 WeakPolarHBondContact O-CA 3.27Å; E304-H308 WeakPolarHBondContact O-CB 3.27Å; E304-H308 PolarHBondContact O-N 3.33Å; H308-A310 VanDerWaalsContact O-CA 3.31Å; H308-A310 WeakPolarHBondContact O-CA 3.23Å; H308-A310 PolarHBondContact O-N 3.16Å
309	G	40.5	Very low	66	Low	32 Å²	32	94.2 Å²	94.2	33%	0.33	51%	0.506	S	S	.	.			trans	-48	107.6	170.5	0	0	0	0	0	109.4	E304 L305 K311	E304-G309 PolarHBondContact O-N 2.9Å; L305-G309 WeakPolarHBondContact O-CA 3.37Å; L305-G309 PolarHBondContact O-N 3.48Å; G309-K311 PolarHBondContact O-N 2.73Å
310	A	45.9	Very low	67	Low	78 Å²	78	92 Å²	92	65%	0.645	50%	0.501	S	S	*	.			trans	-62.6	103.7	-153.8	0	0	0	0	0	108.6	H308 T312	H308-A310 VanDerWaalsContact O-CA 3.31Å; H308-A310 WeakPolarHBondContact O-CA 3.23Å; H308-A310 PolarHBondContact O-N 3.16Å; A310-T312 HydrophobicContact CB-CG2 4.35Å; A310-T312 PolarHBondContact O-N 3.5Å
311	K	44.5	Very low	68	Low	206 Å²	206	89 Å²	89	90%	0.896	49%	0.488	S	S	*	.			trans	-71.9	68.8	173.4	-71.7	-175.8	-179.6	175.9	0	107.8	G309 N313	G309-K311 PolarHBondContact O-N 2.73Å; K311-N313 PolarHBondContact O-N 2.99Å
312	T	51.6	Low	69.4	Low	71 Å²	71	90.5 Å²	90.5	44%	0.436	49%	0.49	S	S	.	.			trans	-63.9	87.7	161.6	60.2	0	0	0	0	105.4	A310 P314	A310-T312 HydrophobicContact CB-CG2 4.35Å; A310-T312 PolarHBondContact O-N 3.5Å; T312-P314 WeakPolarHBondContact O-CD 3.41Å
313	N	60.6	Low	70.4	Confident	137 Å²	137	94.2 Å²	94.2	73%	0.733	50%	0.499	S	S	*	.			trans	-55.7	115.6	175.8	-166.7	14.4	0	0	0	106.2	K311 R315	K311-N313 PolarHBondContact O-N 2.99Å; N313-R315 PolarHBondContact O-N 2.95Å; N313-R315 VanDerWaalsContact O-N 3.1Å
314	P	66.3	Low	71.6	Confident	67 Å²	67	94.4 Å²	94.4	44%	0.435	50%	0.499	S	S	.	.			trans	-58.9	122.3	-169.7	22.8	-34.6	0	0	0	108.6	T312 G316 P324	T312-P314 WeakPolarHBondContact O-CD 3.41Å; P314-G316 PolarHBondContact O-N 3.26Å; P314-P324 HydrophobicContact CB-CB 3.62Å; P314-P324 HydrophobicContact CG-CB 4.46Å
315	R	73.7	Confident	72.8	Confident	122 Å²	122	89.4 Å²	89.4	46%	0.46	48%	0.476	S	S	.	.			trans	-75.3	-6.6	-171.4	-71.9	-171.6	172.1	-165.7	-3.8	113.4	N313 I325 L329	N313-R315 PolarHBondContact O-N 2.95Å; N313-R315 VanDerWaalsContact O-N 3.1Å; R315-I325 PolarHBondContact N-O 2.9Å; R315-I325 VanDerWaalsContact N-O 3.07Å; R315-L329 HydrophobicContact CB-CB 4.49Å; R315-L329 HydrophobicContact CB-CD1 4.06Å; R315-L329 WeakPolarHBondContact O-CD1 3.24Å
316	G	84.3	Confident	74.1	Confident	15 Å²	15	87.4 Å²	87.4	16%	0.155	47%	0.466	C	S	.	.			trans	167.2	178.7	-173.7	0	0	0	0	0	111.3	P314 I325 E336	P314-G316 PolarHBondContact O-N 3.26Å; G316-I325 PolarHBondContact O-N 3.42Å; G316-E336 WeakPolarHBondContact CA-OE2 3.39Å
317	Q	91.9	Very high	75.1	Confident	94 Å²	94	84.4 Å²	84.4	44%	0.439	45%	0.451	S	S	.	.	B	Isolated β-bridge	trans	-120.3	116.1	-179.4	-178.3	72.5	-12.1	0	0	109.8	Y319 K322 K323 E336	Q317-Y319 PolarHBondContact O-N 2.88Å; Q317-Y319 VanDerWaalsContact O-N 3.14Å; Q317-K322 PolarHBondContact NE2-O 3.42Å; Q317-K323 PolarHBondContact OE1-O 3.37Å; Q317-E336 PolarHBondContact N-OE2 2.76Å
318	C	93.4	Very high	76.3	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	43%	0.431	C	S	.	.			trans	-63.3	120.5	-174.1	176.6	0	0	0	0	111.9	A320 C321 K322 K323 I325 E336 H338	C318-A320 VanDerWaalsContact C-N 3.3Å; C318-A320 PolarHBondContact O-N 2.9Å; C318-C321 VanDerWaalsContact SG-SG 3.66Å; C318-K322 VanDerWaalsContact O-CA 3.28Å; C318-K322 WeakPolarHBondContact O-CA 3.27Å; C318-K322 PolarHBondContact O-N 3.49Å; C318-K323 WeakPolarHBondContact CB-O 2.95Å; C318-K323 PolarHBondContact N-O 3.35Å; C318-I325 HydrophobicContact CB-CD1 3.93Å; C318-I325 HydrophobicContact CB-CG1 3.73Å; C318-E336 WeakPolarHBondContact CA-O 3.44Å; C318-H338 WeakPolarHBondContact CB-ND1 3.32Å; C318-H338 PolarHBondContact SG-N 3.23Å; C318-H338 VanDerWaalsContact SG-N 3.4Å; C318-H338 PolarHBondContact SG-ND1 3.32Å; C318-H338 VanDerWaalsContact SG-ND1 3.36Å
319	Y	91.6	Very high	78	Confident	101 Å²	101	73.4 Å²	73.4	40%	0.396	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-36.9	-177.1	179.9	-97.1	0	0	0	113.1	Q317 K322 K335 E336 W337	Q317-Y319 PolarHBondContact O-N 2.88Å; Q317-Y319 VanDerWaalsContact O-N 3.14Å; Y319-K322 WeakPolarHBondContact O-CD 3.2Å; Y319-K322 VanDerWaalsContact O-CE 3.23Å; Y319-K322 WeakPolarHBondContact O-CE 3.33Å; Y319-K322 PolarHBondContact O-NZ 3.08Å; Y319-K335 HydrophobicContact CD1-CD 3.87Å; Y319-K335 HydrophobicContact CD2-CB 4.47Å; Y319-K335 HydrophobicContact CD2-CD 3.75Å; Y319-K335 HydrophobicContact CD2-CG 3.96Å; Y319-K335 HydrophobicContact CE1-CD 3.89Å; Y319-K335 HydrophobicContact CE2-CD 3.78Å; Y319-K335 HydrophobicContact CE2-CG 4.34Å; Y319-K335 HydrophobicContact CG-CB 4.23Å; Y319-K335 HydrophobicContact CG-CD 3.78Å; Y319-K335 HydrophobicContact CG-CG 4.13Å; Y319-E336 WeakPolarHBondContact CB-O 3.47Å; Y319-E336 PolarHBondContact N-O 3.22Å; Y319-W337 AromaticContact CD1-CH2 3.43Å; Y319-W337 HydrophobicContact CD1-CH2 3.43Å; Y319-W337 VanDerWaalsContact CD1-CH2 3.43Å; Y319-W337 AromaticContact CD1-CZ2 3.92Å; Y319-W337 HydrophobicContact CD1-CZ2 3.92Å; Y319-W337 AromaticContact CD1-CZ3 3.79Å; Y319-W337 HydrophobicContact CD1-CZ3 3.79Å; Y319-W337 HydrophobicContact CE1-CH2 4.05Å; Y319-W337 HydrophobicContact CG-CH2 4.34Å; Y319-W337 HydrophobicContact CG-CZ2 4.49Å
320	A	91.9	Very high	80.3	Confident	53 Å²	53	71.9 Å²	71.9	44%	0.438	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-58.5	179.2	0	0	0	0	0	113.2	C318 W337 H341	C318-A320 VanDerWaalsContact C-N 3.3Å; C318-A320 PolarHBondContact O-N 2.9Å; A320-W337 HydrophobicContact CB-CE3 4.09Å; A320-W337 HydrophobicContact CB-CZ3 4.08Å; A320-H341 HydrophobicContact CB-CB 3.77Å
321	C	94.3	Very high	82.4	Confident	38 Å²	38	71.3 Å²	71.3	26%	0.257	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-4.6	-171.1	72.5	0	0	0	0	115.1	C318 K323 H338 H341	C318-C321 VanDerWaalsContact SG-SG 3.66Å; C321-K323 VanDerWaalsContact C-N 3.3Å; C321-K323 PolarHBondContact O-N 2.9Å; C321-H338 PolarHBondContact SG-ND1 2.95Å; C321-H341 VanDerWaalsContact SG-CE1 3.55Å
322	K	93	Very high	84.4	Confident	126 Å²	126	61.9 Å²	61.9	55%	0.548	34%	0.337	S	S	.	.			trans	51.2	44.2	-175.6	-46.5	-55.1	-173.8	-167.1	0	113.3	Q317 C318 Y319	Q317-K322 PolarHBondContact NE2-O 3.42Å; C318-K322 VanDerWaalsContact O-CA 3.28Å; C318-K322 WeakPolarHBondContact O-CA 3.27Å; C318-K322 PolarHBondContact O-N 3.49Å; Y319-K322 WeakPolarHBondContact O-CD 3.2Å; Y319-K322 VanDerWaalsContact O-CE 3.23Å; Y319-K322 WeakPolarHBondContact O-CE 3.33Å; Y319-K322 PolarHBondContact O-NZ 3.08Å
323	K	91.7	Very high	86.1	Confident	135 Å²	135	59 Å²	59	59%	0.587	32%	0.319	S	S	*	.			trans	-122.3	150.7	173.7	-63.2	179.8	-177.6	-179.6	0	110.5	Q317 C318 C321	Q317-K323 PolarHBondContact OE1-O 3.37Å; C318-K323 WeakPolarHBondContact CB-O 2.95Å; C318-K323 PolarHBondContact N-O 3.35Å; C321-K323 VanDerWaalsContact C-N 3.3Å; C321-K323 PolarHBondContact O-N 2.9Å
324	P	91.5	Very high	87.4	Confident	63 Å²	63	56.6 Å²	56.6	41%	0.409	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-61.7	138.5	177.6	22.3	-32.9	0	0	0	111.2	P314 N326 H338	P314-P324 HydrophobicContact CB-CB 3.62Å; P314-P324 HydrophobicContact CG-CB 4.46Å; P324-N326 PolarHBondContact O-N 3.36Å; P324-H338 PolarHBondContact O-NE2 3.47Å
325	I	89.5	Confident	88.6	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.315	C	S	.	.			trans	-89.2	106.6	178.2	-59.4	164.4	0	0	0	109.4	R315 G316 C318 T328 L329 E336	R315-I325 PolarHBondContact N-O 2.9Å; R315-I325 VanDerWaalsContact N-O 3.07Å; G316-I325 PolarHBondContact O-N 3.42Å; C318-I325 HydrophobicContact CB-CD1 3.93Å; C318-I325 HydrophobicContact CB-CG1 3.73Å; I325-T328 WeakPolarHBondContact CG2-O 3.17Å; I325-L329 HydrophobicContact CB-CD1 4.31Å; I325-L329 HydrophobicContact CD1-CD1 3.71Å; I325-L329 HydrophobicContact CD1-CG 3.98Å; I325-L329 HydrophobicContact CG2-CB 3.86Å; I325-L329 HydrophobicContact CG2-CD1 4.38Å; I325-L329 HydrophobicContact CG2-CG 4.42Å; I325-E336 HydrophobicContact CD1-CB 3.95Å
326	N	84.2	Confident	89.5	Confident	94 Å²	94	53 Å²	53	50%	0.503	31%	0.308	S	S	.	.			trans	-97.3	124.8	172.1	-64.7	-15.2	0	0	0	109.1	P324	P324-N326 PolarHBondContact O-N 3.36Å
327	G	83.7	Confident	89.9	Confident	38 Å²	38	53.5 Å²	53.5	39%	0.392	31%	0.306	S	S	.	.	S	Bend	trans	93.9	-122.5	-179.2	0	0	0	0	0	113.9
328	T	85.1	Confident	90	Very high	58 Å²	58	50.3 Å²	50.3	36%	0.356	29%	0.291	S	S	.	.			trans	-81.4	125.7	-175.2	-58.9	0	0	0	0	110.9	I325 I330 P339	I325-T328 WeakPolarHBondContact CG2-O 3.17Å; T328-I330 HydrophobicContact CG2-CD1 4.46Å; T328-P339 HydrophobicContact CG2-CG 4.03Å; T328-P339 WeakPolarHBondContact O-CD 3.02Å
329	L	88.5	Confident	89.9	Confident	14 Å²	14	52.1 Å²	52.1	7%	0.073	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	141.5	176.9	175.6	148.3	0	0	0	110.3	R315 I325 T331 E336	R315-L329 HydrophobicContact CB-CB 4.49Å; R315-L329 HydrophobicContact CB-CD1 4.06Å; R315-L329 WeakPolarHBondContact O-CD1 3.24Å; I325-L329 HydrophobicContact CB-CD1 4.31Å; I325-L329 HydrophobicContact CD1-CD1 3.71Å; I325-L329 HydrophobicContact CD1-CG 3.98Å; I325-L329 HydrophobicContact CG2-CB 3.86Å; I325-L329 HydrophobicContact CG2-CD1 4.38Å; I325-L329 HydrophobicContact CG2-CG 4.42Å; L329-T331 VanDerWaalsContact CD2-OG1 3.28Å; L329-T331 WeakPolarHBondContact CD2-OG1 3.44Å; L329-E336 HydrophobicContact CD1-CB 4.11Å; L329-E336 HydrophobicContact CD1-CG 4.15Å; L329-E336 HydrophobicContact CG-CB 4.47Å
330	I	88.8	Confident	89.9	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.9	172.2	-55.6	-56.5	0	0	0	109.2	A269 R271 T328 A332 E336 W337 P339 F342 V352	A269-I330 HydrophobicContact CB-CG2 3.98Å; R271-I330 HydrophobicContact CG-CD1 3.83Å; T328-I330 HydrophobicContact CG2-CD1 4.46Å; I330-A332 HydrophobicContact CG2-CB 4.49Å; I330-E336 CarbonylContact O-C 3.55Å; I330-E336 WeakPolarHBondContact O-CA 3.21Å; I330-W337 HydrophobicContact CB-CB 4.41Å; I330-W337 PolarHBondContact N-O 2.84Å; I330-W337 PolarHBondContact O-N 3.29Å; I330-P339 HydrophobicContact CG1-CB 4.33Å; I330-P339 HydrophobicContact CG1-CG 4.13Å; I330-F342 HydrophobicContact CG2-CD1 4.16Å; I330-F342 HydrophobicContact CG2-CG 4.26Å; I330-V352 HydrophobicContact CD1-CG1 3.56Å; I330-V352 HydrophobicContact CG1-CG1 4.06Å; I330-V352 HydrophobicContact CG1-CG2 4.17Å
331	T	89.8	Confident	90	Very high	65 Å²	65	53.5 Å²	53.5	40%	0.399	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117.8	172.3	-47.4	0	0	0	0	109.5	L329 K335	L329-T331 VanDerWaalsContact CD2-OG1 3.28Å; L329-T331 WeakPolarHBondContact CD2-OG1 3.44Å; T331-K335 WeakPolarHBondContact CA-O 3.39Å
332	A	87.1	Confident	90	Very high	8 Å²	8	51.7 Å²	51.7	7%	0.066	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	147	-179.2	0	0	0	0	0	110.3	I330 G334 K335 W337 F342 F356	I330-A332 HydrophobicContact CG2-CB 4.49Å; A332-G334 VanDerWaalsContact C-N 3.25Å; A332-G334 PolarHBondContact O-N 3.27Å; A332-K335 PolarHBondContact N-O 3.15Å; A332-K335 CarbonylContact O-C 3.49Å; A332-K335 PolarHBondContact O-N 3.25Å; A332-W337 PolarHBondContact O-NE1 3.13Å; A332-F342 HydrophobicContact CB-CD2 4.13Å; A332-F342 HydrophobicContact CB-CE1 4.13Å; A332-F342 HydrophobicContact CB-CE2 3.43Å; A332-F342 VanDerWaalsContact CB-CE2 3.43Å; A332-F342 HydrophobicContact CB-CZ 3.44Å; A332-F342 VanDerWaalsContact CB-CZ 3.44Å; A332-F356 HydrophobicContact CB-CE1 4.3Å; A332-F356 HydrophobicContact CB-CZ 3.83Å
333	I	88.2	Confident	90.1	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.062	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	41.6	179.7	-50.9	175.6	0	0	0	111.6	K335 F342 F356 E358 N361 A363	I333-K335 HydrophobicContact CG2-CD 4.47Å; I333-K335 WeakPolarHBondContact O-CD 3.45Å; I333-K335 VanDerWaalsContact O-CE 3.28Å; I333-K335 WeakPolarHBondContact O-CE 3.4Å; I333-K335 WeakPolarHBondContact O-CG 3.38Å; I333-K335 PolarHBondContact O-N 2.83Å; I333-F342 HydrophobicContact CD1-CE2 4.44Å; I333-F356 HydrophobicContact CD1-CD2 4.47Å; I333-F356 HydrophobicContact CD1-CE2 4.02Å; I333-F356 HydrophobicContact CG1-CE2 3.76Å; I333-F356 HydrophobicContact CG1-CZ 4.41Å; I333-E358 WeakPolarHBondContact CA-OE2 3.39Å; I333-E358 HydrophobicContact CB-CG 4.47Å; I333-E358 HydrophobicContact CD1-CB 4.39Å; I333-E358 HydrophobicContact CD1-CG 4.08Å; I333-E358 HydrophobicContact CG1-CB 4.25Å; I333-E358 HydrophobicContact CG1-CG 3.93Å; I333-E358 WeakPolarHBondContact CG1-OE2 3.46Å; I333-E358 HydrophobicContact CG2-CG 3.92Å; I333-E358 VanDerWaalsContact CG2-OE1 3.31Å; I333-E358 WeakPolarHBondContact CG2-OE1 3.01Å; I333-E358 WeakPolarHBondContact CG2-OE2 3.44Å; I333-N361 HydrophobicContact CG2-CB 4.46Å; I333-A363 HydrophobicContact CD1-CB 3.54Å
334	G	87	Confident	90.3	Very high	85 Å²	85	41 Å²	41	88%	0.876	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	17.2	-175.5	0	0	0	0	0	115.3	A332	A332-G334 VanDerWaalsContact C-N 3.25Å; A332-G334 PolarHBondContact O-N 3.27Å
335	K	91.1	Very high	90.5	Very high	47 Å²	47	39 Å²	39	20%	0.204	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	161.3	-169.4	-67.3	160.3	-150	-53.5	0	111.2	Y319 T331 A332 I333 W337	Y319-K335 HydrophobicContact CD1-CD 3.87Å; Y319-K335 HydrophobicContact CD2-CB 4.47Å; Y319-K335 HydrophobicContact CD2-CD 3.75Å; Y319-K335 HydrophobicContact CD2-CG 3.96Å; Y319-K335 HydrophobicContact CE1-CD 3.89Å; Y319-K335 HydrophobicContact CE2-CD 3.78Å; Y319-K335 HydrophobicContact CE2-CG 4.34Å; Y319-K335 HydrophobicContact CG-CB 4.23Å; Y319-K335 HydrophobicContact CG-CD 3.78Å; Y319-K335 HydrophobicContact CG-CG 4.13Å; T331-K335 WeakPolarHBondContact CA-O 3.39Å; A332-K335 PolarHBondContact N-O 3.15Å; A332-K335 CarbonylContact O-C 3.49Å; A332-K335 PolarHBondContact O-N 3.25Å; I333-K335 HydrophobicContact CG2-CD 4.47Å; I333-K335 WeakPolarHBondContact O-CD 3.45Å; I333-K335 VanDerWaalsContact O-CE 3.28Å; I333-K335 WeakPolarHBondContact O-CE 3.4Å; I333-K335 WeakPolarHBondContact O-CG 3.38Å; I333-K335 PolarHBondContact O-N 2.83Å; K335-W337 HydrophobicContact CB-CZ2 4.02Å; K335-W337 HydrophobicContact CD-CZ2 4Å; K335-W337 VanDerWaalsContact O-CD1 3.31Å; K335-W337 PolarHBondContact O-NE1 2.71Å
336	E	92.4	Very high	90.7	Very high	68 Å²	68	42.1 Å²	42.1	32%	0.318	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	139.6	180	-60	175.1	147.7	0	0	110.7	G316 Q317 C318 Y319 I325 L329 I330	G316-E336 WeakPolarHBondContact CA-OE2 3.39Å; Q317-E336 PolarHBondContact N-OE2 2.76Å; C318-E336 WeakPolarHBondContact CA-O 3.44Å; Y319-E336 WeakPolarHBondContact CB-O 3.47Å; Y319-E336 PolarHBondContact N-O 3.22Å; I325-E336 HydrophobicContact CD1-CB 3.95Å; L329-E336 HydrophobicContact CD1-CB 4.11Å; L329-E336 HydrophobicContact CD1-CG 4.15Å; L329-E336 HydrophobicContact CG-CB 4.47Å; I330-E336 CarbonylContact O-C 3.55Å; I330-E336 WeakPolarHBondContact O-CA 3.21Å
337	W	93.3	Very high	91.2	Very high	25 Å²	25	40.7 Å²	40.7	10%	0.095	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	143.8	-173.5	-47.8	81	0	0	0	110.6	Y319 A320 I330 A332 K335 F342	Y319-W337 AromaticContact CD1-CH2 3.43Å; Y319-W337 HydrophobicContact CD1-CH2 3.43Å; Y319-W337 VanDerWaalsContact CD1-CH2 3.43Å; Y319-W337 AromaticContact CD1-CZ2 3.92Å; Y319-W337 HydrophobicContact CD1-CZ2 3.92Å; Y319-W337 AromaticContact CD1-CZ3 3.79Å; Y319-W337 HydrophobicContact CD1-CZ3 3.79Å; Y319-W337 HydrophobicContact CE1-CH2 4.05Å; Y319-W337 HydrophobicContact CG-CH2 4.34Å; Y319-W337 HydrophobicContact CG-CZ2 4.49Å; A320-W337 HydrophobicContact CB-CE3 4.09Å; A320-W337 HydrophobicContact CB-CZ3 4.08Å; I330-W337 HydrophobicContact CB-CB 4.41Å; I330-W337 PolarHBondContact N-O 2.84Å; I330-W337 PolarHBondContact O-N 3.29Å; A332-W337 PolarHBondContact O-NE1 3.13Å; K335-W337 HydrophobicContact CB-CZ2 4.02Å; K335-W337 HydrophobicContact CD-CZ2 4Å; K335-W337 VanDerWaalsContact O-CD1 3.31Å; K335-W337 PolarHBondContact O-NE1 2.71Å; W337-F342 HydrophobicContact CB-CB 3.94Å; W337-F342 HydrophobicContact CB-CD2 4.44Å; W337-F342 AromaticContact CD1-CD2 3.87Å; W337-F342 AromaticContact CD2-CD2 3.84Å; W337-F342 HydrophobicContact CD2-CD2 3.84Å; W337-F342 AromaticContact CE2-CD2 3.93Å; W337-F342 HydrophobicContact CE3-CD2 4.4Å; W337-F342 HydrophobicContact CG-CB 4.22Å; W337-F342 AromaticContact CG-CD2 3.82Å; W337-F342 HydrophobicContact CG-CD2 3.82Å; W337-F342 HydrophobicContact CG-CG 4.39Å; W337-F342 AromaticContact NE1-CD2 3.94Å
338	H	93.2	Very high	91.7	Very high	27 Å²	27	47 Å²	47	13%	0.125	27%	0.267	C	S	.	.			trans	-64.7	146	155.9	-65.2	109.2	0	0	0	109.3	C318 C321 P324 E340 H341 F342	C318-H338 WeakPolarHBondContact CB-ND1 3.32Å; C318-H338 PolarHBondContact SG-N 3.23Å; C318-H338 VanDerWaalsContact SG-N 3.4Å; C318-H338 PolarHBondContact SG-ND1 3.32Å; C318-H338 VanDerWaalsContact SG-ND1 3.36Å; C321-H338 PolarHBondContact SG-ND1 2.95Å; P324-H338 PolarHBondContact O-NE2 3.47Å; H338-E340 VanDerWaalsContact C-N 3.27Å; H338-E340 VanDerWaalsContact CB-CD 3.48Å; H338-E340 WeakPolarHBondContact CB-OE1 3.36Å; H338-E340 WeakPolarHBondContact CB-OE2 3.44Å; H338-E340 IonicContact CD2-OE1 3.94Å; H338-E340 IonicContact CG-OE1 3.49Å; H338-E340 PolarHBondContact O-N 2.82Å; H338-H341 HydrophobicContact CB-CB 4.33Å; H338-H341 WeakPolarHBondContact CB-ND1 3.32Å; H338-H341 AromaticContact CG-ND1 3.7Å; H338-H341 AromaticContact ND1-CE1 3.79Å; H338-H341 AromaticContact ND1-ND1 3.31Å; H338-H341 PolarHBondContact ND1-ND1 3.46Å; H338-H341 PolarHBondContact O-N 2.98Å; H338-F342 PolarHBondContact O-N 3.02Å
339	P	91.4	Very high	92.1	Very high	37 Å²	37	46.9 Å²	46.9	24%	0.24	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-40.6	179.6	-27.2	35.4	0	0	0	114.1	T328 I330 H341 V352	T328-P339 HydrophobicContact CG2-CG 4.03Å; T328-P339 WeakPolarHBondContact O-CD 3.02Å; I330-P339 HydrophobicContact CG1-CB 4.33Å; I330-P339 HydrophobicContact CG1-CG 4.13Å; P339-H341 VanDerWaalsContact C-N 3.31Å; P339-H341 PolarHBondContact O-N 3.01Å; P339-V352 HydrophobicContact CB-CG2 4.13Å; P339-V352 WeakPolarHBondContact O-CG2 3.44Å
340	E	92.7	Very high	92.4	Very high	120 Å²	120	48.1 Å²	48.1	56%	0.561	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-18.2	179	70.4	-75.9	175.3	0	0	114.1	H338 T343	H338-E340 VanDerWaalsContact C-N 3.27Å; H338-E340 VanDerWaalsContact CB-CD 3.48Å; H338-E340 WeakPolarHBondContact CB-OE1 3.36Å; H338-E340 WeakPolarHBondContact CB-OE2 3.44Å; H338-E340 IonicContact CD2-OE1 3.94Å; H338-E340 IonicContact CG-OE1 3.49Å; H338-E340 PolarHBondContact O-N 2.82Å; E340-T343 WeakPolarHBondContact O-CG2 3.4Å
341	H	93.9	Very high	92.6	Very high	63 Å²	63	48.1 Å²	48.1	29%	0.292	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-19.1	177	-68.6	127.2	0	0	0	113.4	A320 C321 H338 P339 T343	A320-H341 HydrophobicContact CB-CB 3.77Å; C321-H341 VanDerWaalsContact SG-CE1 3.55Å; H338-H341 HydrophobicContact CB-CB 4.33Å; H338-H341 WeakPolarHBondContact CB-ND1 3.32Å; H338-H341 AromaticContact CG-ND1 3.7Å; H338-H341 AromaticContact ND1-CE1 3.79Å; H338-H341 AromaticContact ND1-ND1 3.31Å; H338-H341 PolarHBondContact ND1-ND1 3.46Å; H338-H341 PolarHBondContact O-N 2.98Å; P339-H341 VanDerWaalsContact C-N 3.31Å; P339-H341 PolarHBondContact O-N 3.01Å; H341-T343 VanDerWaalsContact C-N 3.3Å; H341-T343 PolarHBondContact O-N 3.48Å; H341-T343 PolarHBondContact O-OG1 3.42Å
342	F	94.8	Very high	92.6	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	27%	0.268	C	S	.	.			trans	-77.9	82	175.9	-168.5	-115.4	0	0	0	110.6	A269 I330 A332 I333 W337 H338 L351 V352 F356 A363	A269-F342 HydrophobicContact CB-CD1 4.43Å; A269-F342 HydrophobicContact CB-CE1 3.99Å; I330-F342 HydrophobicContact CG2-CD1 4.16Å; I330-F342 HydrophobicContact CG2-CG 4.26Å; A332-F342 HydrophobicContact CB-CD2 4.13Å; A332-F342 HydrophobicContact CB-CE1 4.13Å; A332-F342 HydrophobicContact CB-CE2 3.43Å; A332-F342 VanDerWaalsContact CB-CE2 3.43Å; A332-F342 HydrophobicContact CB-CZ 3.44Å; A332-F342 VanDerWaalsContact CB-CZ 3.44Å; I333-F342 HydrophobicContact CD1-CE2 4.44Å; W337-F342 HydrophobicContact CB-CB 3.94Å; W337-F342 HydrophobicContact CB-CD2 4.44Å; W337-F342 AromaticContact CD1-CD2 3.87Å; W337-F342 AromaticContact CD2-CD2 3.84Å; W337-F342 HydrophobicContact CD2-CD2 3.84Å; W337-F342 AromaticContact CE2-CD2 3.93Å; W337-F342 HydrophobicContact CE3-CD2 4.4Å; W337-F342 HydrophobicContact CG-CB 4.22Å; W337-F342 AromaticContact CG-CD2 3.82Å; W337-F342 HydrophobicContact CG-CD2 3.82Å; W337-F342 HydrophobicContact CG-CG 4.39Å; W337-F342 AromaticContact NE1-CD2 3.94Å; H338-F342 PolarHBondContact O-N 3.02Å; F342-L351 HydrophobicContact CD1-CB 3.61Å; F342-L351 HydrophobicContact CE1-CB 3.44Å; F342-L351 VanDerWaalsContact CE1-CB 3.44Å; F342-L351 HydrophobicContact CE1-CD1 4.32Å; F342-L351 HydrophobicContact CZ-CB 4.25Å; F342-L351 HydrophobicContact CZ-CD1 4.33Å; F342-L351 PolarHBondContact O-N 2.75Å; F342-V352 HydrophobicContact CB-CG2 4.15Å; F342-V352 HydrophobicContact CD1-CG2 4.26Å; F342-F356 AromaticContact CE1-CD1 3.8Å; F342-F356 HydrophobicContact CE1-CD1 3.8Å; F342-F356 AromaticContact CE1-CE1 3.85Å; F342-F356 HydrophobicContact CE1-CE1 3.85Å; F342-F356 HydrophobicContact CE1-CG 4.31Å; F342-F356 HydrophobicContact CE1-CZ 4.4Å; F342-F356 AromaticContact CZ-CD1 3.73Å; F342-F356 HydrophobicContact CZ-CD1 3.73Å; F342-F356 HydrophobicContact CZ-CD2 4.02Å; F342-F356 AromaticContact CZ-CE1 3.59Å; F342-F356 HydrophobicContact CZ-CE1 3.59Å; F342-F356 AromaticContact CZ-CE2 3.91Å; F342-F356 HydrophobicContact CZ-CE2 3.91Å; F342-F356 AromaticContact CZ-CG 3.94Å; F342-F356 HydrophobicContact CZ-CG 3.94Å; F342-F356 AromaticContact CZ-CZ 3.69Å; F342-F356 HydrophobicContact CZ-CZ 3.69Å; F342-A363 HydrophobicContact CE2-CB 3.84Å; F342-A363 HydrophobicContact CZ-CB 4.01Å
343	T	95.4	Very high	92.6	Very high	37 Å²	37	55.3 Å²	55.3	23%	0.227	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-125.7	155.5	-171.1	56.2	0	0	0	0	112	E340 H341 A345 R348 V349	E340-T343 WeakPolarHBondContact O-CG2 3.4Å; H341-T343 VanDerWaalsContact C-N 3.3Å; H341-T343 PolarHBondContact O-N 3.48Å; H341-T343 PolarHBondContact O-OG1 3.42Å; T343-A345 PolarHBondContact O-N 3.49Å; T343-R348 WeakPolarHBondContact CB-O 3.38Å; T343-R348 WeakPolarHBondContact CG2-O 3.29Å; T343-V349 CarbonylContact C-O 3.2Å; T343-V349 WeakPolarHBondContact CA-O 3.32Å
344	C	95.3	Very high	92.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.319	C	S	.	.			trans	-61.6	127.8	174.8	175	0	0	0	0	111.2	S346 C347 R348 V349 L351 A363 C365	C344-S346 PolarHBondContact O-N 2.91Å; C344-S346 PolarHBondContact SG-N 3.28Å; C344-C347 VanDerWaalsContact SG-SG 3.65Å; C344-R348 WeakPolarHBondContact O-CA 3.33Å; C344-R348 PolarHBondContact O-N 2.85Å; C344-V349 HydrophobicContact CB-CG1 3.95Å; C344-V349 PolarHBondContact N-O 3.31Å; C344-L351 HydrophobicContact CB-CD1 4.34Å; C344-L351 HydrophobicContact CB-CD2 4.26Å; C344-L351 HydrophobicContact CB-CG 4.43Å; C344-A363 CarbonylContact C-O 3.43Å; C344-A363 WeakPolarHBondContact CA-O 3.49Å; C344-C365 HydrophobicContact CB-CB 4.17Å; C344-C365 PolarHBondContact SG-N 3.17Å; C344-C365 VanDerWaalsContact SG-N 3.39Å
345	A	94.4	Very high	92.4	Very high	19 Å²	19	58.3 Å²	58.3	16%	0.157	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-33.7	179.2	0	0	0	0	0	113.7	T343 Q362 A363 Y364	T343-A345 PolarHBondContact O-N 3.49Å; A345-Q362 HydrophobicContact CB-CB 4.07Å; A345-Q362 VanDerWaalsContact CB-OE1 3.28Å; A345-A363 PolarHBondContact N-O 3.49Å; A345-Y364 HydrophobicContact CB-CD1 4.39Å; A345-Y364 HydrophobicContact CB-CE1 3.93Å
346	S	93.8	Very high	92.4	Very high	66 Å²	66	56.2 Å²	56.2	46%	0.462	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-62.1	178.8	173.8	0	0	0	0	113.1	C344 C368	C344-S346 PolarHBondContact O-N 2.91Å; C344-S346 PolarHBondContact SG-N 3.28Å; S346-C368 PolarHBondContact OG-SG 3.36Å
347	C	95.6	Very high	92.2	Very high	65 Å²	65	53.3 Å²	53.3	44%	0.439	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-0.8	-172.2	67.4	0	0	0	0	115.7	C344 V349	C344-C347 VanDerWaalsContact SG-SG 3.65Å; C347-V349 PolarHBondContact O-N 2.9Å; C347-V349 VanDerWaalsContact O-N 3.09Å; C347-V349 VanDerWaalsContact SG-CG1 3.54Å
348	R	94.7	Very high	92.1	Very high	170 Å²	170	55.9 Å²	55.9	64%	0.642	29%	0.285	S	S	*	.			trans	60.4	10.6	-179.8	-50.5	-61	177.8	-178.7	-2.7	116.5	T343 C344	T343-R348 WeakPolarHBondContact CB-O 3.38Å; T343-R348 WeakPolarHBondContact CG2-O 3.29Å; C344-R348 WeakPolarHBondContact O-CA 3.33Å; C344-R348 PolarHBondContact O-N 2.85Å
349	V	93.7	Very high	91.8	Very high	56 Å²	56	59.3 Å²	59.3	34%	0.339	30%	0.297	S	S	.	.			trans	-62.2	141.3	171.3	76.5	0	0	0	0	111.2	T343 C344 C347 L351 C365	T343-V349 CarbonylContact C-O 3.2Å; T343-V349 WeakPolarHBondContact CA-O 3.32Å; C344-V349 HydrophobicContact CB-CG1 3.95Å; C344-V349 PolarHBondContact N-O 3.31Å; C347-V349 PolarHBondContact O-N 2.9Å; C347-V349 VanDerWaalsContact O-N 3.09Å; C347-V349 VanDerWaalsContact SG-CG1 3.54Å; V349-L351 HydrophobicContact CG1-CD2 4.26Å; V349-C365 HydrophobicContact CG1-CB 3.83Å
350	G	93.7	Very high	91.6	Very high	39 Å²	39	63.2 Å²	63.2	40%	0.402	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-71.5	124.6	178.7	0	0	0	0	0	112.7
351	L	93.7	Very high	91.4	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.312	C	S	.	.			trans	-95.1	0.8	-171.3	-64.2	175	0	0	0	114	F342 C344 V349 R353 Q354 F356 A363 C365	F342-L351 HydrophobicContact CD1-CB 3.61Å; F342-L351 HydrophobicContact CE1-CB 3.44Å; F342-L351 VanDerWaalsContact CE1-CB 3.44Å; F342-L351 HydrophobicContact CE1-CD1 4.32Å; F342-L351 HydrophobicContact CZ-CB 4.25Å; F342-L351 HydrophobicContact CZ-CD1 4.33Å; F342-L351 PolarHBondContact O-N 2.75Å; C344-L351 HydrophobicContact CB-CD1 4.34Å; C344-L351 HydrophobicContact CB-CD2 4.26Å; C344-L351 HydrophobicContact CB-CG 4.43Å; V349-L351 HydrophobicContact CG1-CD2 4.26Å; L351-R353 PolarHBondContact O-N 2.85Å; L351-Q354 PolarHBondContact O-N 3.16Å; L351-F356 HydrophobicContact CB-CB 4.41Å; L351-F356 HydrophobicContact CD1-CB 3.86Å; L351-F356 HydrophobicContact CD1-CG 4.46Å; L351-F356 HydrophobicContact CD2-CB 4.16Å; L351-F356 HydrophobicContact CG-CB 4.38Å; L351-A363 HydrophobicContact CD1-CB 3.36Å; L351-C365 HydrophobicContact CD2-CB 3.62Å
352	V	89.7	Confident	91.2	Very high	18 Å²	18	63.3 Å²	63.3	11%	0.109	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.3	-171.1	-177	0	0	0	0	114.4	I330 P339 F342	I330-V352 HydrophobicContact CD1-CG1 3.56Å; I330-V352 HydrophobicContact CG1-CG1 4.06Å; I330-V352 HydrophobicContact CG1-CG2 4.17Å; P339-V352 HydrophobicContact CB-CG2 4.13Å; P339-V352 WeakPolarHBondContact O-CG2 3.44Å; F342-V352 HydrophobicContact CB-CG2 4.15Å; F342-V352 HydrophobicContact CD1-CG2 4.26Å
353	R	86.1	Confident	91.1	Very high	207 Å²	207	63.5 Å²	63.5	78%	0.781	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.5	21.5	177.9	-57.5	-176.8	-173.5	-108.8	10.5	112.1	L351	L351-R353 PolarHBondContact O-N 2.85Å
354	Q	85.3	Confident	91	Very high	93 Å²	93	63 Å²	63	44%	0.435	32%	0.315	S	S	.	.	S	Bend	trans	-131.2	146.7	-178	-65.2	-172	-24.7	0	0	109.2	L351 F356	L351-Q354 PolarHBondContact O-N 3.16Å; Q354-F356 PolarHBondContact O-N 3.02Å
355	D	87.2	Confident	90.9	Very high	67 Å²	67	63.6 Å²	63.6	36%	0.358	32%	0.319	S	S	.	.			trans	-55.8	136.6	166.9	-67.3	-4.2	0	0	0	109.4	N268	N268-D355 PolarHBondContact OD1-OD1 3.17Å
356	F	90.9	Very high	90.6	Very high	3 Å²	3	64.9 Å²	64.9	1%	0.013	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	159.3	173	74.9	-87.5	0	0	0	111.3	H267 A269 A332 I333 F342 L351 Q354 A363 Y364	H267-F356 HydrophobicContact CB-CD1 4.33Å; H267-F356 HydrophobicContact CB-CD2 4.31Å; H267-F356 HydrophobicContact CB-CE1 3.71Å; H267-F356 HydrophobicContact CB-CE2 3.67Å; H267-F356 HydrophobicContact CB-CZ 3.33Å; H267-F356 PolarHBondContact N-O 3.05Å; H267-F356 WeakPolarHBondContact O-CD1 3.32Å; H267-F356 WeakPolarHBondContact O-CE1 3.27Å; H267-F356 PolarHBondContact O-N 3.47Å; A269-F356 HydrophobicContact CB-CE1 4.16Å; A332-F356 HydrophobicContact CB-CE1 4.3Å; A332-F356 HydrophobicContact CB-CZ 3.83Å; I333-F356 HydrophobicContact CD1-CD2 4.47Å; I333-F356 HydrophobicContact CD1-CE2 4.02Å; I333-F356 HydrophobicContact CG1-CE2 3.76Å; I333-F356 HydrophobicContact CG1-CZ 4.41Å; F342-F356 AromaticContact CE1-CD1 3.8Å; F342-F356 HydrophobicContact CE1-CD1 3.8Å; F342-F356 AromaticContact CE1-CE1 3.85Å; F342-F356 HydrophobicContact CE1-CE1 3.85Å; F342-F356 HydrophobicContact CE1-CG 4.31Å; F342-F356 HydrophobicContact CE1-CZ 4.4Å; F342-F356 AromaticContact CZ-CD1 3.73Å; F342-F356 HydrophobicContact CZ-CD1 3.73Å; F342-F356 HydrophobicContact CZ-CD2 4.02Å; F342-F356 AromaticContact CZ-CE1 3.59Å; F342-F356 HydrophobicContact CZ-CE1 3.59Å; F342-F356 AromaticContact CZ-CE2 3.91Å; F342-F356 HydrophobicContact CZ-CE2 3.91Å; F342-F356 AromaticContact CZ-CG 3.94Å; F342-F356 HydrophobicContact CZ-CG 3.94Å; F342-F356 AromaticContact CZ-CZ 3.69Å; F342-F356 HydrophobicContact CZ-CZ 3.69Å; L351-F356 HydrophobicContact CB-CB 4.41Å; L351-F356 HydrophobicContact CD1-CB 3.86Å; L351-F356 HydrophobicContact CD1-CG 4.46Å; L351-F356 HydrophobicContact CD2-CB 4.16Å; L351-F356 HydrophobicContact CG-CB 4.38Å; Q354-F356 PolarHBondContact O-N 3.02Å; F356-A363 HydrophobicContact CD2-CB 4.1Å; F356-Y364 VanDerWaalsContact CA-O 3.31Å; F356-Y364 WeakPolarHBondContact CA-O 3.24Å; F356-Y364 WeakPolarHBondContact CB-O 3.28Å
357	Y	87.9	Confident	90.4	Very high	7 Å²	7	68.4 Å²	68.4	3%	0.027	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134.5	175.7	-67	-96.8	0	0	0	108.8	L264 R266 Y364 T366 H369	L264-Y357 HydrophobicContact CB-CE1 4.13Å; L264-Y357 HydrophobicContact CD2-CD1 4.14Å; L264-Y357 HydrophobicContact CD2-CE1 4Å; R266-Y357 HydrophobicContact CG-CE1 3.7Å; R266-Y357 HydrophobicContact CG-CE2 4.37Å; R266-Y357 PolarHBondContact NE-OH 2.93Å; Y357-Y364 PolarHBondContact N-O 3.3Å; Y357-Y364 PolarHBondContact O-N 3.07Å; Y357-T366 HydrophobicContact CE2-CG2 3.98Å; Y357-H369 WeakPolarHBondContact CB-CD2 3.45Å; Y357-H369 AromaticContact CD1-CG 3.98Å; Y357-H369 HydrophobicContact CD2-CB 3.76Å; Y357-H369 AromaticContact CD2-CG 3.87Å; Y357-H369 HydrophobicContact CE2-CB 4.49Å; Y357-H369 HydrophobicContact CG-CB 3.9Å; Y357-H369 AromaticContact CG-CD2 3.68Å; Y357-H369 AromaticContact CG-CG 3.5Å
358	E	91	Very high	90.2	Very high	78 Å²	78	65.9 Å²	65.9	36%	0.364	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129	172.7	-175.8	175.9	155.5	0	0	109.7	I333 Q362	I333-E358 WeakPolarHBondContact CA-OE2 3.39Å; I333-E358 HydrophobicContact CB-CG 4.47Å; I333-E358 HydrophobicContact CD1-CB 4.39Å; I333-E358 HydrophobicContact CD1-CG 4.08Å; I333-E358 HydrophobicContact CG1-CB 4.25Å; I333-E358 HydrophobicContact CG1-CG 3.93Å; I333-E358 WeakPolarHBondContact CG1-OE2 3.46Å; I333-E358 HydrophobicContact CG2-CG 3.92Å; I333-E358 VanDerWaalsContact CG2-OE1 3.31Å; I333-E358 WeakPolarHBondContact CG2-OE1 3.01Å; I333-E358 WeakPolarHBondContact CG2-OE2 3.44Å; E358-Q362 WeakPolarHBondContact CA-O 3.44Å
359	R	86.3	Confident	89.9	Confident	99 Å²	99	58.3 Å²	58.3	37%	0.374	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	133.7	167.9	-172.1	170.7	177.1	139.8	-1.7	109.3	N361 Q362 Y364	R359-N361 VanDerWaalsContact C-N 3.27Å; R359-N361 PolarHBondContact O-N 3.5Å; R359-Q362 PolarHBondContact N-O 2.88Å; R359-Q362 WeakPolarHBondContact O-CA 2.98Å; R359-Q362 WeakPolarHBondContact O-CB 3.41Å; R359-Q362 PolarHBondContact O-N 3.32Å; R359-Y364 HydrophobicContact CB-CD2 4.3Å; R359-Y364 HydrophobicContact CB-CE2 4.1Å
360	D	87.9	Confident	89.4	Confident	119 Å²	119	56.9 Å²	56.9	64%	0.636	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	42.4	179.8	-52.4	-43.8	0	0	0	113.7	Q362	D360-Q362 PolarHBondContact O-N 2.95Å
361	N	87.2	Confident	89	Confident	93 Å²	93	62 Å²	62	50%	0.497	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	18.6	-172.7	-67.2	-89.8	0	0	0	115.4	I333 R359	I333-N361 HydrophobicContact CG2-CB 4.46Å; R359-N361 VanDerWaalsContact C-N 3.27Å; R359-N361 PolarHBondContact O-N 3.5Å
362	Q	91.2	Very high	88.6	Confident	92 Å²	92	67.6 Å²	67.6	43%	0.43	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.1	179.8	-65.1	-180	54.3	0	0	111.8	A345 E358 R359 D360 Y364	A345-Q362 HydrophobicContact CB-CB 4.07Å; A345-Q362 VanDerWaalsContact CB-OE1 3.28Å; E358-Q362 WeakPolarHBondContact CA-O 3.44Å; R359-Q362 PolarHBondContact N-O 2.88Å; R359-Q362 WeakPolarHBondContact O-CA 2.98Å; R359-Q362 WeakPolarHBondContact O-CB 3.41Å; R359-Q362 PolarHBondContact O-N 3.32Å; D360-Q362 PolarHBondContact O-N 2.95Å; Q362-Y364 HydrophobicContact CB-CE2 3.77Å
363	A	92.9	Very high	88.5	Confident	6 Å²	6	69.2 Å²	69.2	5%	0.05	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	129.8	177.8	0	0	0	0	0	110.9	I333 F342 C344 A345 L351 F356	I333-A363 HydrophobicContact CD1-CB 3.54Å; F342-A363 HydrophobicContact CE2-CB 3.84Å; F342-A363 HydrophobicContact CZ-CB 4.01Å; C344-A363 CarbonylContact C-O 3.43Å; C344-A363 WeakPolarHBondContact CA-O 3.49Å; A345-A363 PolarHBondContact N-O 3.49Å; L351-A363 HydrophobicContact CD1-CB 3.36Å; F356-A363 HydrophobicContact CD2-CB 4.1Å
364	Y	93.6	Very high	88.4	Confident	27 Å²	27	60.3 Å²	60.3	11%	0.106	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.2	173.3	-63.7	-92.5	0	0	0	110.5	A345 F356 Y357 R359 Q362 C368 F373	A345-Y364 HydrophobicContact CB-CD1 4.39Å; A345-Y364 HydrophobicContact CB-CE1 3.93Å; F356-Y364 VanDerWaalsContact CA-O 3.31Å; F356-Y364 WeakPolarHBondContact CA-O 3.24Å; F356-Y364 WeakPolarHBondContact CB-O 3.28Å; Y357-Y364 PolarHBondContact N-O 3.3Å; Y357-Y364 PolarHBondContact O-N 3.07Å; R359-Y364 HydrophobicContact CB-CD2 4.3Å; R359-Y364 HydrophobicContact CB-CE2 4.1Å; Q362-Y364 HydrophobicContact CB-CE2 3.77Å; Y364-C368 HydrophobicContact CD1-CB 4.4Å; Y364-F373 AromaticContact CD1-CE2 4Å; Y364-F373 HydrophobicContact CD1-CE2 4Å; Y364-F373 AromaticContact CD2-CE2 3.93Å; Y364-F373 HydrophobicContact CD2-CE2 3.93Å; Y364-F373 AromaticContact CE1-CE2 3.96Å; Y364-F373 HydrophobicContact CE1-CE2 3.96Å; Y364-F373 HydrophobicContact CE1-CZ 4.04Å; Y364-F373 AromaticContact CE2-CE2 3.89Å; Y364-F373 HydrophobicContact CE2-CE2 3.89Å; Y364-F373 HydrophobicContact CE2-CZ 4.07Å; Y364-F373 AromaticContact CG-CE2 3.99Å; Y364-F373 HydrophobicContact CG-CE2 3.99Å; Y364-F373 AromaticContact CZ-CE2 3.91Å; Y364-F373 AromaticContact CZ-CZ 3.79Å
365	C	92.8	Very high	88.5	Confident	11 Å²	11	57.9 Å²	57.9	7%	0.074	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	155.3	166.5	69	0	0	0	0	109.5	C344 V349 L351 Q367 C368 H369	C344-C365 HydrophobicContact CB-CB 4.17Å; C344-C365 PolarHBondContact SG-N 3.17Å; C344-C365 VanDerWaalsContact SG-N 3.39Å; V349-C365 HydrophobicContact CG1-CB 3.83Å; L351-C365 HydrophobicContact CD2-CB 3.62Å; C365-Q367 VanDerWaalsContact C-N 3.27Å; C365-Q367 PolarHBondContact O-N 3.37Å; C365-Q367 VanDerWaalsContact O-N 3.16Å; C365-C368 PolarHBondContact O-N 3.3Å; C365-C368 VanDerWaalsContact O-N 3.08Å; C365-C368 VanDerWaalsContact SG-SG 3.67Å; C365-H369 PolarHBondContact O-N 3.27Å
366	T	87.5	Confident	88.6	Confident	46 Å²	46	62.1 Å²	62.1	28%	0.282	30%	0.297	S	S	.	.	H	α-helix	trans	-45.7	-48.3	179.3	-52.3	0	0	0	0	113.1	Y357 C368 H369 L370	Y357-T366 HydrophobicContact CE2-CG2 3.98Å; T366-C368 PolarHBondContact O-N 3.25Å; T366-H369 PolarHBondContact O-N 3.21Å; T366-L370 HydrophobicContact CG2-CD1 3.82Å; T366-L370 HydrophobicContact CG2-CG 4.35Å; T366-L370 WeakPolarHBondContact O-CB 3.46Å; T366-L370 VanDerWaalsContact O-CG 3.27Å; T366-L370 WeakPolarHBondContact O-CG 3.34Å; T366-L370 PolarHBondContact O-N 3.19Å
367	Q	89.1	Confident	88.6	Confident	140 Å²	140	62.2 Å²	62.2	65%	0.654	30%	0.297	S	S	*	.	H	α-helix	trans	-63	-44.1	-178.6	-171.2	62	30.8	0	0	113.2	C365 K371	C365-Q367 VanDerWaalsContact C-N 3.27Å; C365-Q367 PolarHBondContact O-N 3.37Å; C365-Q367 VanDerWaalsContact O-N 3.16Å; Q367-K371 VanDerWaalsContact O-CB 3.22Å; Q367-K371 WeakPolarHBondContact O-CB 3.05Å; Q367-K371 PolarHBondContact O-N 2.96Å; Q367-K371 VanDerWaalsContact O-N 3.09Å
368	C	91.8	Very high	88.6	Confident	13 Å²	13	63.1 Å²	63.1	9%	0.088	31%	0.309	C	S	.	.	H	α-helix	trans	-70.6	-38	177.6	-76.2	0	0	0	0	111.5	S346 Y364 C365 T366 M372	S346-C368 PolarHBondContact OG-SG 3.36Å; Y364-C368 HydrophobicContact CD1-CB 4.4Å; C365-C368 PolarHBondContact O-N 3.3Å; C365-C368 VanDerWaalsContact O-N 3.08Å; C365-C368 VanDerWaalsContact SG-SG 3.67Å; T366-C368 PolarHBondContact O-N 3.25Å; C368-M372 WeakPolarHBondContact O-CB 3.27Å; C368-M372 WeakPolarHBondContact O-CG 3.36Å; C368-M372 PolarHBondContact O-N 2.78Å; C368-M372 VanDerWaalsContact O-N 3.11Å
369	H	87.9	Confident	88.6	Confident	11 Å²	11	66.4 Å²	66.4	5%	0.051	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-54.6	177.2	-176.5	-76.7	0	0	0	110.9	L264 Y357 C365 T366 K371 M372 F373	L264-H369 WeakPolarHBondContact CD2-CE1 3.41Å; Y357-H369 WeakPolarHBondContact CB-CD2 3.45Å; Y357-H369 AromaticContact CD1-CG 3.98Å; Y357-H369 HydrophobicContact CD2-CB 3.76Å; Y357-H369 AromaticContact CD2-CG 3.87Å; Y357-H369 HydrophobicContact CE2-CB 4.49Å; Y357-H369 HydrophobicContact CG-CB 3.9Å; Y357-H369 AromaticContact CG-CD2 3.68Å; Y357-H369 AromaticContact CG-CG 3.5Å; C365-H369 PolarHBondContact O-N 3.27Å; T366-H369 PolarHBondContact O-N 3.21Å; H369-K371 PolarHBondContact O-N 2.93Å; H369-M372 PolarHBondContact O-N 3.46Å; H369-F373 HydrophobicContact CB-CD2 4.45Å; H369-F373 AromaticContact CD2-CD2 3.48Å; H369-F373 VanDerWaalsContact CD2-CD2 3.48Å; H369-F373 WeakPolarHBondContact CD2-CD2 3.27Å; H369-F373 AromaticContact CG-CD2 3.97Å; H369-F373 AromaticContact NE2-CD2 3.66Å; H369-F373 WeakPolarHBondContact O-CB 3.33Å; H369-F373 WeakPolarHBondContact O-CD2 3.4Å; H369-F373 PolarHBondContact O-N 2.91Å
370	L	84.8	Confident	88.9	Confident	26 Å²	26	64.1 Å²	64.1	14%	0.136	32%	0.318	C	S	.	.	H	α-helix	trans	-59	-47.2	179.7	-64.6	172.9	0	0	0	111.3	T366 M372 S374 V385	T366-L370 HydrophobicContact CG2-CD1 3.82Å; T366-L370 HydrophobicContact CG2-CG 4.35Å; T366-L370 WeakPolarHBondContact O-CB 3.46Å; T366-L370 VanDerWaalsContact O-CG 3.27Å; T366-L370 WeakPolarHBondContact O-CG 3.34Å; T366-L370 PolarHBondContact O-N 3.19Å; L370-M372 VanDerWaalsContact C-N 3.29Å; L370-M372 PolarHBondContact O-N 3.42Å; L370-S374 WeakPolarHBondContact CD2-OG 3.46Å; L370-S374 WeakPolarHBondContact O-CB 3.28Å; L370-S374 PolarHBondContact O-N 3Å; L370-S374 VanDerWaalsContact O-N 3.07Å; L370-S374 PolarHBondContact O-OG 2.97Å; L370-V385 HydrophobicContact CB-CG2 4.34Å; L370-V385 HydrophobicContact CD1-CG1 3.72Å; L370-V385 HydrophobicContact CD1-CG2 4.14Å; L370-V385 HydrophobicContact CD2-CG1 3.97Å; L370-V385 HydrophobicContact CD2-CG2 4.15Å; L370-V385 HydrophobicContact CG-CG1 4.46Å; L370-V385 HydrophobicContact CG-CG2 4.44Å
371	K	84.6	Confident	89	Confident	145 Å²	145	60 Å²	60	63%	0.63	30%	0.304	S	S	*	.	H	α-helix	trans	-59.7	-35.9	-179.8	-178.8	176.1	177.8	179.6	0	113.8	Q367 H369	Q367-K371 VanDerWaalsContact O-CB 3.22Å; Q367-K371 WeakPolarHBondContact O-CB 3.05Å; Q367-K371 PolarHBondContact O-N 2.96Å; Q367-K371 VanDerWaalsContact O-N 3.09Å; H369-K371 PolarHBondContact O-N 2.93Å
372	M	85.9	Confident	89.1	Confident	118 Å²	118	61.5 Å²	61.5	58%	0.581	31%	0.307	S	S	*	.	H	α-helix	trans	-95.2	-29.1	-173.3	-63.4	-62	-64	0	0	113.5	C368 H369 L370	C368-M372 WeakPolarHBondContact O-CB 3.27Å; C368-M372 WeakPolarHBondContact O-CG 3.36Å; C368-M372 PolarHBondContact O-N 2.78Å; C368-M372 VanDerWaalsContact O-N 3.11Å; H369-M372 PolarHBondContact O-N 3.46Å; L370-M372 VanDerWaalsContact C-N 3.29Å; L370-M372 PolarHBondContact O-N 3.42Å
373	F	86.2	Confident	88.9	Confident	53 Å²	53	58.3 Å²	58.3	23%	0.232	30%	0.297	C	S	.	.	H	α-helix	trans	-129.3	-8.9	-165.2	-50.9	-56.3	0	0	0	115.1	Y364 H369	Y364-F373 AromaticContact CD1-CE2 4Å; Y364-F373 HydrophobicContact CD1-CE2 4Å; Y364-F373 AromaticContact CD2-CE2 3.93Å; Y364-F373 HydrophobicContact CD2-CE2 3.93Å; Y364-F373 AromaticContact CE1-CE2 3.96Å; Y364-F373 HydrophobicContact CE1-CE2 3.96Å; Y364-F373 HydrophobicContact CE1-CZ 4.04Å; Y364-F373 AromaticContact CE2-CE2 3.89Å; Y364-F373 HydrophobicContact CE2-CE2 3.89Å; Y364-F373 HydrophobicContact CE2-CZ 4.07Å; Y364-F373 AromaticContact CG-CE2 3.99Å; Y364-F373 HydrophobicContact CG-CE2 3.99Å; Y364-F373 AromaticContact CZ-CE2 3.91Å; Y364-F373 AromaticContact CZ-CZ 3.79Å; H369-F373 HydrophobicContact CB-CD2 4.45Å; H369-F373 AromaticContact CD2-CD2 3.48Å; H369-F373 VanDerWaalsContact CD2-CD2 3.48Å; H369-F373 WeakPolarHBondContact CD2-CD2 3.27Å; H369-F373 AromaticContact CG-CD2 3.97Å; H369-F373 AromaticContact NE2-CD2 3.66Å; H369-F373 WeakPolarHBondContact O-CB 3.33Å; H369-F373 WeakPolarHBondContact O-CD2 3.4Å; H369-F373 PolarHBondContact O-N 2.91Å
374	S	85	Confident	88.6	Confident	20 Å²	20	58.4 Å²	58.4	14%	0.14	30%	0.296	C	S	.	.	S	Bend	trans	-66.3	142.4	169.4	-79.2	0	0	0	0	110.7	L370 V384	L370-S374 WeakPolarHBondContact CD2-OG 3.46Å; L370-S374 WeakPolarHBondContact O-CB 3.28Å; L370-S374 PolarHBondContact O-N 3Å; L370-S374 VanDerWaalsContact O-N 3.07Å; L370-S374 PolarHBondContact O-OG 2.97Å; S374-V384 WeakPolarHBondContact CB-O 3.36Å; S374-V384 PolarHBondContact OG-O 3.06Å
375	P	86.3	Confident	87.8	Confident	42 Å²	42	59.9 Å²	59.9	27%	0.273	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-66.6	149	174.7	31.8	-36.1	0	0	0	110.1	V384 A395	P375-V384 HydrophobicContact CG-CB 4.47Å; P375-V384 PolarHBondContact O-N 3.49Å; P375-A395 HydrophobicContact CB-CB 3.62Å; P375-A395 HydrophobicContact CG-CB 3.66Å
376	R	89.4	Confident	86.8	Confident	156 Å²	156	67.8 Å²	67.8	59%	0.589	34%	0.344	S	S	*	.	B	Isolated β-bridge	trans	-89.2	136.2	-178.3	-69	-175.9	176.7	-77.3	-8	111.6	G378 G381 E382	R376-G378 PolarHBondContact O-N 3.4Å; R376-G381 WeakPolarHBondContact CB-O 3.21Å; R376-G381 WeakPolarHBondContact CD-O 3.37Å; R376-G381 WeakPolarHBondContact CG-O 3.43Å; R376-G381 PolarHBondContact NH1-O 3.28Å; R376-E382 CarbonylContact C-O 3.59Å; R376-E382 WeakPolarHBondContact CA-O 3.43Å
377	C	91.5	Very high	86.4	Confident	4 Å²	4	71.8 Å²	71.8	3%	0.027	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-61.6	126	177.3	179.4	0	0	0	0	110.5	Y379 C380 G381 E382 V384 A395 H400	C377-Y379 PolarHBondContact O-N 2.87Å; C377-Y379 VanDerWaalsContact O-N 3.08Å; C377-Y379 PolarHBondContact SG-N 3.11Å; C377-C380 VanDerWaalsContact CB-SG 3.52Å; C377-G381 WeakPolarHBondContact O-CA 3.21Å; C377-G381 PolarHBondContact O-N 3.31Å; C377-E382 PolarHBondContact N-O 3.19Å; C377-V384 HydrophobicContact CB-CG2 3.72Å; C377-A395 CarbonylContact C-O 3.31Å; C377-A395 VanDerWaalsContact CA-O 3.29Å; C377-A395 WeakPolarHBondContact CA-O 3.33Å; C377-H400 PolarHBondContact SG-ND1 3.42Å; C377-H400 VanDerWaalsContact SG-ND1 3.37Å
378	G	88.1	Confident	86	Confident	26 Å²	26	66.9 Å²	66.9	27%	0.268	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.3	178.3	0	0	0	0	0	115.3	R376 A395	R376-G378 PolarHBondContact O-N 3.4Å; G378-A395 PolarHBondContact N-O 2.88Å
379	Y	91	Very high	85.6	Confident	148 Å²	148	67.2 Å²	67.2	58%	0.58	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-55.3	178.2	-176	-104.5	0	0	0	112.8	C377 H400 F402	C377-Y379 PolarHBondContact O-N 2.87Å; C377-Y379 VanDerWaalsContact O-N 3.08Å; C377-Y379 PolarHBondContact SG-N 3.11Å; Y379-H400 HydrophobicContact CD1-CB 4.08Å; Y379-H400 AromaticContact CD1-CD2 3.68Å; Y379-H400 AromaticContact CD1-CG 3.61Å; Y379-H400 AromaticContact CD1-ND1 3.8Å; Y379-H400 AromaticContact CD1-NE2 3.91Å; Y379-H400 HydrophobicContact CG-CB 4.19Å; Y379-F402 HydrophobicContact CE2-CE1 4.37Å; Y379-F402 AromaticContact CE2-CZ 3.94Å; Y379-F402 HydrophobicContact CE2-CZ 3.94Å; Y379-F402 AromaticContact CZ-CZ 4Å
380	C	92.8	Very high	85.4	Confident	51 Å²	51	68.3 Å²	68.3	35%	0.345	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-6.7	-173.3	71.6	0	0	0	0	115.2	C377 E382 H397 H400	C377-C380 VanDerWaalsContact CB-SG 3.52Å; C380-E382 PolarHBondContact O-N 3.33Å; C380-E382 VanDerWaalsContact O-N 3.11Å; C380-H397 VanDerWaalsContact SG-CE1 3.55Å; C380-H400 PolarHBondContact SG-CE1 2.85Å; C380-H400 PolarHBondContact SG-ND1 3.15Å; C380-H400 VanDerWaalsContact SG-ND1 3.42Å
381	G	89.8	Confident	85.1	Confident	33 Å²	33	67.1 Å²	67.1	34%	0.34	34%	0.34	S	S	.	.			trans	74.4	-10.7	-179.9	0	0	0	0	0	116.2	R376 C377	R376-G381 WeakPolarHBondContact CB-O 3.21Å; R376-G381 WeakPolarHBondContact CD-O 3.37Å; R376-G381 WeakPolarHBondContact CG-O 3.43Å; R376-G381 PolarHBondContact NH1-O 3.28Å; C377-G381 WeakPolarHBondContact O-CA 3.21Å; C377-G381 PolarHBondContact O-N 3.31Å
382	E	89.2	Confident	84.9	Confident	124 Å²	124	62 Å²	62	58%	0.579	32%	0.319	S	S	*	.	S	Bend	trans	-74.8	160.5	178.1	-66.9	-54.2	146.2	0	0	113.4	R376 C377 C380 V384	R376-E382 CarbonylContact C-O 3.59Å; R376-E382 WeakPolarHBondContact CA-O 3.43Å; C377-E382 PolarHBondContact N-O 3.19Å; C380-E382 PolarHBondContact O-N 3.33Å; C380-E382 VanDerWaalsContact O-N 3.11Å; E382-V384 PolarHBondContact O-N 3.06Å
383	A	86.8	Confident	84.6	Confident	25 Å²	25	61.1 Å²	61.1	21%	0.207	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-64	122.2	178.3	0	0	0	0	0	111.4	V385 H397	A383-V385 HydrophobicContact CB-CG2 4.5Å; A383-V385 PolarHBondContact O-N 3.09Å; A383-H397 PolarHBondContact O-NE2 3.05Å
384	V	85.6	Confident	84.5	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.042	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-77.7	118.4	171.7	-174.4	0	0	0	0	108.6	S374 P375 C377 E382 K387 C388 A395	S374-V384 WeakPolarHBondContact CB-O 3.36Å; S374-V384 PolarHBondContact OG-O 3.06Å; P375-V384 HydrophobicContact CG-CB 4.47Å; P375-V384 PolarHBondContact O-N 3.49Å; C377-V384 HydrophobicContact CB-CG2 3.72Å; E382-V384 PolarHBondContact O-N 3.06Å; V384-K387 WeakPolarHBondContact CG1-O 3.42Å; V384-C388 HydrophobicContact CB-CB 4.44Å; V384-C388 HydrophobicContact CG1-CB 3.44Å; V384-C388 VanDerWaalsContact CG1-CB 3.44Å; V384-A395 HydrophobicContact CB-CB 4.47Å; V384-A395 HydrophobicContact CG2-CB 4.08Å
385	V	76.7	Confident	84.7	Confident	59 Å²	59	65 Å²	65	36%	0.358	34%	0.342	S	S	.	.			trans	-114.6	139.8	-176.5	-179.8	0	0	0	0	108.8	L370 A383 K387	L370-V385 HydrophobicContact CB-CG2 4.34Å; L370-V385 HydrophobicContact CD1-CG1 3.72Å; L370-V385 HydrophobicContact CD1-CG2 4.14Å; L370-V385 HydrophobicContact CD2-CG1 3.97Å; L370-V385 HydrophobicContact CD2-CG2 4.15Å; L370-V385 HydrophobicContact CG-CG1 4.46Å; L370-V385 HydrophobicContact CG-CG2 4.44Å; A383-V385 HydrophobicContact CB-CG2 4.5Å; A383-V385 PolarHBondContact O-N 3.09Å; V385-K387 PolarHBondContact O-N 2.92Å
386	E	72.9	Confident	84.9	Confident	177 Å²	177	63.7 Å²	63.7	83%	0.827	33%	0.332	S	S	*	.	S	Bend	trans	60.9	-85.4	-176.9	-66	163	-160.1	0	0	114.3
387	K	78.5	Confident	84.8	Confident	130 Å²	130	57.6 Å²	57.6	57%	0.565	31%	0.31	S	S	*	.			trans	-94.8	120.1	-175.1	-65.1	-173.6	-178.6	-174	0	110.1	V384 V385 P398	V384-K387 WeakPolarHBondContact CG1-O 3.42Å; V385-K387 PolarHBondContact O-N 2.92Å; K387-P398 HydrophobicContact CB-CG 3.99Å; K387-P398 WeakPolarHBondContact O-CD 3.4Å
388	C	80.6	Confident	84.6	Confident	37 Å²	37	59.4 Å²	59.4	25%	0.25	32%	0.321	C	S	.	.			trans	-116.2	150.6	168.9	65.8	0	0	0	0	110.6	V384 L390 A395 W396	V384-C388 HydrophobicContact CB-CB 4.44Å; V384-C388 HydrophobicContact CG1-CB 3.44Å; V384-C388 VanDerWaalsContact CG1-CB 3.44Å; C388-L390 HydrophobicContact CB-CD2 4.41Å; C388-A395 HydrophobicContact CB-CB 4.41Å; C388-W396 WeakPolarHBondContact CA-O 3.46Å
389	V	84.1	Confident	84.6	Confident	20 Å²	20	63.4 Å²	63.4	12%	0.121	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.4	155.4	179.9	0	0	0	0	106.8	A391 A395 W396 P398 F401	V389-A391 HydrophobicContact CG1-CB 4.44Å; V389-A395 CarbonylContact O-C 3.51Å; V389-A395 WeakPolarHBondContact O-CA 3.34Å; V389-W396 HydrophobicContact CB-CB 4.37Å; V389-W396 PolarHBondContact N-O 3.36Å; V389-W396 PolarHBondContact O-N 3.15Å; V389-P398 HydrophobicContact CG2-CB 4.43Å; V389-P398 HydrophobicContact CG2-CG 4.5Å; V389-F401 HydrophobicContact CB-CB 4.38Å; V389-F401 HydrophobicContact CB-CD1 4.37Å; V389-F401 HydrophobicContact CB-CG 4.44Å; V389-F401 HydrophobicContact CG1-CB 4.49Å; V389-F401 HydrophobicContact CG1-CD1 3.63Å; V389-F401 HydrophobicContact CG1-CE1 4Å; V389-F401 HydrophobicContact CG1-CG 4.04Å; V389-F401 HydrophobicContact CG2-CB 4.45Å
390	L	84.1	Confident	84.6	Confident	33 Å²	33	58.4 Å²	58.4	17%	0.173	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	112.5	173.2	-59.9	-175.3	0	0	0	108.8	V235 V260 C388 A395	V235-L390 WeakPolarHBondContact CG2-O 3.06Å; V260-L390 HydrophobicContact CG1-CD1 3.88Å; V260-L390 HydrophobicContact CG1-CD2 3.71Å; V260-L390 HydrophobicContact CG1-CG 4.48Å; C388-L390 HydrophobicContact CB-CD2 4.41Å; L390-A395 HydrophobicContact CD2-CB 3.99Å
391	A	78.6	Confident	84.5	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	137.9	-179.2	0	0	0	0	0	110.4	V389 A393 R394 W396 F401	V389-A391 HydrophobicContact CG1-CB 4.44Å; A391-A393 VanDerWaalsContact C-N 3.34Å; A391-A393 PolarHBondContact O-N 3.4Å; A391-R394 PolarHBondContact N-O 3.01Å; A391-R394 PolarHBondContact O-N 2.92Å; A391-R394 VanDerWaalsContact O-O 3.07Å; A391-W396 PolarHBondContact O-NE1 3.49Å; A391-F401 HydrophobicContact CB-CD2 4.33Å; A391-F401 HydrophobicContact CB-CE1 4.27Å; A391-F401 HydrophobicContact CB-CE2 3.55Å; A391-F401 HydrophobicContact CB-CZ 3.52Å
392	L	79.2	Confident	84.5	Confident	37 Å²	37	56.4 Å²	56.4	19%	0.194	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	47.9	-177.7	-58.8	-169.2	0	0	0	114	V38 K40 I237 R394 E418 F423	V38-L392 HydrophobicContact CB-CD2 4.15Å; V38-L392 HydrophobicContact CG1-CD2 3.57Å; V38-L392 HydrophobicContact CG1-CG 4.11Å; K40-L392 HydrophobicContact CG-CD2 4.48Å; I237-L392 HydrophobicContact CD1-CD2 3.93Å; L392-R394 PolarHBondContact O-N 3.4Å; L392-R394 VanDerWaalsContact O-N 3.13Å; L392-E418 HydrophobicContact CD1-CB 3.99Å; L392-E418 HydrophobicContact CD1-CG 3.7Å; L392-F423 HydrophobicContact CD1-CE1 3.62Å; L392-F423 HydrophobicContact CD1-CZ 4.11Å; L392-F423 HydrophobicContact CG-CE1 4.17Å
393	A	79.9	Confident	84.7	Confident	100 Å²	100	50.5 Å²	50.5	83%	0.826	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	27	-177.8	0	0	0	0	0	114.5	A391	A391-A393 VanDerWaalsContact C-N 3.34Å; A391-A393 PolarHBondContact O-N 3.4Å
394	R	85.2	Confident	85.1	Confident	151 Å²	151	54.2 Å²	54.2	57%	0.57	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	151.7	175.3	-73.9	-178.2	165.9	178.2	-3.8	110.9	A391 L392 W396	A391-R394 PolarHBondContact N-O 3.01Å; A391-R394 PolarHBondContact O-N 2.92Å; A391-R394 VanDerWaalsContact O-O 3.07Å; L392-R394 PolarHBondContact O-N 3.4Å; L392-R394 VanDerWaalsContact O-N 3.13Å; R394-W396 HydrophobicContact CB-CZ2 4.02Å; R394-W396 VanDerWaalsContact O-CD1 3.31Å; R394-W396 PolarHBondContact O-NE1 3Å
395	A	88.1	Confident	85.4	Confident	5 Å²	5	58 Å²	58	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	148.6	166	0	0	0	0	0	110.3	P375 C377 G378 V384 C388 V389 L390	P375-A395 HydrophobicContact CB-CB 3.62Å; P375-A395 HydrophobicContact CG-CB 3.66Å; C377-A395 CarbonylContact C-O 3.31Å; C377-A395 VanDerWaalsContact CA-O 3.29Å; C377-A395 WeakPolarHBondContact CA-O 3.33Å; G378-A395 PolarHBondContact N-O 2.88Å; V384-A395 HydrophobicContact CB-CB 4.47Å; V384-A395 HydrophobicContact CG2-CB 4.08Å; C388-A395 HydrophobicContact CB-CB 4.41Å; V389-A395 CarbonylContact O-C 3.51Å; V389-A395 WeakPolarHBondContact O-CA 3.34Å; L390-A395 HydrophobicContact CD2-CB 3.99Å
396	W	89.8	Confident	86.3	Confident	14 Å²	14	57.8 Å²	57.8	5%	0.053	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.7	177.1	-51	81.5	0	0	0	108.4	C388 V389 A391 R394 F401 F423	C388-W396 WeakPolarHBondContact CA-O 3.46Å; V389-W396 HydrophobicContact CB-CB 4.37Å; V389-W396 PolarHBondContact N-O 3.36Å; V389-W396 PolarHBondContact O-N 3.15Å; A391-W396 PolarHBondContact O-NE1 3.49Å; R394-W396 HydrophobicContact CB-CZ2 4.02Å; R394-W396 VanDerWaalsContact O-CD1 3.31Å; R394-W396 PolarHBondContact O-NE1 3Å; W396-F401 HydrophobicContact CB-CB 4.02Å; W396-F401 HydrophobicContact CB-CD2 4.43Å; W396-F401 HydrophobicContact CD2-CD2 4.08Å; W396-F401 HydrophobicContact CG-CB 4.46Å; W396-F401 AromaticContact CG-CD2 3.97Å; W396-F401 HydrophobicContact CG-CD2 3.97Å; W396-F423 HydrophobicContact CE3-CE2 4.5Å; W396-F423 AromaticContact CH2-CE2 3.48Å; W396-F423 HydrophobicContact CH2-CE2 3.48Å; W396-F423 VanDerWaalsContact CH2-CE2 3.48Å; W396-F423 AromaticContact CH2-CZ 3.73Å; W396-F423 HydrophobicContact CH2-CZ 3.73Å; W396-F423 AromaticContact CZ2-CE2 3.82Å; W396-F423 HydrophobicContact CZ2-CE2 3.82Å; W396-F423 AromaticContact CZ2-CZ 3.59Å; W396-F423 HydrophobicContact CZ2-CZ 3.59Å; W396-F423 AromaticContact CZ3-CE2 3.84Å; W396-F423 HydrophobicContact CZ3-CE2 3.84Å; W396-F423 HydrophobicContact CZ3-CZ 4.46Å
397	H	88	Confident	87.2	Confident	28 Å²	28	55.7 Å²	55.7	13%	0.13	28%	0.28	C	S	.	.			trans	-66.7	145.4	160.1	-55.8	130.5	0	0	0	108.3	C380 A383 E399 H400 F401	C380-H397 VanDerWaalsContact SG-CE1 3.55Å; A383-H397 PolarHBondContact O-NE2 3.05Å; H397-E399 VanDerWaalsContact CB-CD 3.44Å; H397-E399 HydrophobicContact CB-CG 4.47Å; H397-E399 WeakPolarHBondContact CB-OE1 3.43Å; H397-E399 WeakPolarHBondContact CB-OE2 3.42Å; H397-E399 IonicContact CG-OE1 3.37Å; H397-E399 IonicContact ND1-OE1 3.96Å; H397-E399 PolarHBondContact O-N 3.39Å; H397-H400 HydrophobicContact CB-CB 4.1Å; H397-H400 AromaticContact CG-ND1 3.93Å; H397-H400 AromaticContact ND1-CE1 3.53Å; H397-H400 AromaticContact ND1-ND1 3.12Å; H397-H400 PolarHBondContact ND1-ND1 3.16Å; H397-H400 VanDerWaalsContact ND1-ND1 3.12Å; H397-H400 CarbonylContact O-C 3.56Å; H397-H400 WeakPolarHBondContact O-CA 3.35Å; H397-H400 PolarHBondContact O-N 3.24Å; H397-F401 PolarHBondContact O-N 3.15Å
398	P	87.5	Confident	87.7	Confident	41 Å²	41	52.9 Å²	52.9	27%	0.266	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-53.2	-41.9	178.7	-26.8	35.4	0	0	0	113.2	K387 V389 H400 F401	K387-P398 HydrophobicContact CB-CG 3.99Å; K387-P398 WeakPolarHBondContact O-CD 3.4Å; V389-P398 HydrophobicContact CG2-CB 4.43Å; V389-P398 HydrophobicContact CG2-CG 4.5Å; P398-H400 PolarHBondContact O-N 3.37Å; P398-F401 PolarHBondContact O-N 3.35Å
399	E	88.8	Confident	88	Confident	110 Å²	110	53.9 Å²	53.9	51%	0.514	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-73	-11.2	176.8	73.1	-76.3	179.4	0	0	114.3	H397 F402	H397-E399 VanDerWaalsContact CB-CD 3.44Å; H397-E399 HydrophobicContact CB-CG 4.47Å; H397-E399 WeakPolarHBondContact CB-OE1 3.43Å; H397-E399 WeakPolarHBondContact CB-OE2 3.42Å; H397-E399 IonicContact CG-OE1 3.37Å; H397-E399 IonicContact ND1-OE1 3.96Å; H397-E399 PolarHBondContact O-N 3.39Å; E399-F402 VanDerWaalsContact O-CD1 3.27Å; E399-F402 WeakPolarHBondContact O-CD1 3.24Å
400	H	90.5	Very high	88	Confident	43 Å²	43	53.6 Å²	53.6	20%	0.199	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-101.2	1.3	174.5	-71	170.6	0	0	0	113.3	C377 Y379 C380 H397 P398	C377-H400 PolarHBondContact SG-ND1 3.42Å; C377-H400 VanDerWaalsContact SG-ND1 3.37Å; Y379-H400 HydrophobicContact CD1-CB 4.08Å; Y379-H400 AromaticContact CD1-CD2 3.68Å; Y379-H400 AromaticContact CD1-CG 3.61Å; Y379-H400 AromaticContact CD1-ND1 3.8Å; Y379-H400 AromaticContact CD1-NE2 3.91Å; Y379-H400 HydrophobicContact CG-CB 4.19Å; C380-H400 PolarHBondContact SG-CE1 2.85Å; C380-H400 PolarHBondContact SG-ND1 3.15Å; C380-H400 VanDerWaalsContact SG-ND1 3.42Å; H397-H400 HydrophobicContact CB-CB 4.1Å; H397-H400 AromaticContact CG-ND1 3.93Å; H397-H400 AromaticContact ND1-CE1 3.53Å; H397-H400 AromaticContact ND1-ND1 3.12Å; H397-H400 PolarHBondContact ND1-ND1 3.16Å; H397-H400 VanDerWaalsContact ND1-ND1 3.12Å; H397-H400 CarbonylContact O-C 3.56Å; H397-H400 WeakPolarHBondContact O-CA 3.35Å; H397-H400 PolarHBondContact O-N 3.24Å; P398-H400 PolarHBondContact O-N 3.37Å
401	F	89.8	Confident	87.2	Confident	7 Å²	7	58.2 Å²	58.2	3%	0.031	30%	0.304	C	S	.	.	S	Bend	trans	-110	82	174	-164.9	-113.7	0	0	0	109.9	V389 A391 W396 H397 P398 F410 V416 F423	V389-F401 HydrophobicContact CB-CB 4.38Å; V389-F401 HydrophobicContact CB-CD1 4.37Å; V389-F401 HydrophobicContact CB-CG 4.44Å; V389-F401 HydrophobicContact CG1-CB 4.49Å; V389-F401 HydrophobicContact CG1-CD1 3.63Å; V389-F401 HydrophobicContact CG1-CE1 4Å; V389-F401 HydrophobicContact CG1-CG 4.04Å; V389-F401 HydrophobicContact CG2-CB 4.45Å; A391-F401 HydrophobicContact CB-CD2 4.33Å; A391-F401 HydrophobicContact CB-CE1 4.27Å; A391-F401 HydrophobicContact CB-CE2 3.55Å; A391-F401 HydrophobicContact CB-CZ 3.52Å; W396-F401 HydrophobicContact CB-CB 4.02Å; W396-F401 HydrophobicContact CB-CD2 4.43Å; W396-F401 HydrophobicContact CD2-CD2 4.08Å; W396-F401 HydrophobicContact CG-CB 4.46Å; W396-F401 AromaticContact CG-CD2 3.97Å; W396-F401 HydrophobicContact CG-CD2 3.97Å; H397-F401 PolarHBondContact O-N 3.15Å; P398-F401 PolarHBondContact O-N 3.35Å; F401-F410 HydrophobicContact CD1-CB 4.23Å; F401-F410 AromaticContact CD1-CD2 3.47Å; F401-F410 HydrophobicContact CD1-CD2 3.47Å; F401-F410 VanDerWaalsContact CD1-CD2 3.47Å; F401-F410 HydrophobicContact CD1-CE2 4.3Å; F401-F410 HydrophobicContact CD1-CG 4.29Å; F401-F410 HydrophobicContact CE1-CB 4.2Å; F401-F410 AromaticContact CE1-CD2 3.5Å; F401-F410 HydrophobicContact CE1-CD2 3.5Å; F401-F410 HydrophobicContact CE1-CE2 4.22Å; F401-F410 HydrophobicContact CE1-CG 4.16Å; F401-F410 HydrophobicContact CG-CD2 4.02Å; F401-F410 HydrophobicContact CZ-CD2 4.07Å; F401-F410 HydrophobicContact CZ-CE2 4.35Å; F401-F410 VanDerWaalsContact O-CD2 3.24Å; F401-F410 WeakPolarHBondContact O-CD2 3.47Å; F401-F410 PolarHBondContact O-N 3.36Å; F401-V416 HydrophobicContact CE1-CG2 4.14Å; F401-V416 HydrophobicContact CZ-CG1 4.07Å; F401-V416 HydrophobicContact CZ-CG2 4.31Å; F401-F423 HydrophobicContact CD2-CD2 4.45Å; F401-F423 HydrophobicContact CD2-CE2 4.46Å; F401-F423 AromaticContact CE2-CD1 3.84Å; F401-F423 HydrophobicContact CE2-CD1 3.84Å; F401-F423 HydrophobicContact CE2-CD2 4.23Å; F401-F423 AromaticContact CE2-CE1 3.81Å; F401-F423 HydrophobicContact CE2-CE1 3.81Å; F401-F423 HydrophobicContact CE2-CE2 4.22Å; F401-F423 HydrophobicContact CE2-CG 4.04Å; F401-F423 HydrophobicContact CE2-CZ 4.02Å; F401-F423 HydrophobicContact CZ-CD1 4.34Å
402	F	91.2	Very high	86.4	Confident	36 Å²	36	61.3 Å²	61.3	16%	0.158	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-134	160.1	-172	59.4	-95.4	0	0	0	112.5	Y379 E399 Y404 H407 S408 F410	Y379-F402 HydrophobicContact CE2-CE1 4.37Å; Y379-F402 AromaticContact CE2-CZ 3.94Å; Y379-F402 HydrophobicContact CE2-CZ 3.94Å; Y379-F402 AromaticContact CZ-CZ 4Å; E399-F402 VanDerWaalsContact O-CD1 3.27Å; E399-F402 WeakPolarHBondContact O-CD1 3.24Å; F402-Y404 PolarHBondContact O-N 2.84Å; F402-H407 AromaticContact CE2-ND1 3.9Å; F402-S408 WeakPolarHBondContact CA-O 3.47Å; F402-F410 VanDerWaalsContact C-CZ 3.48Å; F402-F410 WeakPolarHBondContact O-CE2 3.48Å
403	C	93.6	Very high	85.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.339	C	S	.	.			trans	-68.5	125	173.1	174.1	0	0	0	0	111	E405 C406 H407 S408 F410 F423 C425	C403-E405 PolarHBondContact O-N 2.79Å; C403-E405 VanDerWaalsContact O-N 3.17Å; C403-E405 PolarHBondContact SG-N 3.16Å; C403-C406 VanDerWaalsContact CB-SG 3.55Å; C403-C406 VanDerWaalsContact SG-SG 3.62Å; C403-H407 WeakPolarHBondContact O-CA 3.4Å; C403-H407 PolarHBondContact O-N 3Å; C403-S408 PolarHBondContact N-O 3.31Å; C403-F410 HydrophobicContact CB-CE1 3.97Å; C403-F410 HydrophobicContact CB-CZ 3.94Å; C403-F410 VanDerWaalsContact N-CZ 3.34Å; C403-F423 CarbonylContact C-O 3.51Å; C403-F423 WeakPolarHBondContact CA-O 3.41Å; C403-C425 HydrophobicContact CB-CB 4.18Å; C403-C425 PolarHBondContact SG-N 3.02Å; C403-C425 VanDerWaalsContact SG-N 3.35Å
404	Y	93.6	Very high	85.3	Confident	103 Å²	103	62.8 Å²	62.8	40%	0.404	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.1	-179.5	-177	-99.4	0	0	0	114.2	F402 H407 K422 F423 Y424	F402-Y404 PolarHBondContact O-N 2.84Å; Y404-H407 PolarHBondContact O-CE1 3.06Å; Y404-K422 HydrophobicContact CD1-CD 3.77Å; Y404-K422 HydrophobicContact CD2-CB 4.38Å; Y404-K422 HydrophobicContact CD2-CD 3.9Å; Y404-K422 HydrophobicContact CD2-CG 4.04Å; Y404-K422 HydrophobicContact CE1-CD 3.73Å; Y404-K422 HydrophobicContact CE2-CD 3.88Å; Y404-K422 HydrophobicContact CE2-CG 4.34Å; Y404-K422 HydrophobicContact CG-CB 4.11Å; Y404-K422 HydrophobicContact CG-CD 3.85Å; Y404-K422 HydrophobicContact CG-CG 4.16Å; Y404-K422 PolarHBondContact OH-NZ 2.72Å; Y404-F423 WeakPolarHBondContact CB-O 3.49Å; Y404-F423 PolarHBondContact N-O 3.03Å; Y404-Y424 HydrophobicContact CD1-CE1 4.12Å
405	E	93.4	Very high	85.1	Confident	87 Å²	87	58.1 Å²	58.1	41%	0.407	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-47.7	-175.6	-155.7	78.5	-140.8	0	0	113.1	C403 Y424 C428 R432	C403-E405 PolarHBondContact O-N 2.79Å; C403-E405 VanDerWaalsContact O-N 3.17Å; C403-E405 PolarHBondContact SG-N 3.16Å; E405-Y424 HydrophobicContact CB-CD1 4.32Å; E405-Y424 HydrophobicContact CB-CE1 4.48Å; E405-C428 HydrophobicContact CB-CB 3.82Å; E405-C428 HydrophobicContact CG-CB 4.34Å; E405-R432 VanDerWaalsContact CD-NH1 3.26Å; E405-R432 IonicContact OE1-NH1 2.74Å; E405-R432 PolarHBondContact OE1-NH1 2.91Å; E405-R432 WeakPolarHBondContact OE2-CD 3.49Å; E405-R432 IonicContact OE2-CZ 3.55Å; E405-R432 IonicContact OE2-NE 2.86Å; E405-R432 IonicContact OE2-NH1 3.57Å; E405-R432 PolarHBondContact OE2-NH1 3.01Å
406	C	94	Very high	85	Confident	54 Å²	54	57.9 Å²	57.9	37%	0.365	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-0.6	-176.6	70.3	0	0	0	0	114.6	C403 S408	C403-C406 VanDerWaalsContact CB-SG 3.55Å; C403-C406 VanDerWaalsContact SG-SG 3.62Å; C406-S408 PolarHBondContact O-N 2.87Å
407	H	92.6	Very high	85	Confident	132 Å²	132	58 Å²	58	61%	0.611	32%	0.32	S	S	*	.			trans	56.2	8.9	-177.9	-55	-54.1	0	0	0	116.2	F402 C403 Y404	F402-H407 AromaticContact CE2-ND1 3.9Å; C403-H407 WeakPolarHBondContact O-CA 3.4Å; C403-H407 PolarHBondContact O-N 3Å; Y404-H407 PolarHBondContact O-CE1 3.06Å
408	S	88.4	Confident	85.1	Confident	71 Å²	71	58.2 Å²	58.2	50%	0.497	32%	0.321	S	S	.	.			trans	-73.7	131.8	175.2	-59.5	0	0	0	0	110.8	F402 C403 C406	F402-S408 WeakPolarHBondContact CA-O 3.47Å; C403-S408 PolarHBondContact N-O 3.31Å; C406-S408 PolarHBondContact O-N 2.87Å
409	T	86.6	Confident	85.2	Confident	58 Å²	58	57.9 Å²	57.9	36%	0.356	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-63.8	145.4	169.6	49.8	0	0	0	0	111	N411	T409-N411 WeakPolarHBondContact CB-OD1 3.4Å; T409-N411 PolarHBondContact O-N 3.02Å; T409-N411 PolarHBondContact OG1-ND2 3.37Å; T409-N411 PolarHBondContact OG1-OD1 2.89Å
410	F	84.4	Confident	85.1	Confident	14 Å²	14	57.4 Å²	57.4	6%	0.061	32%	0.317	C	S	.	.			trans	-76.3	28.4	-177.2	-60.4	-69.9	0	0	0	115.1	F401 F402 C403 G412 S413 V416 F423 C425	F401-F410 HydrophobicContact CD1-CB 4.23Å; F401-F410 AromaticContact CD1-CD2 3.47Å; F401-F410 HydrophobicContact CD1-CD2 3.47Å; F401-F410 VanDerWaalsContact CD1-CD2 3.47Å; F401-F410 HydrophobicContact CD1-CE2 4.3Å; F401-F410 HydrophobicContact CD1-CG 4.29Å; F401-F410 HydrophobicContact CE1-CB 4.2Å; F401-F410 AromaticContact CE1-CD2 3.5Å; F401-F410 HydrophobicContact CE1-CD2 3.5Å; F401-F410 HydrophobicContact CE1-CE2 4.22Å; F401-F410 HydrophobicContact CE1-CG 4.16Å; F401-F410 HydrophobicContact CG-CD2 4.02Å; F401-F410 HydrophobicContact CZ-CD2 4.07Å; F401-F410 HydrophobicContact CZ-CE2 4.35Å; F401-F410 VanDerWaalsContact O-CD2 3.24Å; F401-F410 WeakPolarHBondContact O-CD2 3.47Å; F401-F410 PolarHBondContact O-N 3.36Å; F402-F410 VanDerWaalsContact C-CZ 3.48Å; F402-F410 WeakPolarHBondContact O-CE2 3.48Å; C403-F410 HydrophobicContact CB-CE1 3.97Å; C403-F410 HydrophobicContact CB-CZ 3.94Å; C403-F410 VanDerWaalsContact N-CZ 3.34Å; F410-G412 PolarHBondContact O-N 3.37Å; F410-S413 PolarHBondContact O-N 2.86Å; F410-V416 HydrophobicContact CB-CG2 3.93Å; F410-V416 HydrophobicContact CD1-CB 4.47Å; F410-V416 HydrophobicContact CD1-CG1 4.25Å; F410-V416 HydrophobicContact CD1-CG2 3.6Å; F410-V416 HydrophobicContact CD2-CG1 4.18Å; F410-V416 HydrophobicContact CD2-CG2 4.04Å; F410-V416 HydrophobicContact CE1-CB 4.44Å; F410-V416 HydrophobicContact CE1-CG1 3.84Å; F410-V416 HydrophobicContact CE1-CG2 4.04Å; F410-V416 HydrophobicContact CE2-CG1 3.77Å; F410-V416 HydrophobicContact CE2-CG2 4.43Å; F410-V416 HydrophobicContact CG-CG1 4.4Å; F410-V416 HydrophobicContact CG-CG2 3.59Å; F410-V416 HydrophobicContact CZ-CG1 3.58Å; F410-V416 HydrophobicContact CZ-CG2 4.43Å; F410-F423 HydrophobicContact CE2-CB 3.63Å; F410-F423 HydrophobicContact CE2-CG 4.44Å; F410-F423 HydrophobicContact CZ-CB 3.63Å; F410-C425 HydrophobicContact CE1-CB 4.04Å
411	N	67.2	Low	84.8	Confident	130 Å²	130	58 Å²	58	70%	0.695	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	101.7	-171.6	-65.9	2.3	0	0	0	111.6	T409 S413	T409-N411 WeakPolarHBondContact CB-OD1 3.4Å; T409-N411 PolarHBondContact O-N 3.02Å; T409-N411 PolarHBondContact OG1-ND2 3.37Å; T409-N411 PolarHBondContact OG1-OD1 2.89Å; N411-S413 VanDerWaalsContact C-N 3.34Å
412	G	62.9	Low	84.8	Confident	66 Å²	66	61.4 Å²	61.4	68%	0.68	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	1.5	-177.2	0	0	0	0	0	115.5	F410 L414	F410-G412 PolarHBondContact O-N 3.37Å; G412-L414 PolarHBondContact O-N 2.74Å
413	S	67.5	Low	84.8	Confident	36 Å²	36	60.5 Å²	60.5	25%	0.252	35%	0.346	S	S	.	.			trans	-72.4	108.2	174.2	-171.3	0	0	0	0	109.8	T36 F410 N411 T415	T36-S413 WeakPolarHBondContact CG2-O 3.47Å; F410-S413 PolarHBondContact O-N 2.86Å; N411-S413 VanDerWaalsContact C-N 3.34Å; S413-T415 PolarHBondContact O-N 3.49Å; S413-T415 VanDerWaalsContact O-N 3.14Å; S413-T415 PolarHBondContact OG-O 3.08Å
414	L	68.1	Low	84.8	Confident	132 Å²	132	60.9 Å²	60.9	69%	0.691	35%	0.347	S	S	*	.	S	Bend	trans	-59.8	-22.9	178.2	-74.8	113.7	0	0	0	113.4	T36 H37 G412	T36-L414 CarbonylContact C-O 3.4Å; H37-L414 PolarHBondContact N-O 3.05Å; G412-L414 PolarHBondContact O-N 2.74Å
415	T	80.6	Confident	84.7	Confident	54 Å²	54	57.2 Å²	57.2	33%	0.331	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	137.6	180	46.8	0	0	0	0	111.7	H37 S413 S426	H37-T415 WeakPolarHBondContact O-CA 3.49Å; S413-T415 PolarHBondContact O-N 3.49Å; S413-T415 VanDerWaalsContact O-N 3.14Å; S413-T415 PolarHBondContact OG-O 3.08Å; T415-S426 PolarHBondContact OG1-OG 2.94Å
416	V	87.5	Confident	84.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	130.2	171.3	-178.7	0	0	0	0	108	H37 V38 T39 F401 F410 F423	H37-V416 PolarHBondContact O-N 3.48Å; V38-V416 WeakPolarHBondContact CA-O 3.48Å; T39-V416 PolarHBondContact N-O 3.02Å; T39-V416 VanDerWaalsContact N-O 3.15Å; F401-V416 HydrophobicContact CE1-CG2 4.14Å; F401-V416 HydrophobicContact CZ-CG1 4.07Å; F401-V416 HydrophobicContact CZ-CG2 4.31Å; F410-V416 HydrophobicContact CB-CG2 3.93Å; F410-V416 HydrophobicContact CD1-CB 4.47Å; F410-V416 HydrophobicContact CD1-CG1 4.25Å; F410-V416 HydrophobicContact CD1-CG2 3.6Å; F410-V416 HydrophobicContact CD2-CG1 4.18Å; F410-V416 HydrophobicContact CD2-CG2 4.04Å; F410-V416 HydrophobicContact CE1-CB 4.44Å; F410-V416 HydrophobicContact CE1-CG1 3.84Å; F410-V416 HydrophobicContact CE1-CG2 4.04Å; F410-V416 HydrophobicContact CE2-CG1 3.77Å; F410-V416 HydrophobicContact CE2-CG2 4.43Å; F410-V416 HydrophobicContact CG-CG1 4.4Å; F410-V416 HydrophobicContact CG-CG2 3.59Å; F410-V416 HydrophobicContact CZ-CG1 3.58Å; F410-V416 HydrophobicContact CZ-CG2 4.43Å; V416-F423 HydrophobicContact CG1-CB 4.01Å; V416-F423 HydrophobicContact CG1-CD1 4.01Å; V416-F423 HydrophobicContact CG1-CG 4.44Å
417	H	89.6	Confident	84.3	Confident	17 Å²	17	57.4 Å²	57.4	8%	0.079	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	131.7	-179.4	-57.2	-88.9	0	0	0	110.2	T39 F423 Y424 S426 Y429	T39-H417 PolarHBondContact OG1-CE1 3.41Å; T39-H417 VanDerWaalsContact OG1-CE1 3.32Å; T39-H417 PolarHBondContact OG1-ND1 2.96Å; H417-F423 CarbonylContact O-C 3.49Å; H417-F423 WeakPolarHBondContact O-CA 3.47Å; H417-Y424 PolarHBondContact N-O 3.35Å; H417-Y424 PolarHBondContact O-N 3.15Å; H417-S426 PolarHBondContact CD2-OG 2.92Å; H417-S426 PolarHBondContact NE2-OG 3.16Å; H417-Y429 HydrophobicContact CB-CD1 4.08Å; H417-Y429 HydrophobicContact CB-CD2 3.34Å; H417-Y429 HydrophobicContact CB-CE1 4.49Å; H417-Y429 HydrophobicContact CB-CE2 3.82Å; H417-Y429 HydrophobicContact CB-CG 3.49Å; H417-Y429 VanDerWaalsContact CB-CG 3.49Å; H417-Y429 AromaticContact CD2-CG 3.99Å; H417-Y429 AromaticContact CG-CD1 3.75Å; H417-Y429 AromaticContact CG-CD2 3.97Å; H417-Y429 AromaticContact CG-CG 3.59Å; H417-Y429 AromaticContact ND1-CD1 3.84Å
418	E	90.1	Very high	84.3	Confident	32 Å²	32	51.9 Å²	51.9	15%	0.15	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.6	175.3	-173	-101.7	120.3	0	0	111.1	T39 K40 L392 N420 G421 K422 F423	T39-E418 PolarHBondContact O-N 3.06Å; K40-E418 VanDerWaalsContact CE-OE2 3.28Å; K40-E418 WeakPolarHBondContact CE-OE2 3.41Å; L392-E418 HydrophobicContact CD1-CB 3.99Å; L392-E418 HydrophobicContact CD1-CG 3.7Å; E418-N420 PolarHBondContact OE1-N 2.98Å; E418-G421 PolarHBondContact OE1-N 2.92Å; E418-K422 WeakPolarHBondContact CA-O 3.47Å; E418-F423 HydrophobicContact CB-CD1 4.32Å; E418-F423 HydrophobicContact CB-CE1 4.39Å; E418-F423 HydrophobicContact CG-CD1 4.39Å; E418-F423 HydrophobicContact CG-CE1 4.19Å
419	Q	88.6	Confident	84.6	Confident	33 Å²	33	49.7 Å²	49.7	15%	0.154	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	111.4	176.3	-173.2	67.7	0.5	0	0	110.1	T41 K422 Y424 Y429 F433	T41-Q419 PolarHBondContact OG1-OE1 3.17Å; Q419-K422 PolarHBondContact N-O 3.27Å; Q419-K422 PolarHBondContact O-N 2.98Å; Q419-Y424 HydrophobicContact CB-CD2 4.23Å; Q419-Y424 HydrophobicContact CB-CE2 3.87Å; Q419-Y429 HydrophobicContact CB-CE2 4.28Å; Q419-F433 HydrophobicContact CB-CE2 4.16Å; Q419-F433 HydrophobicContact CB-CZ 4.36Å; Q419-F433 HydrophobicContact CG-CD2 4.42Å; Q419-F433 HydrophobicContact CG-CE1 4.07Å; Q419-F433 HydrophobicContact CG-CE2 3.98Å; Q419-F433 HydrophobicContact CG-CZ 3.79Å
420	N	87.5	Confident	84.8	Confident	100 Å²	100	49.3 Å²	49.3	54%	0.535	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	42.8	-178.2	-57.9	-57.8	0	0	0	113.9	K43 E418 K422	K43-N420 WeakPolarHBondContact CE-OD1 3.15Å; K43-N420 PolarHBondContact NZ-OD1 3.46Å; E418-N420 PolarHBondContact OE1-N 2.98Å; N420-K422 PolarHBondContact O-N 3.18Å
421	G	84	Confident	85.2	Confident	55 Å²	55	53 Å²	53	57%	0.567	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	9.5	-178.8	0	0	0	0	0	114.5	E418	E418-G421 PolarHBondContact OE1-N 2.92Å
422	K	90.2	Very high	86.3	Confident	79 Å²	79	53.5 Å²	53.5	34%	0.343	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.8	175.5	-63.4	174.9	177.3	-173	0	109.5	Y404 E418 Q419 N420 Y424	Y404-K422 HydrophobicContact CD1-CD 3.77Å; Y404-K422 HydrophobicContact CD2-CB 4.38Å; Y404-K422 HydrophobicContact CD2-CD 3.9Å; Y404-K422 HydrophobicContact CD2-CG 4.04Å; Y404-K422 HydrophobicContact CE1-CD 3.73Å; Y404-K422 HydrophobicContact CE2-CD 3.88Å; Y404-K422 HydrophobicContact CE2-CG 4.34Å; Y404-K422 HydrophobicContact CG-CB 4.11Å; Y404-K422 HydrophobicContact CG-CD 3.85Å; Y404-K422 HydrophobicContact CG-CG 4.16Å; Y404-K422 PolarHBondContact OH-NZ 2.72Å; E418-K422 WeakPolarHBondContact CA-O 3.47Å; Q419-K422 PolarHBondContact N-O 3.27Å; Q419-K422 PolarHBondContact O-N 2.98Å; N420-K422 PolarHBondContact O-N 3.18Å; K422-Y424 HydrophobicContact CB-CE2 3.66Å; K422-Y424 WeakPolarHBondContact O-CD2 2.97Å; K422-Y424 WeakPolarHBondContact O-CE2 3.15Å
423	F	91.1	Very high	87.8	Confident	18 Å²	18	54 Å²	54	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	142	-179.2	-54.7	-79.7	0	0	0	111	L392 W396 F401 C403 Y404 F410 V416 H417 E418	L392-F423 HydrophobicContact CD1-CE1 3.62Å; L392-F423 HydrophobicContact CD1-CZ 4.11Å; L392-F423 HydrophobicContact CG-CE1 4.17Å; W396-F423 HydrophobicContact CE3-CE2 4.5Å; W396-F423 AromaticContact CH2-CE2 3.48Å; W396-F423 HydrophobicContact CH2-CE2 3.48Å; W396-F423 VanDerWaalsContact CH2-CE2 3.48Å; W396-F423 AromaticContact CH2-CZ 3.73Å; W396-F423 HydrophobicContact CH2-CZ 3.73Å; W396-F423 AromaticContact CZ2-CE2 3.82Å; W396-F423 HydrophobicContact CZ2-CE2 3.82Å; W396-F423 AromaticContact CZ2-CZ 3.59Å; W396-F423 HydrophobicContact CZ2-CZ 3.59Å; W396-F423 AromaticContact CZ3-CE2 3.84Å; W396-F423 HydrophobicContact CZ3-CE2 3.84Å; W396-F423 HydrophobicContact CZ3-CZ 4.46Å; F401-F423 HydrophobicContact CD2-CD2 4.45Å; F401-F423 HydrophobicContact CD2-CE2 4.46Å; F401-F423 AromaticContact CE2-CD1 3.84Å; F401-F423 HydrophobicContact CE2-CD1 3.84Å; F401-F423 HydrophobicContact CE2-CD2 4.23Å; F401-F423 AromaticContact CE2-CE1 3.81Å; F401-F423 HydrophobicContact CE2-CE1 3.81Å; F401-F423 HydrophobicContact CE2-CE2 4.22Å; F401-F423 HydrophobicContact CE2-CG 4.04Å; F401-F423 HydrophobicContact CE2-CZ 4.02Å; F401-F423 HydrophobicContact CZ-CD1 4.34Å; C403-F423 CarbonylContact C-O 3.51Å; C403-F423 WeakPolarHBondContact CA-O 3.41Å; Y404-F423 WeakPolarHBondContact CB-O 3.49Å; Y404-F423 PolarHBondContact N-O 3.03Å; F410-F423 HydrophobicContact CE2-CB 3.63Å; F410-F423 HydrophobicContact CE2-CG 4.44Å; F410-F423 HydrophobicContact CZ-CB 3.63Å; V416-F423 HydrophobicContact CG1-CB 4.01Å; V416-F423 HydrophobicContact CG1-CD1 4.01Å; V416-F423 HydrophobicContact CG1-CG 4.44Å; H417-F423 CarbonylContact O-C 3.49Å; H417-F423 WeakPolarHBondContact O-CA 3.47Å; E418-F423 HydrophobicContact CB-CD1 4.32Å; E418-F423 HydrophobicContact CB-CE1 4.39Å; E418-F423 HydrophobicContact CG-CD1 4.39Å; E418-F423 HydrophobicContact CG-CE1 4.19Å
424	Y	92.7	Very high	88.9	Confident	8 Å²	8	53.4 Å²	53.4	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.6	179.1	-59.6	-96.7	0	0	0	110.2	Y404 E405 H417 Q419 K422 Y429 F433	Y404-Y424 HydrophobicContact CD1-CE1 4.12Å; E405-Y424 HydrophobicContact CB-CD1 4.32Å; E405-Y424 HydrophobicContact CB-CE1 4.48Å; H417-Y424 PolarHBondContact N-O 3.35Å; H417-Y424 PolarHBondContact O-N 3.15Å; Q419-Y424 HydrophobicContact CB-CD2 4.23Å; Q419-Y424 HydrophobicContact CB-CE2 3.87Å; K422-Y424 HydrophobicContact CB-CE2 3.66Å; K422-Y424 WeakPolarHBondContact O-CD2 2.97Å; K422-Y424 WeakPolarHBondContact O-CE2 3.15Å; Y424-Y429 HydrophobicContact CD2-CD2 4.48Å; Y424-F433 HydrophobicContact CD1-CE2 4.35Å; Y424-F433 HydrophobicContact CD2-CE2 4.23Å; Y424-F433 HydrophobicContact CE1-CE2 4.06Å; Y424-F433 AromaticContact CE2-CE2 3.94Å; Y424-F433 HydrophobicContact CE2-CE2 3.94Å; Y424-F433 HydrophobicContact CE2-CZ 4.39Å; Y424-F433 HydrophobicContact CG-CE2 4.43Å; Y424-F433 AromaticContact CZ-CE2 3.85Å
425	C	91.4	Very high	90.2	Very high	26 Å²	26	51 Å²	51	18%	0.176	28%	0.279	C	S	.	.			trans	-72.9	155	165.3	70	0	0	0	0	108.3	C403 F410 N427 C428 Y429	C403-C425 HydrophobicContact CB-CB 4.18Å; C403-C425 PolarHBondContact SG-N 3.02Å; C403-C425 VanDerWaalsContact SG-N 3.35Å; F410-C425 HydrophobicContact CE1-CB 4.04Å; C425-N427 PolarHBondContact O-N 2.98Å; C425-N427 VanDerWaalsContact O-N 3.16Å; C425-C428 PolarHBondContact O-N 2.94Å; C425-C428 VanDerWaalsContact O-N 3.08Å; C425-Y429 WeakPolarHBondContact O-CB 3.42Å; C425-Y429 PolarHBondContact O-N 2.95Å
426	S	89.6	Confident	90.9	Very high	27 Å²	27	51.7 Å²	51.7	19%	0.189	28%	0.284	C	S	.	.	H	α-helix	trans	-51.8	-43.2	-175.2	-58.3	0	0	0	0	112.7	T415 H417 Y429 F430	T415-S426 PolarHBondContact OG1-OG 2.94Å; H417-S426 PolarHBondContact CD2-OG 2.92Å; H417-S426 PolarHBondContact NE2-OG 3.16Å; S426-Y429 PolarHBondContact O-N 3.39Å; S426-F430 WeakPolarHBondContact O-CB 3.5Å; S426-F430 WeakPolarHBondContact O-CD2 3.48Å; S426-F430 WeakPolarHBondContact O-CG 3.43Å; S426-F430 PolarHBondContact O-N 2.97Å
427	N	89.8	Confident	91.3	Very high	117 Å²	117	51.7 Å²	51.7	63%	0.626	28%	0.284	S	S	*	.	H	α-helix	trans	-57.6	-56.4	175.4	-173.1	77.3	0	0	0	112.5	C425 Y429 F430 T431	C425-N427 PolarHBondContact O-N 2.98Å; C425-N427 VanDerWaalsContact O-N 3.16Å; N427-Y429 VanDerWaalsContact C-N 3.29Å; N427-Y429 PolarHBondContact O-N 3.24Å; N427-F430 PolarHBondContact O-N 2.83Å; N427-T431 WeakPolarHBondContact O-CB 3.32Å; N427-T431 PolarHBondContact O-N 3.26Å; N427-T431 PolarHBondContact O-OG1 3.19Å
428	C	93.3	Very high	91.6	Very high	17 Å²	17	52 Å²	52	12%	0.115	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-31.1	-179.4	-67.2	0	0	0	0	113.2	E405 C425 R432	E405-C428 HydrophobicContact CB-CB 3.82Å; E405-C428 HydrophobicContact CG-CB 4.34Å; C425-C428 PolarHBondContact O-N 2.94Å; C425-C428 VanDerWaalsContact O-N 3.08Å; C428-R432 VanDerWaalsContact O-CB 3.24Å; C428-R432 WeakPolarHBondContact O-CB 3.39Å; C428-R432 PolarHBondContact O-N 3.49Å
429	Y	93.7	Very high	91.8	Very high	24 Å²	24	52.6 Å²	52.6	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-55.1	174	-177.2	-97.7	0	0	0	110.8	T41 H417 Q419 Y424 C425 S426 N427 T431 R432 F433	T41-Y429 WeakPolarHBondContact CG2-OH 3.41Å; T41-Y429 PolarHBondContact OG1-OH 3.07Å; T41-Y429 VanDerWaalsContact OG1-OH 3.07Å; H417-Y429 HydrophobicContact CB-CD1 4.08Å; H417-Y429 HydrophobicContact CB-CD2 3.34Å; H417-Y429 HydrophobicContact CB-CE1 4.49Å; H417-Y429 HydrophobicContact CB-CE2 3.82Å; H417-Y429 HydrophobicContact CB-CG 3.49Å; H417-Y429 VanDerWaalsContact CB-CG 3.49Å; H417-Y429 AromaticContact CD2-CG 3.99Å; H417-Y429 AromaticContact CG-CD1 3.75Å; H417-Y429 AromaticContact CG-CD2 3.97Å; H417-Y429 AromaticContact CG-CG 3.59Å; H417-Y429 AromaticContact ND1-CD1 3.84Å; Q419-Y429 HydrophobicContact CB-CE2 4.28Å; Y424-Y429 HydrophobicContact CD2-CD2 4.48Å; C425-Y429 WeakPolarHBondContact O-CB 3.42Å; C425-Y429 PolarHBondContact O-N 2.95Å; S426-Y429 PolarHBondContact O-N 3.39Å; N427-Y429 VanDerWaalsContact C-N 3.29Å; N427-Y429 PolarHBondContact O-N 3.24Å; Y429-T431 PolarHBondContact O-N 2.87Å; Y429-R432 PolarHBondContact O-N 2.93Å; Y429-R432 VanDerWaalsContact O-N 3.13Å; Y429-F433 AromaticContact CD2-CD2 3.6Å; Y429-F433 HydrophobicContact CD2-CD2 3.6Å; Y429-F433 HydrophobicContact CD2-CE2 4.22Å; Y429-F433 HydrophobicContact CE2-CB 4.32Å; Y429-F433 AromaticContact CE2-CD2 3.73Å; Y429-F433 HydrophobicContact CE2-CD2 3.73Å; Y429-F433 HydrophobicContact CE2-CE2 4.46Å; Y429-F433 HydrophobicContact CE2-CG 4.33Å; Y429-F433 HydrophobicContact CG-CD2 4.28Å; Y429-F433 PolarHBondContact O-N 3.31Å
430	F	92	Very high	92.1	Very high	50 Å²	50	53.4 Å²	53.4	22%	0.219	31%	0.312	C	S	.	.	H	α-helix	trans	-66	-38.7	-178.7	-67.6	-55.2	0	0	0	112.4	S426 N427 R432 G434 P443 T445	S426-F430 WeakPolarHBondContact O-CB 3.5Å; S426-F430 WeakPolarHBondContact O-CD2 3.48Å; S426-F430 WeakPolarHBondContact O-CG 3.43Å; S426-F430 PolarHBondContact O-N 2.97Å; N427-F430 PolarHBondContact O-N 2.83Å; F430-R432 PolarHBondContact O-N 3.31Å; F430-G434 WeakPolarHBondContact O-CA 3.22Å; F430-G434 PolarHBondContact O-N 3.26Å; F430-P443 HydrophobicContact CB-CB 4.06Å; F430-P443 HydrophobicContact CB-CG 4.23Å; F430-P443 WeakPolarHBondContact O-CB 3.45Å; F430-T445 HydrophobicContact CB-CG2 4.1Å; F430-T445 HydrophobicContact CD2-CG2 3.64Å; F430-T445 HydrophobicContact CE2-CG2 4.19Å; F430-T445 HydrophobicContact CG-CG2 3.91Å
431	T	91.6	Very high	92.4	Very high	93 Å²	93	54.7 Å²	54.7	57%	0.571	32%	0.315	S	S	*	.	H	α-helix	trans	-60.2	-30.2	173.4	-57	0	0	0	0	113	N427 Y429	N427-T431 WeakPolarHBondContact O-CB 3.32Å; N427-T431 PolarHBondContact O-N 3.26Å; N427-T431 PolarHBondContact O-OG1 3.19Å; Y429-T431 PolarHBondContact O-N 2.87Å
432	R	91.4	Very high	93	Very high	139 Å²	139	57.8 Å²	57.8	53%	0.525	32%	0.315	S	S	.	.	H	α-helix	trans	-99.3	-31.7	-173.9	-170.4	171.5	-174.5	120	18.2	114.5	E405 C428 Y429 F430	E405-R432 VanDerWaalsContact CD-NH1 3.26Å; E405-R432 IonicContact OE1-NH1 2.74Å; E405-R432 PolarHBondContact OE1-NH1 2.91Å; E405-R432 WeakPolarHBondContact OE2-CD 3.49Å; E405-R432 IonicContact OE2-CZ 3.55Å; E405-R432 IonicContact OE2-NE 2.86Å; E405-R432 IonicContact OE2-NH1 3.57Å; E405-R432 PolarHBondContact OE2-NH1 3.01Å; C428-R432 VanDerWaalsContact O-CB 3.24Å; C428-R432 WeakPolarHBondContact O-CB 3.39Å; C428-R432 PolarHBondContact O-N 3.49Å; Y429-R432 PolarHBondContact O-N 2.93Å; Y429-R432 VanDerWaalsContact O-N 3.13Å; F430-R432 PolarHBondContact O-N 3.31Å
433	F	92.8	Very high	93.2	Very high	77 Å²	77	55.3 Å²	55.3	34%	0.338	31%	0.306	S	S	.	.	H	α-helix	trans	-130.3	-7.8	-171.7	-51.9	-68.1	0	0	0	113.6	Q419 Y424 Y429	Q419-F433 HydrophobicContact CB-CE2 4.16Å; Q419-F433 HydrophobicContact CB-CZ 4.36Å; Q419-F433 HydrophobicContact CG-CD2 4.42Å; Q419-F433 HydrophobicContact CG-CE1 4.07Å; Q419-F433 HydrophobicContact CG-CE2 3.98Å; Q419-F433 HydrophobicContact CG-CZ 3.79Å; Y424-F433 HydrophobicContact CD1-CE2 4.35Å; Y424-F433 HydrophobicContact CD2-CE2 4.23Å; Y424-F433 HydrophobicContact CE1-CE2 4.06Å; Y424-F433 AromaticContact CE2-CE2 3.94Å; Y424-F433 HydrophobicContact CE2-CE2 3.94Å; Y424-F433 HydrophobicContact CE2-CZ 4.39Å; Y424-F433 HydrophobicContact CG-CE2 4.43Å; Y424-F433 AromaticContact CZ-CE2 3.85Å; Y429-F433 AromaticContact CD2-CD2 3.6Å; Y429-F433 HydrophobicContact CD2-CD2 3.6Å; Y429-F433 HydrophobicContact CD2-CE2 4.22Å; Y429-F433 HydrophobicContact CE2-CB 4.32Å; Y429-F433 AromaticContact CE2-CD2 3.73Å; Y429-F433 HydrophobicContact CE2-CD2 3.73Å; Y429-F433 HydrophobicContact CE2-CE2 4.46Å; Y429-F433 HydrophobicContact CE2-CG 4.33Å; Y429-F433 HydrophobicContact CG-CD2 4.28Å; Y429-F433 PolarHBondContact O-N 3.31Å
434	G	91.6	Very high	93.3	Very high	23 Å²	23	55.3 Å²	55.3	24%	0.237	31%	0.307	C	S	.	.	S	Bend	trans	-76.4	152.5	179.4	0	0	0	0	0	112.7	F430	F430-G434 WeakPolarHBondContact O-CA 3.22Å; F430-G434 PolarHBondContact O-N 3.26Å
435	T	94.2	Very high	93.2	Very high	82 Å²	82	58.1 Å²	58.1	50%	0.503	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-67.5	123.9	176.4	-54.8	0	0	0	0	110.3	I444 P455	T435-I444 WeakPolarHBondContact O-CB 3.49Å; T435-I444 PolarHBondContact O-N 2.91Å; T435-P455 HydrophobicContact CG2-CB 4Å; T435-P455 HydrophobicContact CG2-CG 3.46Å; T435-P455 VanDerWaalsContact CG2-CG 3.46Å
436	P	95.7	Very high	93	Very high	68 Å²	68	62.5 Å²	62.5	44%	0.442	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-72.9	141.4	177.8	29.8	-34.3	0	0	0	111.2
437	C	96.8	Very high	93.1	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-75.5	132.2	170.1	167.6	0	0	0	0	111.2	G439 Q441 Q442 I444 H457 C460	C437-G439 PolarHBondContact O-N 3.5Å; C437-G439 VanDerWaalsContact O-N 3.16Å; C437-G439 PolarHBondContact SG-N 3.32Å; C437-G439 VanDerWaalsContact SG-N 3.35Å; C437-Q441 WeakPolarHBondContact O-CA 3.49Å; C437-Q441 PolarHBondContact O-N 2.76Å; C437-Q442 WeakPolarHBondContact CB-O 3.42Å; C437-Q442 PolarHBondContact N-O 2.84Å; C437-I444 HydrophobicContact CB-CD1 4.09Å; C437-I444 HydrophobicContact CB-CG1 3.89Å; C437-H457 VanDerWaalsContact CB-CE1 3.41Å; C437-H457 WeakPolarHBondContact CB-CE1 3.35Å; C437-H457 WeakPolarHBondContact CB-ND1 3.35Å; C437-H457 PolarHBondContact SG-N 3.01Å; C437-H457 VanDerWaalsContact SG-N 3.39Å; C437-H457 PolarHBondContact SG-ND1 2.96Å; C437-H457 VanDerWaalsContact SG-ND1 3.42Å; C437-C460 WeakPolarHBondContact SG-CB 3.42Å
438	S	95.1	Very high	93.3	Very high	24 Å²	24	60.1 Å²	60.1	17%	0.168	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.2	-175.8	-47.3	0	0	0	0	114.7	M454 P455	S438-M454 WeakPolarHBondContact OG-CB 3.4Å; S438-M454 WeakPolarHBondContact OG-CE 3.42Å; S438-P455 WeakPolarHBondContact CB-O 3.42Å; S438-P455 PolarHBondContact N-O 3.35Å; S438-P455 PolarHBondContact OG-O 3.17Å
439	G	94	Very high	93.3	Very high	45 Å²	45	59.3 Å²	59.3	46%	0.464	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-53.1	174.8	0	0	0	0	0	113.4	C437	C437-G439 PolarHBondContact O-N 3.5Å; C437-G439 VanDerWaalsContact O-N 3.16Å; C437-G439 PolarHBondContact SG-N 3.32Å; C437-G439 VanDerWaalsContact SG-N 3.35Å
440	C	95.4	Very high	93.3	Very high	49 Å²	49	60.2 Å²	60.2	33%	0.331	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-6.5	-172.4	68.9	0	0	0	0	114.9	Q442 H457 C460	C440-Q442 HydrophobicContact CB-CG 4.5Å; C440-Q442 PolarHBondContact O-N 3.48Å; C440-Q442 PolarHBondContact SG-N 3.45Å; C440-H457 VanDerWaalsContact SG-CE1 3.54Å; C440-H457 PolarHBondContact SG-ND1 2.96Å; C440-H457 VanDerWaalsContact SG-ND1 3.37Å; C440-C460 VanDerWaalsContact SG-SG 3.66Å
441	Q	95	Very high	93.4	Very high	128 Å²	128	58.1 Å²	58.1	60%	0.598	33%	0.327	S	S	*	.			trans	57.6	9	-174.6	-54.1	-63.1	-17.9	0	0	115.4	C437	C437-Q441 WeakPolarHBondContact O-CA 3.49Å; C437-Q441 PolarHBondContact O-N 2.76Å
442	Q	95	Very high	93.4	Very high	120 Å²	120	55.4 Å²	55.4	56%	0.561	31%	0.309	S	S	*	.			trans	-81.4	151.5	170.5	-59.3	-50.6	-61.3	0	0	110.4	C437 C440	C437-Q442 WeakPolarHBondContact CB-O 3.42Å; C437-Q442 PolarHBondContact N-O 2.84Å; C440-Q442 HydrophobicContact CB-CG 4.5Å; C440-Q442 PolarHBondContact O-N 3.48Å; C440-Q442 PolarHBondContact SG-N 3.45Å
443	P	94.9	Very high	93.4	Very high	26 Å²	26	56 Å²	56	17%	0.169	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-64.6	146.3	179.6	29	-37.2	0	0	0	112.1	F430 H457	F430-P443 HydrophobicContact CB-CB 4.06Å; F430-P443 HydrophobicContact CB-CG 4.23Å; F430-P443 WeakPolarHBondContact O-CB 3.45Å; P443-H457 PolarHBondContact O-CE1 3.46Å; P443-H457 PolarHBondContact O-NE2 2.86Å
444	I	94	Very high	93.5	Very high	18 Å²	18	56.3 Å²	56.3	9%	0.092	33%	0.326	C	S	.	.			trans	-84.8	114.4	173.8	-69.2	169.9	0	0	0	108.4	T435 C437 D446 Y448 P455	T435-I444 WeakPolarHBondContact O-CB 3.49Å; T435-I444 PolarHBondContact O-N 2.91Å; C437-I444 HydrophobicContact CB-CD1 4.09Å; C437-I444 HydrophobicContact CB-CG1 3.89Å; I444-D446 WeakPolarHBondContact CG2-O 3.34Å; I444-Y448 HydrophobicContact CG2-CD1 3.95Å; I444-Y448 HydrophobicContact CG2-CG 3.97Å; I444-P455 HydrophobicContact CD1-CB 3.73Å; I444-P455 HydrophobicContact CD1-CG 4.34Å
445	T	90.6	Very high	93.7	Very high	68 Å²	68	56.3 Å²	56.3	42%	0.417	32%	0.322	S	S	.	.			trans	-100.9	-19.1	-178.6	45	0	0	0	0	113.6	F430	F430-T445 HydrophobicContact CB-CG2 4.1Å; F430-T445 HydrophobicContact CD2-CG2 3.64Å; F430-T445 HydrophobicContact CE2-CG2 4.19Å; F430-T445 HydrophobicContact CG-CG2 3.91Å
446	D	87.6	Confident	93.8	Very high	117 Å²	117	53.3 Å²	53.3	63%	0.626	30%	0.301	S	S	*	.	S	Bend	trans	-133.7	-175.2	-166.7	-59.6	-80.1	0	0	0	111.5	I444 Y448	I444-D446 WeakPolarHBondContact CG2-O 3.34Å; D446-Y448 PolarHBondContact O-N 3.09Å
447	A	91.4	Very high	93.9	Very high	33 Å²	33	52 Å²	52	27%	0.273	29%	0.289	S	S	.	.			trans	-55	125.8	175.2	0	0	0	0	0	111.7	K458	A447-K458 WeakPolarHBondContact O-CE 3.48Å
448	Y	93.7	Very high	93.7	Very high	62 Å²	62	55.7 Å²	55.7	24%	0.243	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	174.8	-169.7	66.5	-85.5	0	0	0	111.4	I64 R65 I444 D446 P455 W456	I64-Y448 WeakPolarHBondContact CA-O 3.2Å; R65-Y448 HydrophobicContact CB-CE1 4.24Å; R65-Y448 HydrophobicContact CB-CE2 4.21Å; R65-Y448 PolarHBondContact N-O 2.93Å; R65-Y448 PolarHBondContact O-N 3.06Å; R65-Y448 VanDerWaalsContact O-N 3.15Å; I444-Y448 HydrophobicContact CG2-CD1 3.95Å; I444-Y448 HydrophobicContact CG2-CG 3.97Å; D446-Y448 PolarHBondContact O-N 3.09Å; Y448-P455 HydrophobicContact CD2-CB 4.24Å; Y448-P455 HydrophobicContact CE2-CB 4.47Å; Y448-W456 WeakPolarHBondContact CB-O 3.49Å
449	I	93.7	Very high	93.7	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	147.1	171.7	70	175.2	0	0	0	110.4	A62 V63 I64 W456 K458 F461 T471	A62-I449 HydrophobicContact CB-CB 4.45Å; A62-I449 HydrophobicContact CB-CD1 3.85Å; V63-I449 WeakPolarHBondContact O-CA 3.4Å; I64-I449 HydrophobicContact CG1-CG2 3.9Å; I449-W456 HydrophobicContact CD1-CB 4.43Å; I449-W456 HydrophobicContact CG1-CB 3.85Å; I449-W456 HydrophobicContact CG1-CG 4.48Å; I449-W456 PolarHBondContact N-O 3.16Å; I449-W456 PolarHBondContact O-N 3.38Å; I449-K458 HydrophobicContact CG2-CG 4.06Å; I449-F461 HydrophobicContact CD1-CB 3.29Å; I449-F461 HydrophobicContact CD1-CD1 3.63Å; I449-F461 HydrophobicContact CD1-CD2 4.4Å; I449-F461 HydrophobicContact CD1-CG 3.53Å; I449-F461 HydrophobicContact CG1-CB 4.27Å; I449-T471 WeakPolarHBondContact CD1-OG1 3.27Å; I449-T471 HydrophobicContact CG2-CG2 4.23Å
450	T	94	Very high	93.8	Very high	42 Å²	42	59.4 Å²	59.4	26%	0.258	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.8	167.7	-53.9	0	0	0	0	108.5	V63 M454	V63-T450 PolarHBondContact O-N 3.24Å; T450-M454 WeakPolarHBondContact CA-O 3.48Å
451	A	92.7	Very high	93.9	Very high	7 Å²	7	57 Å²	57	6%	0.058	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	146.3	177.5	0	0	0	0	0	108.9	A62 D453 M454 W456 F461 F475	A62-A451 HydrophobicContact CB-CB 4.23Å; A451-D453 PolarHBondContact O-N 3.28Å; A451-M454 PolarHBondContact N-O 2.7Å; A451-M454 PolarHBondContact O-N 3.24Å; A451-M454 VanDerWaalsContact O-N 3.08Å; A451-W456 PolarHBondContact O-NE1 2.85Å; A451-F461 HydrophobicContact CB-CD2 4.08Å; A451-F461 HydrophobicContact CB-CE1 4.12Å; A451-F461 HydrophobicContact CB-CE2 3.48Å; A451-F461 VanDerWaalsContact CB-CE2 3.48Å; A451-F461 HydrophobicContact CB-CZ 3.51Å; A451-F475 HydrophobicContact CB-CZ 4.14Å
452	L	92.6	Very high	94	Very high	35 Å²	35	52.4 Å²	52.4	18%	0.183	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	39.8	-173.9	-47.1	-178.7	0	0	0	112.1	M454 W456 F461 F475 E477 G480 P482	L452-M454 WeakPolarHBondContact O-CB 3.46Å; L452-M454 VanDerWaalsContact O-CG 3.27Å; L452-M454 WeakPolarHBondContact O-CG 3.39Å; L452-M454 PolarHBondContact O-N 2.86Å; L452-W456 HydrophobicContact CD1-CZ2 4.28Å; L452-F461 HydrophobicContact CD1-CE2 4.39Å; L452-F461 HydrophobicContact CG-CE2 4.37Å; L452-F475 HydrophobicContact CD2-CD2 4.48Å; L452-F475 HydrophobicContact CD2-CE2 3.73Å; L452-F475 HydrophobicContact CG-CE2 4.43Å; L452-E477 HydrophobicContact CD1-CG 4.13Å; L452-E477 HydrophobicContact CD2-CB 3.78Å; L452-E477 HydrophobicContact CD2-CG 3.7Å; L452-G480 WeakPolarHBondContact CD1-O 3.24Å; L452-P482 HydrophobicContact CD1-CB 4.09Å; L452-P482 HydrophobicContact CD1-CG 4.35Å
453	D	91.1	Very high	94.1	Very high	153 Å²	153	46.7 Å²	46.7	82%	0.818	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	17.5	-173.4	-59.2	-37.5	0	0	0	116	A451	A451-D453 PolarHBondContact O-N 3.28Å
454	M	94.6	Very high	94.1	Very high	82 Å²	82	49.7 Å²	49.7	40%	0.404	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	154.2	-171.6	-71.3	-63.4	-72.2	0	0	111.5	S438 T450 A451 L452 W456	S438-M454 WeakPolarHBondContact OG-CB 3.4Å; S438-M454 WeakPolarHBondContact OG-CE 3.42Å; T450-M454 WeakPolarHBondContact CA-O 3.48Å; A451-M454 PolarHBondContact N-O 2.7Å; A451-M454 PolarHBondContact O-N 3.24Å; A451-M454 VanDerWaalsContact O-N 3.08Å; L452-M454 WeakPolarHBondContact O-CB 3.46Å; L452-M454 VanDerWaalsContact O-CG 3.27Å; L452-M454 WeakPolarHBondContact O-CG 3.39Å; L452-M454 PolarHBondContact O-N 2.86Å; M454-W456 PolarHBondContact O-NE1 3.02Å; M454-W456 VanDerWaalsContact O-NE1 3.16Å
455	P	96.2	Very high	94.2	Very high	23 Å²	23	51.9 Å²	51.9	15%	0.149	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	143.2	-178	35.5	-34.5	0	0	0	112.3	T435 S438 I444 Y448	T435-P455 HydrophobicContact CG2-CB 4Å; T435-P455 HydrophobicContact CG2-CG 3.46Å; T435-P455 VanDerWaalsContact CG2-CG 3.46Å; S438-P455 WeakPolarHBondContact CB-O 3.42Å; S438-P455 PolarHBondContact N-O 3.35Å; S438-P455 PolarHBondContact OG-O 3.17Å; I444-P455 HydrophobicContact CD1-CB 3.73Å; I444-P455 HydrophobicContact CD1-CG 4.34Å; Y448-P455 HydrophobicContact CD2-CB 4.24Å; Y448-P455 HydrophobicContact CE2-CB 4.47Å
456	W	96.7	Very high	94.5	Very high	20 Å²	20	50.9 Å²	50.9	8%	0.076	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145.1	-178.4	-46.2	74.2	0	0	0	112	Y448 I449 A451 L452 M454 F461	Y448-W456 WeakPolarHBondContact CB-O 3.49Å; I449-W456 HydrophobicContact CD1-CB 4.43Å; I449-W456 HydrophobicContact CG1-CB 3.85Å; I449-W456 HydrophobicContact CG1-CG 4.48Å; I449-W456 PolarHBondContact N-O 3.16Å; I449-W456 PolarHBondContact O-N 3.38Å; A451-W456 PolarHBondContact O-NE1 2.85Å; L452-W456 HydrophobicContact CD1-CZ2 4.28Å; M454-W456 PolarHBondContact O-NE1 3.02Å; M454-W456 VanDerWaalsContact O-NE1 3.16Å; W456-F461 HydrophobicContact CB-CB 4.12Å; W456-F461 HydrophobicContact CD2-CB 4.46Å; W456-F461 AromaticContact CD2-CD2 3.71Å; W456-F461 HydrophobicContact CD2-CD2 3.71Å; W456-F461 AromaticContact CE2-CD2 3.82Å; W456-F461 HydrophobicContact CE3-CD2 4.09Å; W456-F461 HydrophobicContact CG-CB 4.27Å; W456-F461 AromaticContact CG-CD2 3.95Å; W456-F461 HydrophobicContact CG-CD2 3.95Å; W456-F461 HydrophobicContact CZ2-CD2 4.34Å; W456-F461 HydrophobicContact CZ2-CE2 4.48Å
457	H	96.1	Very high	94.9	Very high	39 Å²	39	51.1 Å²	51.1	18%	0.181	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	147.3	157	-54.7	104.6	0	0	0	109.2	C437 C440 P443 D459 C460 F461	C437-H457 VanDerWaalsContact CB-CE1 3.41Å; C437-H457 WeakPolarHBondContact CB-CE1 3.35Å; C437-H457 WeakPolarHBondContact CB-ND1 3.35Å; C437-H457 PolarHBondContact SG-N 3.01Å; C437-H457 VanDerWaalsContact SG-N 3.39Å; C437-H457 PolarHBondContact SG-ND1 2.96Å; C437-H457 VanDerWaalsContact SG-ND1 3.42Å; C440-H457 VanDerWaalsContact SG-CE1 3.54Å; C440-H457 PolarHBondContact SG-ND1 2.96Å; C440-H457 VanDerWaalsContact SG-ND1 3.37Å; P443-H457 PolarHBondContact O-CE1 3.46Å; P443-H457 PolarHBondContact O-NE2 2.86Å; H457-D459 PolarHBondContact O-N 3.35Å; H457-C460 HydrophobicContact CB-CB 4.05Å; H457-C460 PolarHBondContact O-N 3.3Å; H457-F461 PolarHBondContact O-N 3.39Å
458	K	94.2	Very high	95.1	Very high	78 Å²	78	57.1 Å²	57.1	34%	0.339	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-41	179.9	-65	175.8	-177.3	177.1	0	112.4	A447 I449 T471	A447-K458 WeakPolarHBondContact O-CE 3.48Å; I449-K458 HydrophobicContact CG2-CG 4.06Å; K458-T471 PolarHBondContact O-OG1 3.08Å
459	D	94.7	Very high	95.1	Very high	115 Å²	115	58 Å²	58	62%	0.615	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-11.5	-177.8	-50	-46.4	0	0	0	113.7	H457 T462 I469	H457-D459 PolarHBondContact O-N 3.35Å; D459-T462 WeakPolarHBondContact O-CG2 3.22Å; D459-I469 HydrophobicContact CB-CD1 4.2Å
460	C	96.3	Very high	95.2	Very high	32 Å²	32	58 Å²	58	22%	0.216	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-17.8	177.7	-73.5	0	0	0	0	113.2	C437 C440 H457 T462	C437-C460 WeakPolarHBondContact SG-CB 3.42Å; C440-C460 VanDerWaalsContact SG-SG 3.66Å; H457-C460 HydrophobicContact CB-CB 4.05Å; H457-C460 PolarHBondContact O-N 3.3Å; C460-T462 VanDerWaalsContact C-N 3.32Å; C460-T462 PolarHBondContact O-N 3.04Å
461	F	96.6	Very high	94.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.296	C	S	.	.			trans	-81.4	81.7	175.2	-169.5	-113.1	0	0	0	110.5	A62 I449 A451 L452 W456 H457 L470 F475 P482	A62-F461 HydrophobicContact CB-CD1 4.37Å; A62-F461 HydrophobicContact CB-CE1 4.18Å; I449-F461 HydrophobicContact CD1-CB 3.29Å; I449-F461 HydrophobicContact CD1-CD1 3.63Å; I449-F461 HydrophobicContact CD1-CD2 4.4Å; I449-F461 HydrophobicContact CD1-CG 3.53Å; I449-F461 HydrophobicContact CG1-CB 4.27Å; A451-F461 HydrophobicContact CB-CD2 4.08Å; A451-F461 HydrophobicContact CB-CE1 4.12Å; A451-F461 HydrophobicContact CB-CE2 3.48Å; A451-F461 VanDerWaalsContact CB-CE2 3.48Å; A451-F461 HydrophobicContact CB-CZ 3.51Å; L452-F461 HydrophobicContact CD1-CE2 4.39Å; L452-F461 HydrophobicContact CG-CE2 4.37Å; W456-F461 HydrophobicContact CB-CB 4.12Å; W456-F461 HydrophobicContact CD2-CB 4.46Å; W456-F461 AromaticContact CD2-CD2 3.71Å; W456-F461 HydrophobicContact CD2-CD2 3.71Å; W456-F461 AromaticContact CE2-CD2 3.82Å; W456-F461 HydrophobicContact CE3-CD2 4.09Å; W456-F461 HydrophobicContact CG-CB 4.27Å; W456-F461 AromaticContact CG-CD2 3.95Å; W456-F461 HydrophobicContact CG-CD2 3.95Å; W456-F461 HydrophobicContact CZ2-CD2 4.34Å; W456-F461 HydrophobicContact CZ2-CE2 4.48Å; H457-F461 PolarHBondContact O-N 3.39Å; F461-L470 HydrophobicContact CD1-CB 3.64Å; F461-L470 HydrophobicContact CE1-CB 3.67Å; F461-L470 HydrophobicContact CE1-CD1 4.38Å; F461-L470 PolarHBondContact O-N 3.06Å; F461-F475 HydrophobicContact CE1-CB 4.44Å; F461-F475 AromaticContact CE1-CD1 3.7Å; F461-F475 HydrophobicContact CE1-CD1 3.7Å; F461-F475 HydrophobicContact CE1-CD2 4.36Å; F461-F475 AromaticContact CE1-CE1 3.97Å; F461-F475 HydrophobicContact CE1-CE1 3.97Å; F461-F475 AromaticContact CE1-CG 3.91Å; F461-F475 HydrophobicContact CE1-CG 3.91Å; F461-F475 HydrophobicContact CE1-CZ 4.43Å; F461-F475 AromaticContact CZ-CD1 3.88Å; F461-F475 HydrophobicContact CZ-CD1 3.88Å; F461-F475 AromaticContact CZ-CD2 3.77Å; F461-F475 HydrophobicContact CZ-CD2 3.77Å; F461-F475 AromaticContact CZ-CE1 3.93Å; F461-F475 HydrophobicContact CZ-CE1 3.93Å; F461-F475 AromaticContact CZ-CE2 3.85Å; F461-F475 HydrophobicContact CZ-CE2 3.85Å; F461-F475 AromaticContact CZ-CG 3.8Å; F461-F475 HydrophobicContact CZ-CG 3.8Å; F461-F475 AromaticContact CZ-CZ 3.93Å; F461-F475 HydrophobicContact CZ-CZ 3.93Å; F461-P482 HydrophobicContact CD2-CB 4.27Å; F461-P482 HydrophobicContact CD2-CG 4Å; F461-P482 HydrophobicContact CE2-CB 3.53Å; F461-P482 HydrophobicContact CE2-CG 3.69Å; F461-P482 HydrophobicContact CZ-CB 3.68Å; F461-P482 HydrophobicContact CZ-CG 4.31Å
462	T	96.7	Very high	94.5	Very high	31 Å²	31	60.6 Å²	60.6	19%	0.19	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-121.3	150.4	-171.1	56.6	0	0	0	0	111.8	D459 C460 H464 N467 R468 I469 P482	D459-T462 WeakPolarHBondContact O-CG2 3.22Å; C460-T462 VanDerWaalsContact C-N 3.32Å; C460-T462 PolarHBondContact O-N 3.04Å; T462-H464 PolarHBondContact O-N 2.97Å; T462-N467 WeakPolarHBondContact CG2-O 3.43Å; T462-R468 CarbonylContact C-O 3.17Å; T462-R468 VanDerWaalsContact CA-O 3.24Å; T462-R468 WeakPolarHBondContact CA-O 3.37Å; T462-I469 HydrophobicContact CG2-CG1 3.91Å; T462-P482 WeakPolarHBondContact O-CG 3.45Å
463	C	97.2	Very high	94.1	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.33	C	S	.	.			trans	-61.8	121.9	175.2	174.5	0	0	0	0	110.8	D465 C466 N467 R468 L470 P482 C484	C463-D465 PolarHBondContact O-N 2.96Å; C463-D465 VanDerWaalsContact O-N 3.09Å; C463-C466 PolarHBondContact O-N 3.13Å; C463-C466 VanDerWaalsContact SG-SG 3.7Å; C463-N467 WeakPolarHBondContact O-CA 3.46Å; C463-N467 PolarHBondContact O-N 2.85Å; C463-R468 PolarHBondContact N-O 3.47Å; C463-L470 HydrophobicContact CB-CD1 4.09Å; C463-L470 HydrophobicContact CB-CD2 4.23Å; C463-L470 HydrophobicContact CB-CG 4.31Å; C463-P482 WeakPolarHBondContact CA-O 3.41Å; C463-C484 HydrophobicContact CB-CB 4.2Å; C463-C484 PolarHBondContact SG-N 2.97Å
464	H	95.8	Very high	94	Very high	88 Å²	88	55.8 Å²	55.8	41%	0.407	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-32.4	-175	-174.2	82.6	0	0	0	114.9	T462 Y481 P482 Y483	T462-H464 PolarHBondContact O-N 2.97Å; H464-Y481 AromaticContact CE1-CD1 3.82Å; H464-Y481 AromaticContact CE1-CE1 3.92Å; H464-Y481 AromaticContact ND1-CD1 3.42Å; H464-Y481 WeakPolarHBondContact ND1-CD1 3.32Å; H464-Y481 AromaticContact ND1-CE1 3.92Å; H464-Y481 AromaticContact ND1-CG 3.87Å; H464-P482 PolarHBondContact N-O 2.97Å; H464-Y483 HydrophobicContact CB-CD1 4.41Å; H464-Y483 HydrophobicContact CB-CE1 3.86Å; H464-Y483 HydrophobicContact CB-CE2 4.31Å; H464-Y483 PolarHBondContact CD2-OH 2.93Å
465	D	95.8	Very high	94	Very high	64 Å²	64	52.8 Å²	52.8	34%	0.342	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-21.8	179.9	-74.1	-17.2	0	0	0	114.4	C463 Y483 H487 R491	C463-D465 PolarHBondContact O-N 2.96Å; C463-D465 VanDerWaalsContact O-N 3.09Å; D465-Y483 HydrophobicContact CB-CE1 4.48Å; D465-Y483 WeakPolarHBondContact OD2-CE1 3.27Å; D465-H487 HydrophobicContact CB-CB 4.14Å; D465-H487 IonicContact OD2-CD2 3.91Å; D465-H487 IonicContact OD2-CG 2.7Å; D465-R491 IonicContact OD1-CZ 3.05Å; D465-R491 IonicContact OD1-NE 2.78Å; D465-R491 PolarHBondContact OD1-NE 3.5Å; D465-R491 IonicContact OD1-NH2 3.67Å; D465-R491 PolarHBondContact OD1-NH2 3.29Å; D465-R491 WeakPolarHBondContact OD2-CD 3.49Å; D465-R491 IonicContact OD2-CZ 3.84Å; D465-R491 IonicContact OD2-NE 3.74Å; D465-R491 PolarHBondContact OD2-NE 3.2Å; D465-R491 IonicContact OD2-NH2 3.52Å
466	C	96.3	Very high	94	Very high	48 Å²	48	52.5 Å²	52.5	32%	0.324	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.2	5.7	-172.1	73	0	0	0	0	116.6	C463 R468 H487	C463-C466 PolarHBondContact O-N 3.13Å; C463-C466 VanDerWaalsContact SG-SG 3.7Å; C466-R468 PolarHBondContact O-N 2.93Å; C466-H487 WeakPolarHBondContact CB-CE1 3.3Å; C466-H487 PolarHBondContact SG-CE1 3.37Å; C466-H487 PolarHBondContact SG-ND1 3.45Å
467	N	95.9	Very high	93.9	Very high	122 Å²	122	56.5 Å²	56.5	65%	0.652	31%	0.306	S	S	*	.			trans	55.1	15.8	177.7	-55.5	-40.4	0	0	0	115.5	T462 C463 I469	T462-N467 WeakPolarHBondContact CG2-O 3.43Å; C463-N467 WeakPolarHBondContact O-CA 3.46Å; C463-N467 PolarHBondContact O-N 2.85Å; N467-I469 PolarHBondContact O-N 3.05Å
468	R	95.5	Very high	93.7	Very high	159 Å²	159	55 Å²	55	60%	0.6	30%	0.3	S	S	*	.			trans	-70	127.5	173.5	-172.8	-171.8	-56.3	-173.1	1.8	109.7	T462 C463 C466 L470	T462-R468 CarbonylContact C-O 3.17Å; T462-R468 VanDerWaalsContact CA-O 3.24Å; T462-R468 WeakPolarHBondContact CA-O 3.37Å; C463-R468 PolarHBondContact N-O 3.47Å; C466-R468 PolarHBondContact O-N 2.93Å; R468-L470 PolarHBondContact O-N 3.47Å
469	I	95.3	Very high	93.6	Very high	79 Å²	79	59 Å²	59	41%	0.405	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-57.2	132.3	172.7	-61.8	168.9	0	0	0	109.8	D459 T462 N467	D459-I469 HydrophobicContact CB-CD1 4.2Å; T462-I469 HydrophobicContact CG2-CG1 3.91Å; N467-I469 PolarHBondContact O-N 3.05Å
470	L	95.5	Very high	93.4	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	31%	0.309	C	S	.	.			trans	-106.5	-0.2	-177.3	-64.7	171.7	0	0	0	113	F461 C463 R468 G472 S473 F475 P482 C484	F461-L470 HydrophobicContact CD1-CB 3.64Å; F461-L470 HydrophobicContact CE1-CB 3.67Å; F461-L470 HydrophobicContact CE1-CD1 4.38Å; F461-L470 PolarHBondContact O-N 3.06Å; C463-L470 HydrophobicContact CB-CD1 4.09Å; C463-L470 HydrophobicContact CB-CD2 4.23Å; C463-L470 HydrophobicContact CB-CG 4.31Å; R468-L470 PolarHBondContact O-N 3.47Å; L470-G472 PolarHBondContact O-N 2.96Å; L470-S473 WeakPolarHBondContact CA-OG 3.44Å; L470-S473 PolarHBondContact O-N 3.37Å; L470-S473 VanDerWaalsContact O-N 3.16Å; L470-S473 PolarHBondContact O-OG 3.17Å; L470-F475 HydrophobicContact CB-CB 4.36Å; L470-F475 HydrophobicContact CD1-CB 4Å; L470-F475 HydrophobicContact CD2-CB 4.49Å; L470-P482 HydrophobicContact CD1-CB 3.78Å; L470-P482 HydrophobicContact CD1-CG 4.41Å; L470-C484 HydrophobicContact CD2-CB 3.72Å
471	T	87.7	Confident	93.3	Very high	40 Å²	40	59.7 Å²	59.7	25%	0.245	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	121.7	174.4	-57.9	0	0	0	0	109.8	I449 K458 S473	I449-T471 WeakPolarHBondContact CD1-OG1 3.27Å; I449-T471 HydrophobicContact CG2-CG2 4.23Å; K458-T471 PolarHBondContact O-OG1 3.08Å; T471-S473 VanDerWaalsContact C-N 3.34Å; T471-S473 PolarHBondContact O-N 3.25Å
472	G	84.4	Confident	93.3	Very high	63 Å²	63	59.9 Å²	59.9	65%	0.649	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	-12.3	-178.2	0	0	0	0	0	115.8	L470	L470-G472 PolarHBondContact O-N 2.96Å
473	S	83.8	Confident	93.2	Very high	45 Å²	45	58.6 Å²	58.6	32%	0.315	32%	0.315	S	S	.	.	S	Bend	trans	-95.6	170.5	173.9	73.5	0	0	0	0	112.5	L470 T471	L470-S473 WeakPolarHBondContact CA-OG 3.44Å; L470-S473 PolarHBondContact O-N 3.37Å; L470-S473 VanDerWaalsContact O-N 3.16Å; L470-S473 PolarHBondContact O-OG 3.17Å; T471-S473 VanDerWaalsContact C-N 3.34Å; T471-S473 PolarHBondContact O-N 3.25Å
474	S	89.5	Confident	93.2	Very high	42 Å²	42	59 Å²	59	29%	0.294	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	148.8	155.1	34.6	0	0	0	0	110.2	D485	S474-D485 WeakPolarHBondContact CB-OD1 3.43Å; S474-D485 PolarHBondContact OG-OD1 3.49Å; S474-D485 PolarHBondContact OG-OD2 3.18Å
475	F	94.6	Very high	93	Very high	19 Å²	19	57.3 Å²	57.3	8%	0.083	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	162.7	167.2	69.3	-90.4	0	0	0	110.5	G60 A62 A451 L452 F461 L470 Y483	G60-F475 WeakPolarHBondContact O-CD1 3.49Å; G60-F475 WeakPolarHBondContact O-CE1 3.46Å; A62-F475 HydrophobicContact CB-CE1 4.29Å; A451-F475 HydrophobicContact CB-CZ 4.14Å; L452-F475 HydrophobicContact CD2-CD2 4.48Å; L452-F475 HydrophobicContact CD2-CE2 3.73Å; L452-F475 HydrophobicContact CG-CE2 4.43Å; F461-F475 HydrophobicContact CE1-CB 4.44Å; F461-F475 AromaticContact CE1-CD1 3.7Å; F461-F475 HydrophobicContact CE1-CD1 3.7Å; F461-F475 HydrophobicContact CE1-CD2 4.36Å; F461-F475 AromaticContact CE1-CE1 3.97Å; F461-F475 HydrophobicContact CE1-CE1 3.97Å; F461-F475 AromaticContact CE1-CG 3.91Å; F461-F475 HydrophobicContact CE1-CG 3.91Å; F461-F475 HydrophobicContact CE1-CZ 4.43Å; F461-F475 AromaticContact CZ-CD1 3.88Å; F461-F475 HydrophobicContact CZ-CD1 3.88Å; F461-F475 AromaticContact CZ-CD2 3.77Å; F461-F475 HydrophobicContact CZ-CD2 3.77Å; F461-F475 AromaticContact CZ-CE1 3.93Å; F461-F475 HydrophobicContact CZ-CE1 3.93Å; F461-F475 AromaticContact CZ-CE2 3.85Å; F461-F475 HydrophobicContact CZ-CE2 3.85Å; F461-F475 AromaticContact CZ-CG 3.8Å; F461-F475 HydrophobicContact CZ-CG 3.8Å; F461-F475 AromaticContact CZ-CZ 3.93Å; F461-F475 HydrophobicContact CZ-CZ 3.93Å; L470-F475 HydrophobicContact CB-CB 4.36Å; L470-F475 HydrophobicContact CD1-CB 4Å; L470-F475 HydrophobicContact CD2-CB 4.49Å; F475-Y483 WeakPolarHBondContact CA-O 3.47Å
476	H	94.5	Very high	92.8	Very high	18 Å²	18	57.7 Å²	57.7	8%	0.083	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	149.8	172.9	-64.2	-88.7	0	0	0	110.8	P482 Y483 D485 Y488	H476-P482 CarbonylContact O-C 3.57Å; H476-Y483 PolarHBondContact N-O 3.41Å; H476-Y483 PolarHBondContact O-N 3.07Å; H476-D485 IonicContact CD2-OD1 3.47Å; H476-D485 PolarHBondContact CD2-OD1 2.94Å; H476-D485 IonicContact NE2-OD1 3.35Å; H476-Y488 HydrophobicContact CB-CD1 4Å; H476-Y488 HydrophobicContact CB-CD2 3.28Å; H476-Y488 HydrophobicContact CB-CE1 4.45Å; H476-Y488 HydrophobicContact CB-CE2 3.81Å; H476-Y488 HydrophobicContact CB-CG 3.39Å; H476-Y488 AromaticContact CD2-CD1 3.6Å; H476-Y488 AromaticContact CD2-CG 3.71Å; H476-Y488 AromaticContact CE1-CD1 3.93Å; H476-Y488 AromaticContact CE1-CE1 3.89Å; H476-Y488 AromaticContact CG-CD1 3.54Å; H476-Y488 AromaticContact CG-CD2 3.78Å; H476-Y488 AromaticContact CG-CE1 3.93Å; H476-Y488 AromaticContact CG-CG 3.46Å; H476-Y488 VanDerWaalsContact CG-CG 3.46Å; H476-Y488 AromaticContact ND1-CD1 3.76Å; H476-Y488 AromaticContact ND1-CE1 3.68Å; H476-Y488 AromaticContact ND1-CZ 3.92Å; H476-Y488 AromaticContact NE2-CD1 3.83Å
477	E	94.5	Very high	92.8	Very high	103 Å²	103	57.7 Å²	57.7	48%	0.481	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	139.1	173.4	-163.8	-163	139.8	0	0	111.1	L452 G480 Y481	L452-E477 HydrophobicContact CD1-CG 4.13Å; L452-E477 HydrophobicContact CD2-CB 3.78Å; L452-E477 HydrophobicContact CD2-CG 3.7Å; E477-G480 VanDerWaalsContact OE1-CA 3.32Å; E477-G480 WeakPolarHBondContact OE1-CA 3.36Å; E477-G480 PolarHBondContact OE1-N 3.16Å; E477-Y481 WeakPolarHBondContact CA-O 3.4Å
478	I	93.9	Very high	92.7	Very high	8 Å²	8	54.1 Å²	54.1	4%	0.041	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	117.8	158.1	-56.9	173.1	0	0	0	107.4	G480 Y481 Y483 Y488 R491 R492	I478-G480 PolarHBondContact O-N 3.24Å; I478-Y481 PolarHBondContact N-O 2.78Å; I478-Y481 PolarHBondContact O-N 3.39Å; I478-Y483 HydrophobicContact CB-CD2 3.91Å; I478-Y483 HydrophobicContact CB-CE2 3.56Å; I478-Y483 HydrophobicContact CD1-CD2 4.17Å; I478-Y483 HydrophobicContact CD1-CE2 4.28Å; I478-Y483 HydrophobicContact CD1-CG 4.47Å; I478-Y483 HydrophobicContact CG1-CD2 4Å; I478-Y483 HydrophobicContact CG1-CE2 4.12Å; I478-Y488 HydrophobicContact CD1-CD2 3.82Å; I478-Y488 HydrophobicContact CD1-CE2 4.4Å; I478-Y488 HydrophobicContact CG1-CD2 3.83Å; I478-Y488 HydrophobicContact CG1-CE2 4.15Å; I478-R491 HydrophobicContact CD1-CB 4.04Å; I478-R492 HydrophobicContact CD1-CG 4.49Å
479	E	91.1	Very high	92.6	Very high	162 Å²	162	48.8 Å²	48.8	76%	0.757	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	43.5	173.7	-61.8	169.5	-173.9	0	0	113.2	Y481	E479-Y481 WeakPolarHBondContact O-CD2 3.48Å; E479-Y481 PolarHBondContact O-N 2.87Å
480	G	90.7	Very high	92.5	Very high	39 Å²	39	48.2 Å²	48.2	40%	0.402	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-4.4	-176.9	0	0	0	0	0	115.4	L452 E477 I478	L452-G480 WeakPolarHBondContact CD1-O 3.24Å; E477-G480 VanDerWaalsContact OE1-CA 3.32Å; E477-G480 WeakPolarHBondContact OE1-CA 3.36Å; E477-G480 PolarHBondContact OE1-N 3.16Å; I478-G480 PolarHBondContact O-N 3.24Å
481	Y	93.6	Very high	92.3	Very high	122 Å²	122	54.1 Å²	54.1	48%	0.478	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.7	178.5	-62.6	-79.1	0	0	0	112	H464 E477 I478 E479 Y483	H464-Y481 AromaticContact CE1-CD1 3.82Å; H464-Y481 AromaticContact CE1-CE1 3.92Å; H464-Y481 AromaticContact ND1-CD1 3.42Å; H464-Y481 WeakPolarHBondContact ND1-CD1 3.32Å; H464-Y481 AromaticContact ND1-CE1 3.92Å; H464-Y481 AromaticContact ND1-CG 3.87Å; E477-Y481 WeakPolarHBondContact CA-O 3.4Å; I478-Y481 PolarHBondContact N-O 2.78Å; I478-Y481 PolarHBondContact O-N 3.39Å; E479-Y481 WeakPolarHBondContact O-CD2 3.48Å; E479-Y481 PolarHBondContact O-N 2.87Å; Y481-Y483 WeakPolarHBondContact O-CD2 3.37Å; Y481-Y483 VanDerWaalsContact O-CE2 3.29Å; Y481-Y483 WeakPolarHBondContact O-CE2 3.29Å
482	P	96.2	Very high	92.5	Very high	4 Å²	4	58.3 Å²	58.3	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	141.3	176.6	33.3	-34	0	0	0	112.1	L452 F461 T462 C463 H464 L470 H476	L452-P482 HydrophobicContact CD1-CB 4.09Å; L452-P482 HydrophobicContact CD1-CG 4.35Å; F461-P482 HydrophobicContact CD2-CB 4.27Å; F461-P482 HydrophobicContact CD2-CG 4Å; F461-P482 HydrophobicContact CE2-CB 3.53Å; F461-P482 HydrophobicContact CE2-CG 3.69Å; F461-P482 HydrophobicContact CZ-CB 3.68Å; F461-P482 HydrophobicContact CZ-CG 4.31Å; T462-P482 WeakPolarHBondContact O-CG 3.45Å; C463-P482 WeakPolarHBondContact CA-O 3.41Å; H464-P482 PolarHBondContact N-O 2.97Å; L470-P482 HydrophobicContact CD1-CB 3.78Å; L470-P482 HydrophobicContact CD1-CG 4.41Å; H476-P482 CarbonylContact O-C 3.57Å
483	Y	96.3	Very high	92.7	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.7	178.4	-65.8	-96.8	0	0	0	110.6	H464 D465 F475 H476 I478 Y481 H487 R491	H464-Y483 HydrophobicContact CB-CD1 4.41Å; H464-Y483 HydrophobicContact CB-CE1 3.86Å; H464-Y483 HydrophobicContact CB-CE2 4.31Å; H464-Y483 PolarHBondContact CD2-OH 2.93Å; D465-Y483 HydrophobicContact CB-CE1 4.48Å; D465-Y483 WeakPolarHBondContact OD2-CE1 3.27Å; F475-Y483 WeakPolarHBondContact CA-O 3.47Å; H476-Y483 PolarHBondContact N-O 3.41Å; H476-Y483 PolarHBondContact O-N 3.07Å; I478-Y483 HydrophobicContact CB-CD2 3.91Å; I478-Y483 HydrophobicContact CB-CE2 3.56Å; I478-Y483 HydrophobicContact CD1-CD2 4.17Å; I478-Y483 HydrophobicContact CD1-CE2 4.28Å; I478-Y483 HydrophobicContact CD1-CG 4.47Å; I478-Y483 HydrophobicContact CG1-CD2 4Å; I478-Y483 HydrophobicContact CG1-CE2 4.12Å; Y481-Y483 WeakPolarHBondContact O-CD2 3.37Å; Y481-Y483 VanDerWaalsContact O-CE2 3.29Å; Y481-Y483 WeakPolarHBondContact O-CE2 3.29Å; Y483-H487 HydrophobicContact CD1-CB 4.04Å; Y483-R491 VanDerWaalsContact CE1-CD 3.5Å; Y483-R491 VanDerWaalsContact CE1-NE 3.28Å; Y483-R491 VanDerWaalsContact OH-CZ 3.3Å; Y483-R491 PolarHBondContact OH-NH1 3.29Å
484	C	95.7	Very high	93.1	Very high	9 Å²	9	57 Å²	57	6%	0.061	29%	0.293	C	S	.	.			trans	-70.8	156.2	163.2	70.3	0	0	0	0	110.1	C463 L470 S486 H487 Y488	C463-C484 HydrophobicContact CB-CB 4.2Å; C463-C484 PolarHBondContact SG-N 2.97Å; L470-C484 HydrophobicContact CD2-CB 3.72Å; C484-S486 VanDerWaalsContact C-N 3.26Å; C484-S486 PolarHBondContact O-N 3.15Å; C484-S486 VanDerWaalsContact O-N 3.15Å; C484-H487 PolarHBondContact O-N 3.24Å; C484-H487 PolarHBondContact SG-ND1 2.8Å; C484-Y488 PolarHBondContact O-N 2.94Å
485	D	92.6	Very high	93.3	Very high	53 Å²	53	57.2 Å²	57.2	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-48	-47.2	-178.5	-53.5	-9.1	0	0	0	112.1	S474 H476 H487 Y488 Y489	S474-D485 WeakPolarHBondContact CB-OD1 3.43Å; S474-D485 PolarHBondContact OG-OD1 3.49Å; S474-D485 PolarHBondContact OG-OD2 3.18Å; H476-D485 IonicContact CD2-OD1 3.47Å; H476-D485 PolarHBondContact CD2-OD1 2.94Å; H476-D485 IonicContact NE2-OD1 3.35Å; D485-H487 PolarHBondContact O-N 2.67Å; D485-Y488 PolarHBondContact O-N 3.47Å; D485-Y489 HydrophobicContact CB-CD2 4.23Å; D485-Y489 HydrophobicContact CB-CE2 4.11Å; D485-Y489 WeakPolarHBondContact O-CD2 3.2Å; D485-Y489 PolarHBondContact O-N 2.91Å
486	S	92	Very high	93.3	Very high	71 Å²	71	56.3 Å²	56.3	50%	0.497	29%	0.286	S	S	.	.	H	α-helix	trans	-56.5	-48.6	179.4	-178.6	0	0	0	0	113.1	C484 S490	C484-S486 VanDerWaalsContact C-N 3.26Å; C484-S486 PolarHBondContact O-N 3.15Å; C484-S486 VanDerWaalsContact O-N 3.15Å; S486-S490 WeakPolarHBondContact O-CB 3.45Å; S486-S490 PolarHBondContact O-N 3.35Å
487	H	94.9	Very high	93.3	Very high	48 Å²	48	61.4 Å²	61.4	22%	0.222	31%	0.309	C	S	.	.	H	α-helix	trans	-73.9	-35.3	178.8	-70.9	115.2	0	0	0	112.6	D465 C466 Y483 C484 D485 S490 R491	D465-H487 HydrophobicContact CB-CB 4.14Å; D465-H487 IonicContact OD2-CD2 3.91Å; D465-H487 IonicContact OD2-CG 2.7Å; C466-H487 WeakPolarHBondContact CB-CE1 3.3Å; C466-H487 PolarHBondContact SG-CE1 3.37Å; C466-H487 PolarHBondContact SG-ND1 3.45Å; Y483-H487 HydrophobicContact CD1-CB 4.04Å; C484-H487 PolarHBondContact O-N 3.24Å; C484-H487 PolarHBondContact SG-ND1 2.8Å; D485-H487 PolarHBondContact O-N 2.67Å; H487-S490 PolarHBondContact O-N 3.33Å; H487-R491 WeakPolarHBondContact O-CB 3.21Å; H487-R491 WeakPolarHBondContact O-CG 3.02Å; H487-R491 PolarHBondContact O-N 2.98Å
488	Y	95.2	Very high	93.2	Very high	47 Å²	47	60.2 Å²	60.2	18%	0.184	31%	0.311	C	S	.	.	H	α-helix	trans	-57.8	-53.7	173.5	172.4	-102	0	0	0	111.7	H476 I478 C484 D485 S490 R491 R492	H476-Y488 HydrophobicContact CB-CD1 4Å; H476-Y488 HydrophobicContact CB-CD2 3.28Å; H476-Y488 HydrophobicContact CB-CE1 4.45Å; H476-Y488 HydrophobicContact CB-CE2 3.81Å; H476-Y488 HydrophobicContact CB-CG 3.39Å; H476-Y488 AromaticContact CD2-CD1 3.6Å; H476-Y488 AromaticContact CD2-CG 3.71Å; H476-Y488 AromaticContact CE1-CD1 3.93Å; H476-Y488 AromaticContact CE1-CE1 3.89Å; H476-Y488 AromaticContact CG-CD1 3.54Å; H476-Y488 AromaticContact CG-CD2 3.78Å; H476-Y488 AromaticContact CG-CE1 3.93Å; H476-Y488 AromaticContact CG-CG 3.46Å; H476-Y488 VanDerWaalsContact CG-CG 3.46Å; H476-Y488 AromaticContact ND1-CD1 3.76Å; H476-Y488 AromaticContact ND1-CE1 3.68Å; H476-Y488 AromaticContact ND1-CZ 3.92Å; H476-Y488 AromaticContact NE2-CD1 3.83Å; I478-Y488 HydrophobicContact CD1-CD2 3.82Å; I478-Y488 HydrophobicContact CD1-CE2 4.4Å; I478-Y488 HydrophobicContact CG1-CD2 3.83Å; I478-Y488 HydrophobicContact CG1-CE2 4.15Å; C484-Y488 PolarHBondContact O-N 2.94Å; D485-Y488 PolarHBondContact O-N 3.47Å; Y488-S490 VanDerWaalsContact C-N 3.34Å; Y488-S490 PolarHBondContact O-N 3.39Å; Y488-R491 PolarHBondContact O-N 2.97Å; Y488-R492 HydrophobicContact CD2-CG 4.24Å; Y488-R492 HydrophobicContact CE2-CG 3.93Å; Y488-R492 WeakPolarHBondContact O-CB 3.33Å; Y488-R492 WeakPolarHBondContact O-CG 3.2Å; Y488-R492 PolarHBondContact O-N 3Å
489	Y	93.3	Very high	93.2	Very high	48 Å²	48	61.6 Å²	61.6	19%	0.188	32%	0.321	C	S	.	.	H	α-helix	trans	-69.8	-31	179.9	-67.7	-66.3	0	0	0	112.6	D485 G493 L494 L495 P502	D485-Y489 HydrophobicContact CB-CD2 4.23Å; D485-Y489 HydrophobicContact CB-CE2 4.11Å; D485-Y489 WeakPolarHBondContact O-CD2 3.2Å; D485-Y489 PolarHBondContact O-N 2.91Å; Y489-G493 PolarHBondContact O-N 2.86Å; Y489-L494 HydrophobicContact CD1-CB 3.86Å; Y489-L494 HydrophobicContact CD1-CD1 3.96Å; Y489-L494 HydrophobicContact CE1-CD1 4.43Å; Y489-L494 PolarHBondContact O-N 3.28Å; Y489-L495 VanDerWaalsContact CB-CD2 3.49Å; Y489-P502 HydrophobicContact CD1-CB 3.88Å; Y489-P502 HydrophobicContact CD2-CB 3.45Å; Y489-P502 VanDerWaalsContact CD2-CB 3.45Å; Y489-P502 HydrophobicContact CD2-CG 3.22Å; Y489-P502 HydrophobicContact CE1-CB 4.06Å; Y489-P502 HydrophobicContact CE2-CB 3.67Å; Y489-P502 HydrophobicContact CE2-CG 3.65Å; Y489-P502 HydrophobicContact CG-CB 3.58Å; Y489-P502 HydrophobicContact CG-CG 3.74Å
490	S	92.7	Very high	93.3	Very high	67 Å²	67	58.1 Å²	58.1	47%	0.469	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-56.6	171.7	-172.9	0	0	0	0	111.3	S486 H487 Y488 R492 G493	S486-S490 WeakPolarHBondContact O-CB 3.45Å; S486-S490 PolarHBondContact O-N 3.35Å; H487-S490 PolarHBondContact O-N 3.33Å; Y488-S490 VanDerWaalsContact C-N 3.34Å; Y488-S490 PolarHBondContact O-N 3.39Å; S490-R492 VanDerWaalsContact C-N 3.29Å; S490-R492 PolarHBondContact O-N 3.48Å; S490-G493 PolarHBondContact O-N 3.29Å
491	R	91.4	Very high	93.4	Very high	124 Å²	124	61.2 Å²	61.2	47%	0.468	32%	0.322	S	S	.	.	H	α-helix	trans	-59.5	-35.7	178.7	-78.8	-177.2	162.4	-119.6	7.8	113.4	D465 I478 Y483 H487 Y488 G493	D465-R491 IonicContact OD1-CZ 3.05Å; D465-R491 IonicContact OD1-NE 2.78Å; D465-R491 PolarHBondContact OD1-NE 3.5Å; D465-R491 IonicContact OD1-NH2 3.67Å; D465-R491 PolarHBondContact OD1-NH2 3.29Å; D465-R491 WeakPolarHBondContact OD2-CD 3.49Å; D465-R491 IonicContact OD2-CZ 3.84Å; D465-R491 IonicContact OD2-NE 3.74Å; D465-R491 PolarHBondContact OD2-NE 3.2Å; D465-R491 IonicContact OD2-NH2 3.52Å; I478-R491 HydrophobicContact CD1-CB 4.04Å; Y483-R491 VanDerWaalsContact CE1-CD 3.5Å; Y483-R491 VanDerWaalsContact CE1-NE 3.28Å; Y483-R491 VanDerWaalsContact OH-CZ 3.3Å; Y483-R491 PolarHBondContact OH-NH1 3.29Å; H487-R491 WeakPolarHBondContact O-CB 3.21Å; H487-R491 WeakPolarHBondContact O-CG 3.02Å; H487-R491 PolarHBondContact O-N 2.98Å; Y488-R491 PolarHBondContact O-N 2.97Å; R491-G493 PolarHBondContact O-N 2.84Å
492	R	90.7	Very high	93.3	Very high	128 Å²	128	57.3 Å²	57.3	48%	0.483	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.5	177.3	-66.7	-75.5	159.7	169.4	-8.2	113.5	I478 Y488 S490 L494	I478-R492 HydrophobicContact CD1-CG 4.49Å; Y488-R492 HydrophobicContact CD2-CG 4.24Å; Y488-R492 HydrophobicContact CE2-CG 3.93Å; Y488-R492 WeakPolarHBondContact O-CB 3.33Å; Y488-R492 WeakPolarHBondContact O-CG 3.2Å; Y488-R492 PolarHBondContact O-N 3Å; S490-R492 VanDerWaalsContact C-N 3.29Å; S490-R492 PolarHBondContact O-N 3.48Å; R492-L494 VanDerWaalsContact C-N 3.3Å; R492-L494 HydrophobicContact CB-CB 4.48Å; R492-L494 HydrophobicContact CB-CD1 3.65Å; R492-L494 HydrophobicContact CB-CG 4.02Å; R492-L494 PolarHBondContact O-N 2.84Å
493	G	90	Very high	93.1	Very high	40 Å²	40	57.6 Å²	57.6	41%	0.412	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	42.9	-176.8	0	0	0	0	0	111.8	Y489 S490 R491 R514	Y489-G493 PolarHBondContact O-N 2.86Å; S490-G493 PolarHBondContact O-N 3.29Å; R491-G493 PolarHBondContact O-N 2.84Å; G493-R514 WeakPolarHBondContact O-CD 3.2Å; G493-R514 PolarHBondContact O-NH1 3.05Å
494	L	91.5	Very high	92.7	Very high	42 Å²	42	62.9 Å²	62.9	22%	0.22	35%	0.345	C	S	.	.			trans	-112.1	1.5	-175.6	-78.6	168.7	0	0	0	113.5	Y489 R492 I503 R514	Y489-L494 HydrophobicContact CD1-CB 3.86Å; Y489-L494 HydrophobicContact CD1-CD1 3.96Å; Y489-L494 HydrophobicContact CE1-CD1 4.43Å; Y489-L494 PolarHBondContact O-N 3.28Å; R492-L494 VanDerWaalsContact C-N 3.3Å; R492-L494 HydrophobicContact CB-CB 4.48Å; R492-L494 HydrophobicContact CB-CD1 3.65Å; R492-L494 HydrophobicContact CB-CG 4.02Å; R492-L494 PolarHBondContact O-N 2.84Å; L494-I503 WeakPolarHBondContact O-CB 3.21Å; L494-I503 WeakPolarHBondContact O-CG1 3.39Å; L494-I503 PolarHBondContact O-N 2.87Å; L494-R514 VanDerWaalsContact CD2-NH1 3.29Å
495	L	94.1	Very high	92.4	Very high	45 Å²	45	66 Å²	66	24%	0.236	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-78.8	141.6	175.5	-59	-179.3	0	0	0	111.7	Y489 P502	Y489-L495 VanDerWaalsContact CB-CD2 3.49Å; L495-P502 HydrophobicContact CD2-CB 4.46Å; L495-P502 HydrophobicContact CD2-CG 4.03Å
496	C	95.2	Very high	92.3	Very high	1 Å²	1	73.5 Å²	73.5	1%	0.007	40%	0.403	C	S	.	.			trans	-72.2	126.5	171.1	174.1	0	0	0	0	110.4	S498 S500 L501 I503 R514 H516 H519	C496-S498 PolarHBondContact O-N 2.84Å; C496-S498 PolarHBondContact SG-N 3.42Å; C496-S500 WeakPolarHBondContact O-CA 3.35Å; C496-S500 PolarHBondContact O-N 3.43Å; C496-L501 PolarHBondContact N-O 2.85Å; C496-I503 HydrophobicContact CB-CD1 4.2Å; C496-I503 HydrophobicContact CB-CG1 3.83Å; C496-R514 WeakPolarHBondContact CA-O 3.47Å; C496-H516 PolarHBondContact SG-N 3.17Å; C496-H516 VanDerWaalsContact SG-N 3.44Å; C496-H519 PolarHBondContact SG-ND1 3.4Å; C496-H519 VanDerWaalsContact SG-ND1 3.37Å
497	F	93.2	Very high	92.3	Very high	125 Å²	125	72 Å²	72	55%	0.548	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-21.8	-179.7	-175.1	-103	0	0	0	114.1	K513 R514 Y515	F497-K513 HydrophobicContact CB-CB 4.13Å; F497-K513 HydrophobicContact CB-CG 4.48Å; F497-K513 HydrophobicContact CD1-CD 3.74Å; F497-K513 HydrophobicContact CD2-CD 4.08Å; F497-K513 HydrophobicContact CD2-CG 4.21Å; F497-K513 HydrophobicContact CE1-CD 3.91Å; F497-K513 HydrophobicContact CE2-CD 4.26Å; F497-K513 HydrophobicContact CG-CB 4.27Å; F497-K513 HydrophobicContact CG-CD 3.84Å; F497-K513 HydrophobicContact CG-CG 4.12Å; F497-K513 HydrophobicContact CZ-CD 4.18Å; F497-R514 PolarHBondContact N-O 2.88Å; F497-Y515 HydrophobicContact CB-CD1 4.34Å; F497-Y515 HydrophobicContact CB-CE1 3.89Å; F497-Y515 AromaticContact CD1-CE1 3.89Å; F497-Y515 HydrophobicContact CD1-CE1 3.89Å; F497-Y515 HydrophobicContact CG-CE1 4.37Å
498	S	92.3	Very high	92.2	Very high	77 Å²	77	70.4 Å²	70.4	54%	0.538	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-50.9	179.7	-166.6	0	0	0	0	112.8	C496	C496-S498 PolarHBondContact O-N 2.84Å; C496-S498 PolarHBondContact SG-N 3.42Å
499	C	94.6	Very high	92.1	Very high	37 Å²	37	72.9 Å²	72.9	25%	0.25	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-3.6	-174.6	67.8	0	0	0	0	114.9	L501 H516 H519	C499-L501 HydrophobicContact CB-CG 4.48Å; C499-L501 PolarHBondContact O-N 3.45Å; C499-H516 VanDerWaalsContact SG-CE1 3.59Å; C499-H519 PolarHBondContact SG-CE1 3.18Å; C499-H519 PolarHBondContact SG-ND1 3.39Å; C499-H519 VanDerWaalsContact SG-ND1 3.43Å
500	S	92.7	Very high	92	Very high	89 Å²	89	71 Å²	71	62%	0.622	40%	0.397	S	S	*	.			trans	59.3	5.2	-173.8	71.1	0	0	0	0	116.8	C496	C496-S500 WeakPolarHBondContact O-CA 3.35Å; C496-S500 PolarHBondContact O-N 3.43Å
501	L	93	Very high	91.9	Very high	104 Å²	104	69.5 Å²	69.5	55%	0.545	38%	0.384	S	S	.	.			trans	-83	155.4	176.8	-60	176.4	0	0	0	112.2	C496 C499	C496-L501 PolarHBondContact N-O 2.85Å; C499-L501 HydrophobicContact CB-CG 4.48Å; C499-L501 PolarHBondContact O-N 3.45Å
502	P	91.8	Very high	91.7	Very high	41 Å²	41	68.1 Å²	68.1	27%	0.266	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-60.7	132.3	174.2	-25.7	36.9	0	0	0	113.8	Y489 L495 T504 H516	Y489-P502 HydrophobicContact CD1-CB 3.88Å; Y489-P502 HydrophobicContact CD2-CB 3.45Å; Y489-P502 VanDerWaalsContact CD2-CB 3.45Å; Y489-P502 HydrophobicContact CD2-CG 3.22Å; Y489-P502 HydrophobicContact CE1-CB 4.06Å; Y489-P502 HydrophobicContact CE2-CB 3.67Å; Y489-P502 HydrophobicContact CE2-CG 3.65Å; Y489-P502 HydrophobicContact CG-CB 3.58Å; Y489-P502 HydrophobicContact CG-CG 3.74Å; L495-P502 HydrophobicContact CD2-CB 4.46Å; L495-P502 HydrophobicContact CD2-CG 4.03Å; P502-T504 PolarHBondContact O-N 3.37Å; P502-H516 PolarHBondContact O-NE2 2.99Å
503	I	92	Very high	91.8	Very high	9 Å²	9	65.7 Å²	65.7	5%	0.046	40%	0.4	C	S	.	.			trans	-83.5	104.2	174.2	-53.4	165.3	0	0	0	110.2	L494 C496 C507 R514 H516	L494-I503 WeakPolarHBondContact O-CB 3.21Å; L494-I503 WeakPolarHBondContact O-CG1 3.39Å; L494-I503 PolarHBondContact O-N 2.87Å; C496-I503 HydrophobicContact CB-CD1 4.2Å; C496-I503 HydrophobicContact CB-CG1 3.83Å; I503-C507 HydrophobicContact CD1-CB 3.97Å; I503-C507 HydrophobicContact CG2-CB 3.64Å; I503-R514 HydrophobicContact CD1-CB 3.64Å; I503-H516 WeakPolarHBondContact CA-NE2 3.38Å
504	T	87.9	Confident	91.9	Very high	115 Å²	115	67.3 Å²	67.3	71%	0.706	39%	0.394	S	S	*	.			trans	-92	109.6	172.1	51.1	0	0	0	0	110.6	P502	P502-T504 PolarHBondContact O-N 3.37Å
505	G	88.7	Confident	92.1	Very high	74 Å²	74	66.2 Å²	66.2	76%	0.763	39%	0.387	S	S	*	.	S	Bend	trans	95.2	-124.1	177.2	0	0	0	0	0	114.1
506	R	90.9	Very high	92.1	Very high	212 Å²	212	65.2 Å²	65.2	80%	0.8	38%	0.381	S	S	*	.			trans	-71.3	134.1	-174.9	-67.2	-170.5	-63.7	177.6	-0.3	110.9	P517	R506-P517 HydrophobicContact CB-CG 4.33Å
507	C	92.5	Very high	92	Very high	39 Å²	39	67.4 Å²	67.4	26%	0.264	40%	0.396	S	S	.	.			trans	-127.3	151.4	174.4	61.8	0	0	0	0	110.7	I503 N509 R514 Y515	I503-C507 HydrophobicContact CD1-CB 3.97Å; I503-C507 HydrophobicContact CG2-CB 3.64Å; C507-N509 PolarHBondContact SG-OD1 3.13Å; C507-N509 VanDerWaalsContact SG-OD1 3.38Å; C507-R514 PolarHBondContact SG-NH2 3.37Å; C507-Y515 CarbonylContact C-O 3.44Å; C507-Y515 WeakPolarHBondContact CA-O 3.48Å
508	V	93.2	Very high	92	Very high	14 Å²	14	66.5 Å²	66.5	9%	0.085	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	118.3	165.7	172.2	0	0	0	0	108	A510 R514 Y515 P517 F520 T531	V508-A510 HydrophobicContact CG1-CB 4.19Å; V508-R514 CarbonylContact O-C 3.55Å; V508-R514 WeakPolarHBondContact O-CA 3.44Å; V508-Y515 PolarHBondContact N-O 3.44Å; V508-Y515 PolarHBondContact O-N 2.88Å; V508-P517 HydrophobicContact CG2-CB 4.5Å; V508-F520 HydrophobicContact CB-CB 4.08Å; V508-F520 HydrophobicContact CB-CG 4.38Å; V508-F520 HydrophobicContact CG1-CB 3.83Å; V508-F520 HydrophobicContact CG1-CD1 3.57Å; V508-F520 HydrophobicContact CG1-CD2 4.2Å; V508-F520 HydrophobicContact CG1-CE1 4.18Å; V508-F520 HydrophobicContact CG1-CG 3.59Å; V508-F520 HydrophobicContact CG2-CB 4.36Å; V508-T531 HydrophobicContact CB-CG2 4.5Å; V508-T531 HydrophobicContact CG1-CG2 3.84Å; V508-T531 HydrophobicContact CG2-CG2 4.43Å
509	N	92.2	Very high	92.1	Very high	99 Å²	99	65.4 Å²	65.4	53%	0.529	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	113.2	172.8	-64.1	-17.4	0	0	0	108.3	C507 K513 R514	C507-N509 PolarHBondContact SG-OD1 3.13Å; C507-N509 VanDerWaalsContact SG-OD1 3.38Å; N509-K513 WeakPolarHBondContact CA-O 3.46Å; N509-R514 WeakPolarHBondContact OD1-CG 3.46Å; N509-R514 PolarHBondContact OD1-NE 3.22Å; N509-R514 VanDerWaalsContact OD1-NE 3.13Å
510	A	91.3	Very high	92.2	Very high	10 Å²	10	63.7 Å²	63.7	8%	0.083	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	150.7	-177.9	0	0	0	0	0	110.3	V508 G512 K513 F520 F534	V508-A510 HydrophobicContact CG1-CB 4.19Å; A510-G512 PolarHBondContact O-N 3.41Å; A510-K513 PolarHBondContact N-O 2.92Å; A510-K513 CarbonylContact O-C 3.59Å; A510-K513 WeakPolarHBondContact O-CA 3.46Å; A510-K513 PolarHBondContact O-N 3.2Å; A510-F520 HydrophobicContact CB-CD2 4.13Å; A510-F520 HydrophobicContact CB-CE1 4.18Å; A510-F520 HydrophobicContact CB-CE2 3.43Å; A510-F520 VanDerWaalsContact CB-CE2 3.43Å; A510-F520 HydrophobicContact CB-CZ 3.47Å; A510-F520 VanDerWaalsContact CB-CZ 3.47Å; A510-F534 HydrophobicContact CB-CE1 4.1Å; A510-F534 HydrophobicContact CB-CZ 4Å
511	L	89.7	Confident	92.3	Very high	35 Å²	35	62.2 Å²	62.2	18%	0.183	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	33.4	176.5	-49.2	174.7	0	0	0	113.7	K513 F520 F534 E536 P541	L511-K513 WeakPolarHBondContact O-CG 3.43Å; L511-K513 PolarHBondContact O-N 3.47Å; L511-F520 HydrophobicContact CD1-CE2 4.36Å; L511-F534 HydrophobicContact CD2-CE2 3.94Å; L511-F534 HydrophobicContact CD2-CZ 4.44Å; L511-F534 HydrophobicContact CG-CE2 4.45Å; L511-E536 HydrophobicContact CD2-CB 4.15Å; L511-E536 HydrophobicContact CD2-CG 3.64Å; L511-E536 WeakPolarHBondContact CD2-OE2 3.47Å; L511-P541 HydrophobicContact CD1-CB 4.07Å; L511-P541 HydrophobicContact CD1-CG 3.99Å
512	G	88.4	Confident	92.4	Very high	94 Å²	94	57.3 Å²	57.3	97%	0.969	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	11.1	-173.8	0	0	0	0	0	115	A510	A510-G512 PolarHBondContact O-N 3.41Å
513	K	91.8	Very high	92.6	Very high	77 Å²	77	57.4 Å²	57.4	34%	0.335	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	168.5	-172.4	-66.8	157.1	-174.1	-65.1	0	110.2	F497 N509 A510 L511 Y515	F497-K513 HydrophobicContact CB-CB 4.13Å; F497-K513 HydrophobicContact CB-CG 4.48Å; F497-K513 HydrophobicContact CD1-CD 3.74Å; F497-K513 HydrophobicContact CD2-CD 4.08Å; F497-K513 HydrophobicContact CD2-CG 4.21Å; F497-K513 HydrophobicContact CE1-CD 3.91Å; F497-K513 HydrophobicContact CE2-CD 4.26Å; F497-K513 HydrophobicContact CG-CB 4.27Å; F497-K513 HydrophobicContact CG-CD 3.84Å; F497-K513 HydrophobicContact CG-CG 4.12Å; F497-K513 HydrophobicContact CZ-CD 4.18Å; N509-K513 WeakPolarHBondContact CA-O 3.46Å; A510-K513 PolarHBondContact N-O 2.92Å; A510-K513 CarbonylContact O-C 3.59Å; A510-K513 WeakPolarHBondContact O-CA 3.46Å; A510-K513 PolarHBondContact O-N 3.2Å; L511-K513 WeakPolarHBondContact O-CG 3.43Å; L511-K513 PolarHBondContact O-N 3.47Å; K513-Y515 HydrophobicContact CB-CE2 3.67Å; K513-Y515 WeakPolarHBondContact CD-OH 2.98Å
514	R	93.2	Very high	92.8	Very high	75 Å²	75	64 Å²	64	28%	0.283	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.4	178.5	-52.5	-177.1	81	178	-2.9	110.4	G493 L494 C496 F497 I503 C507 V508 N509	G493-R514 WeakPolarHBondContact O-CD 3.2Å; G493-R514 PolarHBondContact O-NH1 3.05Å; L494-R514 VanDerWaalsContact CD2-NH1 3.29Å; C496-R514 WeakPolarHBondContact CA-O 3.47Å; F497-R514 PolarHBondContact N-O 2.88Å; I503-R514 HydrophobicContact CD1-CB 3.64Å; C507-R514 PolarHBondContact SG-NH2 3.37Å; V508-R514 CarbonylContact O-C 3.55Å; V508-R514 WeakPolarHBondContact O-CA 3.44Å; N509-R514 WeakPolarHBondContact OD1-CG 3.46Å; N509-R514 PolarHBondContact OD1-NE 3.22Å; N509-R514 VanDerWaalsContact OD1-NE 3.13Å
515	Y	94.5	Very high	93.2	Very high	18 Å²	18	60.4 Å²	60.4	7%	0.071	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	153	-177.2	-56.3	-97.6	0	0	0	110	F497 C507 V508 K513 F520	F497-Y515 HydrophobicContact CB-CD1 4.34Å; F497-Y515 HydrophobicContact CB-CE1 3.89Å; F497-Y515 AromaticContact CD1-CE1 3.89Å; F497-Y515 HydrophobicContact CD1-CE1 3.89Å; F497-Y515 HydrophobicContact CG-CE1 4.37Å; C507-Y515 CarbonylContact C-O 3.44Å; C507-Y515 WeakPolarHBondContact CA-O 3.48Å; V508-Y515 PolarHBondContact N-O 3.44Å; V508-Y515 PolarHBondContact O-N 2.88Å; K513-Y515 HydrophobicContact CB-CE2 3.67Å; K513-Y515 WeakPolarHBondContact CD-OH 2.98Å; Y515-F520 HydrophobicContact CD1-CD2 4.45Å; Y515-F520 AromaticContact CD2-CD2 3.75Å; Y515-F520 HydrophobicContact CD2-CD2 3.75Å; Y515-F520 HydrophobicContact CD2-CE2 4.47Å; Y515-F520 HydrophobicContact CD2-CG 4.48Å; Y515-F520 AromaticContact CE2-CD2 3.89Å; Y515-F520 HydrophobicContact CE2-CD2 3.89Å; Y515-F520 HydrophobicContact CE2-CE2 4.25Å; Y515-F520 HydrophobicContact CG-CB 4.2Å; Y515-F520 HydrophobicContact CG-CD2 4.06Å
516	H	94.6	Very high	93.4	Very high	24 Å²	24	62.5 Å²	62.5	11%	0.111	33%	0.329	C	S	.	.			trans	-63.9	151.9	154.7	-56.7	144.6	0	0	0	109.5	C496 C499 P502 I503 E518 H519 F520	C496-H516 PolarHBondContact SG-N 3.17Å; C496-H516 VanDerWaalsContact SG-N 3.44Å; C499-H516 VanDerWaalsContact SG-CE1 3.59Å; P502-H516 PolarHBondContact O-NE2 2.99Å; I503-H516 WeakPolarHBondContact CA-NE2 3.38Å; H516-E518 HydrophobicContact CB-CG 4.4Å; H516-E518 WeakPolarHBondContact CB-OE1 3.49Å; H516-E518 WeakPolarHBondContact CB-OE2 3.42Å; H516-E518 IonicContact CG-OE1 3.45Å; H516-E518 IonicContact ND1-OE1 3.06Å; H516-E518 PolarHBondContact ND1-OE1 3.34Å; H516-E518 PolarHBondContact O-N 3.38Å; H516-H519 HydrophobicContact CB-CB 4.18Å; H516-H519 AromaticContact CG-ND1 3.74Å; H516-H519 AromaticContact ND1-CE1 3.41Å; H516-H519 PolarHBondContact ND1-CE1 3.19Å; H516-H519 AromaticContact ND1-ND1 3.13Å; H516-H519 PolarHBondContact ND1-ND1 2.84Å; H516-H519 VanDerWaalsContact ND1-ND1 3.13Å; H516-H519 PolarHBondContact O-N 3.13Å; H516-F520 PolarHBondContact O-N 3.26Å
517	P	93	Very high	93.6	Very high	48 Å²	48	58.5 Å²	58.5	31%	0.312	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-53.4	-40.3	177.9	-26.9	36.2	0	0	0	113.6	R506 V508 H519	R506-P517 HydrophobicContact CB-CG 4.33Å; V508-P517 HydrophobicContact CG2-CB 4.5Å; P517-H519 VanDerWaalsContact C-N 3.26Å; P517-H519 PolarHBondContact O-N 3.21Å
518	E	93.6	Very high	93.6	Very high	105 Å²	105	60.8 Å²	60.8	49%	0.491	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-75	-8.7	176.8	70.6	-76.3	176.1	0	0	114.4	H516 L521	H516-E518 HydrophobicContact CB-CG 4.4Å; H516-E518 WeakPolarHBondContact CB-OE1 3.49Å; H516-E518 WeakPolarHBondContact CB-OE2 3.42Å; H516-E518 IonicContact CG-OE1 3.45Å; H516-E518 IonicContact ND1-OE1 3.06Å; H516-E518 PolarHBondContact ND1-OE1 3.34Å; H516-E518 PolarHBondContact O-N 3.38Å; E518-L521 WeakPolarHBondContact O-CD2 3.45Å
519	H	95.1	Very high	93.6	Very high	55 Å²	55	60.7 Å²	60.7	26%	0.255	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-105.7	-6.8	179.8	-71.7	160.6	0	0	0	114	C496 C499 H516 P517 L521	C496-H519 PolarHBondContact SG-ND1 3.4Å; C496-H519 VanDerWaalsContact SG-ND1 3.37Å; C499-H519 PolarHBondContact SG-CE1 3.18Å; C499-H519 PolarHBondContact SG-ND1 3.39Å; C499-H519 VanDerWaalsContact SG-ND1 3.43Å; H516-H519 HydrophobicContact CB-CB 4.18Å; H516-H519 AromaticContact CG-ND1 3.74Å; H516-H519 AromaticContact ND1-CE1 3.41Å; H516-H519 PolarHBondContact ND1-CE1 3.19Å; H516-H519 AromaticContact ND1-ND1 3.13Å; H516-H519 PolarHBondContact ND1-ND1 2.84Å; H516-H519 VanDerWaalsContact ND1-ND1 3.13Å; H516-H519 PolarHBondContact O-N 3.13Å; P517-H519 VanDerWaalsContact C-N 3.26Å; P517-H519 PolarHBondContact O-N 3.21Å; H519-L521 PolarHBondContact O-N 3.38Å
520	F	95.6	Very high	93.2	Very high	1 Å²	1	62.8 Å²	62.8	0%	0.004	34%	0.339	C	S	.	.			trans	-89.6	80	171.2	-169.5	-116.8	0	0	0	109.8	V508 A510 L511 Y515 H516 L529 F534 P541	V508-F520 HydrophobicContact CB-CB 4.08Å; V508-F520 HydrophobicContact CB-CG 4.38Å; V508-F520 HydrophobicContact CG1-CB 3.83Å; V508-F520 HydrophobicContact CG1-CD1 3.57Å; V508-F520 HydrophobicContact CG1-CD2 4.2Å; V508-F520 HydrophobicContact CG1-CE1 4.18Å; V508-F520 HydrophobicContact CG1-CG 3.59Å; V508-F520 HydrophobicContact CG2-CB 4.36Å; A510-F520 HydrophobicContact CB-CD2 4.13Å; A510-F520 HydrophobicContact CB-CE1 4.18Å; A510-F520 HydrophobicContact CB-CE2 3.43Å; A510-F520 VanDerWaalsContact CB-CE2 3.43Å; A510-F520 HydrophobicContact CB-CZ 3.47Å; A510-F520 VanDerWaalsContact CB-CZ 3.47Å; L511-F520 HydrophobicContact CD1-CE2 4.36Å; Y515-F520 HydrophobicContact CD1-CD2 4.45Å; Y515-F520 AromaticContact CD2-CD2 3.75Å; Y515-F520 HydrophobicContact CD2-CD2 3.75Å; Y515-F520 HydrophobicContact CD2-CE2 4.47Å; Y515-F520 HydrophobicContact CD2-CG 4.48Å; Y515-F520 AromaticContact CE2-CD2 3.89Å; Y515-F520 HydrophobicContact CE2-CD2 3.89Å; Y515-F520 HydrophobicContact CE2-CE2 4.25Å; Y515-F520 HydrophobicContact CG-CB 4.2Å; Y515-F520 HydrophobicContact CG-CD2 4.06Å; H516-F520 PolarHBondContact O-N 3.26Å; F520-L529 HydrophobicContact CD1-CB 3.5Å; F520-L529 HydrophobicContact CD1-CD1 4.45Å; F520-L529 HydrophobicContact CE1-CB 3.56Å; F520-L529 HydrophobicContact CE1-CD1 4.06Å; F520-L529 HydrophobicContact CE1-CG 4.48Å; F520-L529 HydrophobicContact CG-CB 4.49Å; F520-L529 HydrophobicContact CZ-CD1 4.33Å; F520-L529 WeakPolarHBondContact O-CB 3.32Å; F520-L529 PolarHBondContact O-N 3.08Å; F520-F534 HydrophobicContact CE1-CB 4.46Å; F520-F534 AromaticContact CE1-CD1 3.57Å; F520-F534 HydrophobicContact CE1-CD1 3.57Å; F520-F534 AromaticContact CE1-CE1 3.92Å; F520-F534 HydrophobicContact CE1-CE1 3.92Å; F520-F534 HydrophobicContact CE1-CG 4Å; F520-F534 AromaticContact CZ-CD1 3.63Å; F520-F534 HydrophobicContact CZ-CD1 3.63Å; F520-F534 HydrophobicContact CZ-CD2 4.06Å; F520-F534 AromaticContact CZ-CE1 3.68Å; F520-F534 HydrophobicContact CZ-CE1 3.68Å; F520-F534 HydrophobicContact CZ-CE2 4.12Å; F520-F534 AromaticContact CZ-CG 3.84Å; F520-F534 HydrophobicContact CZ-CG 3.84Å; F520-F534 AromaticContact CZ-CZ 3.93Å; F520-F534 HydrophobicContact CZ-CZ 3.93Å; F520-P541 HydrophobicContact CD2-CG 4.36Å; F520-P541 HydrophobicContact CE2-CB 3.73Å; F520-P541 HydrophobicContact CE2-CG 3.7Å; F520-P541 HydrophobicContact CZ-CB 3.61Å; F520-P541 HydrophobicContact CZ-CG 4.09Å
521	L	95.4	Very high	92.5	Very high	58 Å²	58	67 Å²	67	30%	0.304	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-102.9	152.4	-173.2	-55	-176.5	0	0	0	112.1	E518 H519 A523 L526 H527 P528	E518-L521 WeakPolarHBondContact O-CD2 3.45Å; H519-L521 PolarHBondContact O-N 3.38Å; L521-A523 PolarHBondContact O-N 2.8Å; L521-L526 WeakPolarHBondContact CD2-O 3.43Å; L521-H527 WeakPolarHBondContact CA-O 3.2Å; L521-P528 HydrophobicContact CD2-CB 4.08Å; L521-P528 HydrophobicContact CD2-CG 3.76Å
522	C	95.7	Very high	92	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	39%	0.39	C	S	.	.			trans	-62.5	126.5	168.9	177.9	0	0	0	0	110.7	Y524 C525 L526 H527 L529 C543	C522-Y524 PolarHBondContact O-N 3.29Å; C522-C525 WeakPolarHBondContact CB-SG 3.06Å; C522-C525 PolarHBondContact SG-SG 3.39Å; C522-L526 VanDerWaalsContact O-CA 3.24Å; C522-L526 WeakPolarHBondContact O-CA 3.37Å; C522-L526 PolarHBondContact O-N 2.85Å; C522-H527 PolarHBondContact N-O 2.92Å; C522-L529 HydrophobicContact CB-CD1 4.22Å; C522-L529 HydrophobicContact CB-CD2 4.16Å; C522-L529 HydrophobicContact CB-CG 4.22Å; C522-C543 HydrophobicContact CB-CB 4.49Å; C522-C543 PolarHBondContact SG-N 2.92Å
523	A	95.1	Very high	91.8	Very high	44 Å²	44	68.2 Å²	68.2	36%	0.364	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-5	-178.3	0	0	0	0	0	115.2	L521 K540 P541 Y542	L521-A523 PolarHBondContact O-N 2.8Å; A523-K540 HydrophobicContact CB-CB 3.9Å; A523-K540 HydrophobicContact CB-CD 4.25Å; A523-K540 HydrophobicContact CB-CG 4.49Å; A523-P541 WeakPolarHBondContact CB-O 3.41Å; A523-P541 PolarHBondContact N-O 3Å; A523-Y542 HydrophobicContact CB-CD1 4.47Å; A523-Y542 HydrophobicContact CB-CE1 4.02Å; A523-Y542 HydrophobicContact CB-CE2 4.39Å
524	Y	95.5	Very high	91.8	Very high	146 Å²	146	66.8 Å²	66.8	57%	0.573	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-61.6	173.8	-176.9	-102.8	0	0	0	112.5	C522 C546 L550	C522-Y524 PolarHBondContact O-N 3.29Å; Y524-C546 HydrophobicContact CD1-CB 4.09Å; Y524-L550 HydrophobicContact CD1-CD1 4.48Å; Y524-L550 HydrophobicContact CD2-CD1 3.81Å; Y524-L550 HydrophobicContact CD2-CD2 4.36Å; Y524-L550 HydrophobicContact CE2-CD1 4.44Å; Y524-L550 HydrophobicContact CE2-CD2 4.2Å; Y524-L550 HydrophobicContact CG-CD1 3.82Å
525	C	96.4	Very high	91.8	Very high	40 Å²	40	68.2 Å²	68.2	27%	0.27	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-0.6	-174.8	65.2	0	0	0	0	114.9	C522 H527	C522-C525 WeakPolarHBondContact CB-SG 3.06Å; C522-C525 PolarHBondContact SG-SG 3.39Å; C525-H527 PolarHBondContact O-N 3.26Å
526	L	94.8	Very high	91.7	Very high	119 Å²	119	72.4 Å²	72.4	62%	0.623	39%	0.391	S	S	*	.			trans	56.4	9	-179.5	-53.8	178.8	0	0	0	115.9	L521 C522	L521-L526 WeakPolarHBondContact CD2-O 3.43Å; C522-L526 VanDerWaalsContact O-CA 3.24Å; C522-L526 WeakPolarHBondContact O-CA 3.37Å; C522-L526 PolarHBondContact O-N 2.85Å
527	H	93.5	Very high	91.7	Very high	128 Å²	128	74.7 Å²	74.7	59%	0.593	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-70.2	141.5	173.3	-75.4	-58	0	0	0	111.8	L521 C522 C525 L529	L521-H527 WeakPolarHBondContact CA-O 3.2Å; C522-H527 PolarHBondContact N-O 2.92Å; C525-H527 PolarHBondContact O-N 3.26Å; H527-L529 PolarHBondContact O-N 3.24Å
528	P	93	Very high	91.6	Very high	86 Å²	86	76.7 Å²	76.7	56%	0.558	42%	0.417	S	S	*	.	B	Isolated β-bridge	trans	-56.8	133.7	173.6	-25.5	34.2	0	0	0	112.5	L521	L521-P528 HydrophobicContact CD2-CB 4.08Å; L521-P528 HydrophobicContact CD2-CG 3.76Å
529	L	93.2	Very high	91.5	Very high	12 Å²	12	76 Å²	76	6%	0.063	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-101.6	147.1	178	-65.9	172.6	0	0	0	110	F520 C522 H527 F534 P541 C543	F520-L529 HydrophobicContact CD1-CB 3.5Å; F520-L529 HydrophobicContact CD1-CD1 4.45Å; F520-L529 HydrophobicContact CE1-CB 3.56Å; F520-L529 HydrophobicContact CE1-CD1 4.06Å; F520-L529 HydrophobicContact CE1-CG 4.48Å; F520-L529 HydrophobicContact CG-CB 4.49Å; F520-L529 HydrophobicContact CZ-CD1 4.33Å; F520-L529 WeakPolarHBondContact O-CB 3.32Å; F520-L529 PolarHBondContact O-N 3.08Å; C522-L529 HydrophobicContact CB-CD1 4.22Å; C522-L529 HydrophobicContact CB-CD2 4.16Å; C522-L529 HydrophobicContact CB-CG 4.22Å; H527-L529 PolarHBondContact O-N 3.24Å; L529-F534 HydrophobicContact CB-CB 4.46Å; L529-F534 HydrophobicContact CD1-CB 3.81Å; L529-F534 HydrophobicContact CD2-CB 4.25Å; L529-F534 HydrophobicContact CG-CB 4.42Å; L529-P541 HydrophobicContact CD1-CB 3.67Å; L529-P541 HydrophobicContact CD1-CG 4.13Å; L529-C543 HydrophobicContact CD2-CB 3.59Å
530	Q	83.4	Confident	91.4	Very high	144 Å²	144	79 Å²	79	67%	0.673	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-98.1	152.3	173.4	-62.7	179.6	1.5	0	0	110	G532 T533	Q530-G532 PolarHBondContact O-N 2.97Å; Q530-G532 VanDerWaalsContact O-N 3.14Å; Q530-T533 HydrophobicContact CB-CG2 4.43Å; Q530-T533 PolarHBondContact N-OG1 3.41Å; Q530-T533 PolarHBondContact O-N 3.32Å; Q530-T533 PolarHBondContact O-OG1 3.45Å
531	T	76.4	Confident	91.3	Very high	97 Å²	97	79.6 Å²	79.6	60%	0.595	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	118.1	173.5	43.3	0	0	0	0	110.2	V508	V508-T531 HydrophobicContact CB-CG2 4.5Å; V508-T531 HydrophobicContact CG1-CG2 3.84Å; V508-T531 HydrophobicContact CG2-CG2 4.43Å
532	G	78.9	Confident	91.3	Very high	73 Å²	73	78 Å²	78	75%	0.753	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	-9.8	178.1	0	0	0	0	0	116.3	Q530	Q530-G532 PolarHBondContact O-N 2.97Å; Q530-G532 VanDerWaalsContact O-N 3.14Å
533	T	84.9	Confident	91.3	Very high	82 Å²	82	79.5 Å²	79.5	50%	0.503	44%	0.439	S	S	.	.	S	Bend	trans	-103.3	2.2	-178.2	61.9	0	0	0	0	114.7	Q530	Q530-T533 HydrophobicContact CB-CG2 4.43Å; Q530-T533 PolarHBondContact N-OG1 3.41Å; Q530-T533 PolarHBondContact O-N 3.32Å; Q530-T533 PolarHBondContact O-OG1 3.45Å
534	F	92.8	Very high	91.3	Very high	48 Å²	48	82.9 Å²	82.9	21%	0.211	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	160.3	179.7	76.3	-85.7	0	0	0	112.6	A510 L511 F520 L529 E536 P541 Y542	A510-F534 HydrophobicContact CB-CE1 4.1Å; A510-F534 HydrophobicContact CB-CZ 4Å; L511-F534 HydrophobicContact CD2-CE2 3.94Å; L511-F534 HydrophobicContact CD2-CZ 4.44Å; L511-F534 HydrophobicContact CG-CE2 4.45Å; F520-F534 HydrophobicContact CE1-CB 4.46Å; F520-F534 AromaticContact CE1-CD1 3.57Å; F520-F534 HydrophobicContact CE1-CD1 3.57Å; F520-F534 AromaticContact CE1-CE1 3.92Å; F520-F534 HydrophobicContact CE1-CE1 3.92Å; F520-F534 HydrophobicContact CE1-CG 4Å; F520-F534 AromaticContact CZ-CD1 3.63Å; F520-F534 HydrophobicContact CZ-CD1 3.63Å; F520-F534 HydrophobicContact CZ-CD2 4.06Å; F520-F534 AromaticContact CZ-CE1 3.68Å; F520-F534 HydrophobicContact CZ-CE1 3.68Å; F520-F534 HydrophobicContact CZ-CE2 4.12Å; F520-F534 AromaticContact CZ-CG 3.84Å; F520-F534 HydrophobicContact CZ-CG 3.84Å; F520-F534 AromaticContact CZ-CZ 3.93Å; F520-F534 HydrophobicContact CZ-CZ 3.93Å; L529-F534 HydrophobicContact CB-CB 4.46Å; L529-F534 HydrophobicContact CD1-CB 3.81Å; L529-F534 HydrophobicContact CD2-CB 4.25Å; L529-F534 HydrophobicContact CG-CB 4.42Å; F534-E536 HydrophobicContact CE2-CB 4.42Å; F534-P541 HydrophobicContact CD2-CB 3.76Å; F534-P541 HydrophobicContact CE2-CB 4.29Å; F534-P541 HydrophobicContact CG-CB 4.31Å; F534-Y542 CarbonylContact C-O 2.93Å; F534-Y542 VanDerWaalsContact CA-O 3.31Å; F534-Y542 WeakPolarHBondContact CA-O 3.43Å; F534-Y542 WeakPolarHBondContact CB-O 3.18Å
535	K	92.9	Very high	91.2	Very high	104 Å²	104	81.6 Å²	81.6	45%	0.452	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	142.4	166.4	-65.5	-66.5	-175.3	179.1	0	108.9	Y542 F547	K535-Y542 PolarHBondContact N-O 3.43Å; K535-Y542 PolarHBondContact O-N 2.85Å; K535-F547 HydrophobicContact CB-CB 3.79Å; K535-F547 HydrophobicContact CB-CD1 4.1Å; K535-F547 HydrophobicContact CB-CD2 3.26Å; K535-F547 HydrophobicContact CB-CE2 3.77Å; K535-F547 HydrophobicContact CB-CG 3.44Å; K535-F547 VanDerWaalsContact CB-CG 3.44Å; K535-F547 HydrophobicContact CB-CZ 4.4Å; K535-F547 HydrophobicContact CG-CB 4.1Å; K535-F547 HydrophobicContact CG-CD1 4.09Å; K535-F547 HydrophobicContact CG-CD2 4.15Å; K535-F547 HydrophobicContact CG-CG 3.84Å
536	E	92.9	Very high	91.2	Very high	106 Å²	106	80.1 Å²	80.1	50%	0.495	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134.1	176.1	-176.5	177.2	172.7	0	0	110.2	L511 F534 S539 K540	L511-E536 HydrophobicContact CD2-CB 4.15Å; L511-E536 HydrophobicContact CD2-CG 3.64Å; L511-E536 WeakPolarHBondContact CD2-OE2 3.47Å; F534-E536 HydrophobicContact CE2-CB 4.42Å; E536-S539 WeakPolarHBondContact OE1-CA 3.46Å; E536-K540 WeakPolarHBondContact CA-O 3.38Å
537	H	93.3	Very high	91.3	Very high	72 Å²	72	76.7 Å²	76.7	33%	0.333	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	130.7	164.3	-171.1	84.4	0	0	0	109.1	S539 K540 Y542 F547 F551	H537-S539 VanDerWaalsContact C-N 3.32Å; H537-S539 PolarHBondContact O-N 2.9Å; H537-K540 PolarHBondContact N-O 3.15Å; H537-K540 PolarHBondContact O-N 3.45Å; H537-Y542 HydrophobicContact CB-CD2 4.06Å; H537-Y542 HydrophobicContact CB-CE2 3.79Å; H537-F547 HydrophobicContact CB-CD2 4.38Å; H537-F547 HydrophobicContact CB-CE2 3.99Å; H537-F551 HydrophobicContact CB-CD2 4Å; H537-F551 HydrophobicContact CB-CE2 3.66Å; H537-F551 HydrophobicContact CB-CZ 3.96Å; H537-F551 AromaticContact CD2-CD1 3.94Å; H537-F551 AromaticContact CD2-CE1 3.37Å; H537-F551 WeakPolarHBondContact CD2-CE1 3.46Å; H537-F551 AromaticContact CD2-CZ 3.41Å; H537-F551 VanDerWaalsContact CD2-CZ 3.41Å; H537-F551 WeakPolarHBondContact CD2-CZ 3.29Å; H537-F551 AromaticContact CE1-CD1 3.84Å; H537-F551 AromaticContact CE1-CE1 3.99Å; H537-F551 AromaticContact CG-CE1 3.79Å; H537-F551 AromaticContact CG-CE2 3.79Å; H537-F551 AromaticContact CG-CZ 3.68Å; H537-F551 AromaticContact ND1-CD1 3.96Å; H537-F551 AromaticContact NE2-CD1 3.86Å; H537-F551 AromaticContact NE2-CE1 3.54Å
538	S	92	Very high	91.4	Very high	91 Å²	91	73.6 Å²	73.6	64%	0.636	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.1	51	-179.6	-64.6	0	0	0	0	114.3	K540	S538-K540 PolarHBondContact O-N 2.9Å
539	S	90.6	Very high	91.4	Very high	89 Å²	89	75.3 Å²	75.3	62%	0.622	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	16.3	-177.7	72.1	0	0	0	0	116.3	E536 H537	E536-S539 WeakPolarHBondContact OE1-CA 3.46Å; H537-S539 VanDerWaalsContact C-N 3.32Å; H537-S539 PolarHBondContact O-N 2.9Å
540	K	92.8	Very high	91.5	Very high	118 Å²	118	78.2 Å²	78.2	51%	0.513	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.3	176.5	-67.3	-179.1	-178.2	-178.6	0	111	A523 E536 H537 S538 Y542	A523-K540 HydrophobicContact CB-CB 3.9Å; A523-K540 HydrophobicContact CB-CD 4.25Å; A523-K540 HydrophobicContact CB-CG 4.49Å; E536-K540 WeakPolarHBondContact CA-O 3.38Å; H537-K540 PolarHBondContact N-O 3.15Å; H537-K540 PolarHBondContact O-N 3.45Å; S538-K540 PolarHBondContact O-N 2.9Å; K540-Y542 HydrophobicContact CB-CE2 3.7Å; K540-Y542 VanDerWaalsContact O-CD2 3.32Å; K540-Y542 WeakPolarHBondContact O-CD2 3.31Å; K540-Y542 WeakPolarHBondContact O-CE2 3.24Å
541	P	94.3	Very high	92	Very high	15 Å²	15	75.1 Å²	75.1	10%	0.097	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	138.3	179.9	36.4	-32.6	0	0	0	111.1	L511 F520 A523 L529 F534	L511-P541 HydrophobicContact CD1-CB 4.07Å; L511-P541 HydrophobicContact CD1-CG 3.99Å; F520-P541 HydrophobicContact CD2-CG 4.36Å; F520-P541 HydrophobicContact CE2-CB 3.73Å; F520-P541 HydrophobicContact CE2-CG 3.7Å; F520-P541 HydrophobicContact CZ-CB 3.61Å; F520-P541 HydrophobicContact CZ-CG 4.09Å; A523-P541 WeakPolarHBondContact CB-O 3.41Å; A523-P541 PolarHBondContact N-O 3Å; L529-P541 HydrophobicContact CD1-CB 3.67Å; L529-P541 HydrophobicContact CD1-CG 4.13Å; F534-P541 HydrophobicContact CD2-CB 3.76Å; F534-P541 HydrophobicContact CE2-CB 4.29Å; F534-P541 HydrophobicContact CG-CB 4.31Å
542	Y	95.9	Very high	92.3	Very high	25 Å²	25	75.8 Å²	75.8	10%	0.098	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.6	178.5	-64.3	-95.5	0	0	0	109.9	A523 F534 K535 H537 K540 L550 F551	A523-Y542 HydrophobicContact CB-CD1 4.47Å; A523-Y542 HydrophobicContact CB-CE1 4.02Å; A523-Y542 HydrophobicContact CB-CE2 4.39Å; F534-Y542 CarbonylContact C-O 2.93Å; F534-Y542 VanDerWaalsContact CA-O 3.31Å; F534-Y542 WeakPolarHBondContact CA-O 3.43Å; F534-Y542 WeakPolarHBondContact CB-O 3.18Å; K535-Y542 PolarHBondContact N-O 3.43Å; K535-Y542 PolarHBondContact O-N 2.85Å; H537-Y542 HydrophobicContact CB-CD2 4.06Å; H537-Y542 HydrophobicContact CB-CE2 3.79Å; K540-Y542 HydrophobicContact CB-CE2 3.7Å; K540-Y542 VanDerWaalsContact O-CD2 3.32Å; K540-Y542 WeakPolarHBondContact O-CD2 3.31Å; K540-Y542 WeakPolarHBondContact O-CE2 3.24Å; Y542-L550 HydrophobicContact CD1-CD1 4.05Å; Y542-L550 HydrophobicContact CE1-CD1 3.86Å; Y542-F551 HydrophobicContact CD1-CE2 4.13Å; Y542-F551 HydrophobicContact CD2-CE2 4.06Å; Y542-F551 AromaticContact CE1-CE2 3.92Å; Y542-F551 HydrophobicContact CE1-CE2 3.92Å; Y542-F551 HydrophobicContact CE1-CZ 4.21Å; Y542-F551 AromaticContact CE2-CE2 3.87Å; Y542-F551 HydrophobicContact CE2-CE2 3.87Å; Y542-F551 HydrophobicContact CE2-CZ 4.22Å; Y542-F551 HydrophobicContact CG-CE2 4.2Å; Y542-F551 AromaticContact CZ-CE2 3.8Å; Y542-F551 AromaticContact CZ-CZ 3.88Å
543	C	95.6	Very high	93	Very high	30 Å²	30	75.9 Å²	75.9	20%	0.203	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	156.1	166.6	76.5	0	0	0	0	109.4	C522 L529 Q545 C546 F547	C522-C543 HydrophobicContact CB-CB 4.49Å; C522-C543 PolarHBondContact SG-N 2.92Å; L529-C543 HydrophobicContact CD2-CB 3.59Å; C543-Q545 VanDerWaalsContact C-N 3.27Å; C543-Q545 PolarHBondContact O-N 3.35Å; C543-C546 PolarHBondContact O-N 2.91Å; C543-C546 PolarHBondContact SG-N 3.17Å; C543-C546 PolarHBondContact SG-SG 2.83Å; C543-F547 PolarHBondContact O-N 2.83Å
544	H	94.2	Very high	93.4	Very high	115 Å²	115	75.6 Å²	75.6	53%	0.532	41%	0.413	S	S	.	.	H	α-helix	trans	-53	-44.3	-177.2	-178.5	41.5	0	0	0	112.9	F547 T548	H544-F547 PolarHBondContact O-N 3.14Å; H544-T548 PolarHBondContact CE1-OG1 3.39Å; H544-T548 PolarHBondContact O-N 3.21Å; H544-T548 PolarHBondContact O-OG1 3.45Å; H544-T548 VanDerWaalsContact O-OG1 3.05Å
545	Q	94.1	Very high	93.5	Very high	119 Å²	119	77.1 Å²	77.1	56%	0.556	42%	0.424	S	S	*	.	H	α-helix	trans	-59.1	-49.5	178.9	-173.8	65.1	18.8	0	0	112.5	C543 T548 Q549	C543-Q545 VanDerWaalsContact C-N 3.27Å; C543-Q545 PolarHBondContact O-N 3.35Å; Q545-T548 PolarHBondContact O-N 3.48Å; Q545-Q549 WeakPolarHBondContact O-CB 3.49Å; Q545-Q549 VanDerWaalsContact O-CG 3.29Å; Q545-Q549 WeakPolarHBondContact O-CG 3.43Å; Q545-Q549 PolarHBondContact O-N 3Å
546	C	96.3	Very high	93.5	Very high	9 Å²	9	75.5 Å²	75.5	6%	0.061	42%	0.423	C	S	.	.	H	α-helix	trans	-71	-33.7	-179.3	-64.1	0	0	0	0	111.9	Y524 C543 Q549 L550	Y524-C546 HydrophobicContact CD1-CB 4.09Å; C543-C546 PolarHBondContact O-N 2.91Å; C543-C546 PolarHBondContact SG-N 3.17Å; C543-C546 PolarHBondContact SG-SG 2.83Å; C546-Q549 PolarHBondContact O-N 3.22Å; C546-L550 VanDerWaalsContact O-CB 3.31Å; C546-L550 WeakPolarHBondContact O-CB 3.44Å; C546-L550 WeakPolarHBondContact O-CD1 3.31Å; C546-L550 WeakPolarHBondContact O-CG 3.44Å; C546-L550 PolarHBondContact O-N 3.49Å; C546-L550 VanDerWaalsContact O-N 3.08Å
547	F	96	Very high	93.5	Very high	47 Å²	47	73.6 Å²	73.6	21%	0.206	42%	0.418	C	S	.	.	H	α-helix	trans	-62.7	-49.3	174.3	-176.5	-83.5	0	0	0	111	K535 H537 C543 H544 Q549 L550 F551	K535-F547 HydrophobicContact CB-CB 3.79Å; K535-F547 HydrophobicContact CB-CD1 4.1Å; K535-F547 HydrophobicContact CB-CD2 3.26Å; K535-F547 HydrophobicContact CB-CE2 3.77Å; K535-F547 HydrophobicContact CB-CG 3.44Å; K535-F547 VanDerWaalsContact CB-CG 3.44Å; K535-F547 HydrophobicContact CB-CZ 4.4Å; K535-F547 HydrophobicContact CG-CB 4.1Å; K535-F547 HydrophobicContact CG-CD1 4.09Å; K535-F547 HydrophobicContact CG-CD2 4.15Å; K535-F547 HydrophobicContact CG-CG 3.84Å; H537-F547 HydrophobicContact CB-CD2 4.38Å; H537-F547 HydrophobicContact CB-CE2 3.99Å; C543-F547 PolarHBondContact O-N 2.83Å; H544-F547 PolarHBondContact O-N 3.14Å; F547-Q549 VanDerWaalsContact C-N 3.32Å; F547-Q549 PolarHBondContact O-N 3.18Å; F547-L550 PolarHBondContact O-N 2.99Å; F547-F551 AromaticContact CD2-CD2 3.7Å; F547-F551 HydrophobicContact CD2-CD2 3.7Å; F547-F551 HydrophobicContact CD2-CE2 4.35Å; F547-F551 HydrophobicContact CE1-CB 4.33Å; F547-F551 HydrophobicContact CE2-CB 4.5Å; F547-F551 AromaticContact CE2-CD2 3.99Å; F547-F551 HydrophobicContact CE2-CD2 3.99Å; F547-F551 HydrophobicContact CG-CD2 4.11Å; F547-F551 HydrophobicContact CZ-CB 4.29Å; F547-F551 PolarHBondContact O-N 3.46Å
548	T	95	Very high	93.5	Very high	64 Å²	64	73.7 Å²	73.7	39%	0.393	42%	0.424	S	S	.	.	H	α-helix	trans	-63.4	-38	178.1	-53.2	0	0	0	0	111.5	H544 Q545 L550 G552	H544-T548 PolarHBondContact CE1-OG1 3.39Å; H544-T548 PolarHBondContact O-N 3.21Å; H544-T548 PolarHBondContact O-OG1 3.45Å; H544-T548 VanDerWaalsContact O-OG1 3.05Å; Q545-T548 PolarHBondContact O-N 3.48Å; T548-L550 VanDerWaalsContact C-N 3.31Å; T548-L550 PolarHBondContact O-N 3.05Å; T548-G552 WeakPolarHBondContact O-CA 3.42Å; T548-G552 PolarHBondContact O-N 3.42Å; T548-G552 VanDerWaalsContact O-N 3.15Å
549	Q	94.6	Very high	93.7	Very high	122 Å²	122	72.5 Å²	72.5	57%	0.57	41%	0.409	S	S	*	.	H	α-helix	trans	-70	-21.6	177.2	-75.9	176.6	-20.7	0	0	114.8	Q545 C546 F547	Q545-Q549 WeakPolarHBondContact O-CB 3.49Å; Q545-Q549 VanDerWaalsContact O-CG 3.29Å; Q545-Q549 WeakPolarHBondContact O-CG 3.43Å; Q545-Q549 PolarHBondContact O-N 3Å; C546-Q549 PolarHBondContact O-N 3.22Å; F547-Q549 VanDerWaalsContact C-N 3.32Å; F547-Q549 PolarHBondContact O-N 3.18Å
550	L	93.8	Very high	93.9	Very high	73 Å²	73	71.2 Å²	71.2	38%	0.382	39%	0.392	S	S	.	.	H	α-helix	trans	-108.1	-25.3	-175.9	-65.4	171.4	0	0	0	113.8	Y524 Y542 C546 F547 T548	Y524-L550 HydrophobicContact CD1-CD1 4.48Å; Y524-L550 HydrophobicContact CD2-CD1 3.81Å; Y524-L550 HydrophobicContact CD2-CD2 4.36Å; Y524-L550 HydrophobicContact CE2-CD1 4.44Å; Y524-L550 HydrophobicContact CE2-CD2 4.2Å; Y524-L550 HydrophobicContact CG-CD1 3.82Å; Y542-L550 HydrophobicContact CD1-CD1 4.05Å; Y542-L550 HydrophobicContact CE1-CD1 3.86Å; C546-L550 VanDerWaalsContact O-CB 3.31Å; C546-L550 WeakPolarHBondContact O-CB 3.44Å; C546-L550 WeakPolarHBondContact O-CD1 3.31Å; C546-L550 WeakPolarHBondContact O-CG 3.44Å; C546-L550 PolarHBondContact O-N 3.49Å; C546-L550 VanDerWaalsContact O-N 3.08Å; F547-L550 PolarHBondContact O-N 2.99Å; T548-L550 VanDerWaalsContact C-N 3.31Å; T548-L550 PolarHBondContact O-N 3.05Å
551	F	93.9	Very high	94	Very high	78 Å²	78	67.3 Å²	67.3	34%	0.342	38%	0.382	S	S	.	.	H	α-helix	trans	-142.1	2.1	-168.8	-46.1	-65.9	0	0	0	114.7	H537 Y542 F547	H537-F551 HydrophobicContact CB-CD2 4Å; H537-F551 HydrophobicContact CB-CE2 3.66Å; H537-F551 HydrophobicContact CB-CZ 3.96Å; H537-F551 AromaticContact CD2-CD1 3.94Å; H537-F551 AromaticContact CD2-CE1 3.37Å; H537-F551 WeakPolarHBondContact CD2-CE1 3.46Å; H537-F551 AromaticContact CD2-CZ 3.41Å; H537-F551 VanDerWaalsContact CD2-CZ 3.41Å; H537-F551 WeakPolarHBondContact CD2-CZ 3.29Å; H537-F551 AromaticContact CE1-CD1 3.84Å; H537-F551 AromaticContact CE1-CE1 3.99Å; H537-F551 AromaticContact CG-CE1 3.79Å; H537-F551 AromaticContact CG-CE2 3.79Å; H537-F551 AromaticContact CG-CZ 3.68Å; H537-F551 AromaticContact ND1-CD1 3.96Å; H537-F551 AromaticContact NE2-CD1 3.86Å; H537-F551 AromaticContact NE2-CE1 3.54Å; Y542-F551 HydrophobicContact CD1-CE2 4.13Å; Y542-F551 HydrophobicContact CD2-CE2 4.06Å; Y542-F551 AromaticContact CE1-CE2 3.92Å; Y542-F551 HydrophobicContact CE1-CE2 3.92Å; Y542-F551 HydrophobicContact CE1-CZ 4.21Å; Y542-F551 AromaticContact CE2-CE2 3.87Å; Y542-F551 HydrophobicContact CE2-CE2 3.87Å; Y542-F551 HydrophobicContact CE2-CZ 4.22Å; Y542-F551 HydrophobicContact CG-CE2 4.2Å; Y542-F551 AromaticContact CZ-CE2 3.8Å; Y542-F551 AromaticContact CZ-CZ 3.88Å; F547-F551 AromaticContact CD2-CD2 3.7Å; F547-F551 HydrophobicContact CD2-CD2 3.7Å; F547-F551 HydrophobicContact CD2-CE2 4.35Å; F547-F551 HydrophobicContact CE1-CB 4.33Å; F547-F551 HydrophobicContact CE2-CB 4.5Å; F547-F551 AromaticContact CE2-CD2 3.99Å; F547-F551 HydrophobicContact CE2-CD2 3.99Å; F547-F551 HydrophobicContact CG-CD2 4.11Å; F547-F551 HydrophobicContact CZ-CB 4.29Å; F547-F551 PolarHBondContact O-N 3.46Å
552	G	84.1	Confident	94	Very high	111 Å²	111	72.1 Å²	72.1	100%	1.144	41%	0.408	S	S	*	.			trans	-101.2	0	179.9	0	0	0	0	0	112.8	T548	T548-G552 WeakPolarHBondContact O-CA 3.42Å; T548-G552 PolarHBondContact O-N 3.42Å; T548-G552 VanDerWaalsContact O-N 3.15Å

Retrieved 552 of 552 residues in 681.7 ms (Link to these results)

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