A0A077Z5U8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z5U8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 314 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	64.8	Low	69.3	Low	198 Å²	198	106.5 Å²	106.5	98%	0.975	60%	0.599	S	S	*	*				0	-55.4	0	-64.6	-53.6	-81.9	0	0	112.8	L3 L4 C5	M1-L3 PolarHBondContact O-N 2.66Å; M1-L4 PolarHBondContact O-N 3.14Å; M1-C5 PolarHBondContact O-N 3Å
2	A	67.1	Low	69.7	Low	77 Å²	77	105.6 Å²	105.6	64%	0.636	59%	0.589	S	S	*	*	H	α-helix	trans	-56.7	-41.7	-178.2	0	0	0	0	0	115	L4 C5 L6	A2-L4 VanDerWaalsContact C-N 3.33Å; A2-L4 PolarHBondContact O-N 2.68Å; A2-C5 PolarHBondContact O-N 3.01Å; A2-L6 PolarHBondContact O-N 3.31Å; A2-L6 VanDerWaalsContact O-N 3.15Å
3	L	64.7	Low	69.6	Low	134 Å²	134	101.1 Å²	101.1	70%	0.702	57%	0.574	S	S	*	*	H	α-helix	trans	-63.5	-36.5	-179.8	-154	84.7	0	0	0	112.9	M1 L6 L7	M1-L3 PolarHBondContact O-N 2.66Å; L3-L6 PolarHBondContact O-N 2.99Å; L3-L7 PolarHBondContact O-N 3.08Å
4	L	67.1	Low	69.4	Low	121 Å²	121	102.2 Å²	102.2	63%	0.634	57%	0.572	S	S	*	*	H	α-helix	trans	-69.3	-38.8	179	-150.7	83.2	0	0	0	111	M1 A2 L7 T8	M1-L4 PolarHBondContact O-N 3.14Å; A2-L4 VanDerWaalsContact C-N 3.33Å; A2-L4 PolarHBondContact O-N 2.68Å; L4-L7 PolarHBondContact O-N 3.43Å; L4-T8 PolarHBondContact O-N 3.36Å; L4-T8 PolarHBondContact O-OG1 3.21Å
5	C	63.3	Low	69.2	Low	72 Å²	72	99.1 Å²	99.1	49%	0.486	56%	0.564	S	S	.	*	H	α-helix	trans	-65.8	-35.8	175.3	-69	0	0	0	0	113	M1 A2 T8 L9	M1-C5 PolarHBondContact O-N 3Å; A2-C5 PolarHBondContact O-N 3.01Å; C5-T8 PolarHBondContact O-OG1 3.17Å; C5-L9 WeakPolarHBondContact O-CG 3.48Å; C5-L9 PolarHBondContact O-N 2.89Å; C5-L9 VanDerWaalsContact O-N 3.16Å
6	L	71.3	Confident	69.1	Low	114 Å²	114	101.6 Å²	101.6	60%	0.597	57%	0.567	S	S	*	*	H	α-helix	trans	-68.6	-38.6	177.5	-72.4	168.3	0	0	0	111.9	A2 L3 S10	A2-L6 PolarHBondContact O-N 3.31Å; A2-L6 VanDerWaalsContact O-N 3.15Å; L3-L6 PolarHBondContact O-N 2.99Å; L6-S10 WeakPolarHBondContact O-CB 3.37Å; L6-S10 PolarHBondContact O-N 3.42Å
7	L	72.2	Confident	68.9	Low	101 Å²	101	102.8 Å²	102.8	53%	0.529	57%	0.571	S	S	.	*	H	α-helix	trans	-65.1	-42.4	176.7	-75.2	164.6	0	0	0	112.3	L3 L4 S10 L11	L3-L7 PolarHBondContact O-N 3.08Å; L4-L7 PolarHBondContact O-N 3.43Å; L7-S10 PolarHBondContact O-N 2.84Å; L7-L11 WeakPolarHBondContact O-CG 3.39Å; L7-L11 PolarHBondContact O-N 3.35Å
8	T	71.9	Confident	68.5	Low	72 Å²	72	105.6 Å²	105.6	44%	0.442	58%	0.579	S	S	.	*	H	α-helix	trans	-66.9	-41.1	178	55.4	0	0	0	0	112	L4 C5 S10 L11 I12	L4-T8 PolarHBondContact O-N 3.36Å; L4-T8 PolarHBondContact O-OG1 3.21Å; C5-T8 PolarHBondContact O-OG1 3.17Å; T8-S10 VanDerWaalsContact C-N 3.35Å; T8-S10 PolarHBondContact O-N 3.48Å; T8-L11 PolarHBondContact O-N 3.04Å; T8-I12 WeakPolarHBondContact O-CD1 3.49Å; T8-I12 VanDerWaalsContact O-CG1 3.22Å; T8-I12 WeakPolarHBondContact O-CG1 3.48Å; T8-I12 PolarHBondContact O-N 3.49Å
9	L	74.5	Confident	68.5	Low	114 Å²	114	107.3 Å²	107.3	60%	0.597	58%	0.583	S	S	*	*	H	α-helix	trans	-61.7	-42	174.6	-73.9	170.1	0	0	0	112.1	C5 I12 A13	C5-L9 WeakPolarHBondContact O-CG 3.48Å; C5-L9 PolarHBondContact O-N 2.89Å; C5-L9 VanDerWaalsContact O-N 3.16Å; L9-I12 PolarHBondContact O-N 3.29Å; L9-A13 WeakPolarHBondContact O-CB 3.4Å; L9-A13 PolarHBondContact O-N 3.06Å
10	S	71.4	Confident	68.5	Low	59 Å²	59	105.2 Å²	105.2	41%	0.413	58%	0.576	S	S	.	*	H	α-helix	trans	-61.9	-46.2	176.4	-175.2	0	0	0	0	112.1	L6 L7 T8 I12 A13 Q14	L6-S10 WeakPolarHBondContact O-CB 3.37Å; L6-S10 PolarHBondContact O-N 3.42Å; L7-S10 PolarHBondContact O-N 2.84Å; T8-S10 VanDerWaalsContact C-N 3.35Å; T8-S10 PolarHBondContact O-N 3.48Å; S10-I12 PolarHBondContact O-N 3.5Å; S10-A13 PolarHBondContact O-N 3.26Å; S10-Q14 WeakPolarHBondContact O-CG 3.24Å; S10-Q14 PolarHBondContact O-N 3.5Å
11	L	73.8	Confident	68.5	Low	110 Å²	110	102 Å²	102	58%	0.576	57%	0.567	S	S	*	*	H	α-helix	trans	-63.1	-41.7	177.7	-74.7	165.9	0	0	0	112.3	L7 T8 A13 Q14 A15	L7-L11 WeakPolarHBondContact O-CG 3.39Å; L7-L11 PolarHBondContact O-N 3.35Å; T8-L11 PolarHBondContact O-N 3.04Å; L11-A13 VanDerWaalsContact C-N 3.34Å; L11-Q14 PolarHBondContact O-N 2.82Å; L11-A15 WeakPolarHBondContact O-CB 3.42Å; L11-A15 PolarHBondContact O-N 3.46Å
12	I	74.6	Confident	68.8	Low	95 Å²	95	97.4 Å²	97.4	49%	0.487	55%	0.546	S	S	.	.	H	α-helix	trans	-64.4	-41.2	176	-66.8	164.2	0	0	0	110.5	T8 L9 S10 A15 K16	T8-I12 WeakPolarHBondContact O-CD1 3.49Å; T8-I12 VanDerWaalsContact O-CG1 3.22Å; T8-I12 WeakPolarHBondContact O-CG1 3.48Å; T8-I12 PolarHBondContact O-N 3.49Å; L9-I12 PolarHBondContact O-N 3.29Å; S10-I12 PolarHBondContact O-N 3.5Å; I12-A15 PolarHBondContact O-N 3.49Å; I12-K16 WeakPolarHBondContact O-CG 3.46Å; I12-K16 PolarHBondContact O-N 3.46Å
13	A	67.9	Low	69.2	Low	47 Å²	47	99.9 Å²	99.9	39%	0.388	54%	0.539	S	S	.	.	H	α-helix	trans	-63.5	-46.5	176.8	0	0	0	0	0	111.5	L9 S10 L11 K16 L17	L9-A13 WeakPolarHBondContact O-CB 3.4Å; L9-A13 PolarHBondContact O-N 3.06Å; S10-A13 PolarHBondContact O-N 3.26Å; L11-A13 VanDerWaalsContact C-N 3.34Å; A13-K16 PolarHBondContact O-N 2.94Å; A13-L17 WeakPolarHBondContact O-CD1 3.13Å; A13-L17 PolarHBondContact O-N 3.28Å
14	Q	67.2	Low	70	Confident	117 Å²	117	100.4 Å²	100.4	55%	0.547	54%	0.538	S	S	.	.	H	α-helix	trans	-61.2	-44	176.3	-74	-177.8	-23.6	0	0	112.2	S10 L11 K16 L17 Q18	S10-Q14 WeakPolarHBondContact O-CG 3.24Å; S10-Q14 PolarHBondContact O-N 3.5Å; L11-Q14 PolarHBondContact O-N 2.82Å; Q14-K16 VanDerWaalsContact C-N 3.34Å; Q14-K16 PolarHBondContact O-N 2.9Å; Q14-L17 PolarHBondContact O-N 3.07Å; Q14-Q18 WeakPolarHBondContact O-CB 3.43Å; Q14-Q18 PolarHBondContact O-N 3.23Å
15	A	65.8	Low	70.9	Confident	55 Å²	55	97.7 Å²	97.7	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-60.1	-43.7	176.4	0	0	0	0	0	111.8	L11 I12 Q18 E19	L11-A15 WeakPolarHBondContact O-CB 3.42Å; L11-A15 PolarHBondContact O-N 3.46Å; I12-A15 PolarHBondContact O-N 3.49Å; A15-Q18 PolarHBondContact O-N 3.38Å; A15-E19 WeakPolarHBondContact O-CB 3.36Å; A15-E19 PolarHBondContact O-N 3.47Å
16	K	68	Low	72	Confident	139 Å²	139	96.8 Å²	96.8	60%	0.604	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-41.1	175.6	-76.7	-174.7	177.2	-175.1	0	112.8	I12 A13 Q14 E19 S20	I12-K16 WeakPolarHBondContact O-CG 3.46Å; I12-K16 PolarHBondContact O-N 3.46Å; A13-K16 PolarHBondContact O-N 2.94Å; Q14-K16 VanDerWaalsContact C-N 3.34Å; Q14-K16 PolarHBondContact O-N 2.9Å; K16-E19 PolarHBondContact O-N 3.4Å; K16-S20 WeakPolarHBondContact O-CB 3.36Å; K16-S20 PolarHBondContact O-N 2.75Å; K16-S20 PolarHBondContact O-OG 3.48Å
17	L	65.2	Low	72.8	Confident	123 Å²	123	95.6 Å²	95.6	64%	0.644	51%	0.505	S	S	*	.	H	α-helix	trans	-63.7	-43.3	176.3	-98.8	131.2	0	0	0	111.8	A13 Q14 S20 G21	A13-L17 WeakPolarHBondContact O-CD1 3.13Å; A13-L17 PolarHBondContact O-N 3.28Å; Q14-L17 PolarHBondContact O-N 3.07Å; L17-S20 WeakPolarHBondContact CA-OG 3.35Å; L17-S20 PolarHBondContact O-N 2.63Å; L17-S20 PolarHBondContact O-OG 3.14Å; L17-G21 PolarHBondContact O-N 3Å
18	Q	62.6	Low	73.6	Confident	153 Å²	153	95.5 Å²	95.5	72%	0.715	51%	0.505	S	S	*	.	H	α-helix	trans	-65.2	-42.4	176.5	-173.9	175.5	-13.7	0	0	111.6	Q14 A15 G21 L22	Q14-Q18 WeakPolarHBondContact O-CB 3.43Å; Q14-Q18 PolarHBondContact O-N 3.23Å; A15-Q18 PolarHBondContact O-N 3.38Å; Q18-G21 PolarHBondContact O-N 2.95Å; Q18-L22 WeakPolarHBondContact O-CB 3.41Å; Q18-L22 PolarHBondContact O-N 3.43Å
19	E	67.4	Low	74.5	Confident	138 Å²	138	94.6 Å²	94.6	65%	0.645	51%	0.505	S	S	*	.	H	α-helix	trans	-63.7	-40.7	175.4	-169.6	176.6	-173.5	0	0	111.7	A15 K16 L22 R23	A15-E19 WeakPolarHBondContact O-CB 3.36Å; A15-E19 PolarHBondContact O-N 3.47Å; K16-E19 PolarHBondContact O-N 3.4Å; E19-L22 PolarHBondContact O-N 2.7Å; E19-R23 WeakPolarHBondContact O-CB 3.41Å; E19-R23 PolarHBondContact O-N 3.36Å
20	S	69	Low	75.3	Confident	65 Å²	65	91.5 Å²	91.5	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-64.4	-42.6	174.7	60.1	0	0	0	0	112.6	K16 L17 R23 E24	K16-S20 WeakPolarHBondContact O-CB 3.36Å; K16-S20 PolarHBondContact O-N 2.75Å; K16-S20 PolarHBondContact O-OG 3.48Å; L17-S20 WeakPolarHBondContact CA-OG 3.35Å; L17-S20 PolarHBondContact O-N 2.63Å; L17-S20 PolarHBondContact O-OG 3.14Å; S20-R23 PolarHBondContact O-N 3.23Å; S20-E24 PolarHBondContact O-N 3Å
21	G	69.6	Low	76.3	Confident	37 Å²	37	90.7 Å²	90.7	38%	0.381	48%	0.477	S	S	.	.	H	α-helix	trans	-65.6	-41.3	178.2	0	0	0	0	0	112.3	L17 Q18 E24 S25	L17-G21 PolarHBondContact O-N 3Å; Q18-G21 PolarHBondContact O-N 2.95Å; G21-E24 PolarHBondContact O-N 2.94Å; G21-S25 PolarHBondContact O-N 3.5Å
22	L	70.9	Confident	77.2	Confident	103 Å²	103	90 Å²	90	54%	0.539	47%	0.474	S	S	.	.	H	α-helix	trans	-61.4	-46.7	174.4	-171.3	70	0	0	0	110.6	Q18 E19 E24 S25 E26	Q18-L22 WeakPolarHBondContact O-CB 3.41Å; Q18-L22 PolarHBondContact O-N 3.43Å; E19-L22 PolarHBondContact O-N 2.7Å; L22-E24 VanDerWaalsContact C-N 3.31Å; L22-E24 PolarHBondContact O-N 3.33Å; L22-S25 PolarHBondContact O-N 2.99Å; L22-S25 PolarHBondContact O-OG 2.92Å; L22-E26 WeakPolarHBondContact O-CG 3.44Å; L22-E26 PolarHBondContact O-N 3.44Å
23	R	74.9	Confident	78.1	Confident	129 Å²	129	90.3 Å²	90.3	49%	0.487	48%	0.48	S	S	.	.	H	α-helix	trans	-61.9	-37.1	179.3	-171.1	175.4	179	-167.1	-3.2	112.7	E19 S20 R27	E19-R23 WeakPolarHBondContact O-CB 3.41Å; E19-R23 PolarHBondContact O-N 3.36Å; S20-R23 PolarHBondContact O-N 3.23Å; R23-R27 WeakPolarHBondContact O-CB 3.15Å; R23-R27 PolarHBondContact O-N 2.76Å
24	E	82.5	Confident	79.2	Confident	145 Å²	145	88.7 Å²	88.7	68%	0.678	47%	0.467	S	S	*	.	H	α-helix	trans	-68.9	-42.7	175.9	-170.9	169.3	-163.9	0	0	112	S20 G21 L22 E26 R27 L28	S20-E24 PolarHBondContact O-N 3Å; G21-E24 PolarHBondContact O-N 2.94Å; L22-E24 VanDerWaalsContact C-N 3.31Å; L22-E24 PolarHBondContact O-N 3.33Å; E24-E26 VanDerWaalsContact C-N 3.34Å; E24-E26 PolarHBondContact O-N 3.41Å; E24-R27 WeakPolarHBondContact O-CB 3.41Å; E24-R27 PolarHBondContact O-N 2.91Å; E24-L28 PolarHBondContact O-N 3.45Å
25	S	85.3	Confident	80.4	Confident	63 Å²	63	83.5 Å²	83.5	44%	0.441	45%	0.445	S	S	.	.	H	α-helix	trans	-61	-41.6	175.9	74.6	0	0	0	0	112.4	G21 L22 L28 A29	G21-S25 PolarHBondContact O-N 3.5Å; L22-S25 PolarHBondContact O-N 2.99Å; L22-S25 PolarHBondContact O-OG 2.92Å; S25-L28 PolarHBondContact O-N 3.36Å; S25-A29 WeakPolarHBondContact O-CB 3.49Å; S25-A29 PolarHBondContact O-N 2.89Å
26	E	86.1	Confident	81.7	Confident	53 Å²	53	84.8 Å²	84.8	25%	0.248	45%	0.447	C	S	.	.	H	α-helix	trans	-66.6	-41.3	176	-69.7	-175.8	154.2	0	0	111.9	L22 E24 L28 A29 F30 R57	L22-E26 WeakPolarHBondContact O-CG 3.44Å; L22-E26 PolarHBondContact O-N 3.44Å; E24-E26 VanDerWaalsContact C-N 3.34Å; E24-E26 PolarHBondContact O-N 3.41Å; E26-L28 VanDerWaalsContact C-N 3.32Å; E26-L28 PolarHBondContact O-N 2.89Å; E26-A29 PolarHBondContact O-N 3.39Å; E26-F30 WeakPolarHBondContact O-CB 3.37Å; E26-F30 PolarHBondContact O-N 3.47Å; E26-R57 IonicContact OE1-CZ 3.41Å; E26-R57 IonicContact OE1-NH1 2.63Å; E26-R57 PolarHBondContact OE1-NH1 2.97Å; E26-R57 IonicContact OE1-NH2 3.64Å; E26-R57 IonicContact OE2-CZ 3.6Å; E26-R57 IonicContact OE2-NH1 2.75Å; E26-R57 PolarHBondContact OE2-NH1 3.36Å
27	R	87.8	Confident	82.8	Confident	89 Å²	89	82.9 Å²	82.9	34%	0.336	44%	0.439	S	S	.	.	H	α-helix	trans	-59.9	-43.5	175.9	-177	-176.8	173.4	127.4	0.8	111	R23 E24 L31 F52 S53 Y55	R23-R27 WeakPolarHBondContact O-CB 3.15Å; R23-R27 PolarHBondContact O-N 2.76Å; E24-R27 WeakPolarHBondContact O-CB 3.41Å; E24-R27 PolarHBondContact O-N 2.91Å; R27-L31 WeakPolarHBondContact O-CB 3.09Å; R27-L31 PolarHBondContact O-N 3.44Å; R27-F52 HydrophobicContact CG-CD1 4.32Å; R27-F52 HydrophobicContact CG-CE1 3.55Å; R27-F52 HydrophobicContact CG-CZ 4.45Å; R27-F52 PolarHBondContact NH2-O 2.8Å; R27-S53 PolarHBondContact NH2-O 3.48Å; R27-Y55 HydrophobicContact CB-CD1 3.92Å; R27-Y55 HydrophobicContact CB-CE1 4.14Å; R27-Y55 HydrophobicContact CG-CD1 3.92Å; R27-Y55 HydrophobicContact CG-CG 4.12Å
28	L	89.7	Confident	84.1	Confident	100 Å²	100	78.2 Å²	78.2	52%	0.524	41%	0.414	S	S	.	.	H	α-helix	trans	-69.1	-41.9	178.6	-172.2	64.5	0	0	0	111.8	E24 S25 E26 F30 L31 N32	E24-L28 PolarHBondContact O-N 3.45Å; S25-L28 PolarHBondContact O-N 3.36Å; E26-L28 VanDerWaalsContact C-N 3.32Å; E26-L28 PolarHBondContact O-N 2.89Å; L28-F30 VanDerWaalsContact C-N 3.33Å; L28-F30 PolarHBondContact O-N 3.22Å; L28-L31 PolarHBondContact O-N 3.42Å; L28-N32 PolarHBondContact O-N 3.25Å; L28-N32 PolarHBondContact O-ND2 3.18Å
29	A	90.9	Very high	85.4	Confident	53 Å²	53	75.3 Å²	75.3	44%	0.438	40%	0.402	S	S	.	.	H	α-helix	trans	-61.1	-41.8	174.8	0	0	0	0	0	112.1	S25 E26 N32 T33	S25-A29 WeakPolarHBondContact O-CB 3.49Å; S25-A29 PolarHBondContact O-N 2.89Å; E26-A29 PolarHBondContact O-N 3.39Å; A29-N32 PolarHBondContact O-N 3.03Å; A29-T33 WeakPolarHBondContact O-CB 3.24Å; A29-T33 PolarHBondContact O-N 3.24Å; A29-T33 PolarHBondContact O-OG1 3.37Å
30	F	91.7	Very high	86.5	Confident	48 Å²	48	74.1 Å²	74.1	21%	0.211	40%	0.4	C	S	.	.	H	α-helix	trans	-63.1	-45.7	174.5	178.1	-103	0	0	0	111.8	E26 L28 N32 T33 A34 F52 Y55 F71	E26-F30 WeakPolarHBondContact O-CB 3.37Å; E26-F30 PolarHBondContact O-N 3.47Å; L28-F30 VanDerWaalsContact C-N 3.33Å; L28-F30 PolarHBondContact O-N 3.22Å; F30-N32 PolarHBondContact O-N 3.39Å; F30-T33 PolarHBondContact O-N 2.66Å; F30-A34 WeakPolarHBondContact O-CB 3.47Å; F30-A34 PolarHBondContact O-N 2.94Å; F30-F52 HydrophobicContact CD1-CE1 4.36Å; F30-F52 HydrophobicContact CD1-CE2 4.35Å; F30-F52 AromaticContact CD1-CZ 3.69Å; F30-F52 HydrophobicContact CD1-CZ 3.69Å; F30-F52 HydrophobicContact CE1-CE2 4.12Å; F30-F52 AromaticContact CE1-CZ 3.87Å; F30-F52 HydrophobicContact CE1-CZ 3.87Å; F30-Y55 HydrophobicContact CB-CE2 4.09Å; F30-Y55 AromaticContact CD1-CD2 3.64Å; F30-Y55 HydrophobicContact CD1-CD2 3.64Å; F30-Y55 AromaticContact CD1-CE2 3.66Å; F30-Y55 HydrophobicContact CD1-CE2 3.66Å; F30-Y55 HydrophobicContact CD2-CE2 4.29Å; F30-Y55 AromaticContact CE1-CD2 3.88Å; F30-Y55 HydrophobicContact CE1-CD2 3.88Å; F30-Y55 HydrophobicContact CE1-CE2 4.1Å; F30-Y55 HydrophobicContact CG-CD2 4.22Å; F30-Y55 AromaticContact CG-CE2 3.75Å; F30-Y55 HydrophobicContact CG-CE2 3.75Å; F30-F71 HydrophobicContact CD1-CZ 4.16Å; F30-F71 HydrophobicContact CE1-CE2 4.01Å; F30-F71 AromaticContact CE1-CZ 3.48Å; F30-F71 HydrophobicContact CE1-CZ 3.48Å; F30-F71 VanDerWaalsContact CE1-CZ 3.48Å; F30-F71 HydrophobicContact CZ-CE2 4.36Å; F30-F71 HydrophobicContact CZ-CZ 4.13Å
31	L	91.8	Very high	87.5	Confident	42 Å²	42	77.1 Å²	77.1	22%	0.22	40%	0.402	C	S	.	.	H	α-helix	trans	-58.4	-47.2	176.4	176.1	58.2	0	0	0	111.8	R27 L28 T33 A34 G35 I50 F52 F71	R27-L31 WeakPolarHBondContact O-CB 3.09Å; R27-L31 PolarHBondContact O-N 3.44Å; L28-L31 PolarHBondContact O-N 3.42Å; L31-T33 PolarHBondContact O-N 2.83Å; L31-A34 PolarHBondContact O-N 2.75Å; L31-G35 PolarHBondContact O-N 3.25Å; L31-I50 HydrophobicContact CD1-CG2 4.14Å; L31-F52 HydrophobicContact CB-CD1 4.11Å; L31-F52 HydrophobicContact CB-CE1 4.31Å; L31-F52 HydrophobicContact CD1-CB 3.66Å; L31-F52 HydrophobicContact CD1-CD1 4.06Å; L31-F52 HydrophobicContact CD1-CG 3.94Å; L31-F52 HydrophobicContact CD2-CB 4.31Å; L31-F52 HydrophobicContact CD2-CD1 4.2Å; L31-F52 HydrophobicContact CG-CD1 4.35Å; L31-F71 HydrophobicContact CD1-CD1 4.3Å; L31-F71 HydrophobicContact CD1-CE1 3.85Å
32	N	92.2	Very high	88.4	Confident	97 Å²	97	76.3 Å²	76.3	52%	0.519	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-46	179.2	-71.1	-19.2	0	0	0	111.3	L28 A29 F30 A34 G35 T36	L28-N32 PolarHBondContact O-N 3.25Å; L28-N32 PolarHBondContact O-ND2 3.18Å; A29-N32 PolarHBondContact O-N 3.03Å; F30-N32 PolarHBondContact O-N 3.39Å; N32-A34 PolarHBondContact O-N 3.22Å; N32-G35 PolarHBondContact O-N 3.43Å; N32-T36 PolarHBondContact O-N 3.48Å; N32-T36 PolarHBondContact O-OG1 2.96Å
33	T	92.7	Very high	89.2	Confident	100 Å²	100	74.6 Å²	74.6	61%	0.613	39%	0.389	S	S	*	.	H	α-helix	trans	-62	-45.7	178.4	-54.3	0	0	0	0	111.6	A29 F30 L31 G35 F37	A29-T33 WeakPolarHBondContact O-CB 3.24Å; A29-T33 PolarHBondContact O-N 3.24Å; A29-T33 PolarHBondContact O-OG1 3.37Å; F30-T33 PolarHBondContact O-N 2.66Å; L31-T33 PolarHBondContact O-N 2.83Å; T33-G35 VanDerWaalsContact C-N 3.33Å; T33-G35 PolarHBondContact O-N 3.39Å; T33-F37 WeakPolarHBondContact O-CB 3.21Å; T33-F37 PolarHBondContact O-N 3.23Å; T33-F37 VanDerWaalsContact O-N 3.08Å
34	A	92.1	Very high	89.9	Confident	13 Å²	13	73.2 Å²	73.2	11%	0.107	40%	0.397	C	S	.	.	H	α-helix	trans	-64.5	-38.7	177.1	0	0	0	0	0	111.7	F30 L31 N32 F37 F38 F71	F30-A34 WeakPolarHBondContact O-CB 3.47Å; F30-A34 PolarHBondContact O-N 2.94Å; L31-A34 PolarHBondContact O-N 2.75Å; N32-A34 PolarHBondContact O-N 3.22Å; A34-F37 WeakPolarHBondContact O-CB 3.3Å; A34-F37 PolarHBondContact O-N 3.03Å; A34-F38 HydrophobicContact CB-CE2 4.05Å; A34-F38 WeakPolarHBondContact O-CD2 3.36Å; A34-F38 WeakPolarHBondContact O-CG 3.33Å; A34-F38 PolarHBondContact O-N 3.4Å; A34-F71 HydrophobicContact CB-CE1 3.79Å; A34-F71 HydrophobicContact CB-CE2 4.35Å; A34-F71 HydrophobicContact CB-CZ 3.54Å
35	G	91.9	Very high	90.2	Very high	8 Å²	8	67.6 Å²	67.6	8%	0.082	37%	0.371	C	S	.	.	H	α-helix	trans	-60.7	-51	177.9	0	0	0	0	0	112.7	L31 N32 T33 F37 F38 I39	L31-G35 PolarHBondContact O-N 3.25Å; N32-G35 PolarHBondContact O-N 3.43Å; T33-G35 VanDerWaalsContact C-N 3.33Å; T33-G35 PolarHBondContact O-N 3.39Å; G35-F37 VanDerWaalsContact C-N 3.31Å; G35-F37 PolarHBondContact O-N 2.91Å; G35-F38 PolarHBondContact O-N 3.08Å; G35-I39 WeakPolarHBondContact O-CG1 3.37Å; G35-I39 PolarHBondContact O-N 3.43Å; G35-I39 VanDerWaalsContact O-N 3.07Å
36	T	93	Very high	90.4	Very high	83 Å²	83	73.6 Å²	73.6	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-56.3	-47.8	173.4	-58.3	0	0	0	0	110.9	N32 F38 I39 D40	N32-T36 PolarHBondContact O-N 3.48Å; N32-T36 PolarHBondContact O-OG1 2.96Å; T36-F38 PolarHBondContact O-N 3Å; T36-I39 PolarHBondContact O-N 3.46Å; T36-D40 PolarHBondContact O-N 3.23Å
37	F	91.8	Very high	90.6	Very high	98 Å²	98	72.4 Å²	72.4	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-58.1	-43.2	178.8	173	-89.4	0	0	0	113	T33 A34 G35 R41 W130	T33-F37 WeakPolarHBondContact O-CB 3.21Å; T33-F37 PolarHBondContact O-N 3.23Å; T33-F37 VanDerWaalsContact O-N 3.08Å; A34-F37 WeakPolarHBondContact O-CB 3.3Å; A34-F37 PolarHBondContact O-N 3.03Å; G35-F37 VanDerWaalsContact C-N 3.31Å; G35-F37 PolarHBondContact O-N 2.91Å; F37-R41 HydrophobicContact CZ-CG 4.42Å; F37-R41 WeakPolarHBondContact O-CB 3Å; F37-R41 PolarHBondContact O-N 3.07Å; F37-W130 AromaticContact CE1-CH2 3.24Å; F37-W130 HydrophobicContact CE1-CH2 3.24Å; F37-W130 AromaticContact CE1-CZ2 3.8Å; F37-W130 HydrophobicContact CE1-CZ2 3.8Å; F37-W130 AromaticContact CE1-CZ3 3.84Å; F37-W130 HydrophobicContact CE1-CZ3 3.84Å; F37-W130 AromaticContact CZ-CH2 3.52Å; F37-W130 HydrophobicContact CZ-CH2 3.52Å; F37-W130 AromaticContact CZ-CZ2 3.6Å; F37-W130 HydrophobicContact CZ-CZ2 3.6Å; F37-W130 HydrophobicContact CZ-CZ3 4.48Å
38	F	91.4	Very high	90.7	Very high	26 Å²	26	76.2 Å²	76.2	11%	0.114	40%	0.395	C	S	.	.	H	α-helix	trans	-66.6	-40.5	177.2	-68.2	-52	0	0	0	112.8	A34 G35 T36 D40 R41 L42 I50 F71 L73 W130	A34-F38 HydrophobicContact CB-CE2 4.05Å; A34-F38 WeakPolarHBondContact O-CD2 3.36Å; A34-F38 WeakPolarHBondContact O-CG 3.33Å; A34-F38 PolarHBondContact O-N 3.4Å; G35-F38 PolarHBondContact O-N 3.08Å; T36-F38 PolarHBondContact O-N 3Å; F38-D40 VanDerWaalsContact C-N 3.34Å; F38-R41 PolarHBondContact O-N 2.88Å; F38-L42 HydrophobicContact CB-CD1 4.45Å; F38-L42 VanDerWaalsContact O-CB 3.24Å; F38-L42 WeakPolarHBondContact O-CB 3.24Å; F38-L42 VanDerWaalsContact O-CG 3.3Å; F38-L42 WeakPolarHBondContact O-CG 3.4Å; F38-L42 PolarHBondContact O-N 3.27Å; F38-I50 HydrophobicContact CD2-CD1 4.42Å; F38-F71 HydrophobicContact CE2-CB 4.02Å; F38-F71 AromaticContact CE2-CD1 3.83Å; F38-F71 HydrophobicContact CE2-CD1 3.83Å; F38-F71 AromaticContact CE2-CD2 3.91Å; F38-F71 HydrophobicContact CE2-CD2 3.91Å; F38-F71 HydrophobicContact CE2-CE1 4.2Å; F38-F71 HydrophobicContact CE2-CE2 4.28Å; F38-F71 AromaticContact CE2-CG 3.65Å; F38-F71 HydrophobicContact CE2-CG 3.65Å; F38-F71 HydrophobicContact CE2-CZ 4.4Å; F38-F71 HydrophobicContact CZ-CB 4.23Å; F38-F71 AromaticContact CZ-CD2 3.83Å; F38-F71 HydrophobicContact CZ-CD2 3.83Å; F38-F71 HydrophobicContact CZ-CE2 4.29Å; F38-F71 AromaticContact CZ-CG 3.97Å; F38-F71 HydrophobicContact CZ-CG 3.97Å; F38-L73 HydrophobicContact CB-CD1 4.23Å; F38-L73 HydrophobicContact CD1-CD1 4.06Å; F38-L73 HydrophobicContact CD2-CD1 4.34Å; F38-L73 HydrophobicContact CD2-CD2 3.9Å; F38-L73 HydrophobicContact CE2-CD2 4.32Å; F38-L73 HydrophobicContact CG-CD1 3.97Å; F38-L73 HydrophobicContact CG-CD2 4.29Å; F38-W130 HydrophobicContact CD1-CZ3 4.29Å; F38-W130 HydrophobicContact CE1-CZ3 4.02Å
39	I	90.6	Very high	90.8	Very high	92 Å²	92	74.5 Å²	74.5	47%	0.472	39%	0.386	S	S	.	.	H	α-helix	trans	-60.4	-47.6	177.9	-70.1	166	0	0	0	109.9	G35 T36 A43 V47	G35-I39 WeakPolarHBondContact O-CG1 3.37Å; G35-I39 PolarHBondContact O-N 3.43Å; G35-I39 VanDerWaalsContact O-N 3.07Å; T36-I39 PolarHBondContact O-N 3.46Å; I39-A43 PolarHBondContact O-N 3.07Å; I39-V47 HydrophobicContact CG1-CB 4.1Å; I39-V47 HydrophobicContact CG1-CG2 4.3Å
40	D	90.8	Very high	90.9	Very high	112 Å²	112	73.9 Å²	73.9	60%	0.599	38%	0.375	S	S	*	.	H	α-helix	trans	-66.3	-43.6	-179.1	-65.8	-18.6	0	0	0	111.4	T36 F38	T36-D40 PolarHBondContact O-N 3.23Å; F38-D40 VanDerWaalsContact C-N 3.34Å
41	R	89.1	Confident	90.9	Very high	129 Å²	129	77.8 Å²	77.8	49%	0.487	39%	0.392	S	S	.	.	H	α-helix	trans	-76.6	-28.2	-173.2	-165.4	54.4	164.1	165.2	-4.2	113.9	F37 F38 W130 E132	F37-R41 HydrophobicContact CZ-CG 4.42Å; F37-R41 WeakPolarHBondContact O-CB 3Å; F37-R41 PolarHBondContact O-N 3.07Å; F38-R41 PolarHBondContact O-N 2.88Å; R41-W130 HydrophobicContact CG-CD2 3.89Å; R41-W130 HydrophobicContact CG-CG 4.2Å; R41-W130 HydrophobicContact CG-CZ2 3.97Å; R41-E132 IonicContact CZ-OE2 2.93Å; R41-E132 IonicContact NE-OE2 3.77Å; R41-E132 PolarHBondContact NE-OE2 3.15Å; R41-E132 IonicContact NH2-OE1 3.05Å; R41-E132 PolarHBondContact NH2-OE1 2.79Å; R41-E132 IonicContact NH2-OE2 2.91Å; R41-E132 PolarHBondContact NH2-OE2 3.4Å
42	L	89.3	Confident	90.7	Very high	19 Å²	19	77.1 Å²	77.1	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-93	-7.6	-177.9	-65	175.2	0	0	0	113.5	F38 I45 V47 L73 W130	F38-L42 HydrophobicContact CB-CD1 4.45Å; F38-L42 VanDerWaalsContact O-CB 3.24Å; F38-L42 WeakPolarHBondContact O-CB 3.24Å; F38-L42 VanDerWaalsContact O-CG 3.3Å; F38-L42 WeakPolarHBondContact O-CG 3.4Å; F38-L42 PolarHBondContact O-N 3.27Å; L42-I45 HydrophobicContact CB-CB 4.37Å; L42-I45 WeakPolarHBondContact O-CA 3.33Å; L42-I45 WeakPolarHBondContact O-CB 3.48Å; L42-I45 PolarHBondContact O-N 2.89Å; L42-V47 HydrophobicContact CD1-CG2 3.94Å; L42-L73 HydrophobicContact CD1-CD1 3.67Å; L42-W130 HydrophobicContact CD2-CB 3.94Å
43	A	88.1	Confident	90.4	Very high	68 Å²	68	75 Å²	75	56%	0.562	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	133.3	175.4	0	0	0	0	0	111.1	I39	I39-A43 PolarHBondContact O-N 3.07Å
44	P	89.3	Confident	90.2	Very high	100 Å²	100	72.2 Å²	72.2	65%	0.649	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.2	5.3	13.5	37.4	-38.4	0	0	0	115.2	R46 P78	P44-R46 PolarHBondContact O-N 2.83Å; P44-P78 HydrophobicContact CB-CG 3.73Å; P44-P78 HydrophobicContact CG-CG 3.78Å; P44-P78 WeakPolarHBondContact O-CG 3.38Å
45	I	89	Confident	90	Very high	27 Å²	27	72.5 Å²	72.5	14%	0.138	36%	0.359	C	S	.	.	S	Bend	trans	-65.3	126.9	174.1	-56.5	172.3	0	0	0	108.7	L42 V75 L129	L42-I45 HydrophobicContact CB-CB 4.37Å; L42-I45 WeakPolarHBondContact O-CA 3.33Å; L42-I45 WeakPolarHBondContact O-CB 3.48Å; L42-I45 PolarHBondContact O-N 2.89Å; I45-V75 HydrophobicContact CG2-CB 3.65Å; I45-V75 HydrophobicContact CG2-CG1 4.17Å; I45-V75 HydrophobicContact CG2-CG2 4.18Å; I45-L129 HydrophobicContact CD1-CD1 4.09Å; I45-L129 HydrophobicContact CD1-CD2 3.83Å; I45-L129 HydrophobicContact CD1-CG 4.45Å
46	R	90	Very high	89.9	Confident	188 Å²	188	72.3 Å²	72.3	71%	0.709	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	122.7	179.2	-61.1	-176	-176.4	-177.8	0.9	110	P44 V75 S76	P44-R46 PolarHBondContact O-N 2.83Å; R46-V75 CarbonylContact O-C 3.13Å; R46-V75 VanDerWaalsContact O-CA 3.25Å; R46-V75 WeakPolarHBondContact O-CA 3.42Å; R46-S76 PolarHBondContact N-O 3.02Å; R46-S76 PolarHBondContact O-N 3.49Å
47	V	89.7	Confident	89.7	Confident	28 Å²	28	74.3 Å²	74.3	17%	0.17	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	116.9	168.6	-175.1	0	0	0	0	108.1	I39 L42 I50 L73 V75	I39-V47 HydrophobicContact CG1-CB 4.1Å; I39-V47 HydrophobicContact CG1-CG2 4.3Å; L42-V47 HydrophobicContact CD1-CG2 3.94Å; V47-I50 HydrophobicContact CG1-CD1 3.87Å; V47-I50 HydrophobicContact CG1-CG1 3.52Å; V47-L73 HydrophobicContact CG1-CD2 4.26Å; V47-V75 HydrophobicContact CG2-CG1 4.38Å
48	R	90.4	Very high	89.6	Confident	170 Å²	170	69.7 Å²	69.7	64%	0.642	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	-40.5	-178	-64.6	-171.8	176.7	-169.8	-0	112.6	Q74 S76	R48-Q74 HydrophobicContact CB-CB 4.4Å; R48-Q74 HydrophobicContact CB-CG 4.36Å; R48-Q74 PolarHBondContact N-O 3.43Å; R48-S76 VanDerWaalsContact NE-CB 3.26Å; R48-S76 PolarHBondContact NE-OG 3.39Å; R48-S76 VanDerWaalsContact NH2-CB 3.29Å; R48-S76 PolarHBondContact NH2-OG 3.46Å
49	D	92.1	Very high	89.3	Confident	64 Å²	64	72.5 Å²	72.5	34%	0.342	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	147.8	-178.4	-177.4	37.8	0	0	0	109.8	K51 L73 Q74	D49-K51 WeakPolarHBondContact OD2-CE 3.32Å; D49-K51 WeakPolarHBondContact OD2-CG 3.42Å; D49-L73 WeakPolarHBondContact O-CA 3.33Å; D49-Q74 HydrophobicContact CB-CB 3.89Å; D49-Q74 PolarHBondContact N-O 2.99Å; D49-Q74 PolarHBondContact O-N 3.39Å
50	I	91.5	Very high	89	Confident	40 Å²	40	69.5 Å²	69.5	21%	0.205	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	107.3	178.1	-54.7	-173.2	0	0	0	108.1	L31 F38 V47 F71 L73	L31-I50 HydrophobicContact CD1-CG2 4.14Å; F38-I50 HydrophobicContact CD2-CD1 4.42Å; V47-I50 HydrophobicContact CG1-CD1 3.87Å; V47-I50 HydrophobicContact CG1-CG1 3.52Å; I50-F71 HydrophobicContact CG2-CD1 3.97Å; I50-L73 HydrophobicContact CB-CD2 4.11Å; I50-L73 HydrophobicContact CD1-CD2 4.08Å; I50-L73 HydrophobicContact CG1-CD2 3.69Å; I50-L73 HydrophobicContact CG2-CD2 3.78Å
51	K	91.5	Very high	88.4	Confident	130 Å²	130	70.7 Å²	70.7	57%	0.565	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.3	172.1	-61	-171.4	179	-174.7	0	110.1	D49 F71 R72	D49-K51 WeakPolarHBondContact OD2-CE 3.32Å; D49-K51 WeakPolarHBondContact OD2-CG 3.42Å; K51-F71 CarbonylContact O-C 3.59Å; K51-F71 WeakPolarHBondContact O-CA 3.22Å; K51-R72 HydrophobicContact CB-CB 4.27Å; K51-R72 PolarHBondContact N-O 2.98Å; K51-R72 PolarHBondContact O-N 3.15Å
52	F	88.6	Confident	87.7	Confident	27 Å²	27	72.5 Å²	72.5	12%	0.118	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	103.9	-177.6	-179.2	-139.1	0	0	0	111	R27 F30 L31 E54 Y55 K70 F71	R27-F52 HydrophobicContact CG-CD1 4.32Å; R27-F52 HydrophobicContact CG-CE1 3.55Å; R27-F52 HydrophobicContact CG-CZ 4.45Å; R27-F52 PolarHBondContact NH2-O 2.8Å; F30-F52 HydrophobicContact CD1-CE1 4.36Å; F30-F52 HydrophobicContact CD1-CE2 4.35Å; F30-F52 AromaticContact CD1-CZ 3.69Å; F30-F52 HydrophobicContact CD1-CZ 3.69Å; F30-F52 HydrophobicContact CE1-CE2 4.12Å; F30-F52 AromaticContact CE1-CZ 3.87Å; F30-F52 HydrophobicContact CE1-CZ 3.87Å; L31-F52 HydrophobicContact CB-CD1 4.11Å; L31-F52 HydrophobicContact CB-CE1 4.31Å; L31-F52 HydrophobicContact CD1-CB 3.66Å; L31-F52 HydrophobicContact CD1-CD1 4.06Å; L31-F52 HydrophobicContact CD1-CG 3.94Å; L31-F52 HydrophobicContact CD2-CB 4.31Å; L31-F52 HydrophobicContact CD2-CD1 4.2Å; L31-F52 HydrophobicContact CG-CD1 4.35Å; F52-E54 WeakPolarHBondContact CE2-O 3.31Å; F52-Y55 HydrophobicContact CE1-CG 4.36Å; F52-Y55 VanDerWaalsContact CZ-CB 3.41Å; F52-Y55 AromaticContact CZ-CD2 3.8Å; F52-Y55 HydrophobicContact CZ-CD2 3.8Å; F52-Y55 AromaticContact CZ-CG 3.86Å; F52-Y55 HydrophobicContact CZ-CG 3.86Å; F52-K70 WeakPolarHBondContact CD2-O 3.41Å; F52-F71 HydrophobicContact CB-CD1 4.32Å; F52-F71 HydrophobicContact CB-CE1 4.43Å; F52-F71 AromaticContact CD2-CD1 3.71Å; F52-F71 HydrophobicContact CD2-CD1 3.71Å; F52-F71 AromaticContact CD2-CE1 3.45Å; F52-F71 HydrophobicContact CD2-CE1 3.45Å; F52-F71 VanDerWaalsContact CD2-CE1 3.45Å; F52-F71 HydrophobicContact CD2-CE2 4.42Å; F52-F71 HydrophobicContact CD2-CG 4.32Å; F52-F71 AromaticContact CD2-CZ 3.85Å; F52-F71 HydrophobicContact CD2-CZ 3.85Å; F52-F71 HydrophobicContact CE2-CD1 4.35Å; F52-F71 AromaticContact CE2-CE1 3.74Å; F52-F71 HydrophobicContact CE2-CE1 3.74Å; F52-F71 HydrophobicContact CE2-CE2 4.18Å; F52-F71 AromaticContact CE2-CZ 3.66Å; F52-F71 HydrophobicContact CE2-CZ 3.66Å; F52-F71 HydrophobicContact CG-CD1 4.3Å; F52-F71 HydrophobicContact CG-CE1 4.03Å; F52-F71 HydrophobicContact CZ-CE1 4.49Å; F52-F71 HydrophobicContact CZ-CZ 4.36Å
53	S	85.6	Confident	87.1	Confident	53 Å²	53	76.5 Å²	76.5	37%	0.371	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-43.7	-170.3	61.3	0	0	0	0	113	R27 K70	R27-S53 PolarHBondContact NH2-O 3.48Å; S53-K70 PolarHBondContact N-O 2.93Å; S53-K70 VanDerWaalsContact N-O 3.12Å
54	E	87.8	Confident	86.8	Confident	41 Å²	41	84 Å²	84	19%	0.192	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142	-170.4	-63.5	164.5	-132	0	0	110.2	F52 G69 K70 M101	F52-E54 WeakPolarHBondContact CE2-O 3.31Å; E54-G69 VanDerWaalsContact O-CA 3.28Å; E54-G69 WeakPolarHBondContact O-CA 3.38Å; E54-K70 HydrophobicContact CB-CB 4.04Å; E54-K70 HydrophobicContact CG-CD 4.5Å; E54-K70 PolarHBondContact O-N 3.08Å; E54-K70 WeakPolarHBondContact OE1-CD 3.44Å; E54-K70 IonicContact OE1-NZ 3.25Å; E54-K70 PolarHBondContact OE1-NZ 3.23Å; E54-M101 HydrophobicContact CB-CE 4.06Å; E54-M101 HydrophobicContact CB-SD 3.79Å
55	Y	88.9	Confident	86.7	Confident	20 Å²	20	81.7 Å²	81.7	8%	0.078	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	132.8	-179.2	175.5	-119.9	0	0	0	110.7	R27 F30 F52 I68	R27-Y55 HydrophobicContact CB-CD1 3.92Å; R27-Y55 HydrophobicContact CB-CE1 4.14Å; R27-Y55 HydrophobicContact CG-CD1 3.92Å; R27-Y55 HydrophobicContact CG-CG 4.12Å; F30-Y55 HydrophobicContact CB-CE2 4.09Å; F30-Y55 AromaticContact CD1-CD2 3.64Å; F30-Y55 HydrophobicContact CD1-CD2 3.64Å; F30-Y55 AromaticContact CD1-CE2 3.66Å; F30-Y55 HydrophobicContact CD1-CE2 3.66Å; F30-Y55 HydrophobicContact CD2-CE2 4.29Å; F30-Y55 AromaticContact CE1-CD2 3.88Å; F30-Y55 HydrophobicContact CE1-CD2 3.88Å; F30-Y55 HydrophobicContact CE1-CE2 4.1Å; F30-Y55 HydrophobicContact CG-CD2 4.22Å; F30-Y55 AromaticContact CG-CE2 3.75Å; F30-Y55 HydrophobicContact CG-CE2 3.75Å; F52-Y55 HydrophobicContact CE1-CG 4.36Å; F52-Y55 VanDerWaalsContact CZ-CB 3.41Å; F52-Y55 AromaticContact CZ-CD2 3.8Å; F52-Y55 HydrophobicContact CZ-CD2 3.8Å; F52-Y55 AromaticContact CZ-CG 3.86Å; F52-Y55 HydrophobicContact CZ-CG 3.86Å; Y55-I68 WeakPolarHBondContact CA-O 3.42Å
56	D	89.3	Confident	86.6	Confident	3 Å²	3	82.5 Å²	82.5	2%	0.016	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	137	170.4	-96.7	-6.5	0	0	0	111.5	G67 I68 G98 G99 E100 M101 C102	D56-G67 CarbonylContact O-C 3.54Å; D56-G67 WeakPolarHBondContact O-CA 3.38Å; D56-I68 PolarHBondContact N-O 3.02Å; D56-I68 PolarHBondContact O-N 3.3Å; D56-G98 VanDerWaalsContact OD1-CA 3.25Å; D56-G98 WeakPolarHBondContact OD1-CA 3.41Å; D56-G99 PolarHBondContact OD1-N 3.02Å; D56-G99 VanDerWaalsContact OD2-C 3.25Å; D56-G99 VanDerWaalsContact OD2-CA 3.26Å; D56-G99 WeakPolarHBondContact OD2-CA 3.36Å; D56-G99 PolarHBondContact OD2-N 3.24Å; D56-E100 PolarHBondContact OD2-N 2.94Å; D56-M101 HydrophobicContact CB-CB 3.98Å; D56-M101 HydrophobicContact CB-CG 4.31Å; D56-M101 HydrophobicContact CB-SD 4.08Å; D56-M101 WeakPolarHBondContact OD2-CA 3.07Å; D56-M101 WeakPolarHBondContact OD2-CB 3.4Å; D56-M101 WeakPolarHBondContact OD2-CG 3.25Å; D56-M101 PolarHBondContact OD2-N 3.46Å; D56-C102 PolarHBondContact OD2-N 3Å
57	R	89.3	Confident	86.6	Confident	126 Å²	126	74.7 Å²	74.7	48%	0.475	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.1	169.5	-177.1	-172.6	180	106.4	-12.1	108.5	E26 P65	E26-R57 IonicContact OE1-CZ 3.41Å; E26-R57 IonicContact OE1-NH1 2.63Å; E26-R57 PolarHBondContact OE1-NH1 2.97Å; E26-R57 IonicContact OE1-NH2 3.64Å; E26-R57 IonicContact OE2-CZ 3.6Å; E26-R57 IonicContact OE2-NH1 2.75Å; E26-R57 PolarHBondContact OE2-NH1 3.36Å; R57-P65 HydrophobicContact CG-CB 4.14Å; R57-P65 VanDerWaalsContact CZ-CG 3.48Å; R57-P65 VanDerWaalsContact NH2-CG 3.29Å
58	C	89	Confident	86.6	Confident	1 Å²	1	74 Å²	74	1%	0.007	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.6	-176.8	-56.1	0	0	0	0	111.6	P65 Y66 I68 C102	C58-P65 VanDerWaalsContact O-CA 3.24Å; C58-P65 WeakPolarHBondContact O-CA 3.46Å; C58-P65 WeakPolarHBondContact O-CB 3.35Å; C58-Y66 HydrophobicContact CB-CD1 4.12Å; C58-Y66 HydrophobicContact CB-CD2 4.11Å; C58-Y66 HydrophobicContact CB-CE1 3.55Å; C58-Y66 HydrophobicContact CB-CE2 3.56Å; C58-Y66 HydrophobicContact CB-CG 4.35Å; C58-Y66 VanDerWaalsContact CB-OH 3.31Å; C58-Y66 WeakPolarHBondContact CB-OH 3.5Å; C58-Y66 PolarHBondContact N-O 3.25Å; C58-Y66 PolarHBondContact O-N 3.26Å; C58-Y66 VanDerWaalsContact O-N 3.08Å; C58-I68 WeakPolarHBondContact SG-CD1 3.46Å; C58-I68 VanDerWaalsContact SG-CG1 3.58Å; C58-C102 WeakPolarHBondContact CA-SG 3.47Å; C58-C102 HydrophobicContact CB-CB 3.88Å; C58-C102 WeakPolarHBondContact CB-SG 2.96Å; C58-C102 VanDerWaalsContact SG-CA 3.54Å; C58-C102 WeakPolarHBondContact SG-CB 3.31Å; C58-C102 CovalentContact SG-SG 2.03Å; C58-C102 PolarHBondContact SG-SG 2.73Å
59	P	86.4	Confident	86.7	Confident	85 Å²	85	66.8 Å²	66.8	55%	0.552	33%	0.326	S	S	*	.			trans	-65.8	144.3	173	29.2	-33.9	0	0	0	110.2
60	H	84.2	Confident	86.6	Confident	28 Å²	28	68.5 Å²	68.5	13%	0.13	33%	0.331	C	S	.	.			trans	-124.5	115.6	168.3	-164.1	-50.7	0	0	0	108.9	N62 R63 R64 Y66 F139	H60-N62 PolarHBondContact O-N 2.89Å; H60-R63 HydrophobicContact CB-CB 4.08Å; H60-R63 VanDerWaalsContact CE1-CD 3.49Å; H60-R63 WeakPolarHBondContact CE1-CD 3.28Å; H60-R63 PolarHBondContact O-N 3.38Å; H60-R63 VanDerWaalsContact O-N 3.14Å; H60-R64 WeakPolarHBondContact CB-O 3.34Å; H60-Y66 HydrophobicContact CB-CD1 4.09Å; H60-Y66 HydrophobicContact CB-CE1 4.37Å; H60-F139 AromaticContact CD2-CE1 3.73Å; H60-F139 AromaticContact CD2-CZ 3.42Å; H60-F139 VanDerWaalsContact CD2-CZ 3.42Å; H60-F139 WeakPolarHBondContact CD2-CZ 3.49Å; H60-F139 AromaticContact NE2-CD1 3.84Å; H60-F139 AromaticContact NE2-CE1 3.41Å; H60-F139 WeakPolarHBondContact NE2-CE1 3.3Å; H60-F139 AromaticContact NE2-CE2 3.93Å; H60-F139 AromaticContact NE2-CZ 3.48Å; H60-F139 WeakPolarHBondContact NE2-CZ 3.33Å
61	E	78.2	Confident	86.6	Confident	138 Å²	138	68.9 Å²	68.9	65%	0.645	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	127.2	175.9	-85.9	164.6	-140.4	0	0	109.2	R63 Q111	E61-R63 PolarHBondContact O-N 2.94Å; E61-R63 VanDerWaalsContact O-N 3.07Å; E61-Q111 PolarHBondContact OE1-NE2 2.85Å; E61-Q111 VanDerWaalsContact OE1-NE2 3.15Å
62	N	73.4	Confident	86.5	Confident	167 Å²	167	70.9 Å²	70.9	89%	0.893	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	16.6	178	-51.1	-43.3	0	0	0	115.6	H60	H60-N62 PolarHBondContact O-N 2.89Å
63	R	76.6	Confident	86.6	Confident	102 Å²	102	72 Å²	72	39%	0.385	34%	0.342	S	S	.	.	S	Bend	trans	-140.3	175	175	-61.3	-169	173.9	174.2	-9.4	111.1	H60 E61 F139 G141	H60-R63 HydrophobicContact CB-CB 4.08Å; H60-R63 VanDerWaalsContact CE1-CD 3.49Å; H60-R63 WeakPolarHBondContact CE1-CD 3.28Å; H60-R63 PolarHBondContact O-N 3.38Å; H60-R63 VanDerWaalsContact O-N 3.14Å; E61-R63 PolarHBondContact O-N 2.94Å; E61-R63 VanDerWaalsContact O-N 3.07Å; R63-F139 PolarHBondContact NH1-O 2.94Å; R63-G141 VanDerWaalsContact NH2-CA 3.31Å; R63-G141 PolarHBondContact NH2-O 2.76Å
64	R	83.1	Confident	86.9	Confident	225 Å²	225	74.7 Å²	74.7	85%	0.849	35%	0.348	S	S	*	.			trans	-64.2	141.8	170.2	-66	-174.7	179.7	-170.4	-0.3	109.2	H60	H60-R64 WeakPolarHBondContact CB-O 3.34Å
65	P	86.6	Confident	86.9	Confident	53 Å²	53	75.4 Å²	75.4	34%	0.344	36%	0.355	S	S	.	.			trans	-58.7	157	172.7	26.3	-33	0	0	0	110.2	R57 C58	R57-P65 HydrophobicContact CG-CB 4.14Å; R57-P65 VanDerWaalsContact CZ-CG 3.48Å; R57-P65 VanDerWaalsContact NH2-CG 3.29Å; C58-P65 VanDerWaalsContact O-CA 3.24Å; C58-P65 WeakPolarHBondContact O-CA 3.46Å; C58-P65 WeakPolarHBondContact O-CB 3.35Å
66	Y	87.1	Confident	86.9	Confident	43 Å²	43	75.6 Å²	75.6	17%	0.169	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	158.9	177.9	65.1	-83.1	0	0	0	110.1	C58 H60 I68 Q111 P113 F139	C58-Y66 HydrophobicContact CB-CD1 4.12Å; C58-Y66 HydrophobicContact CB-CD2 4.11Å; C58-Y66 HydrophobicContact CB-CE1 3.55Å; C58-Y66 HydrophobicContact CB-CE2 3.56Å; C58-Y66 HydrophobicContact CB-CG 4.35Å; C58-Y66 VanDerWaalsContact CB-OH 3.31Å; C58-Y66 WeakPolarHBondContact CB-OH 3.5Å; C58-Y66 PolarHBondContact N-O 3.25Å; C58-Y66 PolarHBondContact O-N 3.26Å; C58-Y66 VanDerWaalsContact O-N 3.08Å; H60-Y66 HydrophobicContact CB-CD1 4.09Å; H60-Y66 HydrophobicContact CB-CE1 4.37Å; Y66-I68 HydrophobicContact CD2-CG1 4.13Å; Y66-I68 HydrophobicContact CE2-CD1 3.88Å; Y66-I68 HydrophobicContact CE2-CG1 3.65Å; Y66-Q111 PolarHBondContact OH-O 2.9Å; Y66-P113 HydrophobicContact CD2-CG 4.35Å; Y66-P113 HydrophobicContact CE2-CB 3.92Å; Y66-P113 HydrophobicContact CE2-CG 3.79Å; Y66-F139 HydrophobicContact CD1-CZ 4.33Å; Y66-F139 AromaticContact CE1-CZ 3.97Å; Y66-F139 HydrophobicContact CE1-CZ 3.97Å
67	G	88.7	Confident	86.5	Confident	24 Å²	24	78.7 Å²	78.7	25%	0.247	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	141.7	176	0	0	0	0	0	111.8	D56	D56-G67 CarbonylContact O-C 3.54Å; D56-G67 WeakPolarHBondContact O-CA 3.38Å
68	I	91.4	Very high	85.9	Confident	14 Å²	14	76.9 Å²	76.9	7%	0.072	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138	162.9	-60.2	-179.8	0	0	0	107.5	Y55 D56 C58 Y66 M101 W105 P113	Y55-I68 WeakPolarHBondContact CA-O 3.42Å; D56-I68 PolarHBondContact N-O 3.02Å; D56-I68 PolarHBondContact O-N 3.3Å; C58-I68 WeakPolarHBondContact SG-CD1 3.46Å; C58-I68 VanDerWaalsContact SG-CG1 3.58Å; Y66-I68 HydrophobicContact CD2-CG1 4.13Å; Y66-I68 HydrophobicContact CE2-CD1 3.88Å; Y66-I68 HydrophobicContact CE2-CG1 3.65Å; I68-M101 HydrophobicContact CG2-CB 4.45Å; I68-M101 HydrophobicContact CG2-CE 3.85Å; I68-W105 HydrophobicContact CG2-CE3 3.63Å; I68-W105 HydrophobicContact CG2-CZ3 3.96Å; I68-P113 HydrophobicContact CD1-CB 3.78Å; I68-P113 HydrophobicContact CG1-CB 4.16Å
69	G	90.8	Very high	84.9	Confident	19 Å²	19	80.8 Å²	80.8	20%	0.196	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	154.5	-178.2	0	0	0	0	0	113.5	E54	E54-G69 VanDerWaalsContact O-CA 3.28Å; E54-G69 WeakPolarHBondContact O-CA 3.38Å
70	K	91	Very high	83.3	Confident	100 Å²	100	80 Å²	80	44%	0.435	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.9	171.5	-173.3	178.5	172.6	-175.5	0	110	F52 S53 E54	F52-K70 WeakPolarHBondContact CD2-O 3.41Å; S53-K70 PolarHBondContact N-O 2.93Å; S53-K70 VanDerWaalsContact N-O 3.12Å; E54-K70 HydrophobicContact CB-CB 4.04Å; E54-K70 HydrophobicContact CG-CD 4.5Å; E54-K70 PolarHBondContact O-N 3.08Å; E54-K70 WeakPolarHBondContact OE1-CD 3.44Å; E54-K70 IonicContact OE1-NZ 3.25Å; E54-K70 PolarHBondContact OE1-NZ 3.23Å
71	F	90.8	Very high	81.5	Confident	48 Å²	48	85.3 Å²	85.3	21%	0.211	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140.4	-175	-57.3	-92.6	0	0	0	110.2	F30 L31 A34 F38 I50 K51 F52 L73	F30-F71 HydrophobicContact CD1-CZ 4.16Å; F30-F71 HydrophobicContact CE1-CE2 4.01Å; F30-F71 AromaticContact CE1-CZ 3.48Å; F30-F71 HydrophobicContact CE1-CZ 3.48Å; F30-F71 VanDerWaalsContact CE1-CZ 3.48Å; F30-F71 HydrophobicContact CZ-CE2 4.36Å; F30-F71 HydrophobicContact CZ-CZ 4.13Å; L31-F71 HydrophobicContact CD1-CD1 4.3Å; L31-F71 HydrophobicContact CD1-CE1 3.85Å; A34-F71 HydrophobicContact CB-CE1 3.79Å; A34-F71 HydrophobicContact CB-CE2 4.35Å; A34-F71 HydrophobicContact CB-CZ 3.54Å; F38-F71 HydrophobicContact CE2-CB 4.02Å; F38-F71 AromaticContact CE2-CD1 3.83Å; F38-F71 HydrophobicContact CE2-CD1 3.83Å; F38-F71 AromaticContact CE2-CD2 3.91Å; F38-F71 HydrophobicContact CE2-CD2 3.91Å; F38-F71 HydrophobicContact CE2-CE1 4.2Å; F38-F71 HydrophobicContact CE2-CE2 4.28Å; F38-F71 AromaticContact CE2-CG 3.65Å; F38-F71 HydrophobicContact CE2-CG 3.65Å; F38-F71 HydrophobicContact CE2-CZ 4.4Å; F38-F71 HydrophobicContact CZ-CB 4.23Å; F38-F71 AromaticContact CZ-CD2 3.83Å; F38-F71 HydrophobicContact CZ-CD2 3.83Å; F38-F71 HydrophobicContact CZ-CE2 4.29Å; F38-F71 AromaticContact CZ-CG 3.97Å; F38-F71 HydrophobicContact CZ-CG 3.97Å; I50-F71 HydrophobicContact CG2-CD1 3.97Å; K51-F71 CarbonylContact O-C 3.59Å; K51-F71 WeakPolarHBondContact O-CA 3.22Å; F52-F71 HydrophobicContact CB-CD1 4.32Å; F52-F71 HydrophobicContact CB-CE1 4.43Å; F52-F71 AromaticContact CD2-CD1 3.71Å; F52-F71 HydrophobicContact CD2-CD1 3.71Å; F52-F71 AromaticContact CD2-CE1 3.45Å; F52-F71 HydrophobicContact CD2-CE1 3.45Å; F52-F71 VanDerWaalsContact CD2-CE1 3.45Å; F52-F71 HydrophobicContact CD2-CE2 4.42Å; F52-F71 HydrophobicContact CD2-CG 4.32Å; F52-F71 AromaticContact CD2-CZ 3.85Å; F52-F71 HydrophobicContact CD2-CZ 3.85Å; F52-F71 HydrophobicContact CE2-CD1 4.35Å; F52-F71 AromaticContact CE2-CE1 3.74Å; F52-F71 HydrophobicContact CE2-CE1 3.74Å; F52-F71 HydrophobicContact CE2-CE2 4.18Å; F52-F71 AromaticContact CE2-CZ 3.66Å; F52-F71 HydrophobicContact CE2-CZ 3.66Å; F52-F71 HydrophobicContact CG-CD1 4.3Å; F52-F71 HydrophobicContact CG-CE1 4.03Å; F52-F71 HydrophobicContact CZ-CE1 4.49Å; F52-F71 HydrophobicContact CZ-CZ 4.36Å; F71-L73 HydrophobicContact CB-CD2 4.49Å
72	R	90.6	Very high	80.2	Confident	172 Å²	172	86.6 Å²	86.6	65%	0.649	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	115.7	167.2	-176.9	177.1	-173.9	164.8	1.9	107.8	K51	K51-R72 HydrophobicContact CB-CB 4.27Å; K51-R72 PolarHBondContact N-O 2.98Å; K51-R72 PolarHBondContact O-N 3.15Å
73	L	90.6	Very high	78.6	Confident	50 Å²	50	83.3 Å²	83.3	26%	0.262	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	128.1	-178.6	-52.5	177.9	0	0	0	109	F38 L42 V47 D49 I50 F71 V75	F38-L73 HydrophobicContact CB-CD1 4.23Å; F38-L73 HydrophobicContact CD1-CD1 4.06Å; F38-L73 HydrophobicContact CD2-CD1 4.34Å; F38-L73 HydrophobicContact CD2-CD2 3.9Å; F38-L73 HydrophobicContact CE2-CD2 4.32Å; F38-L73 HydrophobicContact CG-CD1 3.97Å; F38-L73 HydrophobicContact CG-CD2 4.29Å; L42-L73 HydrophobicContact CD1-CD1 3.67Å; V47-L73 HydrophobicContact CG1-CD2 4.26Å; D49-L73 WeakPolarHBondContact O-CA 3.33Å; I50-L73 HydrophobicContact CB-CD2 4.11Å; I50-L73 HydrophobicContact CD1-CD2 4.08Å; I50-L73 HydrophobicContact CG1-CD2 3.69Å; I50-L73 HydrophobicContact CG2-CD2 3.78Å; F71-L73 HydrophobicContact CB-CD2 4.49Å; L73-V75 HydrophobicContact CB-CG1 3.94Å
74	Q	90.5	Very high	77.1	Confident	109 Å²	109	89.2 Å²	89.2	51%	0.509	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	124.3	161.3	-169.5	176.7	9.3	0	0	107.3	R48 D49	R48-Q74 HydrophobicContact CB-CB 4.4Å; R48-Q74 HydrophobicContact CB-CG 4.36Å; R48-Q74 PolarHBondContact N-O 3.43Å; D49-Q74 HydrophobicContact CB-CB 3.89Å; D49-Q74 PolarHBondContact N-O 2.99Å; D49-Q74 PolarHBondContact O-N 3.39Å
75	V	89	Confident	75	Confident	56 Å²	56	87.6 Å²	87.6	34%	0.339	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	156.8	-173.9	-61.6	0	0	0	0	111.6	I45 R46 V47 L73	I45-V75 HydrophobicContact CG2-CB 3.65Å; I45-V75 HydrophobicContact CG2-CG1 4.17Å; I45-V75 HydrophobicContact CG2-CG2 4.18Å; R46-V75 CarbonylContact O-C 3.13Å; R46-V75 VanDerWaalsContact O-CA 3.25Å; R46-V75 WeakPolarHBondContact O-CA 3.42Å; V47-V75 HydrophobicContact CG2-CG1 4.38Å; L73-V75 HydrophobicContact CB-CG1 3.94Å
76	S	87.8	Confident	72.9	Confident	24 Å²	24	90.3 Å²	90.3	17%	0.168	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	128.7	166.1	52.5	0	0	0	0	111.1	R46 R48	R46-S76 PolarHBondContact N-O 3.02Å; R46-S76 PolarHBondContact O-N 3.49Å; R48-S76 VanDerWaalsContact NE-CB 3.26Å; R48-S76 PolarHBondContact NE-OG 3.39Å; R48-S76 VanDerWaalsContact NH2-CB 3.29Å; R48-S76 PolarHBondContact NH2-OG 3.46Å
77	C	81.6	Confident	70.1	Confident	69 Å²	69	92.3 Å²	92.3	47%	0.466	54%	0.541	S	S	.	.			trans	-78.3	144.4	175.9	-59.4	0	0	0	0	110.6	G79	C77-G79 PolarHBondContact O-N 2.99Å
78	P	76.9	Confident	67.4	Low	87 Å²	87	93.7 Å²	93.7	57%	0.565	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	125.1	165.8	5.6	4.6	0	0	0	109	P44	P44-P78 HydrophobicContact CB-CG 3.73Å; P44-P78 HydrophobicContact CG-CG 3.78Å; P44-P78 WeakPolarHBondContact O-CG 3.38Å
79	G	67.1	Low	64.7	Low	84 Å²	84	101.9 Å²	101.9	87%	0.866	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	122.2	-1.6	172.4	0	0	0	0	0	118.2	C77	C77-G79 PolarHBondContact O-N 2.99Å
80	G	54.4	Low	61.8	Low	68 Å²	68	106.1 Å²	106.1	70%	0.701	62%	0.62	S	S	*	*	S	Bend	trans	83.4	130.5	172.4	0	0	0	0	0	115.1
81	D	46.2	Very low	59.3	Low	140 Å²	140	109 Å²	109	75%	0.749	64%	0.639	S	S	*	*			trans	50.9	88.1	165.5	-65	-13.1	0	0	0	120.7
82	L	50.2	Low	56.5	Low	165 Å²	165	115.4 Å²	115.4	86%	0.864	67%	0.669	S	S	*	*			trans	-108.6	63.8	137.8	-78.1	168.4	0	0	0	108.9	R84	L82-R84 PolarHBondContact O-N 3.16Å
83	S	39.7	Very low	53.8	Low	97 Å²	97	112.8 Å²	112.8	68%	0.678	67%	0.673	S	S	*	*			trans	-76.6	78.9	162.9	35.2	0	0	0	0	108.5
84	R	44.9	Very low	51.1	Low	226 Å²	226	118.8 Å²	118.8	85%	0.853	70%	0.699	S	S	*	*			trans	-112.5	95.7	156.5	-157	175	121.2	135	1.7	107.8	L82 S86	L82-R84 PolarHBondContact O-N 3.16Å; R84-S86 PolarHBondContact O-N 3.15Å
85	E	40.2	Very low	48.7	Very low	191 Å²	191	122 Å²	122	89%	0.893	71%	0.714	S	S	*	*			trans	-55.9	100.4	169	-68	-176.9	154.2	0	0	109.1
86	S	40.7	Very low	46.4	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	71%	0.71	S	S	*	*			trans	-87.6	96.8	153.1	53.3	0	0	0	0	106.5	R84 G88	R84-S86 PolarHBondContact O-N 3.15Å; S86-G88 VanDerWaalsContact C-N 3.33Å; S86-G88 PolarHBondContact O-N 3.29Å
87	G	29.7	Very low	44.3	Very low	85 Å²	85	129.4 Å²	129.4	88%	0.876	74%	0.74	S	S	*	*			trans	-56.3	96.5	167.5	0	0	0	0	0	109.5
88	G	31.7	Very low	42.9	Very low	54 Å²	54	128.4 Å²	128.4	56%	0.557	74%	0.741	S	S	*	*			trans	-99.2	106.8	174.6	0	0	0	0	0	108.8	S86 S90	S86-G88 VanDerWaalsContact C-N 3.33Å; S86-G88 PolarHBondContact O-N 3.29Å; G88-S90 PolarHBondContact O-N 3.34Å
89	H	33.8	Very low	42.3	Very low	186 Å²	186	125.5 Å²	125.5	86%	0.861	73%	0.726	S	S	*	*			trans	-43.3	122.9	165.5	-103.6	15.4	0	0	0	110.2	I91	H89-I91 PolarHBondContact O-N 3.32Å; H89-I91 VanDerWaalsContact O-N 3.16Å
90	S	30	Very low	43	Very low	107 Å²	107	127 Å²	127	75%	0.748	71%	0.711	S	S	*	*			trans	-66.5	104.8	164.9	45.8	0	0	0	0	108.2	G88	G88-S90 PolarHBondContact O-N 3.34Å
91	I	39.3	Very low	44.6	Very low	162 Å²	162	124 Å²	124	83%	0.831	68%	0.679	S	S	*	*			trans	-79.8	130.2	163.3	-63.2	177.8	0	0	0	107.2	H89	H89-I91 PolarHBondContact O-N 3.32Å; H89-I91 VanDerWaalsContact O-N 3.16Å
92	E	32.2	Very low	46.5	Very low	182 Å²	182	118 Å²	118	85%	0.85	65%	0.647	S	S	*	*			trans	-47	141.4	-175.8	-72	173.4	137.7	0	0	114.1	Q94	E92-Q94 PolarHBondContact O-N 3.38Å
93	T	32.7	Very low	48.2	Very low	117 Å²	117	117.6 Å²	117.6	72%	0.718	64%	0.639	S	S	*	*			trans	-67.5	93.9	174	-37.9	0	0	0	0	109.9	Q95	T93-Q95 PolarHBondContact O-N 3.03Å
94	Q	35.6	Very low	50.5	Low	175 Å²	175	120.8 Å²	120.8	82%	0.818	64%	0.64	S	S	*	*			trans	-77.6	115.5	154.1	-91.1	-178.1	-20.6	0	0	108	E92 S96	E92-Q94 PolarHBondContact O-N 3.38Å; Q94-S96 PolarHBondContact O-N 3.42Å
95	Q	38.5	Very low	52.6	Low	176 Å²	176	111.9 Å²	111.9	82%	0.822	61%	0.607	S	S	*	*			trans	-59.6	104.7	163.4	-80.8	175.3	-18.3	0	0	107.9	T93 Y97	T93-Q95 PolarHBondContact O-N 3.03Å; Q95-Y97 PolarHBondContact O-N 2.91Å
96	S	41.3	Very low	55	Low	38 Å²	38	107.8 Å²	107.8	27%	0.266	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-65.2	126.5	169.5	177.9	0	0	0	0	108.5	Q94 E100	Q94-S96 PolarHBondContact O-N 3.42Å; S96-E100 PolarHBondContact OG-OE2 2.89Å
97	Y	44.8	Very low	57.4	Low	199 Å²	199	102.5 Å²	102.5	78%	0.78	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-64.8	133.5	171.9	-81.4	-95.9	0	0	0	108.4	Q95 G99	Q95-Y97 PolarHBondContact O-N 2.91Å; Y97-G99 PolarHBondContact O-N 3.08Å
98	G	52.2	Low	60.2	Low	48 Å²	48	99.8 Å²	99.8	50%	0.495	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	129.4	-168.1	0	0	0	0	0	114.1	D56	D56-G98 VanDerWaalsContact OD1-CA 3.25Å; D56-G98 WeakPolarHBondContact OD1-CA 3.41Å
99	G	63.7	Low	62.7	Low	25 Å²	25	100.3 Å²	100.3	26%	0.258	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	110	-9.1	172	0	0	0	0	0	115.7	D56 Y97 K103	D56-G99 PolarHBondContact OD1-N 3.02Å; D56-G99 VanDerWaalsContact OD2-C 3.25Å; D56-G99 VanDerWaalsContact OD2-CA 3.26Å; D56-G99 WeakPolarHBondContact OD2-CA 3.36Å; D56-G99 PolarHBondContact OD2-N 3.24Å; Y97-G99 PolarHBondContact O-N 3.08Å; G99-K103 PolarHBondContact O-N 2.88Å
100	E	81.5	Confident	65.2	Low	116 Å²	116	92.4 Å²	92.4	54%	0.542	48%	0.483	S	S	.	.	H	α-helix	trans	-68.9	-39.1	177.6	-68.8	-176.6	153.1	0	0	112.4	D56 S96 C102 K103 K104	D56-E100 PolarHBondContact OD2-N 2.94Å; S96-E100 PolarHBondContact OG-OE2 2.89Å; E100-C102 PolarHBondContact O-N 2.84Å; E100-K103 PolarHBondContact O-N 2.94Å; E100-K104 WeakPolarHBondContact O-CB 3.45Å; E100-K104 PolarHBondContact O-N 2.76Å
101	M	87.3	Confident	68	Low	6 Å²	6	88.9 Å²	88.9	3%	0.03	46%	0.455	C	S	.	.	H	α-helix	trans	-65.6	-42.3	179.7	-53.2	174.6	73.6	0	0	110.1	E54 D56 I68 K103 K104 W105	E54-M101 HydrophobicContact CB-CE 4.06Å; E54-M101 HydrophobicContact CB-SD 3.79Å; D56-M101 HydrophobicContact CB-CB 3.98Å; D56-M101 HydrophobicContact CB-CG 4.31Å; D56-M101 HydrophobicContact CB-SD 4.08Å; D56-M101 WeakPolarHBondContact OD2-CA 3.07Å; D56-M101 WeakPolarHBondContact OD2-CB 3.4Å; D56-M101 WeakPolarHBondContact OD2-CG 3.25Å; D56-M101 PolarHBondContact OD2-N 3.46Å; I68-M101 HydrophobicContact CG2-CB 4.45Å; I68-M101 HydrophobicContact CG2-CE 3.85Å; M101-K103 VanDerWaalsContact C-N 3.28Å; M101-K103 PolarHBondContact O-N 3.42Å; M101-K104 PolarHBondContact O-N 2.87Å; M101-W105 HydrophobicContact CB-CD2 4.46Å; M101-W105 HydrophobicContact CE-CD2 4.46Å; M101-W105 HydrophobicContact CE-CE3 3.76Å; M101-W105 HydrophobicContact CE-CH2 3.33Å; M101-W105 HydrophobicContact CE-CZ2 4.09Å; M101-W105 HydrophobicContact CE-CZ3 3.14Å; M101-W105 WeakPolarHBondContact O-CA 3.22Å; M101-W105 VanDerWaalsContact O-CB 3.3Å; M101-W105 WeakPolarHBondContact O-CB 3.4Å; M101-W105 PolarHBondContact O-N 2.82Å
102	C	87.7	Confident	70.3	Confident	13 Å²	13	81.2 Å²	81.2	9%	0.088	42%	0.416	C	S	.	.	H	α-helix	trans	-57.2	-42.7	177.1	-58.9	0	0	0	0	111.9	D56 C58 E100 R106	D56-C102 PolarHBondContact OD2-N 3Å; C58-C102 WeakPolarHBondContact CA-SG 3.47Å; C58-C102 HydrophobicContact CB-CB 3.88Å; C58-C102 WeakPolarHBondContact CB-SG 2.96Å; C58-C102 VanDerWaalsContact SG-CA 3.54Å; C58-C102 WeakPolarHBondContact SG-CB 3.31Å; C58-C102 CovalentContact SG-SG 2.03Å; C58-C102 PolarHBondContact SG-SG 2.73Å; E100-C102 PolarHBondContact O-N 2.84Å; C102-R106 WeakPolarHBondContact O-CB 3.29Å; C102-R106 VanDerWaalsContact O-CD 3.27Å; C102-R106 WeakPolarHBondContact O-CD 3.35Å
103	K	85.7	Confident	73.1	Confident	156 Å²	156	73.8 Å²	73.8	68%	0.678	38%	0.383	S	S	*	.	H	α-helix	trans	-74	-41.4	-179.6	-70.8	179.7	-176.9	176.7	0	112.3	G99 E100 M101 R106	G99-K103 PolarHBondContact O-N 2.88Å; E100-K103 PolarHBondContact O-N 2.94Å; M101-K103 VanDerWaalsContact C-N 3.28Å; M101-K103 PolarHBondContact O-N 3.42Å; K103-R106 WeakPolarHBondContact O-CG 3.47Å; K103-R106 PolarHBondContact O-NE 2.85Å
104	K	86.3	Confident	76	Confident	165 Å²	165	70.3 Å²	70.3	72%	0.717	36%	0.359	S	S	*	.	H	α-helix	trans	-77.5	-38.7	-174.5	-170.4	-179.8	179.3	173.7	0	112.6	E100 M101	E100-K104 WeakPolarHBondContact O-CB 3.45Å; E100-K104 PolarHBondContact O-N 2.76Å; M101-K104 PolarHBondContact O-N 2.87Å
105	W	90.1	Very high	78.8	Confident	39 Å²	39	65.1 Å²	65.1	15%	0.148	34%	0.337	C	S	.	.	S	Bend	trans	-104.7	48.8	-173	-58.1	-6.6	0	0	0	111	I68 M101 P113 Q114 Q116	I68-W105 HydrophobicContact CG2-CE3 3.63Å; I68-W105 HydrophobicContact CG2-CZ3 3.96Å; M101-W105 HydrophobicContact CB-CD2 4.46Å; M101-W105 HydrophobicContact CE-CD2 4.46Å; M101-W105 HydrophobicContact CE-CE3 3.76Å; M101-W105 HydrophobicContact CE-CH2 3.33Å; M101-W105 HydrophobicContact CE-CZ2 4.09Å; M101-W105 HydrophobicContact CE-CZ3 3.14Å; M101-W105 WeakPolarHBondContact O-CA 3.22Å; M101-W105 VanDerWaalsContact O-CB 3.3Å; M101-W105 WeakPolarHBondContact O-CB 3.4Å; M101-W105 PolarHBondContact O-N 2.82Å; W105-P113 CarbonylContact O-C 3.48Å; W105-P113 VanDerWaalsContact O-CA 3.28Å; W105-P113 WeakPolarHBondContact O-CA 3.14Å; W105-Q114 HydrophobicContact CB-CB 4.39Å; W105-Q114 PolarHBondContact O-N 3.29Å; W105-Q116 HydrophobicContact CB-CG 4.49Å; W105-Q116 HydrophobicContact CD2-CG 3.33Å; W105-Q116 VanDerWaalsContact CE2-CG 3.46Å; W105-Q116 HydrophobicContact CE3-CG 3.53Å; W105-Q116 HydrophobicContact CG-CG 3.76Å; W105-Q116 HydrophobicContact CH2-CG 4.01Å; W105-Q116 HydrophobicContact CZ2-CG 3.84Å; W105-Q116 HydrophobicContact CZ3-CG 3.85Å
106	R	90.4	Very high	81.4	Confident	104 Å²	104	59.8 Å²	59.8	39%	0.392	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-128.5	152.2	175.4	69.3	-173.4	178.4	158.9	-3	112.1	C102 K103 T110 L112	C102-R106 WeakPolarHBondContact O-CB 3.29Å; C102-R106 VanDerWaalsContact O-CD 3.27Å; C102-R106 WeakPolarHBondContact O-CD 3.35Å; K103-R106 WeakPolarHBondContact O-CG 3.47Å; K103-R106 PolarHBondContact O-NE 2.85Å; R106-T110 VanDerWaalsContact CD-O 3.3Å; R106-T110 WeakPolarHBondContact CD-O 3.37Å; R106-L112 CarbonylContact C-O 3.48Å; R106-L112 WeakPolarHBondContact CA-O 3.28Å; R106-L112 WeakPolarHBondContact CB-O 3.47Å
107	Y	90.8	Very high	83.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.304	C	S	.	.			trans	-65.9	129.7	172.2	-171.3	-86	0	0	0	109.7	G109 T110 L112 L136 F164 K169 H254 T256	Y107-G109 PolarHBondContact O-N 3.2Å; Y107-T110 WeakPolarHBondContact CB-OG1 3.19Å; Y107-T110 HydrophobicContact CD1-CG2 4Å; Y107-T110 PolarHBondContact O-N 2.98Å; Y107-T110 PolarHBondContact O-OG1 2.89Å; Y107-L112 PolarHBondContact N-O 3.02Å; Y107-L136 HydrophobicContact CD1-CD2 3.49Å; Y107-L136 VanDerWaalsContact CD1-CD2 3.49Å; Y107-L136 HydrophobicContact CD2-CD1 4.04Å; Y107-L136 HydrophobicContact CD2-CD2 3.92Å; Y107-L136 HydrophobicContact CE1-CD2 3.61Å; Y107-L136 HydrophobicContact CE2-CD1 4.34Å; Y107-L136 HydrophobicContact CE2-CD2 4.04Å; Y107-L136 HydrophobicContact CG-CD1 4.36Å; Y107-L136 HydrophobicContact CG-CD2 3.63Å; Y107-L136 HydrophobicContact CG-CG 4.45Å; Y107-F164 VanDerWaalsContact CA-CZ 3.49Å; Y107-F164 HydrophobicContact CD2-CB 4.37Å; Y107-F164 HydrophobicContact CD2-CD1 4.11Å; Y107-F164 AromaticContact CD2-CD2 3.74Å; Y107-F164 HydrophobicContact CD2-CD2 3.74Å; Y107-F164 HydrophobicContact CD2-CE1 4.22Å; Y107-F164 AromaticContact CD2-CE2 3.87Å; Y107-F164 HydrophobicContact CD2-CE2 3.87Å; Y107-F164 AromaticContact CD2-CG 3.83Å; Y107-F164 HydrophobicContact CD2-CG 3.83Å; Y107-F164 HydrophobicContact CD2-CZ 4.08Å; Y107-F164 HydrophobicContact CE2-CD2 4.44Å; Y107-F164 HydrophobicContact CG-CE1 4.41Å; Y107-F164 HydrophobicContact CG-CZ 4.41Å; Y107-K169 HydrophobicContact CE1-CB 4.21Å; Y107-K169 HydrophobicContact CE1-CD 4.02Å; Y107-K169 HydrophobicContact CE1-CG 3.88Å; Y107-K169 PolarHBondContact OH-N 3.04Å; Y107-H254 AromaticContact CE1-ND1 3.85Å; Y107-H254 AromaticContact CZ-ND1 3.75Å; Y107-H254 WeakPolarHBondContact OH-CA 3.4Å; Y107-H254 WeakPolarHBondContact OH-CB 3.3Å; Y107-H254 PolarHBondContact OH-ND1 2.83Å; Y107-H254 PolarHBondContact OH-O 3.11Å; Y107-H254 VanDerWaalsContact OH-O 3.09Å; Y107-T256 HydrophobicContact CE2-CG2 3.86Å
108	P	87.8	Confident	85.8	Confident	27 Å²	27	52.3 Å²	52.3	18%	0.175	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	123.8	-166.1	-24.3	30.4	0	0	0	114	K169 K253	P108-K169 WeakPolarHBondContact O-CE 3.18Å; P108-K169 PolarHBondContact O-NZ 2.75Å; P108-K253 HydrophobicContact CB-CD 4.03Å; P108-K253 WeakPolarHBondContact CD-O 3.42Å; P108-K253 HydrophobicContact CG-CB 3.86Å; P108-K253 HydrophobicContact CG-CD 3.61Å; P108-K253 HydrophobicContact CG-CG 3.75Å
109	G	85.7	Confident	87.5	Confident	65 Å²	65	55.9 Å²	55.9	67%	0.67	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	23.2	-178	0	0	0	0	0	114.3	Y107	Y107-G109 PolarHBondContact O-N 3.2Å
110	T	86.8	Confident	88.7	Confident	20 Å²	20	62.9 Å²	62.9	12%	0.123	31%	0.313	C	S	.	.	S	Bend	trans	-137	177.6	170.5	74.1	0	0	0	0	109.1	R106 Y107 L112	R106-T110 VanDerWaalsContact CD-O 3.3Å; R106-T110 WeakPolarHBondContact CD-O 3.37Å; Y107-T110 WeakPolarHBondContact CB-OG1 3.19Å; Y107-T110 HydrophobicContact CD1-CG2 4Å; Y107-T110 PolarHBondContact O-N 2.98Å; Y107-T110 PolarHBondContact O-OG1 2.89Å; T110-L112 PolarHBondContact OG1-N 2.75Å
111	Q	87.3	Confident	89.2	Confident	33 Å²	33	59.1 Å²	59.1	15%	0.154	30%	0.296	C	S	.	.			trans	-101.6	8.9	169.9	-67.5	164.9	-11.1	0	0	112.3	E61 Y66 P113 F139	E61-Q111 PolarHBondContact OE1-NE2 2.85Å; E61-Q111 VanDerWaalsContact OE1-NE2 3.15Å; Y66-Q111 PolarHBondContact OH-O 2.9Å; Q111-P113 WeakPolarHBondContact O-CD 3.31Å; Q111-F139 HydrophobicContact CB-CE1 4.07Å; Q111-F139 VanDerWaalsContact O-CE1 3.31Å; Q111-F139 WeakPolarHBondContact O-CE1 3.37Å; Q111-F139 WeakPolarHBondContact O-CZ 3.41Å
112	L	88.7	Confident	89.4	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-66.3	121.9	179.5	-177.9	82.7	0	0	0	110	R106 Y107 T110 A134 L136 F139 F164	R106-L112 CarbonylContact C-O 3.48Å; R106-L112 WeakPolarHBondContact CA-O 3.28Å; R106-L112 WeakPolarHBondContact CB-O 3.47Å; Y107-L112 PolarHBondContact N-O 3.02Å; T110-L112 PolarHBondContact OG1-N 2.75Å; L112-A134 HydrophobicContact CD1-CB 3.44Å; L112-A134 VanDerWaalsContact CD1-CB 3.44Å; L112-A134 HydrophobicContact CD2-CB 4.38Å; L112-A134 HydrophobicContact CG-CB 3.97Å; L112-L136 HydrophobicContact CD2-CB 4.36Å; L112-L136 HydrophobicContact CD2-CD1 3.36Å; L112-L136 HydrophobicContact CD2-CD2 4.47Å; L112-L136 HydrophobicContact CD2-CG 3.46Å; L112-L136 VanDerWaalsContact CD2-CG 3.46Å; L112-F139 VanDerWaalsContact CA-CE1 3.49Å; L112-F139 HydrophobicContact CB-CD1 3.94Å; L112-F139 HydrophobicContact CB-CE1 4.25Å; L112-F139 HydrophobicContact CB-CG 4.28Å; L112-F139 HydrophobicContact CD1-CB 3.27Å; L112-F139 HydrophobicContact CD1-CD1 3.79Å; L112-F139 HydrophobicContact CD1-CD2 3.46Å; L112-F139 VanDerWaalsContact CD1-CD2 3.46Å; L112-F139 HydrophobicContact CD1-CE1 4.46Å; L112-F139 HydrophobicContact CD1-CE2 4.16Å; L112-F139 HydrophobicContact CD1-CG 3.23Å; L112-F139 HydrophobicContact CG-CG 4.36Å; L112-F164 HydrophobicContact CD2-CD1 3.71Å; L112-F164 HydrophobicContact CD2-CE1 4.33Å
113	P	91.4	Very high	89.6	Confident	26 Å²	26	64.4 Å²	64.4	17%	0.169	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-70.7	143.7	175.9	29.1	-34.1	0	0	0	112.3	Y66 I68 W105 Q111 A134	Y66-P113 HydrophobicContact CD2-CG 4.35Å; Y66-P113 HydrophobicContact CE2-CB 3.92Å; Y66-P113 HydrophobicContact CE2-CG 3.79Å; I68-P113 HydrophobicContact CD1-CB 3.78Å; I68-P113 HydrophobicContact CG1-CB 4.16Å; W105-P113 CarbonylContact O-C 3.48Å; W105-P113 VanDerWaalsContact O-CA 3.28Å; W105-P113 WeakPolarHBondContact O-CA 3.14Å; Q111-P113 WeakPolarHBondContact O-CD 3.31Å; P113-A134 HydrophobicContact CG-CB 4.29Å
114	Q	93.1	Very high	89.8	Confident	45 Å²	45	59.5 Å²	59.5	21%	0.21	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-88.1	129.1	171.6	-166.7	175.9	16.4	0	0	109.9	W105 Q116 T162 F164	W105-Q114 HydrophobicContact CB-CB 4.39Å; W105-Q114 PolarHBondContact O-N 3.29Å; Q114-Q116 VanDerWaalsContact CD-NE2 3.33Å; Q114-Q116 PolarHBondContact O-N 2.03Å; Q114-Q116 VanDerWaalsContact O-N 3.13Å; Q114-T162 PolarHBondContact NE2-O 3.18Å; Q114-F164 HydrophobicContact CB-CD1 4.2Å; Q114-F164 HydrophobicContact CB-CE1 3.34Å; Q114-F164 HydrophobicContact CB-CE2 4.05Å; Q114-F164 HydrophobicContact CB-CZ 3.27Å; Q114-F164 VanDerWaalsContact CD-CE2 3.49Å; Q114-F164 HydrophobicContact CG-CD1 4.21Å; Q114-F164 HydrophobicContact CG-CD2 4.12Å; Q114-F164 HydrophobicContact CG-CE1 3.68Å; Q114-F164 HydrophobicContact CG-CE2 3.57Å; Q114-F164 HydrophobicContact CG-CG 4.44Å; Q114-F164 HydrophobicContact CG-CZ 3.34Å
115	L	93.8	Very high	89.9	Confident	66 Å²	66	58.8 Å²	58.8	35%	0.346	30%	0.303	S	S	.	.			trans	-72.6	105.1	164.7	179.5	57.7	0	0	0	108.8	L117 Y131 P133 G163	L115-L117 VanDerWaalsContact O-CD1 3.29Å; L115-L117 WeakPolarHBondContact O-CD1 3.4Å; L115-Y131 HydrophobicContact CD2-CD2 3.61Å; L115-Y131 HydrophobicContact CD2-CE2 3.58Å; L115-Y131 HydrophobicContact CG-CE2 4.21Å; L115-P133 HydrophobicContact CB-CB 4.19Å; L115-P133 HydrophobicContact CD2-CB 4.5Å; L115-G163 PolarHBondContact N-O 3.21Å; L115-G163 VanDerWaalsContact O-CA 3.25Å; L115-G163 WeakPolarHBondContact O-CA 3.19Å
116	Q	92.2	Very high	89.9	Confident	64 Å²	64	57.9 Å²	57.9	30%	0.299	30%	0.303	S	S	.	.			trans	-68.6	134.8	180	-65.8	-59.8	-49.5	0	0	111.2	W105 Q114	W105-Q116 HydrophobicContact CB-CG 4.49Å; W105-Q116 HydrophobicContact CD2-CG 3.33Å; W105-Q116 VanDerWaalsContact CE2-CG 3.46Å; W105-Q116 HydrophobicContact CE3-CG 3.53Å; W105-Q116 HydrophobicContact CG-CG 3.76Å; W105-Q116 HydrophobicContact CH2-CG 4.01Å; W105-Q116 HydrophobicContact CZ2-CG 3.84Å; W105-Q116 HydrophobicContact CZ3-CG 3.85Å; Q114-Q116 VanDerWaalsContact CD-NE2 3.33Å; Q114-Q116 PolarHBondContact O-N 2.03Å; Q114-Q116 VanDerWaalsContact O-N 3.13Å
117	L	90.3	Very high	89.9	Confident	18 Å²	18	62.7 Å²	62.7	9%	0.094	33%	0.327	C	S	.	.			trans	-122.5	137.8	172.7	-57.4	104.5	0	0	0	110	L115 L121 R122 Y131 R161	L115-L117 VanDerWaalsContact O-CD1 3.29Å; L115-L117 WeakPolarHBondContact O-CD1 3.4Å; L117-L121 HydrophobicContact CB-CB 4.44Å; L117-L121 HydrophobicContact CD2-CB 4.17Å; L117-R122 HydrophobicContact CB-CG 4.16Å; L117-Y131 HydrophobicContact CD1-CE2 3.77Å; L117-Y131 HydrophobicContact CD2-CD2 3.8Å; L117-Y131 HydrophobicContact CD2-CE2 3.64Å; L117-Y131 HydrophobicContact CG-CE2 4.04Å; L117-R161 HydrophobicContact CD1-CB 4.24Å; L117-R161 HydrophobicContact CD2-CB 4.12Å
118	P	89.5	Confident	89.7	Confident	62 Å²	62	64.8 Å²	64.8	40%	0.403	34%	0.34	S	S	.	.			trans	-53.8	145.3	159.4	-22.2	32.9	0	0	0	110.8	Y120 L121 R122	P118-Y120 HydrophobicContact CB-CD1 3.58Å; P118-Y120 HydrophobicContact CB-CE1 3.19Å; P118-Y120 HydrophobicContact CB-CG 4.46Å; P118-Y120 HydrophobicContact CG-CE1 3.92Å; P118-Y120 PolarHBondContact O-N 3.4Å; P118-Y120 VanDerWaalsContact O-N 3.13Å; P118-L121 HydrophobicContact CG-CD1 4.37Å; P118-L121 PolarHBondContact O-N 2.85Å; P118-R122 PolarHBondContact O-N 2.83Å
119	D	87.4	Confident	89.5	Confident	122 Å²	122	69.6 Å²	69.6	65%	0.652	36%	0.363	S	S	*	.	H	α-helix	trans	-56.8	-35.6	-173.7	-69.1	-21.3	0	0	0	113.3	L121 R122	D119-L121 PolarHBondContact O-N 2.9Å; D119-R122 WeakPolarHBondContact O-CB 3.28Å; D119-R122 PolarHBondContact O-N 3.39Å; D119-R122 VanDerWaalsContact O-N 3.15Å; D119-R122 IonicContact OD1-CZ 3.48Å; D119-R122 IonicContact OD1-NE 3.28Å; D119-R122 PolarHBondContact OD1-NE 2.83Å; D119-R122 VanDerWaalsContact OD1-NE 3.11Å; D119-R122 IonicContact OD1-NH2 2.72Å
120	Y	88.9	Confident	89.4	Confident	172 Å²	172	70.2 Å²	70.2	68%	0.675	35%	0.346	S	S	*	.	H	α-helix	trans	-67.1	-17.6	177.5	69.4	-92.5	0	0	0	114.1	P118 A126	P118-Y120 HydrophobicContact CB-CD1 3.58Å; P118-Y120 HydrophobicContact CB-CE1 3.19Å; P118-Y120 HydrophobicContact CB-CG 4.46Å; P118-Y120 HydrophobicContact CG-CE1 3.92Å; P118-Y120 PolarHBondContact O-N 3.4Å; P118-Y120 VanDerWaalsContact O-N 3.13Å; Y120-A126 VanDerWaalsContact O-CB 3.32Å; Y120-A126 WeakPolarHBondContact O-CB 3.47Å
121	L	92.1	Very high	89.6	Confident	37 Å²	37	71.4 Å²	71.4	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-97.3	-7.8	175.5	-63.1	-174.5	0	0	0	113.4	L117 P118 D119 A126 V128 R161	L117-L121 HydrophobicContact CB-CB 4.44Å; L117-L121 HydrophobicContact CD2-CB 4.17Å; P118-L121 HydrophobicContact CG-CD1 4.37Å; P118-L121 PolarHBondContact O-N 2.85Å; D119-L121 PolarHBondContact O-N 2.9Å; L121-A126 HydrophobicContact CD2-CB 4.18Å; L121-V128 HydrophobicContact CB-CG2 4.32Å; L121-V128 HydrophobicContact CD2-CG2 4.23Å; L121-R161 PolarHBondContact O-NH1 2.73Å; L121-R161 VanDerWaalsContact O-NH1 3.08Å
122	R	91.9	Very high	89.7	Confident	82 Å²	82	74.6 Å²	74.6	31%	0.309	36%	0.363	S	S	.	.	H	α-helix	trans	-66.9	-39.6	177	-67.7	-174.8	-176	-149.4	4.4	111.4	L117 P118 D119 R124 E160 R161	L117-R122 HydrophobicContact CB-CG 4.16Å; P118-R122 PolarHBondContact O-N 2.83Å; D119-R122 WeakPolarHBondContact O-CB 3.28Å; D119-R122 PolarHBondContact O-N 3.39Å; D119-R122 VanDerWaalsContact O-N 3.15Å; D119-R122 IonicContact OD1-CZ 3.48Å; D119-R122 IonicContact OD1-NE 3.28Å; D119-R122 PolarHBondContact OD1-NE 2.83Å; D119-R122 VanDerWaalsContact OD1-NE 3.11Å; D119-R122 IonicContact OD1-NH2 2.72Å; R122-R124 PolarHBondContact O-N 2.81Å; R122-E160 HydrophobicContact CB-CB 4.33Å; R122-E160 CarbonylContact O-C 3.56Å; R122-E160 WeakPolarHBondContact O-CA 3.3Å; R122-R161 PolarHBondContact O-N 2.81Å
123	S	91.5	Very high	89.8	Confident	48 Å²	48	75.6 Å²	75.6	34%	0.336	37%	0.37	S	S	.	.	S	Bend	trans	-56.7	134.2	176.9	171.8	0	0	0	0	111	D125 A126 R161	S123-D125 PolarHBondContact O-N 3.05Å; S123-D125 PolarHBondContact OG-N 3.33Å; S123-A126 VanDerWaalsContact O-CB 3.23Å; S123-A126 WeakPolarHBondContact O-CB 3.43Å; S123-A126 PolarHBondContact O-N 3.43Å; S123-R161 PolarHBondContact O-NH1 2.82Å
124	R	89.2	Confident	89.6	Confident	53 Å²	53	75.8 Å²	75.8	20%	0.2	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-28.4	176.6	-75.7	-64.7	-160.5	-165.9	-3.7	112.9	R122 A126 N157 T158 R161 D257	R122-R124 PolarHBondContact O-N 2.81Å; R124-A126 PolarHBondContact O-N 3.23Å; R124-N157 WeakPolarHBondContact CG-O 3.43Å; R124-N157 PolarHBondContact NE-O 3.21Å; R124-N157 PolarHBondContact NH2-O 3.03Å; R124-T158 WeakPolarHBondContact CG-O 2.98Å; R124-R161 PolarHBondContact O-NH2 3.24Å; R124-R161 VanDerWaalsContact O-NH2 3.15Å; R124-D257 IonicContact CZ-OD2 3.43Å; R124-D257 VanDerWaalsContact CZ-OD2 3.28Å; R124-D257 IonicContact NH1-OD2 2.75Å; R124-D257 PolarHBondContact NH1-OD2 3.13Å; R124-D257 PolarHBondContact NH2-O 3.03Å; R124-D257 IonicContact NH2-OD2 3.35Å; R124-D257 PolarHBondContact NH2-OD2 2.95Å
125	D	88.9	Confident	89.3	Confident	151 Å²	151	74.6 Å²	74.6	81%	0.807	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-17	178	-53.7	-39.7	0	0	0	112.9	S123 K127	S123-D125 PolarHBondContact O-N 3.05Å; S123-D125 PolarHBondContact OG-N 3.33Å; D125-K127 PolarHBondContact O-N 3.36Å
126	A	91.2	Very high	89	Confident	19 Å²	19	71.9 Å²	71.9	16%	0.157	35%	0.354	C	S	.	.	S	Bend	trans	-67.5	132.2	175.2	0	0	0	0	0	110.7	Y120 L121 S123 R124 V128 R161	Y120-A126 VanDerWaalsContact O-CB 3.32Å; Y120-A126 WeakPolarHBondContact O-CB 3.47Å; L121-A126 HydrophobicContact CD2-CB 4.18Å; S123-A126 VanDerWaalsContact O-CB 3.23Å; S123-A126 WeakPolarHBondContact O-CB 3.43Å; S123-A126 PolarHBondContact O-N 3.43Å; R124-A126 PolarHBondContact O-N 3.23Å; A126-V128 PolarHBondContact O-N 2.95Å; A126-R161 PolarHBondContact O-NH1 2.78Å; A126-R161 PolarHBondContact O-NH2 3.15Å
127	K	89.1	Confident	88.4	Confident	205 Å²	205	72.4 Å²	72.4	89%	0.891	36%	0.357	S	S	*	.			trans	-75.1	117.1	172.8	-64.8	-175.3	-179.1	-178.4	0	109.1	D125	D125-K127 PolarHBondContact O-N 3.36Å
128	V	87	Confident	87.6	Confident	45 Å²	45	73.8 Å²	73.8	27%	0.273	37%	0.368	S	S	.	.			trans	-117.1	130.2	175.9	-172.2	0	0	0	0	108	L121 A126 W130	L121-V128 HydrophobicContact CB-CG2 4.32Å; L121-V128 HydrophobicContact CD2-CG2 4.23Å; A126-V128 PolarHBondContact O-N 2.95Å; V128-W130 WeakPolarHBondContact CG1-O 3.05Å
129	L	83.3	Confident	86.7	Confident	127 Å²	127	72.3 Å²	72.3	67%	0.665	36%	0.355	S	S	*	.	S	Bend	trans	-61.9	-46.3	-179.8	-70.3	176.2	0	0	0	111.8	I45	I45-L129 HydrophobicContact CD1-CD1 4.09Å; I45-L129 HydrophobicContact CD1-CD2 3.83Å; I45-L129 HydrophobicContact CD1-CG 4.45Å
130	W	84.3	Confident	85.5	Confident	78 Å²	78	70.5 Å²	70.5	30%	0.295	35%	0.346	S	S	.	.			trans	-149.6	133.7	179.4	175.6	59.1	0	0	0	109.8	F37 F38 R41 L42 V128 E132	F37-W130 AromaticContact CE1-CH2 3.24Å; F37-W130 HydrophobicContact CE1-CH2 3.24Å; F37-W130 AromaticContact CE1-CZ2 3.8Å; F37-W130 HydrophobicContact CE1-CZ2 3.8Å; F37-W130 AromaticContact CE1-CZ3 3.84Å; F37-W130 HydrophobicContact CE1-CZ3 3.84Å; F37-W130 AromaticContact CZ-CH2 3.52Å; F37-W130 HydrophobicContact CZ-CH2 3.52Å; F37-W130 AromaticContact CZ-CZ2 3.6Å; F37-W130 HydrophobicContact CZ-CZ2 3.6Å; F37-W130 HydrophobicContact CZ-CZ3 4.48Å; F38-W130 HydrophobicContact CD1-CZ3 4.29Å; F38-W130 HydrophobicContact CE1-CZ3 4.02Å; R41-W130 HydrophobicContact CG-CD2 3.89Å; R41-W130 HydrophobicContact CG-CG 4.2Å; R41-W130 HydrophobicContact CG-CZ2 3.97Å; L42-W130 HydrophobicContact CD2-CB 3.94Å; V128-W130 WeakPolarHBondContact CG1-O 3.05Å; W130-E132 HydrophobicContact CZ2-CB 3.65Å; W130-E132 HydrophobicContact CZ2-CG 4.44Å; W130-E132 WeakPolarHBondContact CZ2-OE2 3.05Å; W130-E132 PolarHBondContact NE1-OE2 3.38Å
131	Y	90.7	Very high	83.6	Confident	46 Å²	46	64.1 Å²	64.1	18%	0.18	33%	0.332	C	S	.	.			trans	-147.5	110.1	-178.3	179.5	-105.3	0	0	0	110.1	L115 L117 P133 R161 G163 D257	L115-Y131 HydrophobicContact CD2-CD2 3.61Å; L115-Y131 HydrophobicContact CD2-CE2 3.58Å; L115-Y131 HydrophobicContact CG-CE2 4.21Å; L117-Y131 HydrophobicContact CD1-CE2 3.77Å; L117-Y131 HydrophobicContact CD2-CD2 3.8Å; L117-Y131 HydrophobicContact CD2-CE2 3.64Å; L117-Y131 HydrophobicContact CG-CE2 4.04Å; Y131-P133 HydrophobicContact CE1-CG 3.72Å; Y131-R161 HydrophobicContact CD1-CG 4.33Å; Y131-R161 HydrophobicContact CE1-CB 4.09Å; Y131-R161 HydrophobicContact CE1-CG 3.93Å; Y131-R161 HydrophobicContact CE2-CB 4.23Å; Y131-G163 WeakPolarHBondContact OH-CA 3.27Å; Y131-G163 PolarHBondContact OH-N 3.38Å; Y131-D257 WeakPolarHBondContact CE1-OD2 3.49Å; Y131-D257 PolarHBondContact OH-OD1 2.74Å
132	E	88.8	Confident	81.2	Confident	99 Å²	99	72.9 Å²	72.9	46%	0.463	36%	0.364	S	S	.	.			trans	-143.6	84.3	-176	-168.4	161.2	-168.6	0	0	109.3	R41 W130	R41-E132 IonicContact CZ-OE2 2.93Å; R41-E132 IonicContact NE-OE2 3.77Å; R41-E132 PolarHBondContact NE-OE2 3.15Å; R41-E132 IonicContact NH2-OE1 3.05Å; R41-E132 PolarHBondContact NH2-OE1 2.79Å; R41-E132 IonicContact NH2-OE2 2.91Å; R41-E132 PolarHBondContact NH2-OE2 3.4Å; W130-E132 HydrophobicContact CZ2-CB 3.65Å; W130-E132 HydrophobicContact CZ2-CG 4.44Å; W130-E132 WeakPolarHBondContact CZ2-OE2 3.05Å; W130-E132 PolarHBondContact NE1-OE2 3.38Å
133	P	91.8	Very high	78.5	Confident	23 Å²	23	75 Å²	75	15%	0.149	38%	0.382	C	S	.	.			trans	-74.7	156.1	-179	31.3	-35.3	0	0	0	111.3	L115 Y131 G163	L115-P133 HydrophobicContact CB-CB 4.19Å; L115-P133 HydrophobicContact CD2-CB 4.5Å; Y131-P133 HydrophobicContact CE1-CG 3.72Å; P133-G163 VanDerWaalsContact CB-O 3.29Å; P133-G163 WeakPolarHBondContact CB-O 3.25Å
134	A	86.8	Confident	75.7	Confident	30 Å²	30	78.4 Å²	78.4	25%	0.248	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	146	173.6	0	0	0	0	0	110.8	L112 P113 S165	L112-A134 HydrophobicContact CD1-CB 3.44Å; L112-A134 VanDerWaalsContact CD1-CB 3.44Å; L112-A134 HydrophobicContact CD2-CB 4.38Å; L112-A134 HydrophobicContact CG-CB 3.97Å; P113-A134 HydrophobicContact CG-CB 4.29Å; A134-S165 PolarHBondContact O-N 3.45Å
135	N	87.4	Confident	73.1	Confident	20 Å²	20	85.9 Å²	85.9	11%	0.107	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.9	-172.1	172.3	-68.7	0	0	0	111.3	E137 S138 F139 W154 S165	N135-E137 PolarHBondContact O-N 3.48Å; N135-E137 PolarHBondContact OD1-N 3.35Å; N135-E137 VanDerWaalsContact OD1-N 3.08Å; N135-E137 PolarHBondContact OD1-OE2 3.13Å; N135-S138 WeakPolarHBondContact CB-OG 3.25Å; N135-S138 PolarHBondContact O-N 3.02Å; N135-S138 PolarHBondContact O-OG 3.33Å; N135-S138 PolarHBondContact OD1-N 2.85Å; N135-S138 PolarHBondContact OD1-OG 2.97Å; N135-F139 WeakPolarHBondContact O-CB 3.4Å; N135-F139 PolarHBondContact O-N 2.52Å; N135-F139 VanDerWaalsContact O-N 3.07Å; N135-W154 WeakPolarHBondContact ND2-CH2 3.13Å; N135-W154 WeakPolarHBondContact ND2-CZ3 3.14Å; N135-S165 WeakPolarHBondContact CA-O 3.41Å
136	L	86.6	Confident	70.6	Confident	8 Å²	8	83.7 Å²	83.7	4%	0.042	43%	0.43	C	S	.	.	H	α-helix	trans	-62.9	-39.6	-173.9	-87	97.6	0	0	0	113.6	Y107 L112 F164 S165 T256	Y107-L136 HydrophobicContact CD1-CD2 3.49Å; Y107-L136 VanDerWaalsContact CD1-CD2 3.49Å; Y107-L136 HydrophobicContact CD2-CD1 4.04Å; Y107-L136 HydrophobicContact CD2-CD2 3.92Å; Y107-L136 HydrophobicContact CE1-CD2 3.61Å; Y107-L136 HydrophobicContact CE2-CD1 4.34Å; Y107-L136 HydrophobicContact CE2-CD2 4.04Å; Y107-L136 HydrophobicContact CG-CD1 4.36Å; Y107-L136 HydrophobicContact CG-CD2 3.63Å; Y107-L136 HydrophobicContact CG-CG 4.45Å; L112-L136 HydrophobicContact CD2-CB 4.36Å; L112-L136 HydrophobicContact CD2-CD1 3.36Å; L112-L136 HydrophobicContact CD2-CD2 4.47Å; L112-L136 HydrophobicContact CD2-CG 3.46Å; L112-L136 VanDerWaalsContact CD2-CG 3.46Å; L136-F164 HydrophobicContact CD1-CB 3.89Å; L136-S165 WeakPolarHBondContact CD1-O 3.19Å; L136-S165 PolarHBondContact N-O 3.42Å; L136-T256 HydrophobicContact CD1-CG2 4.13Å
137	E	79.4	Confident	68.1	Low	75 Å²	75	92.8 Å²	92.8	35%	0.35	46%	0.461	S	S	.	.	H	α-helix	trans	-71.4	-33.5	-176.5	-65	69	-150.6	0	0	111.6	N135 W154 G166 M167	N135-E137 PolarHBondContact O-N 3.48Å; N135-E137 PolarHBondContact OD1-N 3.35Å; N135-E137 VanDerWaalsContact OD1-N 3.08Å; N135-E137 PolarHBondContact OD1-OE2 3.13Å; E137-W154 WeakPolarHBondContact OE2-CH2 3.47Å; E137-G166 VanDerWaalsContact CD-CA 3.5Å; E137-G166 VanDerWaalsContact OE1-CA 3.31Å; E137-G166 WeakPolarHBondContact OE1-CA 3.4Å; E137-G166 WeakPolarHBondContact OE2-CA 3.45Å; E137-M167 PolarHBondContact OE1-N 3.07Å
138	S	73.5	Confident	66	Low	47 Å²	47	92.1 Å²	92.1	33%	0.329	46%	0.461	S	S	.	.	H	α-helix	trans	-83.4	-28.5	179.4	68.7	0	0	0	0	113.6	N135	N135-S138 WeakPolarHBondContact CB-OG 3.25Å; N135-S138 PolarHBondContact O-N 3.02Å; N135-S138 PolarHBondContact O-OG 3.33Å; N135-S138 PolarHBondContact OD1-N 2.85Å; N135-S138 PolarHBondContact OD1-OG 2.97Å
139	F	71.3	Confident	64.4	Low	31 Å²	31	93 Å²	93	14%	0.136	47%	0.466	C	S	.	.	H	α-helix	trans	-77.4	-34	-175.3	-164.5	-94.1	0	0	0	113	H60 R63 Y66 Q111 L112 N135 G141	H60-F139 AromaticContact CD2-CE1 3.73Å; H60-F139 AromaticContact CD2-CZ 3.42Å; H60-F139 VanDerWaalsContact CD2-CZ 3.42Å; H60-F139 WeakPolarHBondContact CD2-CZ 3.49Å; H60-F139 AromaticContact NE2-CD1 3.84Å; H60-F139 AromaticContact NE2-CE1 3.41Å; H60-F139 WeakPolarHBondContact NE2-CE1 3.3Å; H60-F139 AromaticContact NE2-CE2 3.93Å; H60-F139 AromaticContact NE2-CZ 3.48Å; H60-F139 WeakPolarHBondContact NE2-CZ 3.33Å; R63-F139 PolarHBondContact NH1-O 2.94Å; Y66-F139 HydrophobicContact CD1-CZ 4.33Å; Y66-F139 AromaticContact CE1-CZ 3.97Å; Y66-F139 HydrophobicContact CE1-CZ 3.97Å; Q111-F139 HydrophobicContact CB-CE1 4.07Å; Q111-F139 VanDerWaalsContact O-CE1 3.31Å; Q111-F139 WeakPolarHBondContact O-CE1 3.37Å; Q111-F139 WeakPolarHBondContact O-CZ 3.41Å; L112-F139 VanDerWaalsContact CA-CE1 3.49Å; L112-F139 HydrophobicContact CB-CD1 3.94Å; L112-F139 HydrophobicContact CB-CE1 4.25Å; L112-F139 HydrophobicContact CB-CG 4.28Å; L112-F139 HydrophobicContact CD1-CB 3.27Å; L112-F139 HydrophobicContact CD1-CD1 3.79Å; L112-F139 HydrophobicContact CD1-CD2 3.46Å; L112-F139 VanDerWaalsContact CD1-CD2 3.46Å; L112-F139 HydrophobicContact CD1-CE1 4.46Å; L112-F139 HydrophobicContact CD1-CE2 4.16Å; L112-F139 HydrophobicContact CD1-CG 3.23Å; L112-F139 HydrophobicContact CG-CG 4.36Å; N135-F139 WeakPolarHBondContact O-CB 3.4Å; N135-F139 PolarHBondContact O-N 2.52Å; N135-F139 VanDerWaalsContact O-N 3.07Å; F139-G141 PolarHBondContact O-N 3.46Å
140	N	61	Low	63	Low	85 Å²	85	90 Å²	90	46%	0.455	46%	0.46	S	S	.	.	S	Bend	trans	-75.3	37	-175.9	-81.6	-11.7	0	0	0	115.3	Y142	N140-Y142 VanDerWaalsContact C-N 3.3Å; N140-Y142 WeakPolarHBondContact O-CD2 3.35Å; N140-Y142 PolarHBondContact O-N 3.13Å
141	G	49.3	Very low	62	Low	38 Å²	38	89.3 Å²	89.3	39%	0.392	46%	0.464	S	S	.	.	S	Bend	trans	83.3	-32.4	149.1	0	0	0	0	0	118.1	R63 F139 N143	R63-G141 VanDerWaalsContact NH2-CA 3.31Å; R63-G141 PolarHBondContact NH2-O 2.76Å; F139-G141 PolarHBondContact O-N 3.46Å; G141-N143 VanDerWaalsContact C-N 3.28Å; G141-N143 PolarHBondContact O-N 2.75Å; G141-N143 VanDerWaalsContact O-N 3.17Å
142	Y	43	Very low	60.6	Low	220 Å²	220	92.4 Å²	92.4	86%	0.863	49%	0.488	S	S	*	.	S	Bend	trans	-74.2	-9.3	-165.3	-79.3	-74	0	0	0	116.3	N140	N140-Y142 VanDerWaalsContact C-N 3.3Å; N140-Y142 WeakPolarHBondContact O-CD2 3.35Å; N140-Y142 PolarHBondContact O-N 3.13Å
143	N	35.1	Very low	59.9	Low	127 Å²	127	98.4 Å²	98.4	68%	0.679	51%	0.506	S	S	*	.			trans	-133.8	113.9	171.4	-70.1	-51.9	0	0	0	110.4	G141 R145	G141-N143 VanDerWaalsContact C-N 3.28Å; G141-N143 PolarHBondContact O-N 2.75Å; G141-N143 VanDerWaalsContact O-N 3.17Å; N143-R145 PolarHBondContact O-N 3.21Å
144	S	33	Very low	59.5	Low	120 Å²	120	99.1 Å²	99.1	84%	0.839	51%	0.506	S	S	*	.	S	Bend	trans	-71.8	23.4	177.1	51.5	0	0	0	0	114.1
145	R	34.1	Very low	59.6	Low	209 Å²	209	102 Å²	102	79%	0.789	52%	0.517	S	S	*	.	S	Bend	trans	-137.4	118.3	163.3	-65.5	-175.6	-178.1	-174.5	-0.2	104.5	N143 R147	N143-R145 PolarHBondContact O-N 3.21Å; R145-R147 PolarHBondContact O-N 2.81Å
146	S	36.4	Very low	59.8	Low	105 Å²	105	108.7 Å²	108.7	73%	0.734	54%	0.54	S	S	*	.			trans	-55.8	82.4	157	49.6	0	0	0	0	106.5	E148	S146-E148 VanDerWaalsContact C-N 3.31Å; S146-E148 PolarHBondContact O-N 3.12Å
147	R	38.4	Very low	60.1	Low	210 Å²	210	108.3 Å²	108.3	79%	0.792	54%	0.538	S	S	*	.			trans	-55.6	113.6	154.6	-87	-177.2	165.1	173.1	-3.8	102	R145 V149	R145-R147 PolarHBondContact O-N 2.81Å; R147-V149 PolarHBondContact O-N 3.43Å
148	E	45.1	Very low	60.7	Low	191 Å²	191	109 Å²	109	89%	0.893	55%	0.548	S	S	*	.			trans	-49.5	94	160.1	-73.5	179	155	0	0	105.3	S146 A150	S146-E148 VanDerWaalsContact C-N 3.31Å; S146-E148 PolarHBondContact O-N 3.12Å; E148-A150 PolarHBondContact O-N 3.33Å; E148-A150 VanDerWaalsContact O-N 3.14Å
149	V	52.5	Low	61.5	Low	63 Å²	63	108.4 Å²	108.4	38%	0.382	54%	0.539	S	S	.	.			trans	-65.2	121.3	170.6	-176.2	0	0	0	0	102.5	R147 T151 W154	R147-V149 PolarHBondContact O-N 3.43Å; V149-T151 VanDerWaalsContact O-CG2 3.24Å; V149-T151 WeakPolarHBondContact O-CG2 3.32Å; V149-T151 PolarHBondContact O-N 2.89Å; V149-W154 HydrophobicContact CB-CZ2 4.12Å; V149-W154 HydrophobicContact CG1-CH2 4.28Å; V149-W154 HydrophobicContact CG1-CZ2 3.38Å
150	A	53.9	Low	62.6	Low	65 Å²	65	107.8 Å²	107.8	54%	0.537	54%	0.536	S	S	.	.			trans	-62.7	86.2	179.8	0	0	0	0	0	109	E148 T152	E148-A150 PolarHBondContact O-N 3.33Å; E148-A150 VanDerWaalsContact O-N 3.14Å; A150-T152 PolarHBondContact O-N 3.39Å
151	T	63.3	Low	64.2	Low	63 Å²	63	105.1 Å²	105.1	39%	0.387	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-72.2	-10.3	-176.3	57.4	0	0	0	0	111.6	V149 R153 W154	V149-T151 VanDerWaalsContact O-CG2 3.24Å; V149-T151 WeakPolarHBondContact O-CG2 3.32Å; V149-T151 PolarHBondContact O-N 2.89Å; T151-R153 PolarHBondContact O-N 3.32Å; T151-W154 HydrophobicContact CG2-CD2 4.08Å; T151-W154 HydrophobicContact CG2-CE3 3.74Å; T151-W154 HydrophobicContact CG2-CH2 4.26Å; T151-W154 HydrophobicContact CG2-CZ3 3.84Å; T151-W154 WeakPolarHBondContact O-CB 3.35Å; T151-W154 PolarHBondContact O-N 3.29Å
152	T	62.7	Low	66.4	Low	111 Å²	111	103.8 Å²	103.8	68%	0.681	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-59.5	-26.7	178.8	54.2	0	0	0	0	113	A150	A150-T152 PolarHBondContact O-N 3.39Å
153	R	74.2	Confident	68.8	Low	226 Å²	226	93.3 Å²	93.3	85%	0.853	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-94.2	-3.1	178.3	-62.6	-173.6	-179	-174	0.4	114	T151	T151-R153 PolarHBondContact O-N 3.32Å
154	W	82.2	Confident	71.6	Confident	37 Å²	37	87.5 Å²	87.5	14%	0.14	43%	0.432	C	S	.	.	S	Bend	trans	-73.6	136.4	-178.4	-67.9	-2.4	0	0	0	110.4	N135 E137 V149 T151 R156 S165 Y173 N258	N135-W154 WeakPolarHBondContact ND2-CH2 3.13Å; N135-W154 WeakPolarHBondContact ND2-CZ3 3.14Å; E137-W154 WeakPolarHBondContact OE2-CH2 3.47Å; V149-W154 HydrophobicContact CB-CZ2 4.12Å; V149-W154 HydrophobicContact CG1-CH2 4.28Å; V149-W154 HydrophobicContact CG1-CZ2 3.38Å; T151-W154 HydrophobicContact CG2-CD2 4.08Å; T151-W154 HydrophobicContact CG2-CE3 3.74Å; T151-W154 HydrophobicContact CG2-CH2 4.26Å; T151-W154 HydrophobicContact CG2-CZ3 3.84Å; T151-W154 WeakPolarHBondContact O-CB 3.35Å; T151-W154 PolarHBondContact O-N 3.29Å; W154-R156 PolarHBondContact O-N 3.5Å; W154-S165 WeakPolarHBondContact CZ3-OG 3.25Å; W154-Y173 HydrophobicContact CD2-CE1 4.16Å; W154-Y173 HydrophobicContact CE3-CE1 4.39Å; W154-Y173 HydrophobicContact CG-CE1 4.46Å; W154-Y173 HydrophobicContact CZ2-CE1 4.45Å; W154-Y173 WeakPolarHBondContact CZ2-OH 3.17Å; W154-N258 WeakPolarHBondContact CB-ND2 3.49Å; W154-N258 HydrophobicContact CE3-CB 4.36Å
155	I	88.8	Confident	74.4	Confident	92 Å²	92	82.5 Å²	82.5	47%	0.472	40%	0.397	S	S	.	.			trans	-54.8	136.8	169.7	-60.5	173.9	0	0	0	107.6	N258 W260	I155-N258 VanDerWaalsContact O-CA 3.25Å; I155-N258 WeakPolarHBondContact O-CA 3.29Å; I155-N258 WeakPolarHBondContact O-CB 3.38Å; I155-N258 PolarHBondContact O-ND2 3.47Å; I155-W260 HydrophobicContact CG2-CH2 3.66Å; I155-W260 HydrophobicContact CG2-CZ3 4.01Å
156	R	91.5	Very high	77.1	Confident	159 Å²	159	72.5 Å²	72.5	60%	0.6	36%	0.359	S	S	*	.			trans	-108.7	134.3	-178.3	-66	-177.3	179.6	-176.5	-1.9	110	W154 T158 D257 W260	W154-R156 PolarHBondContact O-N 3.5Å; R156-T158 PolarHBondContact O-N 2.82Å; R156-T158 VanDerWaalsContact O-N 3.08Å; R156-D257 CarbonylContact C-O 3.55Å; R156-D257 WeakPolarHBondContact CA-O 3.38Å; R156-W260 VanDerWaalsContact C-CZ3 3.47Å; R156-W260 VanDerWaalsContact O-CH2 3.24Å; R156-W260 WeakPolarHBondContact O-CH2 3.3Å
157	N	93.7	Very high	79.7	Confident	0 Å²	0	70 Å²	70	0%	0	34%	0.336	C	S	.	.			trans	-61.1	109.1	167.9	-175.2	-18.9	0	0	0	108.5	R124 Y159 E160 Y249 T256 D257 W260	R124-N157 WeakPolarHBondContact CG-O 3.43Å; R124-N157 PolarHBondContact NE-O 3.21Å; R124-N157 PolarHBondContact NH2-O 3.03Å; N157-Y159 VanDerWaalsContact C-N 3.28Å; N157-Y159 WeakPolarHBondContact OD1-CB 3.44Å; N157-Y159 PolarHBondContact OD1-N 3.08Å; N157-E160 PolarHBondContact OD1-N 3.37Å; N157-Y249 WeakPolarHBondContact ND2-CE2 3.33Å; N157-Y249 PolarHBondContact ND2-OH 3.34Å; N157-Y249 VanDerWaalsContact ND2-OH 3.08Å; N157-Y249 WeakPolarHBondContact OD1-CE2 3.46Å; N157-T256 PolarHBondContact ND2-O 2.97Å; N157-T256 VanDerWaalsContact ND2-O 3.12Å; N157-D257 PolarHBondContact N-O 2.8Å; N157-W260 VanDerWaalsContact CA-CE3 3.49Å; N157-W260 HydrophobicContact CB-CD2 4.08Å; N157-W260 HydrophobicContact CB-CE3 3.48Å; N157-W260 VanDerWaalsContact CB-CE3 3.48Å; N157-W260 HydrophobicContact CB-CZ3 3.77Å
158	T	90.9	Very high	82.2	Confident	91 Å²	91	61.2 Å²	61.2	56%	0.558	31%	0.311	S	S	*	.	S	Bend	trans	-77	-17.2	-176.9	49.7	0	0	0	0	112.6	R124 R156	R124-T158 WeakPolarHBondContact CG-O 2.98Å; R156-T158 PolarHBondContact O-N 2.82Å; R156-T158 VanDerWaalsContact O-N 3.08Å
159	Y	92	Very high	84.3	Confident	34 Å²	34	57.5 Å²	57.5	13%	0.133	29%	0.292	C	S	.	.	S	Bend	trans	-82.9	-44.5	-176.4	-61.5	-92.9	0	0	0	112.4	N157 Y249 W260 E262 I311 M313	N157-Y159 VanDerWaalsContact C-N 3.28Å; N157-Y159 WeakPolarHBondContact OD1-CB 3.44Å; N157-Y159 PolarHBondContact OD1-N 3.08Å; Y159-Y249 VanDerWaalsContact CD1-CB 3.49Å; Y159-Y249 HydrophobicContact CD1-CD2 4.15Å; Y159-Y249 AromaticContact CD1-CG 3.91Å; Y159-Y249 HydrophobicContact CD1-CG 3.91Å; Y159-Y249 AromaticContact CD2-CD2 3.2Å; Y159-Y249 HydrophobicContact CD2-CD2 3.2Å; Y159-Y249 AromaticContact CD2-CE2 3.88Å; Y159-Y249 HydrophobicContact CD2-CE2 3.88Å; Y159-Y249 AromaticContact CD2-CG 3.84Å; Y159-Y249 HydrophobicContact CD2-CG 3.84Å; Y159-Y249 VanDerWaalsContact CE1-CB 3.45Å; Y159-Y249 HydrophobicContact CE1-CG 4.31Å; Y159-Y249 AromaticContact CE2-CD2 3.73Å; Y159-Y249 HydrophobicContact CE2-CD2 3.73Å; Y159-Y249 HydrophobicContact CE2-CG 4.25Å; Y159-Y249 HydrophobicContact CG-CD1 4.46Å; Y159-Y249 AromaticContact CG-CD2 3.44Å; Y159-Y249 HydrophobicContact CG-CD2 3.44Å; Y159-Y249 VanDerWaalsContact CG-CD2 3.44Å; Y159-Y249 HydrophobicContact CG-CE2 4.09Å; Y159-Y249 AromaticContact CG-CG 3.63Å; Y159-Y249 HydrophobicContact CG-CG 3.63Å; Y159-W260 AromaticContact CE2-NE1 3.88Å; Y159-E262 WeakPolarHBondContact CE2-OE1 3.25Å; Y159-E262 PolarHBondContact OH-OE1 2.88Å; Y159-I311 HydrophobicContact CD1-CG2 4.36Å; Y159-M313 HydrophobicContact CD1-CG 4.05Å; Y159-M313 HydrophobicContact CE1-CE 3.58Å; Y159-M313 HydrophobicContact CE1-CG 3.36Å; Y159-M313 HydrophobicContact CE1-SD 4.25Å; Y159-M313 HydrophobicContact CE2-CE 4.02Å; Y159-M313 WeakPolarHBondContact OH-CE 3.28Å
160	E	93.6	Very high	86.2	Confident	17 Å²	17	54.8 Å²	54.8	8%	0.079	28%	0.275	C	S	.	.			trans	-153.3	159.4	-177.4	65.5	-180	158.1	0	0	114.2	R122 N157 T162 Y249 I311	R122-E160 HydrophobicContact CB-CB 4.33Å; R122-E160 CarbonylContact O-C 3.56Å; R122-E160 WeakPolarHBondContact O-CA 3.3Å; N157-E160 PolarHBondContact OD1-N 3.37Å; E160-T162 HydrophobicContact CG-CG2 3.98Å; E160-Y249 HydrophobicContact CG-CE1 4.41Å; E160-Y249 WeakPolarHBondContact CG-OH 3.5Å; E160-Y249 VanDerWaalsContact OE1-CE1 3.25Å; E160-Y249 WeakPolarHBondContact OE1-CE1 3.47Å; E160-Y249 VanDerWaalsContact OE1-CZ 3.26Å; E160-Y249 PolarHBondContact OE1-OH 3.04Å; E160-I311 HydrophobicContact CG-CD1 4.48Å
161	R	94.8	Very high	87.9	Confident	29 Å²	29	55.3 Å²	55.3	11%	0.109	27%	0.273	C	S	.	.			trans	-83.3	123	157.1	-64.7	-177	-173.8	81.7	5.6	107.8	L117 L121 R122 S123 R124 A126 Y131 D257	L117-R161 HydrophobicContact CD1-CB 4.24Å; L117-R161 HydrophobicContact CD2-CB 4.12Å; L121-R161 PolarHBondContact O-NH1 2.73Å; L121-R161 VanDerWaalsContact O-NH1 3.08Å; R122-R161 PolarHBondContact O-N 2.81Å; S123-R161 PolarHBondContact O-NH1 2.82Å; R124-R161 PolarHBondContact O-NH2 3.24Å; R124-R161 VanDerWaalsContact O-NH2 3.15Å; A126-R161 PolarHBondContact O-NH1 2.78Å; A126-R161 PolarHBondContact O-NH2 3.15Å; Y131-R161 HydrophobicContact CD1-CG 4.33Å; Y131-R161 HydrophobicContact CE1-CB 4.09Å; Y131-R161 HydrophobicContact CE1-CG 3.93Å; Y131-R161 HydrophobicContact CE2-CB 4.23Å; R161-D257 WeakPolarHBondContact CA-OD1 3.45Å
162	T	94.6	Very high	89.2	Confident	10 Å²	10	58.4 Å²	58.4	6%	0.061	28%	0.283	C	S	.	.			trans	-98.5	-15	-177.6	74.4	0	0	0	0	112.9	Q114 E160 F164 N255 T256 D257	Q114-T162 PolarHBondContact NE2-O 3.18Å; E160-T162 HydrophobicContact CG-CG2 3.98Å; T162-F164 PolarHBondContact OG1-N 2.69Å; T162-F164 PolarHBondContact OG1-O 3.01Å; T162-N255 HydrophobicContact CG2-CB 4.21Å; T162-N255 PolarHBondContact OG1-O 3.35Å; T162-T256 WeakPolarHBondContact CG2-O 3.46Å; T162-T256 VanDerWaalsContact OG1-C 3.28Å; T162-T256 WeakPolarHBondContact OG1-CA 3.48Å; T162-D257 PolarHBondContact N-OD1 3.11Å; T162-D257 PolarHBondContact OG1-N 3.22Å
163	G	94.6	Very high	90.6	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	88.5	8.3	-174.5	0	0	0	0	0	113.7	L115 Y131 P133	L115-G163 PolarHBondContact N-O 3.21Å; L115-G163 VanDerWaalsContact O-CA 3.25Å; L115-G163 WeakPolarHBondContact O-CA 3.19Å; Y131-G163 WeakPolarHBondContact OH-CA 3.27Å; Y131-G163 PolarHBondContact OH-N 3.38Å; P133-G163 VanDerWaalsContact CB-O 3.29Å; P133-G163 WeakPolarHBondContact CB-O 3.25Å
164	F	93.8	Very high	91.5	Very high	5 Å²	5	46.5 Å²	46.5	2%	0.022	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	127.4	178.3	-59.1	-63.4	0	0	0	110.4	Y107 L112 Q114 L136 T162 T256 D257	Y107-F164 VanDerWaalsContact CA-CZ 3.49Å; Y107-F164 HydrophobicContact CD2-CB 4.37Å; Y107-F164 HydrophobicContact CD2-CD1 4.11Å; Y107-F164 AromaticContact CD2-CD2 3.74Å; Y107-F164 HydrophobicContact CD2-CD2 3.74Å; Y107-F164 HydrophobicContact CD2-CE1 4.22Å; Y107-F164 AromaticContact CD2-CE2 3.87Å; Y107-F164 HydrophobicContact CD2-CE2 3.87Å; Y107-F164 AromaticContact CD2-CG 3.83Å; Y107-F164 HydrophobicContact CD2-CG 3.83Å; Y107-F164 HydrophobicContact CD2-CZ 4.08Å; Y107-F164 HydrophobicContact CE2-CD2 4.44Å; Y107-F164 HydrophobicContact CG-CE1 4.41Å; Y107-F164 HydrophobicContact CG-CZ 4.41Å; L112-F164 HydrophobicContact CD2-CD1 3.71Å; L112-F164 HydrophobicContact CD2-CE1 4.33Å; Q114-F164 HydrophobicContact CB-CD1 4.2Å; Q114-F164 HydrophobicContact CB-CE1 3.34Å; Q114-F164 HydrophobicContact CB-CE2 4.05Å; Q114-F164 HydrophobicContact CB-CZ 3.27Å; Q114-F164 VanDerWaalsContact CD-CE2 3.49Å; Q114-F164 HydrophobicContact CG-CD1 4.21Å; Q114-F164 HydrophobicContact CG-CD2 4.12Å; Q114-F164 HydrophobicContact CG-CE1 3.68Å; Q114-F164 HydrophobicContact CG-CE2 3.57Å; Q114-F164 HydrophobicContact CG-CG 4.44Å; Q114-F164 HydrophobicContact CG-CZ 3.34Å; L136-F164 HydrophobicContact CD1-CB 3.89Å; T162-F164 PolarHBondContact OG1-N 2.69Å; T162-F164 PolarHBondContact OG1-O 3.01Å; F164-T256 HydrophobicContact CB-CG2 4.22Å; F164-T256 WeakPolarHBondContact O-CB 3.38Å; F164-D257 WeakPolarHBondContact O-CB 3.46Å; F164-D257 PolarHBondContact O-N 3.29Å
165	S	92.4	Very high	92	Very high	15 Å²	15	46.9 Å²	46.9	11%	0.105	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	150	170.6	-179.2	0	0	0	0	110.9	A134 N135 L136 W154 N258	A134-S165 PolarHBondContact O-N 3.45Å; N135-S165 WeakPolarHBondContact CA-O 3.41Å; L136-S165 WeakPolarHBondContact CD1-O 3.19Å; L136-S165 PolarHBondContact N-O 3.42Å; W154-S165 WeakPolarHBondContact CZ3-OG 3.25Å; S165-N258 PolarHBondContact OG-OD1 2.77Å; S165-N258 VanDerWaalsContact OG-OD1 3.08Å
166	G	90.8	Very high	92.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	112.8	179.7	-179.4	0	0	0	0	0	113.6	E137 T256 N258	E137-G166 VanDerWaalsContact CD-CA 3.5Å; E137-G166 VanDerWaalsContact OE1-CA 3.31Å; E137-G166 WeakPolarHBondContact OE1-CA 3.4Å; E137-G166 WeakPolarHBondContact OE2-CA 3.45Å; G166-T256 WeakPolarHBondContact O-CB 3.42Å; G166-T256 WeakPolarHBondContact O-CG2 3.04Å; G166-T256 PolarHBondContact O-OG1 3.33Å; G166-N258 PolarHBondContact N-OD1 3.02Å; G166-N258 WeakPolarHBondContact O-CB 3.34Å
167	M	90.4	Very high	92.5	Very high	52 Å²	52	36.8 Å²	36.8	26%	0.256	20%	0.202	S	C	.	.			trans	-83.2	-32.4	175.3	-173.9	179.7	72.2	0	0	111.9	E137 K169 L170 Y173 A259	E137-M167 PolarHBondContact OE1-N 3.07Å; M167-K169 PolarHBondContact O-N 3.36Å; M167-L170 WeakPolarHBondContact CG-O 3.26Å; M167-L170 PolarHBondContact O-N 2.9Å; M167-Y173 HydrophobicContact CB-CD1 4.14Å; M167-Y173 HydrophobicContact CB-CD2 4.42Å; M167-Y173 HydrophobicContact CB-CE1 3.86Å; M167-Y173 HydrophobicContact CB-CE2 4.12Å; M167-Y173 HydrophobicContact CB-CG 4.43Å; M167-Y173 HydrophobicContact SD-CD2 4.16Å; M167-Y173 HydrophobicContact SD-CE2 4.23Å; M167-A259 HydrophobicContact CB-CB 4.49Å; M167-A259 HydrophobicContact CG-CB 4.13Å
168	G	90.8	Very high	92.5	Very high	25 Å²	25	36.8 Å²	36.8	26%	0.258	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	-122.5	179.5	0	0	0	0	0	114.4
169	K	89.8	Confident	92.8	Very high	113 Å²	113	32.5 Å²	32.5	49%	0.491	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	3.4	-177.7	-77.8	179.6	176.4	-178.8	0	113	Y107 P108 M167	Y107-K169 HydrophobicContact CE1-CB 4.21Å; Y107-K169 HydrophobicContact CE1-CD 4.02Å; Y107-K169 HydrophobicContact CE1-CG 3.88Å; Y107-K169 PolarHBondContact OH-N 3.04Å; P108-K169 WeakPolarHBondContact O-CE 3.18Å; P108-K169 PolarHBondContact O-NZ 2.75Å; M167-K169 PolarHBondContact O-N 3.36Å
170	L	92.1	Very high	93	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.031	17%	0.17	C	C	.	.	S	Bend	trans	-84.8	149.2	179	-60.9	-178.8	0	0	0	110.2	M167 E172 W208 H254 A259 L261	M167-L170 WeakPolarHBondContact CG-O 3.26Å; M167-L170 PolarHBondContact O-N 2.9Å; L170-E172 VanDerWaalsContact C-N 3.33Å; L170-E172 PolarHBondContact O-N 3.12Å; L170-W208 HydrophobicContact CD2-CH2 3.86Å; L170-H254 HydrophobicContact CD2-CB 4.15Å; L170-A259 HydrophobicContact CB-CB 4.01Å; L170-A259 HydrophobicContact CD1-CB 3.73Å; L170-A259 WeakPolarHBondContact CD1-O 3.44Å; L170-A259 HydrophobicContact CG-CB 4.4Å; L170-L261 HydrophobicContact CD1-CD2 4.5Å; L170-L261 HydrophobicContact CD2-CD2 3.66Å; L170-L261 HydrophobicContact CD2-CG 4.36Å
171	P	89.1	Confident	93.2	Very high	76 Å²	76	30.3 Å²	30.3	49%	0.494	17%	0.166	S	C	.	.	S	Bend	trans	-60	-37.5	-178.7	-26.9	32.9	0	0	0	114.8	N176 W208	P171-N176 VanDerWaalsContact CD-OD1 3.23Å; P171-N176 WeakPolarHBondContact CD-OD1 3.32Å; P171-W208 HydrophobicContact CG-CH2 4.03Å; P171-W208 HydrophobicContact CG-CZ2 4.19Å; P171-W208 HydrophobicContact CG-CZ3 4.37Å
172	E	90.7	Very high	93.3	Very high	129 Å²	129	28.9 Å²	28.9	60%	0.603	16%	0.161	S	C	*	.	S	Bend	trans	-139.6	155	-170.2	-64.8	173.8	-163.6	0	0	111.7	L170 N176 A259	L170-E172 VanDerWaalsContact C-N 3.33Å; L170-E172 PolarHBondContact O-N 3.12Å; E172-N176 PolarHBondContact N-OD1 3.35Å; E172-N176 PolarHBondContact O-ND2 3.08Å; E172-A259 VanDerWaalsContact O-CB 3.3Å; E172-A259 WeakPolarHBondContact O-CB 3.24Å
173	Y	91.6	Very high	93.4	Very high	82 Å²	82	28.4 Å²	28.4	32%	0.322	16%	0.158	S	C	.	.	S	Bend	trans	-66.1	146	165.3	-72.2	-84.4	0	0	0	110.3	W154 M167 N258	W154-Y173 HydrophobicContact CD2-CE1 4.16Å; W154-Y173 HydrophobicContact CE3-CE1 4.39Å; W154-Y173 HydrophobicContact CG-CE1 4.46Å; W154-Y173 HydrophobicContact CZ2-CE1 4.45Å; W154-Y173 WeakPolarHBondContact CZ2-OH 3.17Å; M167-Y173 HydrophobicContact CB-CD1 4.14Å; M167-Y173 HydrophobicContact CB-CD2 4.42Å; M167-Y173 HydrophobicContact CB-CE1 3.86Å; M167-Y173 HydrophobicContact CB-CE2 4.12Å; M167-Y173 HydrophobicContact CB-CG 4.43Å; M167-Y173 HydrophobicContact SD-CD2 4.16Å; M167-Y173 HydrophobicContact SD-CE2 4.23Å; Y173-N258 HydrophobicContact CD1-CB 3.85Å; Y173-N258 HydrophobicContact CE1-CB 4.11Å
174	G	93.1	Very high	93.5	Very high	4 Å²	4	28.6 Å²	28.6	4%	0.041	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.3	-150.3	-176.8	0	0	0	0	0	113.6	N176 N258 A259 W260	G174-N176 PolarHBondContact O-ND2 3.42Å; G174-N258 PolarHBondContact N-O 2.96Å; G174-A259 CarbonylContact O-C 3.53Å; G174-A259 WeakPolarHBondContact O-CA 3.46Å; G174-W260 PolarHBondContact O-N 3.09Å
175	A	93.4	Very high	93.5	Very high	45 Å²	45	31 Å²	31	37%	0.372	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.6	-177.1	0	0	0	0	0	111.8	W260 E262	A175-W260 CarbonylContact C-O 3.57Å; A175-W260 HydrophobicContact CB-CZ2 4.4Å; A175-E262 HydrophobicContact CB-CB 4.16Å; A175-E262 HydrophobicContact CB-CG 3.8Å; A175-E262 WeakPolarHBondContact CB-OE2 3.43Å
176	N	94.4	Very high	93.5	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.043	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	116.3	176.8	-69.1	-105.9	0	0	0	109.2	P171 E172 G174 A178 W208 W260 L261 E262	P171-N176 VanDerWaalsContact CD-OD1 3.23Å; P171-N176 WeakPolarHBondContact CD-OD1 3.32Å; E172-N176 PolarHBondContact N-OD1 3.35Å; E172-N176 PolarHBondContact O-ND2 3.08Å; G174-N176 PolarHBondContact O-ND2 3.42Å; N176-A178 PolarHBondContact O-N 3.08Å; N176-W208 HydrophobicContact CB-CZ3 4.08Å; N176-W260 WeakPolarHBondContact CB-O 3.4Å; N176-W260 PolarHBondContact N-O 2.74Å; N176-W260 PolarHBondContact ND2-O 3.05Å; N176-L261 HydrophobicContact CB-CD2 3.94Å; N176-L261 WeakPolarHBondContact O-CA 3.23Å; N176-E262 PolarHBondContact O-N 3.15Å
177	A	95	Very high	93.3	Very high	32 Å²	32	38 Å²	38	26%	0.264	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.1	-171.5	0	0	0	0	0	112.5	V209 E262	A177-V209 HydrophobicContact CB-CG2 3.72Å; A177-V209 WeakPolarHBondContact CB-O 3.37Å; A177-V209 PolarHBondContact O-N 3.35Å; A177-E262 CarbonylContact C-O 3.48Å; A177-E262 VanDerWaalsContact CA-O 3.25Å; A177-E262 WeakPolarHBondContact CA-O 3.32Å
178	A	95.2	Very high	93	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.8	-179.7	0	0	0	0	0	112.5	N176 R206 F207 L250 L261 E262 G263 A264	N176-A178 PolarHBondContact O-N 3.08Å; A178-R206 HydrophobicContact CB-CG 4.43Å; A178-F207 CarbonylContact C-O 3.54Å; A178-F207 VanDerWaalsContact CA-O 3.3Å; A178-F207 WeakPolarHBondContact CA-O 3.35Å; A178-L250 HydrophobicContact CB-CD1 4.11Å; A178-L261 HydrophobicContact CB-CD1 4.32Å; A178-L261 HydrophobicContact CB-CD2 4.36Å; A178-E262 PolarHBondContact N-O 2.94Å; A178-G263 VanDerWaalsContact O-CA 3.31Å; A178-G263 WeakPolarHBondContact O-CA 3.12Å; A178-A264 PolarHBondContact O-N 3.13Å
179	L	95.7	Very high	92.8	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	124	172.7	172.7	62.6	0	0	0	108.7	L181 R206 F207 V209 I214 I219 K222 A264 I266	L179-L181 HydrophobicContact CD1-CD2 4.16Å; L179-L181 HydrophobicContact CD2-CD2 3.92Å; L179-L181 HydrophobicContact CG-CD2 3.93Å; L179-L181 HydrophobicContact CG-CG 4.49Å; L179-R206 WeakPolarHBondContact O-CA 3.23Å; L179-F207 HydrophobicContact CB-CB 4.43Å; L179-F207 PolarHBondContact N-O 3.01Å; L179-F207 PolarHBondContact O-N 3.09Å; L179-V209 HydrophobicContact CB-CG1 3.88Å; L179-I214 HydrophobicContact CB-CD1 4.36Å; L179-I214 HydrophobicContact CD1-CD1 4.44Å; L179-I214 HydrophobicContact CD1-CG1 4.48Å; L179-I214 HydrophobicContact CD1-CG2 3.98Å; L179-I214 HydrophobicContact CD2-CG2 4.29Å; L179-I219 HydrophobicContact CD2-CG1 4.4Å; L179-K222 HydrophobicContact CD2-CB 4.39Å; L179-K222 HydrophobicContact CD2-CG 4.16Å; L179-A264 HydrophobicContact CD1-CB 4.31Å; L179-I266 HydrophobicContact CD1-CB 4.2Å; L179-I266 HydrophobicContact CD1-CG1 3.58Å
180	Y	96.8	Very high	92.9	Very high	5 Å²	5	43.4 Å²	43.4	2%	0.02	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.4	167.5	-75.8	11.6	0	0	0	109.1	L204 P205 R206 L250 K251 N252 L261 A264 I265 I266 F309	Y180-L204 HydrophobicContact CD2-CB 4.13Å; Y180-L204 HydrophobicContact CD2-CD1 4.14Å; Y180-L204 HydrophobicContact CG-CB 4.26Å; Y180-P205 WeakPolarHBondContact CA-O 3.43Å; Y180-R206 HydrophobicContact CD1-CB 3.85Å; Y180-R206 HydrophobicContact CD1-CG 3.79Å; Y180-R206 HydrophobicContact CE1-CB 3.76Å; Y180-R206 VanDerWaalsContact CE1-CD 3.43Å; Y180-R206 HydrophobicContact CE1-CG 3.45Å; Y180-R206 VanDerWaalsContact CE1-CG 3.45Å; Y180-L250 HydrophobicContact CD1-CD1 4.11Å; Y180-L250 HydrophobicContact CD2-CD2 4.43Å; Y180-L250 HydrophobicContact CE1-CD1 4.14Å; Y180-L250 HydrophobicContact CE2-CB 4.34Å; Y180-L250 HydrophobicContact CG-CD1 4.38Å; Y180-K251 PolarHBondContact OH-O 3Å; Y180-K251 VanDerWaalsContact OH-O 3.12Å; Y180-N252 PolarHBondContact OH-ND2 2.91Å; Y180-L261 HydrophobicContact CE1-CD1 4.18Å; Y180-A264 PolarHBondContact N-O 2.8Å; Y180-I265 HydrophobicContact CD2-CG1 4.37Å; Y180-I265 WeakPolarHBondContact O-CA 3.41Å; Y180-I266 PolarHBondContact O-N 3.49Å; Y180-F309 HydrophobicContact CD2-CB 4.17Å; Y180-F309 HydrophobicContact CE2-CB 4.12Å; Y180-F309 HydrophobicContact CE2-CD1 4.21Å
181	L	97.2	Very high	93	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.4	171.5	-61.1	-174.8	0	0	0	109.2	L179 I183 P205 F207 I219 K222 V223 L226 I266 L268	L179-L181 HydrophobicContact CD1-CD2 4.16Å; L179-L181 HydrophobicContact CD2-CD2 3.92Å; L179-L181 HydrophobicContact CG-CD2 3.93Å; L179-L181 HydrophobicContact CG-CG 4.49Å; L181-I183 HydrophobicContact CB-CD1 4.39Å; L181-I183 HydrophobicContact CB-CG1 4.38Å; L181-P205 PolarHBondContact N-O 3.24Å; L181-P205 WeakPolarHBondContact O-CD 3.45Å; L181-F207 HydrophobicContact CD1-CD2 4.1Å; L181-F207 HydrophobicContact CD1-CE2 3.52Å; L181-F207 HydrophobicContact CD1-CZ 4.28Å; L181-F207 HydrophobicContact CG-CD2 4.09Å; L181-F207 HydrophobicContact CG-CE2 3.86Å; L181-I219 HydrophobicContact CD2-CG2 4.42Å; L181-K222 HydrophobicContact CD1-CB 4.38Å; L181-V223 HydrophobicContact CD1-CG2 3.84Å; L181-L226 HydrophobicContact CD1-CD2 4.4Å; L181-I266 HydrophobicContact CD2-CB 4.24Å; L181-L268 HydrophobicContact CD1-CD1 4.45Å; L181-L268 HydrophobicContact CD2-CD1 4.28Å
182	L	97.5	Very high	93.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	107.5	164.6	175.8	65.6	0	0	0	107.7	T184 I193 L204 Y245 I265 I266 H267 L268 P302 F305 A306	L182-T184 HydrophobicContact CG-CG2 4.28Å; L182-I193 HydrophobicContact CD1-CB 4.12Å; L182-I193 HydrophobicContact CD1-CG2 3.82Å; L182-L204 HydrophobicContact CB-CD1 4.33Å; L182-L204 HydrophobicContact CB-CD2 4.49Å; L182-L204 HydrophobicContact CD1-CD2 3.77Å; L182-Y245 HydrophobicContact CD2-CD2 4.04Å; L182-Y245 HydrophobicContact CD2-CE2 4.02Å; L182-I265 HydrophobicContact CB-CG2 4.38Å; L182-I266 PolarHBondContact N-O 2.76Å; L182-H267 CarbonylContact O-C 3.47Å; L182-H267 VanDerWaalsContact O-CA 3.28Å; L182-H267 WeakPolarHBondContact O-CA 3.4Å; L182-H267 PolarHBondContact O-CD2 3.27Å; L182-L268 PolarHBondContact O-N 2.91Å; L182-P302 HydrophobicContact CD2-CB 3.98Å; L182-P302 WeakPolarHBondContact CD2-O 3.48Å; L182-F305 HydrophobicContact CD1-CD1 3.98Å; L182-F305 HydrophobicContact CD1-CE1 4.21Å; L182-A306 HydrophobicContact CD2-CB 3.99Å
183	I	97.1	Very high	93.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.4	177.4	-63.2	161.1	0	0	0	108.2	L181 I193 I194 L226 L268 F277 W293	L181-I183 HydrophobicContact CB-CD1 4.39Å; L181-I183 HydrophobicContact CB-CG1 4.38Å; I183-I193 CarbonylContact O-C 3.48Å; I183-I193 VanDerWaalsContact O-CA 3.28Å; I183-I193 WeakPolarHBondContact O-CA 3.49Å; I183-I194 HydrophobicContact CB-CB 4.37Å; I183-I194 HydrophobicContact CB-CD1 3.85Å; I183-I194 HydrophobicContact CB-CG1 4.2Å; I183-I194 HydrophobicContact CD1-CD1 4Å; I183-I194 HydrophobicContact CG2-CD1 3.7Å; I183-I194 HydrophobicContact CG2-CG1 4.27Å; I183-I194 PolarHBondContact O-N 2.91Å; I183-L226 HydrophobicContact CD1-CD2 3.43Å; I183-L226 VanDerWaalsContact CD1-CD2 3.43Å; I183-L268 VanDerWaalsContact CA-O 3.3Å; I183-L268 WeakPolarHBondContact CA-O 3.15Å; I183-L268 HydrophobicContact CG1-CB 4.15Å; I183-L268 HydrophobicContact CG1-CD1 4.23Å; I183-F277 HydrophobicContact CD1-CE1 3.84Å; I183-F277 HydrophobicContact CD1-CE2 4.38Å; I183-F277 HydrophobicContact CD1-CZ 3.65Å; I183-F277 HydrophobicContact CG1-CZ 4.44Å; I183-F277 HydrophobicContact CG2-CD2 4.13Å; I183-F277 HydrophobicContact CG2-CE2 3.72Å; I183-F277 HydrophobicContact CG2-CZ 4.11Å; I183-W293 HydrophobicContact CG2-CH2 4.1Å
184	T	96.7	Very high	93.7	Very high	4 Å²	4	33.6 Å²	33.6	3%	0.025	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	153.2	178	62.7	0	0	0	0	111.6	L182 T191 K192 I193 H267 L268 H269 D270 P302	L182-T184 HydrophobicContact CG-CG2 4.28Å; T184-T191 HydrophobicContact CG2-CG2 4.25Å; T184-K192 CarbonylContact C-O 3.54Å; T184-K192 WeakPolarHBondContact CA-O 3.2Å; T184-I193 HydrophobicContact CG2-CG2 3.8Å; T184-H267 WeakPolarHBondContact CG2-NE2 3.28Å; T184-H267 PolarHBondContact OG1-NE2 3.02Å; T184-L268 PolarHBondContact N-O 2.79Å; T184-H269 PolarHBondContact O-ND1 3.32Å; T184-H269 PolarHBondContact OG1-ND1 2.81Å; T184-D270 PolarHBondContact O-N 2.81Å; T184-P302 HydrophobicContact CG2-CB 3.94Å; T184-P302 HydrophobicContact CG2-CG 3.95Å
185	R	94.5	Very high	93.8	Very high	56 Å²	56	33.4 Å²	33.4	21%	0.211	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.8	167.8	-179.4	173.9	177.2	-171.5	2.9	109.7	K192 D270 Y274 G275 W293	R185-K192 PolarHBondContact N-O 2.76Å; R185-K192 PolarHBondContact O-N 3.48Å; R185-D270 HydrophobicContact CB-CB 4.39Å; R185-Y274 VanDerWaalsContact CZ-C 3.42Å; R185-Y274 PolarHBondContact NH1-O 3.47Å; R185-Y274 PolarHBondContact NH2-O 3.19Å; R185-G275 VanDerWaalsContact CZ-N 3.34Å; R185-W293 HydrophobicContact CB-CE3 4.44Å; R185-W293 HydrophobicContact CB-CH2 3.46Å; R185-W293 VanDerWaalsContact CB-CH2 3.46Å; R185-W293 HydrophobicContact CB-CZ2 4.25Å; R185-W293 HydrophobicContact CB-CZ3 3.59Å
186	Y	91.8	Very high	93.8	Very high	142 Å²	142	32.4 Å²	32.4	56%	0.557	16%	0.16	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.1	171.5	-174.9	-104.7	0	0	0	109.2	G189	Y186-G189 VanDerWaalsContact CE2-C 3.48Å; Y186-G189 WeakPolarHBondContact CE2-O 3.45Å; Y186-G189 VanDerWaalsContact OH-CA 3.28Å; Y186-G189 WeakPolarHBondContact OH-CA 3.46Å
187	S	85.8	Confident	93.3	Very high	19 Å²	19	34.5 Å²	34.5	13%	0.133	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	123.8	-176.9	-179.6	0	0	0	0	109.7	G189 T190	S187-G189 PolarHBondContact O-N 3.05Å; S187-T190 PolarHBondContact N-O 3.01Å; S187-T190 PolarHBondContact O-N 2.71Å; S187-T190 PolarHBondContact O-OG1 3.06Å
188	Y	84.9	Confident	92.6	Very high	221 Å²	221	34.2 Å²	34.2	87%	0.867	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	51.7	177.6	-54.7	-76.3	0	0	0	113.6	T190	Y188-T190 PolarHBondContact O-N 2.86Å
189	G	86.1	Confident	91.5	Very high	44 Å²	44	41.9 Å²	41.9	45%	0.454	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	-16.7	179.1	0	0	0	0	0	114.9	Y186 S187	Y186-G189 VanDerWaalsContact CE2-C 3.48Å; Y186-G189 WeakPolarHBondContact CE2-O 3.45Å; Y186-G189 VanDerWaalsContact OH-CA 3.28Å; Y186-G189 WeakPolarHBondContact OH-CA 3.46Å; S187-G189 PolarHBondContact O-N 3.05Å
190	T	92.1	Very high	90.4	Very high	39 Å²	39	49.1 Å²	49.1	24%	0.239	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145.7	-170.4	65.6	0	0	0	0	112.5	S187 Y188 F295	S187-T190 PolarHBondContact N-O 3.01Å; S187-T190 PolarHBondContact O-N 2.71Å; S187-T190 PolarHBondContact O-OG1 3.06Å; Y188-T190 PolarHBondContact O-N 2.86Å; T190-F295 HydrophobicContact CG2-CD1 4.48Å
191	T	94.8	Very high	89.6	Confident	36 Å²	36	52.3 Å²	52.3	22%	0.221	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	130.7	168.9	-61.3	0	0	0	0	109.8	T184 L296 P302	T184-T191 HydrophobicContact CG2-CG2 4.25Å; T191-L296 HydrophobicContact CG2-CB 4.34Å; T191-L296 HydrophobicContact CG2-CD2 4.15Å; T191-L296 WeakPolarHBondContact O-CB 3.35Å; T191-L296 PolarHBondContact O-N 2.68Å; T191-P302 HydrophobicContact CG2-CG 4.44Å
192	K	95.2	Very high	89.1	Confident	47 Å²	47	56.5 Å²	56.5	20%	0.204	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	152	173.5	-63	174.3	-179.3	170	0	110.2	T184 R185 W293 R294 F295	T184-K192 CarbonylContact C-O 3.54Å; T184-K192 WeakPolarHBondContact CA-O 3.2Å; R185-K192 PolarHBondContact N-O 2.76Å; R185-K192 PolarHBondContact O-N 3.48Å; K192-W293 HydrophobicContact CB-CB 4.41Å; K192-W293 HydrophobicContact CB-CD2 4.41Å; K192-W293 HydrophobicContact CB-CE3 3.62Å; K192-W293 HydrophobicContact CB-CZ3 4.26Å; K192-W293 HydrophobicContact CD-CB 4.44Å; K192-R294 CarbonylContact C-O 3.55Å; K192-R294 WeakPolarHBondContact CA-O 3.46Å; K192-F295 HydrophobicContact CD-CE1 4.28Å; K192-F295 HydrophobicContact CG-CD1 3.99Å; K192-F295 HydrophobicContact CG-CE1 4.22Å
193	I	95.8	Very high	88.8	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.015	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.9	176.2	61.7	167.5	0	0	0	111.2	L182 I183 T184 W293 R294 L296 F305	L182-I193 HydrophobicContact CD1-CB 4.12Å; L182-I193 HydrophobicContact CD1-CG2 3.82Å; I183-I193 CarbonylContact O-C 3.48Å; I183-I193 VanDerWaalsContact O-CA 3.28Å; I183-I193 WeakPolarHBondContact O-CA 3.49Å; T184-I193 HydrophobicContact CG2-CG2 3.8Å; I193-W293 CarbonylContact O-C 3.51Å; I193-W293 VanDerWaalsContact O-CA 3.28Å; I193-W293 WeakPolarHBondContact O-CA 3.42Å; I193-R294 HydrophobicContact CG1-CB 4.04Å; I193-R294 PolarHBondContact N-O 3.03Å; I193-R294 PolarHBondContact O-N 3.25Å; I193-L296 HydrophobicContact CG2-CB 4.34Å; I193-L296 HydrophobicContact CG2-CD2 4.47Å; I193-F305 HydrophobicContact CD1-CD1 3.84Å; I193-F305 HydrophobicContact CD1-CE1 3.13Å; I193-F305 HydrophobicContact CD1-CE2 4.08Å; I193-F305 HydrophobicContact CD1-CZ 3.27Å
194	I	95.4	Very high	88.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.1	167.5	-62	176.5	0	0	0	109	I183 P205 F277 P281 Y291 W293	I183-I194 HydrophobicContact CB-CB 4.37Å; I183-I194 HydrophobicContact CB-CD1 3.85Å; I183-I194 HydrophobicContact CB-CG1 4.2Å; I183-I194 HydrophobicContact CD1-CD1 4Å; I183-I194 HydrophobicContact CG2-CD1 3.7Å; I183-I194 HydrophobicContact CG2-CG1 4.27Å; I183-I194 PolarHBondContact O-N 2.91Å; I194-P205 HydrophobicContact CG2-CG 3.81Å; I194-P205 WeakPolarHBondContact O-CD 3.28Å; I194-F277 HydrophobicContact CD1-CB 4.16Å; I194-F277 HydrophobicContact CD1-CD1 3.83Å; I194-F277 HydrophobicContact CD1-CD2 4.31Å; I194-F277 HydrophobicContact CD1-CE1 4.29Å; I194-F277 HydrophobicContact CD1-CG 3.84Å; I194-P281 HydrophobicContact CD1-CB 4.3Å; I194-P281 HydrophobicContact CD1-CG 3.65Å; I194-P281 HydrophobicContact CG1-CG 4.03Å; I194-P281 HydrophobicContact CG2-CB 4.33Å; I194-P281 HydrophobicContact CG2-CG 3.95Å; I194-Y291 HydrophobicContact CG2-CD1 4.15Å; I194-Y291 HydrophobicContact CG2-CG 4.42Å; I194-W293 HydrophobicContact CD1-CH2 3.98Å; I194-W293 HydrophobicContact CD1-CZ2 3.82Å; I194-W293 HydrophobicContact CG1-CD2 3.92Å; I194-W293 HydrophobicContact CG1-CE3 3.88Å; I194-W293 HydrophobicContact CG1-CH2 3.74Å; I194-W293 HydrophobicContact CG1-CZ2 3.75Å; I194-W293 HydrophobicContact CG1-CZ3 3.79Å
195	A	94.2	Very high	88.6	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153.8	175.3	0	0	0	0	0	111.7	I202 A203 Y291 R292 R294	A195-I202 HydrophobicContact CB-CG2 3.87Å; A195-A203 CarbonylContact C-O 3.6Å; A195-A203 WeakPolarHBondContact CA-O 3.31Å; A195-Y291 WeakPolarHBondContact O-CA 3.48Å; A195-R292 PolarHBondContact N-O 3.28Å; A195-R292 PolarHBondContact O-N 3.48Å; A195-R294 HydrophobicContact CB-CG 3.99Å
196	E	92.7	Very high	88.6	Confident	24 Å²	24	55.4 Å²	55.4	11%	0.112	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	134.1	172.8	-163.6	177.2	147.8	0	0	109.6	T198 Y201 A203 R289 R290 Y291	E196-T198 HydrophobicContact CB-CG2 4.29Å; E196-T198 HydrophobicContact CG-CG2 3.74Å; E196-T198 PolarHBondContact O-N 2.79Å; E196-Y201 PolarHBondContact OE1-OH 2.9Å; E196-A203 HydrophobicContact CB-CB 3.98Å; E196-A203 PolarHBondContact N-O 2.89Å; E196-R289 HydrophobicContact CG-CB 4.35Å; E196-R289 IonicContact OE2-NE 2.83Å; E196-R290 CarbonylContact C-O 3.59Å; E196-R290 WeakPolarHBondContact CA-O 3.29Å; E196-Y291 HydrophobicContact CB-CD1 4.15Å; E196-Y291 HydrophobicContact CB-CE1 3.75Å; E196-Y291 HydrophobicContact CG-CE1 4.18Å
197	D	85.4	Confident	88.8	Confident	52 Å²	52	48.7 Å²	48.7	28%	0.278	25%	0.253	S	S	.	.			trans	-87.3	93.2	-179.3	-163.9	14.9	0	0	0	110	R290 R292 R294	D197-R290 HydrophobicContact CB-CB 4.03Å; D197-R290 PolarHBondContact N-O 3.06Å; D197-R292 HydrophobicContact CB-CG 4.12Å; D197-R292 IonicContact OD1-CZ 3.11Å; D197-R292 IonicContact OD1-NE 2.58Å; D197-R292 PolarHBondContact OD1-NE 2.83Å; D197-R292 IonicContact OD1-NH2 3.9Å; D197-R292 PolarHBondContact OD1-NH2 3.06Å; D197-R292 IonicContact OD2-CZ 3.49Å; D197-R292 IonicContact OD2-NE 3.59Å; D197-R292 PolarHBondContact OD2-NE 2.64Å; D197-R292 IonicContact OD2-NH2 3.42Å; D197-R294 IonicContact OD1-NH2 2.69Å; D197-R294 PolarHBondContact OD1-NH2 3.23Å
198	T	80.4	Confident	89.1	Confident	27 Å²	27	52.5 Å²	52.5	17%	0.166	26%	0.264	C	S	.	.			trans	-132.3	147.8	175.3	89.5	0	0	0	0	109.8	E196 D200 Y201	E196-T198 HydrophobicContact CB-CG2 4.29Å; E196-T198 HydrophobicContact CG-CG2 3.74Å; E196-T198 PolarHBondContact O-N 2.79Å; T198-D200 VanDerWaalsContact C-N 3.32Å; T198-Y201 HydrophobicContact CG2-CE1 4.12Å; T198-Y201 HydrophobicContact CG2-CE2 4.12Å; T198-Y201 VanDerWaalsContact OG1-CD1 3.32Å; T198-Y201 WeakPolarHBondContact OG1-CD1 3.35Å; T198-Y201 VanDerWaalsContact OG1-CE1 3.28Å; T198-Y201 WeakPolarHBondContact OG1-CE1 3.41Å; T198-Y201 PolarHBondContact OG1-N 3.02Å; T198-Y201 PolarHBondContact OG1-O 3.37Å
199	D	70.8	Confident	89.5	Confident	160 Å²	160	42.9 Å²	42.9	86%	0.856	23%	0.228	S	C	*	.	S	Bend	trans	-73.8	-26.1	-176.6	-62.2	-35.4	0	0	0	112.4
200	D	73.3	Confident	89.5	Confident	153 Å²	153	51 Å²	51	82%	0.818	25%	0.251	S	S	*	.	S	Bend	trans	-101.9	-20.4	-167.9	-62.1	-35.9	0	0	0	114.1	T198	T198-D200 VanDerWaalsContact C-N 3.32Å
201	Y	79.3	Confident	88.4	Confident	72 Å²	72	56.5 Å²	56.5	28%	0.282	27%	0.272	S	S	.	.			trans	-159.5	164.9	-176.3	64.7	-83	0	0	0	112.8	E196 T198 A203 K253	E196-Y201 PolarHBondContact OE1-OH 2.9Å; T198-Y201 HydrophobicContact CG2-CE1 4.12Å; T198-Y201 HydrophobicContact CG2-CE2 4.12Å; T198-Y201 VanDerWaalsContact OG1-CD1 3.32Å; T198-Y201 WeakPolarHBondContact OG1-CD1 3.35Å; T198-Y201 VanDerWaalsContact OG1-CE1 3.28Å; T198-Y201 WeakPolarHBondContact OG1-CE1 3.41Å; T198-Y201 PolarHBondContact OG1-N 3.02Å; T198-Y201 PolarHBondContact OG1-O 3.37Å; Y201-A203 HydrophobicContact CD2-CB 3.96Å; Y201-A203 HydrophobicContact CE2-CB 3.61Å; Y201-K253 HydrophobicContact CD1-CD 4.14Å; Y201-K253 HydrophobicContact CE1-CD 3.64Å; Y201-K253 HydrophobicContact CE2-CD 4.05Å; Y201-K253 VanDerWaalsContact OH-CE 3.28Å; Y201-K253 WeakPolarHBondContact OH-CE 3.29Å; Y201-K253 PolarHBondContact OH-NZ 2.83Å
202	I	87	Confident	86.9	Confident	87 Å²	87	58.9 Å²	58.9	45%	0.446	30%	0.295	S	S	.	.			trans	-102.1	132.4	171	-58.7	176.6	0	0	0	108.1	A195 F305 F309	A195-I202 HydrophobicContact CB-CG2 3.87Å; I202-F305 HydrophobicContact CG2-CZ 4.06Å; I202-F309 HydrophobicContact CG2-CZ 4.27Å; I202-F309 WeakPolarHBondContact O-CE1 3.17Å
203	A	91.5	Very high	86.2	Confident	15 Å²	15	61.2 Å²	61.2	12%	0.124	31%	0.313	C	S	.	.			trans	-132.2	146.6	172.9	0	0	0	0	0	111.5	A195 E196 Y201	A195-A203 CarbonylContact C-O 3.6Å; A195-A203 WeakPolarHBondContact CA-O 3.31Å; E196-A203 HydrophobicContact CB-CB 3.98Å; E196-A203 PolarHBondContact N-O 2.89Å; Y201-A203 HydrophobicContact CD2-CB 3.96Å; Y201-A203 HydrophobicContact CE2-CB 3.61Å
204	L	95	Very high	85.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	32%	0.321	C	S	.	.			trans	-80.7	150.6	171.3	-67.1	178.8	0	0	0	110.8	Y180 L182 R206 I265 F305 F309	Y180-L204 HydrophobicContact CD2-CB 4.13Å; Y180-L204 HydrophobicContact CD2-CD1 4.14Å; Y180-L204 HydrophobicContact CG-CB 4.26Å; L182-L204 HydrophobicContact CB-CD1 4.33Å; L182-L204 HydrophobicContact CB-CD2 4.49Å; L182-L204 HydrophobicContact CD1-CD2 3.77Å; L204-R206 PolarHBondContact O-N 2.94Å; L204-I265 HydrophobicContact CD1-CG2 4.06Å; L204-F305 HydrophobicContact CD2-CE1 4.08Å; L204-F309 HydrophobicContact CD1-CD2 3.87Å; L204-F309 HydrophobicContact CD1-CE2 4.21Å; L204-F309 HydrophobicContact CD1-CG 4.11Å; L204-F309 HydrophobicContact CG-CD1 4.49Å; L204-F309 HydrophobicContact CG-CD2 4.18Å; L204-F309 HydrophobicContact CG-CE1 4.37Å; L204-F309 HydrophobicContact CG-CE2 4.07Å; L204-F309 HydrophobicContact CG-CG 4.4Å; L204-F309 HydrophobicContact CG-CZ 4.16Å
205	P	95.5	Very high	85.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.341	C	S	.	.			trans	-47.7	124	164.8	-25.7	31.5	0	0	0	111.3	Y180 L181 I194 F207 L226 Y291	Y180-P205 WeakPolarHBondContact CA-O 3.43Å; L181-P205 PolarHBondContact N-O 3.24Å; L181-P205 WeakPolarHBondContact O-CD 3.45Å; I194-P205 HydrophobicContact CG2-CG 3.81Å; I194-P205 WeakPolarHBondContact O-CD 3.28Å; P205-F207 HydrophobicContact CB-CE2 4.13Å; P205-L226 HydrophobicContact CB-CD1 4.04Å; P205-L226 HydrophobicContact CB-CD2 3.53Å; P205-L226 HydrophobicContact CB-CG 4.46Å; P205-L226 HydrophobicContact CG-CD1 4.3Å; P205-L226 HydrophobicContact CG-CD2 3.69Å; P205-Y291 HydrophobicContact CB-CE1 4.01Å; P205-Y291 HydrophobicContact CG-CD1 3.88Å; P205-Y291 HydrophobicContact CG-CE1 3.73Å
206	R	94.4	Very high	85.6	Confident	22 Å²	22	68.6 Å²	68.6	8%	0.083	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.1	-170.1	174.9	179.7	80.4	87.9	-7.3	111.1	A178 L179 Y180 L204 W208 H283	A178-R206 HydrophobicContact CB-CG 4.43Å; L179-R206 WeakPolarHBondContact O-CA 3.23Å; Y180-R206 HydrophobicContact CD1-CB 3.85Å; Y180-R206 HydrophobicContact CD1-CG 3.79Å; Y180-R206 HydrophobicContact CE1-CB 3.76Å; Y180-R206 VanDerWaalsContact CE1-CD 3.43Å; Y180-R206 HydrophobicContact CE1-CG 3.45Å; Y180-R206 VanDerWaalsContact CE1-CG 3.45Å; L204-R206 PolarHBondContact O-N 2.94Å; R206-W208 VanDerWaalsContact NH1-CZ3 3.33Å; R206-H283 PolarHBondContact O-NE2 3.23Å
207	F	95.1	Very high	85.7	Confident	1 Å²	1	72.8 Å²	72.8	0%	0.004	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.6	178.5	-59.5	-87.1	0	0	0	111.2	A178 L179 L181 P205 K222 K225 L226 H283	A178-F207 CarbonylContact C-O 3.54Å; A178-F207 VanDerWaalsContact CA-O 3.3Å; A178-F207 WeakPolarHBondContact CA-O 3.35Å; L179-F207 HydrophobicContact CB-CB 4.43Å; L179-F207 PolarHBondContact N-O 3.01Å; L179-F207 PolarHBondContact O-N 3.09Å; L181-F207 HydrophobicContact CD1-CD2 4.1Å; L181-F207 HydrophobicContact CD1-CE2 3.52Å; L181-F207 HydrophobicContact CD1-CZ 4.28Å; L181-F207 HydrophobicContact CG-CD2 4.09Å; L181-F207 HydrophobicContact CG-CE2 3.86Å; P205-F207 HydrophobicContact CB-CE2 4.13Å; F207-K222 HydrophobicContact CB-CD 3.84Å; F207-K222 HydrophobicContact CB-CG 3.99Å; F207-K222 HydrophobicContact CD1-CB 4.01Å; F207-K222 HydrophobicContact CD1-CD 3.61Å; F207-K222 HydrophobicContact CD1-CG 4.1Å; F207-K222 HydrophobicContact CD2-CB 4.06Å; F207-K222 HydrophobicContact CD2-CG 4.44Å; F207-K222 HydrophobicContact CE1-CB 4.22Å; F207-K222 HydrophobicContact CE1-CD 4.39Å; F207-K222 WeakPolarHBondContact CE1-O 3.1Å; F207-K222 HydrophobicContact CE2-CB 4.33Å; F207-K222 HydrophobicContact CG-CB 3.91Å; F207-K222 HydrophobicContact CG-CD 3.82Å; F207-K222 HydrophobicContact CG-CG 3.9Å; F207-K222 HydrophobicContact CZ-CB 4.4Å; F207-K222 WeakPolarHBondContact CZ-O 3.38Å; F207-K225 HydrophobicContact CE1-CB 4.12Å; F207-L226 HydrophobicContact CE2-CD2 4.43Å; F207-L226 HydrophobicContact CZ-CB 4.03Å; F207-L226 HydrophobicContact CZ-CD1 4.41Å; F207-L226 HydrophobicContact CZ-CD2 4.31Å; F207-L226 HydrophobicContact CZ-CG 4.49Å; F207-H283 AromaticContact CD1-CE1 3.63Å; F207-H283 AromaticContact CD1-NE2 3.62Å; F207-H283 AromaticContact CE1-CD2 3.92Å; F207-H283 AromaticContact CE1-CE1 3.33Å; F207-H283 WeakPolarHBondContact CE1-CE1 3.47Å; F207-H283 AromaticContact CE1-NE2 3.22Å; F207-H283 WeakPolarHBondContact CE1-NE2 3.25Å; F207-H283 AromaticContact CE2-NE2 3.97Å; F207-H283 AromaticContact CZ-CD2 3.77Å; F207-H283 AromaticContact CZ-CE1 3.96Å; F207-H283 AromaticContact CZ-NE2 3.39Å; F207-H283 WeakPolarHBondContact CZ-NE2 3.31Å
208	W	93.3	Very high	86.1	Confident	99 Å²	99	72.2 Å²	72.2	38%	0.375	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.5	167.2	-60.8	117	0	0	0	110.3	L170 P171 N176 R206 K222 L261	L170-W208 HydrophobicContact CD2-CH2 3.86Å; P171-W208 HydrophobicContact CG-CH2 4.03Å; P171-W208 HydrophobicContact CG-CZ2 4.19Å; P171-W208 HydrophobicContact CG-CZ3 4.37Å; N176-W208 HydrophobicContact CB-CZ3 4.08Å; R206-W208 VanDerWaalsContact NH1-CZ3 3.33Å; W208-K222 WeakPolarHBondContact O-CE 3.25Å; W208-K222 PolarHBondContact O-NZ 2.84Å; W208-L261 HydrophobicContact CH2-CD2 3.86Å; W208-L261 HydrophobicContact CZ3-CD2 3.51Å
209	V	93.4	Very high	86.8	Confident	18 Å²	18	70.9 Å²	70.9	11%	0.109	37%	0.368	C	S	.	.			trans	-131.2	148	177.6	-59.8	0	0	0	0	109.4	A177 L179 K211 I214 L218	A177-V209 HydrophobicContact CB-CG2 3.72Å; A177-V209 WeakPolarHBondContact CB-O 3.37Å; A177-V209 PolarHBondContact O-N 3.35Å; L179-V209 HydrophobicContact CB-CG1 3.88Å; V209-K211 WeakPolarHBondContact CG2-O 3.48Å; V209-I214 HydrophobicContact CG1-CD1 4.25Å; V209-I214 HydrophobicContact CG2-CD1 4.17Å; V209-L218 HydrophobicContact CB-CD2 4.44Å; V209-L218 HydrophobicContact CG1-CD1 4.42Å; V209-L218 HydrophobicContact CG1-CD2 3.93Å
210	K	84.5	Confident	88	Confident	214 Å²	214	65.9 Å²	65.9	93%	0.93	34%	0.338	S	S	*	.	S	Bend	trans	-86.1	-21.1	-178.2	-68.4	-171.4	176.7	-172.5	0	113.6
211	K	68.7	Low	88.9	Confident	155 Å²	155	64.2 Å²	64.2	67%	0.674	32%	0.324	S	S	*	.	S	Bend	trans	-135.5	150.5	-176.2	-66.5	-174.8	177.4	-176.7	0	108.7	V209 T213	V209-K211 WeakPolarHBondContact CG2-O 3.48Å; K211-T213 PolarHBondContact O-N 2.95Å
212	A	64.1	Low	89.7	Confident	86 Å²	86	61.5 Å²	61.5	71%	0.711	31%	0.313	S	S	*	.	S	Bend	trans	-67.9	-19.5	175.4	0	0	0	0	0	112.9	I214	A212-I214 PolarHBondContact O-N 2.84Å; A212-I214 VanDerWaalsContact O-N 3.12Å
213	T	81.3	Confident	90.1	Very high	96 Å²	96	57.3 Å²	57.3	59%	0.589	29%	0.292	S	S	*	.			trans	-70.6	107.9	178.7	53	0	0	0	0	110.5	K211	K211-T213 PolarHBondContact O-N 2.95Å
214	I	87.9	Confident	90.1	Very high	36 Å²	36	61.5 Å²	61.5	19%	0.185	31%	0.309	C	S	.	.			trans	-97.4	94.7	176	-53.1	-56.5	0	0	0	109	L179 V209 A212 L218 I219 A264 I266	L179-I214 HydrophobicContact CB-CD1 4.36Å; L179-I214 HydrophobicContact CD1-CD1 4.44Å; L179-I214 HydrophobicContact CD1-CG1 4.48Å; L179-I214 HydrophobicContact CD1-CG2 3.98Å; L179-I214 HydrophobicContact CD2-CG2 4.29Å; V209-I214 HydrophobicContact CG1-CD1 4.25Å; V209-I214 HydrophobicContact CG2-CD1 4.17Å; A212-I214 PolarHBondContact O-N 2.84Å; A212-I214 VanDerWaalsContact O-N 3.12Å; I214-L218 HydrophobicContact CD1-CD2 3.67Å; I214-L218 HydrophobicContact CG2-CD2 4.49Å; I214-I219 HydrophobicContact CG2-CD1 3.82Å; I214-I219 HydrophobicContact CG2-CG1 3.66Å; I214-A264 HydrophobicContact CG1-CB 3.98Å; I214-I266 HydrophobicContact CG2-CG1 4.11Å
215	D	91.7	Very high	90	Very high	79 Å²	79	64.1 Å²	64.1	42%	0.422	32%	0.32	S	S	.	.			trans	-93.3	171.1	176	62.9	42.8	0	0	0	112.8	D217 L218 I219	D215-D217 VanDerWaalsContact C-N 3.28Å; D215-D217 PolarHBondContact O-N 2.89Å; D215-D217 PolarHBondContact OD1-N 2.58Å; D215-D217 VanDerWaalsContact OD1-N 3.11Å; D215-L218 VanDerWaalsContact OD1-CB 3.3Å; D215-L218 WeakPolarHBondContact OD1-CB 3.42Å; D215-L218 PolarHBondContact OD1-N 2.54Å; D215-I219 WeakPolarHBondContact O-CD1 3.42Å; D215-I219 VanDerWaalsContact O-CG1 3.29Å; D215-I219 WeakPolarHBondContact O-CG1 3.3Å; D215-I219 PolarHBondContact O-N 3.33Å; D215-I219 VanDerWaalsContact O-N 3.16Å
216	S	93.6	Very high	89.9	Confident	43 Å²	43	64.1 Å²	64.1	30%	0.301	32%	0.32	S	S	.	.	H	α-helix	trans	-59.3	-38.7	-179.7	-55.7	0	0	0	0	112.3	I219 K220 R242	S216-I219 PolarHBondContact O-N 3.16Å; S216-K220 VanDerWaalsContact O-CG 3.32Å; S216-K220 WeakPolarHBondContact O-CG 3.22Å; S216-K220 PolarHBondContact O-N 3.23Å; S216-R242 VanDerWaalsContact OG-CZ 3.3Å; S216-R242 PolarHBondContact OG-NH1 3.11Å; S216-R242 PolarHBondContact OG-NH2 3.13Å
217	D	93.7	Very high	89.6	Confident	112 Å²	112	64 Å²	64	60%	0.599	32%	0.321	S	S	*	.	H	α-helix	trans	-73.4	-38.4	-174	-68.1	-22.6	0	0	0	111.5	D215 I219 K220 K221	D215-D217 VanDerWaalsContact C-N 3.28Å; D215-D217 PolarHBondContact O-N 2.89Å; D215-D217 PolarHBondContact OD1-N 2.58Å; D215-D217 VanDerWaalsContact OD1-N 3.11Å; D217-I219 VanDerWaalsContact C-N 3.35Å; D217-K220 PolarHBondContact O-N 3.21Å; D217-K221 WeakPolarHBondContact O-CB 3.32Å; D217-K221 PolarHBondContact O-N 3.21Å
218	L	94.3	Very high	88.9	Confident	40 Å²	40	70.9 Å²	70.9	21%	0.209	35%	0.351	C	S	.	.	H	α-helix	trans	-58.5	-48.2	170	-179.3	66.4	0	0	0	110.6	V209 I214 D215 K221 K222	V209-L218 HydrophobicContact CB-CD2 4.44Å; V209-L218 HydrophobicContact CG1-CD1 4.42Å; V209-L218 HydrophobicContact CG1-CD2 3.93Å; I214-L218 HydrophobicContact CD1-CD2 3.67Å; I214-L218 HydrophobicContact CG2-CD2 4.49Å; D215-L218 VanDerWaalsContact OD1-CB 3.3Å; D215-L218 WeakPolarHBondContact OD1-CB 3.42Å; D215-L218 PolarHBondContact OD1-N 2.54Å; L218-K221 PolarHBondContact O-N 2.89Å; L218-K222 HydrophobicContact CD1-CG 4.41Å; L218-K222 WeakPolarHBondContact O-CG 3.49Å; L218-K222 PolarHBondContact O-N 3.12Å
219	I	95.2	Very high	88.6	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-48.3	179.9	-61.6	161.7	0	0	0	110.2	L179 L181 I214 D215 S216 D217 K221 K222 V223 V239 I266 L268	L179-I219 HydrophobicContact CD2-CG1 4.4Å; L181-I219 HydrophobicContact CD2-CG2 4.42Å; I214-I219 HydrophobicContact CG2-CD1 3.82Å; I214-I219 HydrophobicContact CG2-CG1 3.66Å; D215-I219 WeakPolarHBondContact O-CD1 3.42Å; D215-I219 VanDerWaalsContact O-CG1 3.29Å; D215-I219 WeakPolarHBondContact O-CG1 3.3Å; D215-I219 PolarHBondContact O-N 3.33Å; D215-I219 VanDerWaalsContact O-N 3.16Å; S216-I219 PolarHBondContact O-N 3.16Å; D217-I219 VanDerWaalsContact C-N 3.35Å; I219-K221 VanDerWaalsContact C-N 3.29Å; I219-K221 PolarHBondContact O-N 3.25Å; I219-K222 PolarHBondContact O-N 3.48Å; I219-V223 HydrophobicContact CG2-CG2 4.02Å; I219-V223 VanDerWaalsContact O-CG2 3.29Å; I219-V223 WeakPolarHBondContact O-CG2 3.21Å; I219-V223 PolarHBondContact O-N 3.35Å; I219-V239 HydrophobicContact CB-CG1 4.33Å; I219-V239 HydrophobicContact CB-CG2 4.26Å; I219-V239 HydrophobicContact CG2-CG1 4.44Å; I219-V239 HydrophobicContact CG2-CG2 3.69Å; I219-I266 HydrophobicContact CD1-CG1 4.34Å; I219-I266 HydrophobicContact CD1-CG2 4.07Å; I219-L268 HydrophobicContact CG2-CD1 4.12Å; I219-L268 HydrophobicContact CG2-CD2 4.22Å
220	K	95.1	Very high	88.4	Confident	55 Å²	55	73.1 Å²	73.1	24%	0.239	36%	0.361	C	S	.	.	H	α-helix	trans	-51.9	-49.4	175.9	-74	172.6	-177.7	178.2	0	111.1	S216 D217 K222 V223 Q224 I235 N236 V239	S216-K220 VanDerWaalsContact O-CG 3.32Å; S216-K220 WeakPolarHBondContact O-CG 3.22Å; S216-K220 PolarHBondContact O-N 3.23Å; D217-K220 PolarHBondContact O-N 3.21Å; K220-K222 VanDerWaalsContact C-N 3.33Å; K220-K222 PolarHBondContact O-N 3.01Å; K220-V223 PolarHBondContact O-N 3.12Å; K220-Q224 WeakPolarHBondContact O-CB 3.31Å; K220-Q224 VanDerWaalsContact O-CG 3.29Å; K220-Q224 WeakPolarHBondContact O-CG 3.27Å; K220-Q224 PolarHBondContact O-N 3.34Å; K220-I235 HydrophobicContact CB-CG2 4.36Å; K220-I235 HydrophobicContact CG-CG2 4.24Å; K220-N236 WeakPolarHBondContact CE-OD1 3.28Å; K220-N236 PolarHBondContact NZ-OD1 3.48Å; K220-V239 HydrophobicContact CG-CB 4.09Å; K220-V239 HydrophobicContact CG-CG1 4.09Å; K220-V239 HydrophobicContact CG-CG2 3.78Å
221	K	93.4	Very high	88.8	Confident	117 Å²	117	64.7 Å²	64.7	51%	0.509	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-38	178.7	-174.4	176.2	-175.2	171.6	0	112.7	D217 L218 I219 K225	D217-K221 WeakPolarHBondContact O-CB 3.32Å; D217-K221 PolarHBondContact O-N 3.21Å; L218-K221 PolarHBondContact O-N 2.89Å; I219-K221 VanDerWaalsContact C-N 3.29Å; I219-K221 PolarHBondContact O-N 3.25Å; K221-K225 VanDerWaalsContact O-CG 3.32Å; K221-K225 WeakPolarHBondContact O-CG 3.36Å; K221-K225 PolarHBondContact O-N 2.92Å
222	K	94.9	Very high	89.9	Confident	15 Å²	15	61.9 Å²	61.9	7%	0.065	33%	0.326	C	S	.	.	H	α-helix	trans	-74.5	-37.1	177.6	-65.6	-45	-165.8	157.1	0	112.2	L179 L181 F207 W208 L218 I219 K220 K225 L226 E285	L179-K222 HydrophobicContact CD2-CB 4.39Å; L179-K222 HydrophobicContact CD2-CG 4.16Å; L181-K222 HydrophobicContact CD1-CB 4.38Å; F207-K222 HydrophobicContact CB-CD 3.84Å; F207-K222 HydrophobicContact CB-CG 3.99Å; F207-K222 HydrophobicContact CD1-CB 4.01Å; F207-K222 HydrophobicContact CD1-CD 3.61Å; F207-K222 HydrophobicContact CD1-CG 4.1Å; F207-K222 HydrophobicContact CD2-CB 4.06Å; F207-K222 HydrophobicContact CD2-CG 4.44Å; F207-K222 HydrophobicContact CE1-CB 4.22Å; F207-K222 HydrophobicContact CE1-CD 4.39Å; F207-K222 WeakPolarHBondContact CE1-O 3.1Å; F207-K222 HydrophobicContact CE2-CB 4.33Å; F207-K222 HydrophobicContact CG-CB 3.91Å; F207-K222 HydrophobicContact CG-CD 3.82Å; F207-K222 HydrophobicContact CG-CG 3.9Å; F207-K222 HydrophobicContact CZ-CB 4.4Å; F207-K222 WeakPolarHBondContact CZ-O 3.38Å; W208-K222 WeakPolarHBondContact O-CE 3.25Å; W208-K222 PolarHBondContact O-NZ 2.84Å; L218-K222 HydrophobicContact CD1-CG 4.41Å; L218-K222 WeakPolarHBondContact O-CG 3.49Å; L218-K222 PolarHBondContact O-N 3.12Å; I219-K222 PolarHBondContact O-N 3.48Å; K220-K222 VanDerWaalsContact C-N 3.33Å; K220-K222 PolarHBondContact O-N 3.01Å; K222-K225 HydrophobicContact CD-CD 4.4Å; K222-K225 WeakPolarHBondContact O-CB 3.4Å; K222-K225 PolarHBondContact O-N 3.19Å; K222-K225 VanDerWaalsContact O-N 3.11Å; K222-L226 PolarHBondContact O-N 2.88Å; K222-E285 IonicContact NZ-OE1 2.86Å; K222-E285 PolarHBondContact NZ-OE1 3.29Å; K222-E285 IonicContact NZ-OE2 2.95Å; K222-E285 PolarHBondContact NZ-OE2 2.68Å
223	V	94.9	Very high	91.2	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65	-40.7	173.7	175.8	0	0	0	0	111.5	L181 I219 K220 K225 L226 N227 I235 M238 L268 F277	L181-V223 HydrophobicContact CD1-CG2 3.84Å; I219-V223 HydrophobicContact CG2-CG2 4.02Å; I219-V223 VanDerWaalsContact O-CG2 3.29Å; I219-V223 WeakPolarHBondContact O-CG2 3.21Å; I219-V223 PolarHBondContact O-N 3.35Å; K220-V223 PolarHBondContact O-N 3.12Å; V223-K225 PolarHBondContact O-N 3.39Å; V223-L226 PolarHBondContact O-N 2.8Å; V223-N227 PolarHBondContact O-N 2.86Å; V223-N227 PolarHBondContact O-ND2 3.45Å; V223-I235 HydrophobicContact CB-CG2 4.02Å; V223-I235 HydrophobicContact CG1-CB 4.48Å; V223-I235 HydrophobicContact CG1-CD1 4.17Å; V223-I235 HydrophobicContact CG1-CG1 3.97Å; V223-I235 HydrophobicContact CG1-CG2 3.85Å; V223-M238 HydrophobicContact CG1-CE 4.4Å; V223-L268 HydrophobicContact CG2-CD1 3.27Å; V223-F277 HydrophobicContact CG1-CE1 4.31Å; V223-F277 HydrophobicContact CG1-CZ 3.85Å
224	Q	93.1	Very high	91.7	Very high	103 Å²	103	60.1 Å²	60.1	48%	0.481	31%	0.305	S	S	.	.	H	α-helix	trans	-57.6	-30.1	172.2	-76.7	173.3	-22.3	0	0	112.6	K220 L226 N227 I235	K220-Q224 WeakPolarHBondContact O-CB 3.31Å; K220-Q224 VanDerWaalsContact O-CG 3.29Å; K220-Q224 WeakPolarHBondContact O-CG 3.27Å; K220-Q224 PolarHBondContact O-N 3.34Å; Q224-L226 VanDerWaalsContact C-N 3.34Å; Q224-N227 WeakPolarHBondContact CA-ND2 3.48Å; Q224-I235 HydrophobicContact CG-CD1 3.65Å
225	K	93	Very high	92	Very high	56 Å²	56	58.6 Å²	58.6	24%	0.243	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-10.6	177.9	-71.1	173.5	166.2	-169.2	0	114	F207 K221 K222 V223 H283 S284 E285	F207-K225 HydrophobicContact CE1-CB 4.12Å; K221-K225 VanDerWaalsContact O-CG 3.32Å; K221-K225 WeakPolarHBondContact O-CG 3.36Å; K221-K225 PolarHBondContact O-N 2.92Å; K222-K225 HydrophobicContact CD-CD 4.4Å; K222-K225 WeakPolarHBondContact O-CB 3.4Å; K222-K225 PolarHBondContact O-N 3.19Å; K222-K225 VanDerWaalsContact O-N 3.11Å; V223-K225 PolarHBondContact O-N 3.39Å; K225-H283 CarbonylContact O-C 3.57Å; K225-H283 WeakPolarHBondContact O-CA 3.41Å; K225-S284 WeakPolarHBondContact CB-OG 3.2Å; K225-S284 WeakPolarHBondContact CG-OG 3.48Å; K225-S284 PolarHBondContact O-N 3.03Å; K225-S284 PolarHBondContact O-OG 3.47Å; K225-E285 HydrophobicContact CD-CG 3.93Å; K225-E285 WeakPolarHBondContact CD-OE1 3.28Å; K225-E285 WeakPolarHBondContact CE-OE1 3.28Å; K225-E285 IonicContact NZ-OE1 3.87Å; K225-E285 PolarHBondContact NZ-OE1 3.41Å
226	L	93	Very high	92.2	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-7.1	178.7	-165.4	52.9	0	0	0	113.4	L181 I183 P205 F207 K222 V223 Q224 P281 V282 H283 Y291	L181-L226 HydrophobicContact CD1-CD2 4.4Å; I183-L226 HydrophobicContact CD1-CD2 3.43Å; I183-L226 VanDerWaalsContact CD1-CD2 3.43Å; P205-L226 HydrophobicContact CB-CD1 4.04Å; P205-L226 HydrophobicContact CB-CD2 3.53Å; P205-L226 HydrophobicContact CB-CG 4.46Å; P205-L226 HydrophobicContact CG-CD1 4.3Å; P205-L226 HydrophobicContact CG-CD2 3.69Å; F207-L226 HydrophobicContact CE2-CD2 4.43Å; F207-L226 HydrophobicContact CZ-CB 4.03Å; F207-L226 HydrophobicContact CZ-CD1 4.41Å; F207-L226 HydrophobicContact CZ-CD2 4.31Å; F207-L226 HydrophobicContact CZ-CG 4.49Å; K222-L226 PolarHBondContact O-N 2.88Å; V223-L226 PolarHBondContact O-N 2.8Å; Q224-L226 VanDerWaalsContact C-N 3.34Å; L226-P281 WeakPolarHBondContact O-CB 3.48Å; L226-V282 CarbonylContact C-O 3.51Å; L226-V282 WeakPolarHBondContact CA-O 3.43Å; L226-V282 PolarHBondContact O-N 3.34Å; L226-H283 HydrophobicContact CD1-CB 4.05Å; L226-Y291 HydrophobicContact CD1-CD2 4.34Å; L226-Y291 HydrophobicContact CD1-CE2 4.45Å
227	N	87.9	Confident	92.2	Very high	18 Å²	18	58.3 Å²	58.3	10%	0.096	30%	0.295	C	S	.	.			trans	-131.9	166.4	-175.5	94	82.3	0	0	0	110.8	V223 Q224 Y229 C230 I235 F277	V223-N227 PolarHBondContact O-N 2.86Å; V223-N227 PolarHBondContact O-ND2 3.45Å; Q224-N227 WeakPolarHBondContact CA-ND2 3.48Å; N227-Y229 PolarHBondContact OD1-N 3.38Å; N227-C230 HydrophobicContact CB-CB 4.43Å; N227-C230 VanDerWaalsContact OD1-CB 3.3Å; N227-C230 WeakPolarHBondContact OD1-CB 3.32Å; N227-C230 PolarHBondContact OD1-N 3.11Å; N227-I235 WeakPolarHBondContact ND2-CD1 3.45Å; N227-F277 HydrophobicContact CB-CD1 3.61Å; N227-F277 HydrophobicContact CB-CE1 3.65Å
228	K	80.8	Confident	92.2	Very high	147 Å²	147	53.2 Å²	53.2	64%	0.639	27%	0.268	S	S	*	.	S	Bend	trans	-118.7	-23.4	173.8	-172	176.1	174.5	-168.9	0	113.5
229	Y	85.6	Confident	92.3	Very high	151 Å²	151	51.3 Å²	51.3	59%	0.592	26%	0.258	S	S	*	.	S	Bend	trans	-122.1	-16.2	-164.5	-55	-64.8	0	0	0	114.8	N227 S231	N227-Y229 PolarHBondContact OD1-N 3.38Å; Y229-S231 PolarHBondContact O-N 2.91Å
230	C	90.7	Very high	92.3	Very high	13 Å²	13	57.6 Å²	57.6	9%	0.088	29%	0.287	C	S	.	.			trans	-64.1	126.4	179	-60.2	0	0	0	0	110.4	N227 I235 C276	N227-C230 HydrophobicContact CB-CB 4.43Å; N227-C230 VanDerWaalsContact OD1-CB 3.3Å; N227-C230 WeakPolarHBondContact OD1-CB 3.32Å; N227-C230 PolarHBondContact OD1-N 3.11Å; C230-I235 HydrophobicContact CB-CD1 3.94Å; C230-I235 HydrophobicContact CB-CG1 3.71Å; C230-C276 HydrophobicContact CB-CB 3.7Å; C230-C276 WeakPolarHBondContact CB-SG 3.47Å; C230-C276 WeakPolarHBondContact SG-CB 3.39Å; C230-C276 PolarHBondContact SG-O 2.86Å; C230-C276 VanDerWaalsContact SG-O 3.34Å; C230-C276 CovalentContact SG-SG 2.05Å; C230-C276 PolarHBondContact SG-SG 2.93Å
231	S	91.4	Very high	92.3	Very high	37 Å²	37	58.7 Å²	58.7	26%	0.259	30%	0.299	S	S	.	.			trans	-64.8	152.3	172.1	65.2	0	0	0	0	110.6	Y229 S233 E234 I235	Y229-S231 PolarHBondContact O-N 2.91Å; S231-S233 PolarHBondContact O-N 2.79Å; S231-S233 PolarHBondContact OG-OG 3.2Å; S231-E234 WeakPolarHBondContact CB-OE2 3.41Å; S231-E234 PolarHBondContact N-OE2 2.91Å; S231-E234 PolarHBondContact O-N 3.01Å; S231-E234 WeakPolarHBondContact OG-CB 3.22Å; S231-E234 WeakPolarHBondContact OG-CG 3.33Å; S231-E234 PolarHBondContact OG-N 3.28Å; S231-E234 PolarHBondContact OG-OE2 2.88Å; S231-I235 WeakPolarHBondContact O-CG1 3.36Å; S231-I235 PolarHBondContact O-N 2.86Å; S231-I235 VanDerWaalsContact O-N 3.12Å
232	P	91.4	Very high	92.4	Very high	96 Å²	96	56.9 Å²	56.9	62%	0.623	29%	0.289	S	S	*	.	H	α-helix	trans	-56.5	-32	174.7	-27.5	35.9	0	0	0	113.8	N236	P232-N236 VanDerWaalsContact O-CB 3.29Å; P232-N236 WeakPolarHBondContact O-CB 3.36Å; P232-N236 PolarHBondContact O-N 3.17Å
233	S	92.1	Very high	92.5	Very high	80 Å²	80	60.4 Å²	60.4	56%	0.559	31%	0.305	S	S	*	.	H	α-helix	trans	-67.6	-46.4	177.2	45.2	0	0	0	0	112	S231 I235 N236 V237	S231-S233 PolarHBondContact O-N 2.79Å; S231-S233 PolarHBondContact OG-OG 3.2Å; S233-I235 PolarHBondContact O-N 2.81Å; S233-N236 WeakPolarHBondContact O-CB 3.4Å; S233-N236 PolarHBondContact O-N 3.28Å; S233-V237 WeakPolarHBondContact O-CG2 3.49Å; S233-V237 PolarHBondContact O-N 3.42Å
234	E	92.7	Very high	92.5	Very high	64 Å²	64	63.6 Å²	63.6	30%	0.299	33%	0.328	S	S	.	.	H	α-helix	trans	-59.7	-46	175.4	-71.4	163	137.6	0	0	111.3	S231 N236 V237 M238 S272	S231-E234 WeakPolarHBondContact CB-OE2 3.41Å; S231-E234 PolarHBondContact N-OE2 2.91Å; S231-E234 PolarHBondContact O-N 3.01Å; S231-E234 WeakPolarHBondContact OG-CB 3.22Å; S231-E234 WeakPolarHBondContact OG-CG 3.33Å; S231-E234 PolarHBondContact OG-N 3.28Å; S231-E234 PolarHBondContact OG-OE2 2.88Å; E234-N236 VanDerWaalsContact C-N 3.3Å; E234-N236 PolarHBondContact O-N 2.98Å; E234-V237 PolarHBondContact O-N 2.69Å; E234-M238 WeakPolarHBondContact O-CG 3.39Å; E234-M238 PolarHBondContact O-N 3.37Å; E234-S272 WeakPolarHBondContact OE1-CB 3.42Å
235	I	94.4	Very high	92.6	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-61.2	-41.6	176.1	-62	174.6	0	0	0	110.7	K220 V223 Q224 N227 C230 S231 S233 V237 M238 V239	K220-I235 HydrophobicContact CB-CG2 4.36Å; K220-I235 HydrophobicContact CG-CG2 4.24Å; V223-I235 HydrophobicContact CB-CG2 4.02Å; V223-I235 HydrophobicContact CG1-CB 4.48Å; V223-I235 HydrophobicContact CG1-CD1 4.17Å; V223-I235 HydrophobicContact CG1-CG1 3.97Å; V223-I235 HydrophobicContact CG1-CG2 3.85Å; Q224-I235 HydrophobicContact CG-CD1 3.65Å; N227-I235 WeakPolarHBondContact ND2-CD1 3.45Å; C230-I235 HydrophobicContact CB-CD1 3.94Å; C230-I235 HydrophobicContact CB-CG1 3.71Å; S231-I235 WeakPolarHBondContact O-CG1 3.36Å; S231-I235 PolarHBondContact O-N 2.86Å; S231-I235 VanDerWaalsContact O-N 3.12Å; S233-I235 PolarHBondContact O-N 2.81Å; I235-V237 VanDerWaalsContact C-N 3.35Å; I235-V237 PolarHBondContact O-N 3.11Å; I235-M238 HydrophobicContact CB-CE 4.46Å; I235-M238 HydrophobicContact CG1-CE 4.09Å; I235-M238 PolarHBondContact O-N 2.76Å; I235-V239 HydrophobicContact CG2-CG2 4.23Å; I235-V239 WeakPolarHBondContact O-CB 3.35Å; I235-V239 VanDerWaalsContact O-CG2 3.3Å; I235-V239 WeakPolarHBondContact O-CG2 3.3Å; I235-V239 PolarHBondContact O-N 2.75Å
236	N	94.4	Very high	92.7	Very high	46 Å²	46	57.8 Å²	57.8	25%	0.246	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-43.3	179.3	-175.6	66.3	0	0	0	111.8	K220 P232 S233 E234 V239 Q240	K220-N236 WeakPolarHBondContact CE-OD1 3.28Å; K220-N236 PolarHBondContact NZ-OD1 3.48Å; P232-N236 VanDerWaalsContact O-CB 3.29Å; P232-N236 WeakPolarHBondContact O-CB 3.36Å; P232-N236 PolarHBondContact O-N 3.17Å; S233-N236 WeakPolarHBondContact O-CB 3.4Å; S233-N236 PolarHBondContact O-N 3.28Å; E234-N236 VanDerWaalsContact C-N 3.3Å; E234-N236 PolarHBondContact O-N 2.98Å; N236-V239 PolarHBondContact O-N 3.35Å; N236-Q240 VanDerWaalsContact ND2-CD 3.35Å; N236-Q240 PolarHBondContact ND2-NE2 2.72Å; N236-Q240 VanDerWaalsContact ND2-NE2 3.12Å; N236-Q240 WeakPolarHBondContact O-CB 3.47Å; N236-Q240 VanDerWaalsContact O-CG 3.28Å; N236-Q240 WeakPolarHBondContact O-CG 3.29Å; N236-Q240 PolarHBondContact O-N 3.49Å
237	V	93.8	Very high	92.7	Very high	70 Å²	70	62.8 Å²	62.8	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-50.1	175.4	172.9	0	0	0	0	110.5	S233 E234 I235 V239 Q240 T241	S233-V237 WeakPolarHBondContact O-CG2 3.49Å; S233-V237 PolarHBondContact O-N 3.42Å; E234-V237 PolarHBondContact O-N 2.69Å; I235-V237 VanDerWaalsContact C-N 3.35Å; I235-V237 PolarHBondContact O-N 3.11Å; V237-V239 VanDerWaalsContact C-N 3.27Å; V237-V239 PolarHBondContact O-N 2.89Å; V237-Q240 PolarHBondContact O-N 3.44Å; V237-Q240 VanDerWaalsContact O-N 3.14Å; V237-T241 PolarHBondContact O-N 2.91Å; V237-T241 PolarHBondContact O-OG1 3.33Å; V237-T241 VanDerWaalsContact O-OG1 3.06Å
238	M	95.2	Very high	93	Very high	5 Å²	5	62.8 Å²	62.8	3%	0.025	34%	0.335	C	S	.	.	H	α-helix	trans	-56.2	-41.1	177.7	-70.3	-168	-81.2	0	0	112.6	V223 E234 I235 T241 R242 L268 H269 D270 F277	V223-M238 HydrophobicContact CG1-CE 4.4Å; E234-M238 WeakPolarHBondContact O-CG 3.39Å; E234-M238 PolarHBondContact O-N 3.37Å; I235-M238 HydrophobicContact CB-CE 4.46Å; I235-M238 HydrophobicContact CG1-CE 4.09Å; I235-M238 PolarHBondContact O-N 2.76Å; M238-T241 PolarHBondContact O-OG1 3.16Å; M238-R242 PolarHBondContact O-N 2.94Å; M238-L268 WeakPolarHBondContact O-CD2 3.34Å; M238-H269 WeakPolarHBondContact CG-O 3.47Å; M238-D270 HydrophobicContact SD-CB 4.15Å; M238-F277 HydrophobicContact CE-CE2 3.7Å; M238-F277 HydrophobicContact CE-CZ 4.02Å; M238-F277 HydrophobicContact SD-CE2 3.74Å; M238-F277 HydrophobicContact SD-CZ 4.36Å
239	V	96.2	Very high	93.7	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-73.3	-35.4	179.9	173.2	0	0	0	0	111.7	I219 K220 I235 N236 V237 T241 R242 L268	I219-V239 HydrophobicContact CB-CG1 4.33Å; I219-V239 HydrophobicContact CB-CG2 4.26Å; I219-V239 HydrophobicContact CG2-CG1 4.44Å; I219-V239 HydrophobicContact CG2-CG2 3.69Å; K220-V239 HydrophobicContact CG-CB 4.09Å; K220-V239 HydrophobicContact CG-CG1 4.09Å; K220-V239 HydrophobicContact CG-CG2 3.78Å; I235-V239 HydrophobicContact CG2-CG2 4.23Å; I235-V239 WeakPolarHBondContact O-CB 3.35Å; I235-V239 VanDerWaalsContact O-CG2 3.3Å; I235-V239 WeakPolarHBondContact O-CG2 3.3Å; I235-V239 PolarHBondContact O-N 2.75Å; N236-V239 PolarHBondContact O-N 3.35Å; V237-V239 VanDerWaalsContact C-N 3.27Å; V237-V239 PolarHBondContact O-N 2.89Å; V239-T241 VanDerWaalsContact C-N 3.35Å; V239-R242 WeakPolarHBondContact O-CB 3.24Å; V239-R242 VanDerWaalsContact O-CD 3.25Å; V239-R242 WeakPolarHBondContact O-CD 3.47Å; V239-R242 WeakPolarHBondContact O-CG 3.37Å; V239-R242 PolarHBondContact O-N 3.3Å; V239-R242 PolarHBondContact O-NH1 2.97Å; V239-L268 HydrophobicContact CG2-CD2 4.43Å
240	Q	94.6	Very high	94.1	Very high	132 Å²	132	48.6 Å²	48.6	62%	0.617	28%	0.276	S	S	*	.	H	α-helix	trans	-67.5	-35.3	177	-76.7	176	-17.3	0	0	112.3	N236 V237	N236-Q240 VanDerWaalsContact ND2-CD 3.35Å; N236-Q240 PolarHBondContact ND2-NE2 2.72Å; N236-Q240 VanDerWaalsContact ND2-NE2 3.12Å; N236-Q240 WeakPolarHBondContact O-CB 3.47Å; N236-Q240 VanDerWaalsContact O-CG 3.28Å; N236-Q240 WeakPolarHBondContact O-CG 3.29Å; N236-Q240 PolarHBondContact O-N 3.49Å; V237-Q240 PolarHBondContact O-N 3.44Å; V237-Q240 VanDerWaalsContact O-N 3.14Å
241	T	94.9	Very high	94.2	Very high	78 Å²	78	52.2 Å²	52.2	48%	0.479	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	7.4	179.8	61	0	0	0	0	113.9	V237 M238 V239	V237-T241 PolarHBondContact O-N 2.91Å; V237-T241 PolarHBondContact O-OG1 3.33Å; V237-T241 VanDerWaalsContact O-OG1 3.06Å; M238-T241 PolarHBondContact O-OG1 3.16Å; V239-T241 VanDerWaalsContact C-N 3.35Å
242	R	96.3	Very high	94.3	Very high	79 Å²	79	52 Å²	52	30%	0.298	29%	0.287	S	S	.	.			trans	-55.7	154.2	-177.8	73.8	-176.9	178.3	-93.4	9.8	112.9	S216 M238 V239 I266 H267 L268	S216-R242 VanDerWaalsContact OG-CZ 3.3Å; S216-R242 PolarHBondContact OG-NH1 3.11Å; S216-R242 PolarHBondContact OG-NH2 3.13Å; M238-R242 PolarHBondContact O-N 2.94Å; V239-R242 WeakPolarHBondContact O-CB 3.24Å; V239-R242 VanDerWaalsContact O-CD 3.25Å; V239-R242 WeakPolarHBondContact O-CD 3.47Å; V239-R242 WeakPolarHBondContact O-CG 3.37Å; V239-R242 PolarHBondContact O-N 3.3Å; V239-R242 PolarHBondContact O-NH1 2.97Å; R242-I266 HydrophobicContact CB-CG2 4.02Å; R242-I266 HydrophobicContact CG-CG2 4.46Å; R242-H267 WeakPolarHBondContact CA-O 3.3Å; R242-L268 HydrophobicContact CB-CD2 3.61Å
243	Q	96.4	Very high	94.3	Very high	88 Å²	88	51.2 Å²	51.2	41%	0.411	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.8	172.1	-61.6	-176.1	-25.5	0	0	110.4	Y245 H267	Q243-Y245 HydrophobicContact CB-CD1 3.91Å; Q243-Y245 HydrophobicContact CB-CE1 3.46Å; Q243-Y245 VanDerWaalsContact CB-CE1 3.46Å; Q243-Y245 HydrophobicContact CG-CE1 4.34Å; Q243-Y245 PolarHBondContact OE1-OH 2.96Å; Q243-H267 HydrophobicContact CB-CB 4.36Å; Q243-H267 PolarHBondContact N-O 3.34Å; Q243-H267 PolarHBondContact O-N 2.05Å
244	S	95.1	Very high	94.3	Very high	68 Å²	68	48.8 Å²	48.8	48%	0.476	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	114.7	169.6	-172.2	0	0	0	0	108.7
245	Y	95.7	Very high	94.4	Very high	25 Å²	25	45.9 Å²	45.9	10%	0.098	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-24.2	-179.1	-76	-5.4	0	0	0	113.2	L182 Q243 I265 H267 P302 R303 A306	L182-Y245 HydrophobicContact CD2-CD2 4.04Å; L182-Y245 HydrophobicContact CD2-CE2 4.02Å; Q243-Y245 HydrophobicContact CB-CD1 3.91Å; Q243-Y245 HydrophobicContact CB-CE1 3.46Å; Q243-Y245 VanDerWaalsContact CB-CE1 3.46Å; Q243-Y245 HydrophobicContact CG-CE1 4.34Å; Q243-Y245 PolarHBondContact OE1-OH 2.96Å; Y245-I265 PolarHBondContact N-O 2.99Å; Y245-H267 HydrophobicContact CD1-CB 4.26Å; Y245-H267 HydrophobicContact CD2-CB 3.54Å; Y245-H267 HydrophobicContact CE1-CB 4.05Å; Y245-H267 HydrophobicContact CE2-CB 3.29Å; Y245-H267 AromaticContact CE2-CG 3.42Å; Y245-H267 VanDerWaalsContact CE2-CG 3.42Å; Y245-H267 AromaticContact CE2-ND1 3.87Å; Y245-H267 HydrophobicContact CG-CB 4.03Å; Y245-H267 AromaticContact CZ-CG 3.54Å; Y245-H267 AromaticContact CZ-ND1 3.49Å; Y245-H267 PolarHBondContact OH-ND1 3.23Å; Y245-P302 HydrophobicContact CE2-CB 3.92Å; Y245-R303 HydrophobicContact CD1-CB 4.41Å; Y245-R303 HydrophobicContact CD1-CG 4.3Å; Y245-R303 HydrophobicContact CD2-CB 4.17Å; Y245-R303 HydrophobicContact CE1-CB 4.23Å; Y245-R303 HydrophobicContact CE2-CB 3.97Å; Y245-R303 HydrophobicContact CG-CB 4.38Å; Y245-R303 HydrophobicContact CG-CG 4.32Å; Y245-A306 HydrophobicContact CD2-CB 3.67Å; Y245-A306 HydrophobicContact CG-CB 4.28Å
246	H	94.6	Very high	94.5	Very high	12 Å²	12	45.7 Å²	45.7	6%	0.056	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	145.9	178.7	-176.6	68.2	0	0	0	111	Y249 A264 I265 I311	H246-Y249 PolarHBondContact NE2-O 3.41Å; H246-A264 CarbonylContact O-C 3.43Å; H246-A264 VanDerWaalsContact O-CA 3.24Å; H246-A264 WeakPolarHBondContact O-CA 3.34Å; H246-I265 HydrophobicContact CB-CB 3.99Å; H246-I265 HydrophobicContact CB-CD1 3.78Å; H246-I265 HydrophobicContact CB-CG1 3.87Å; H246-I265 PolarHBondContact N-O 3.17Å; H246-I265 PolarHBondContact O-N 3.09Å; H246-I311 PolarHBondContact CE1-O 3.06Å
247	V	93.4	Very high	94.5	Very high	105 Å²	105	44 Å²	44	64%	0.636	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-138.1	132.8	167.5	-177.5	0	0	0	0	108.2	G263 A264	V247-G263 CarbonylContact C-O 3.49Å; V247-G263 VanDerWaalsContact CA-O 3.27Å; V247-G263 WeakPolarHBondContact CA-O 3.36Å; V247-A264 HydrophobicContact CG2-CB 4.21Å
248	G	93.4	Very high	94.6	Very high	17 Å²	17	41 Å²	41	18%	0.175	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127.7	-141.4	-179.2	0	0	0	0	0	111.7	L250 E262 G263	G248-L250 PolarHBondContact O-N 3.32Å; G248-E262 CarbonylContact O-C 2.9Å; G248-E262 VanDerWaalsContact O-CA 3.31Å; G248-E262 WeakPolarHBondContact O-CA 3.48Å; G248-G263 PolarHBondContact N-O 2.97Å; G248-G263 PolarHBondContact O-N 2.94Å
249	Y	94.9	Very high	94.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	131.7	-177.4	-173.4	-94.3	0	0	0	112.7	N157 Y159 E160 H246 K251 N255 W260 G310 I311	N157-Y249 WeakPolarHBondContact ND2-CE2 3.33Å; N157-Y249 PolarHBondContact ND2-OH 3.34Å; N157-Y249 VanDerWaalsContact ND2-OH 3.08Å; N157-Y249 WeakPolarHBondContact OD1-CE2 3.46Å; Y159-Y249 VanDerWaalsContact CD1-CB 3.49Å; Y159-Y249 HydrophobicContact CD1-CD2 4.15Å; Y159-Y249 AromaticContact CD1-CG 3.91Å; Y159-Y249 HydrophobicContact CD1-CG 3.91Å; Y159-Y249 AromaticContact CD2-CD2 3.2Å; Y159-Y249 HydrophobicContact CD2-CD2 3.2Å; Y159-Y249 AromaticContact CD2-CE2 3.88Å; Y159-Y249 HydrophobicContact CD2-CE2 3.88Å; Y159-Y249 AromaticContact CD2-CG 3.84Å; Y159-Y249 HydrophobicContact CD2-CG 3.84Å; Y159-Y249 VanDerWaalsContact CE1-CB 3.45Å; Y159-Y249 HydrophobicContact CE1-CG 4.31Å; Y159-Y249 AromaticContact CE2-CD2 3.73Å; Y159-Y249 HydrophobicContact CE2-CD2 3.73Å; Y159-Y249 HydrophobicContact CE2-CG 4.25Å; Y159-Y249 HydrophobicContact CG-CD1 4.46Å; Y159-Y249 AromaticContact CG-CD2 3.44Å; Y159-Y249 HydrophobicContact CG-CD2 3.44Å; Y159-Y249 VanDerWaalsContact CG-CD2 3.44Å; Y159-Y249 HydrophobicContact CG-CE2 4.09Å; Y159-Y249 AromaticContact CG-CG 3.63Å; Y159-Y249 HydrophobicContact CG-CG 3.63Å; E160-Y249 HydrophobicContact CG-CE1 4.41Å; E160-Y249 WeakPolarHBondContact CG-OH 3.5Å; E160-Y249 VanDerWaalsContact OE1-CE1 3.25Å; E160-Y249 WeakPolarHBondContact OE1-CE1 3.47Å; E160-Y249 VanDerWaalsContact OE1-CZ 3.26Å; E160-Y249 PolarHBondContact OE1-OH 3.04Å; H246-Y249 PolarHBondContact NE2-O 3.41Å; Y249-K251 HydrophobicContact CD1-CG 4.45Å; Y249-K251 HydrophobicContact CE1-CG 4.16Å; Y249-N255 PolarHBondContact OH-ND2 3.39Å; Y249-W260 HydrophobicContact CD2-CB 4.27Å; Y249-W260 AromaticContact CD2-CD1 3.41Å; Y249-W260 VanDerWaalsContact CD2-CD1 3.41Å; Y249-W260 AromaticContact CD2-CG 3.99Å; Y249-W260 HydrophobicContact CD2-CG 3.99Å; Y249-W260 HydrophobicContact CE2-CB 3.5Å; Y249-W260 AromaticContact CE2-CD1 3.51Å; Y249-W260 AromaticContact CE2-CG 3.59Å; Y249-W260 HydrophobicContact CE2-CG 3.59Å; Y249-G310 WeakPolarHBondContact O-CA 3.17Å; Y249-I311 HydrophobicContact CD1-CB 3.78Å; Y249-I311 HydrophobicContact CD1-CD1 3.6Å; Y249-I311 HydrophobicContact CD1-CG1 3.66Å; Y249-I311 HydrophobicContact CE1-CD1 3.54Å; Y249-I311 HydrophobicContact CE1-CG1 4.05Å; Y249-I311 HydrophobicContact CG-CB 4.37Å; Y249-I311 PolarHBondContact O-N 3.19Å; Y249-I311 VanDerWaalsContact O-N 3.11Å
250	L	95.3	Very high	94.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.5	177.4	-60.5	175.8	0	0	0	109.3	A178 Y180 G248 N252 N255 L261 I265 F309	A178-L250 HydrophobicContact CB-CD1 4.11Å; Y180-L250 HydrophobicContact CD1-CD1 4.11Å; Y180-L250 HydrophobicContact CD2-CD2 4.43Å; Y180-L250 HydrophobicContact CE1-CD1 4.14Å; Y180-L250 HydrophobicContact CE2-CB 4.34Å; Y180-L250 HydrophobicContact CG-CD1 4.38Å; G248-L250 PolarHBondContact O-N 3.32Å; L250-N252 PolarHBondContact O-N 3.25Å; L250-N255 PolarHBondContact O-ND2 3.31Å; L250-L261 HydrophobicContact CB-CB 3.9Å; L250-L261 PolarHBondContact N-O 3.32Å; L250-I265 HydrophobicContact CD2-CD1 4.06Å; L250-I265 HydrophobicContact CD2-CG1 3.6Å; L250-F309 CarbonylContact C-O 3.58Å; L250-F309 WeakPolarHBondContact CA-O 3.29Å
251	K	92.9	Very high	94.6	Very high	89 Å²	89	35.1 Å²	35.1	39%	0.387	18%	0.183	S	C	.	.			trans	-61.5	129.6	173.3	-67.8	-175.3	-175	172.3	0	109.4	Y180 Y249 T308 F309 G310 I311	Y180-K251 PolarHBondContact OH-O 3Å; Y180-K251 VanDerWaalsContact OH-O 3.12Å; Y249-K251 HydrophobicContact CD1-CG 4.45Å; Y249-K251 HydrophobicContact CE1-CG 4.16Å; K251-T308 WeakPolarHBondContact CD-O 3.47Å; K251-F309 PolarHBondContact N-O 2.76Å; K251-G310 WeakPolarHBondContact CE-O 3.42Å; K251-I311 HydrophobicContact CD-CG1 4.23Å; K251-I311 HydrophobicContact CG-CD1 4.25Å; K251-I311 HydrophobicContact CG-CG1 3.93Å
252	N	92.8	Very high	94.6	Very high	34 Å²	34	34 Å²	34	18%	0.182	17%	0.172	C	C	.	.			trans	-151.5	144.1	176	-165.2	-79.6	0	0	0	110.1	Y180 L250 H254 N255 L261	Y180-N252 PolarHBondContact OH-ND2 2.91Å; L250-N252 PolarHBondContact O-N 3.25Å; N252-H254 PolarHBondContact O-N 3.31Å; N252-H254 VanDerWaalsContact OD1-CB 3.31Å; N252-H254 WeakPolarHBondContact OD1-CB 3.4Å; N252-H254 PolarHBondContact OD1-CD2 3.4Å; N252-H254 VanDerWaalsContact OD1-CD2 3.27Å; N252-H254 PolarHBondContact OD1-N 3.31Å; N252-N255 PolarHBondContact N-ND2 2.9Å; N252-N255 WeakPolarHBondContact O-CB 3.47Å; N252-N255 PolarHBondContact O-N 3.05Å; N252-L261 HydrophobicContact CB-CD1 3.7Å; N252-L261 HydrophobicContact CB-CG 4.16Å
253	K	90.4	Very high	94.5	Very high	78 Å²	78	30.8 Å²	30.8	34%	0.339	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.3	176	66.4	176	-164	172.1	0	114.5	P108 Y201	P108-K253 HydrophobicContact CB-CD 4.03Å; P108-K253 WeakPolarHBondContact CD-O 3.42Å; P108-K253 HydrophobicContact CG-CB 3.86Å; P108-K253 HydrophobicContact CG-CD 3.61Å; P108-K253 HydrophobicContact CG-CG 3.75Å; Y201-K253 HydrophobicContact CD1-CD 4.14Å; Y201-K253 HydrophobicContact CE1-CD 3.64Å; Y201-K253 HydrophobicContact CE2-CD 4.05Å; Y201-K253 VanDerWaalsContact OH-CE 3.28Å; Y201-K253 WeakPolarHBondContact OH-CE 3.29Å; Y201-K253 PolarHBondContact OH-NZ 2.83Å
254	H	92.8	Very high	94.4	Very high	29 Å²	29	26.7 Å²	26.7	13%	0.134	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-1	177.4	-62.7	-58.2	0	0	0	113.6	Y107 L170 N252	Y107-H254 AromaticContact CE1-ND1 3.85Å; Y107-H254 AromaticContact CZ-ND1 3.75Å; Y107-H254 WeakPolarHBondContact OH-CA 3.4Å; Y107-H254 WeakPolarHBondContact OH-CB 3.3Å; Y107-H254 PolarHBondContact OH-ND1 2.83Å; Y107-H254 PolarHBondContact OH-O 3.11Å; Y107-H254 VanDerWaalsContact OH-O 3.09Å; L170-H254 HydrophobicContact CD2-CB 4.15Å; N252-H254 PolarHBondContact O-N 3.31Å; N252-H254 VanDerWaalsContact OD1-CB 3.31Å; N252-H254 WeakPolarHBondContact OD1-CB 3.4Å; N252-H254 PolarHBondContact OD1-CD2 3.4Å; N252-H254 VanDerWaalsContact OD1-CD2 3.27Å; N252-H254 PolarHBondContact OD1-N 3.31Å
255	N	95.1	Very high	94.5	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.021	12%	0.123	C	C	.	.			trans	-68.2	140.5	173.3	-66.7	-7	0	0	0	109.6	T162 Y249 L250 N252 W260 L261	T162-N255 HydrophobicContact CG2-CB 4.21Å; T162-N255 PolarHBondContact OG1-O 3.35Å; Y249-N255 PolarHBondContact OH-ND2 3.39Å; L250-N255 PolarHBondContact O-ND2 3.31Å; N252-N255 PolarHBondContact N-ND2 2.9Å; N252-N255 WeakPolarHBondContact O-CB 3.47Å; N252-N255 PolarHBondContact O-N 3.05Å; N255-W260 HydrophobicContact CB-CB 4.16Å; N255-W260 WeakPolarHBondContact OD1-CA 3.01Å; N255-L261 PolarHBondContact OD1-N 2.65Å
256	T	95.5	Very high	94.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.12	C	C	.	.			trans	-121.4	178.1	176.6	67.3	0	0	0	0	109.5	Y107 L136 N157 T162 F164 G166 N258 A259	Y107-T256 HydrophobicContact CE2-CG2 3.86Å; L136-T256 HydrophobicContact CD1-CG2 4.13Å; N157-T256 PolarHBondContact ND2-O 2.97Å; N157-T256 VanDerWaalsContact ND2-O 3.12Å; T162-T256 WeakPolarHBondContact CG2-O 3.46Å; T162-T256 VanDerWaalsContact OG1-C 3.28Å; T162-T256 WeakPolarHBondContact OG1-CA 3.48Å; F164-T256 HydrophobicContact CB-CG2 4.22Å; F164-T256 WeakPolarHBondContact O-CB 3.38Å; G166-T256 WeakPolarHBondContact O-CB 3.42Å; G166-T256 WeakPolarHBondContact O-CG2 3.04Å; G166-T256 PolarHBondContact O-OG1 3.33Å; T256-N258 PolarHBondContact O-N 2.86Å; T256-N258 PolarHBondContact OG1-N 2.75Å; T256-N258 VanDerWaalsContact OG1-N 3.13Å; T256-A259 PolarHBondContact N-O 3.11Å; T256-A259 PolarHBondContact OG1-N 2.82Å; T256-A259 PolarHBondContact OG1-O 3.01Å; T256-A259 VanDerWaalsContact OG1-O 3.13Å
257	D	95.2	Very high	94.7	Very high	9 Å²	9	23 Å²	23	5%	0.048	12%	0.121	C	C	.	.	S	Bend	trans	-65.7	-11.7	169.2	-93.9	49.4	0	0	0	113.1	R124 Y131 R156 N157 R161 T162 F164	R124-D257 IonicContact CZ-OD2 3.43Å; R124-D257 VanDerWaalsContact CZ-OD2 3.28Å; R124-D257 IonicContact NH1-OD2 2.75Å; R124-D257 PolarHBondContact NH1-OD2 3.13Å; R124-D257 PolarHBondContact NH2-O 3.03Å; R124-D257 IonicContact NH2-OD2 3.35Å; R124-D257 PolarHBondContact NH2-OD2 2.95Å; Y131-D257 WeakPolarHBondContact CE1-OD2 3.49Å; Y131-D257 PolarHBondContact OH-OD1 2.74Å; R156-D257 CarbonylContact C-O 3.55Å; R156-D257 WeakPolarHBondContact CA-O 3.38Å; N157-D257 PolarHBondContact N-O 2.8Å; R161-D257 WeakPolarHBondContact CA-OD1 3.45Å; T162-D257 PolarHBondContact N-OD1 3.11Å; T162-D257 PolarHBondContact OG1-N 3.22Å; F164-D257 WeakPolarHBondContact O-CB 3.46Å; F164-D257 PolarHBondContact O-N 3.29Å
258	N	94.9	Very high	94.9	Very high	9 Å²	9	18 Å²	18	5%	0.048	9%	0.091	C	C	.	.	S	Bend	trans	-130.9	-7.9	-172.9	-50.3	106.5	0	0	0	115.4	W154 I155 S165 G166 Y173 G174 T256	W154-N258 WeakPolarHBondContact CB-ND2 3.49Å; W154-N258 HydrophobicContact CE3-CB 4.36Å; I155-N258 VanDerWaalsContact O-CA 3.25Å; I155-N258 WeakPolarHBondContact O-CA 3.29Å; I155-N258 WeakPolarHBondContact O-CB 3.38Å; I155-N258 PolarHBondContact O-ND2 3.47Å; S165-N258 PolarHBondContact OG-OD1 2.77Å; S165-N258 VanDerWaalsContact OG-OD1 3.08Å; G166-N258 PolarHBondContact N-OD1 3.02Å; G166-N258 WeakPolarHBondContact O-CB 3.34Å; Y173-N258 HydrophobicContact CD1-CB 3.85Å; Y173-N258 HydrophobicContact CE1-CB 4.11Å; G174-N258 PolarHBondContact N-O 2.96Å; T256-N258 PolarHBondContact O-N 2.86Å; T256-N258 PolarHBondContact OG1-N 2.75Å; T256-N258 VanDerWaalsContact OG1-N 3.13Å
259	A	94.9	Very high	95.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	135	174.9	0	0	0	0	0	109.4	M167 L170 E172 G174 T256	M167-A259 HydrophobicContact CB-CB 4.49Å; M167-A259 HydrophobicContact CG-CB 4.13Å; L170-A259 HydrophobicContact CB-CB 4.01Å; L170-A259 HydrophobicContact CD1-CB 3.73Å; L170-A259 WeakPolarHBondContact CD1-O 3.44Å; L170-A259 HydrophobicContact CG-CB 4.4Å; E172-A259 VanDerWaalsContact O-CB 3.3Å; E172-A259 WeakPolarHBondContact O-CB 3.24Å; G174-A259 CarbonylContact O-C 3.53Å; G174-A259 WeakPolarHBondContact O-CA 3.46Å; T256-A259 PolarHBondContact N-O 3.11Å; T256-A259 PolarHBondContact OG1-N 2.82Å; T256-A259 PolarHBondContact OG1-O 3.01Å; T256-A259 VanDerWaalsContact OG1-O 3.13Å
260	W	96.2	Very high	95	Very high	13 Å²	13	20 Å²	20	5%	0.049	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	167.1	-178.4	60	94.6	0	0	0	111.9	I155 R156 N157 Y159 G174 A175 N176 Y249 N255 E262	I155-W260 HydrophobicContact CG2-CH2 3.66Å; I155-W260 HydrophobicContact CG2-CZ3 4.01Å; R156-W260 VanDerWaalsContact C-CZ3 3.47Å; R156-W260 VanDerWaalsContact O-CH2 3.24Å; R156-W260 WeakPolarHBondContact O-CH2 3.3Å; N157-W260 VanDerWaalsContact CA-CE3 3.49Å; N157-W260 HydrophobicContact CB-CD2 4.08Å; N157-W260 HydrophobicContact CB-CE3 3.48Å; N157-W260 VanDerWaalsContact CB-CE3 3.48Å; N157-W260 HydrophobicContact CB-CZ3 3.77Å; Y159-W260 AromaticContact CE2-NE1 3.88Å; G174-W260 PolarHBondContact O-N 3.09Å; A175-W260 CarbonylContact C-O 3.57Å; A175-W260 HydrophobicContact CB-CZ2 4.4Å; N176-W260 WeakPolarHBondContact CB-O 3.4Å; N176-W260 PolarHBondContact N-O 2.74Å; N176-W260 PolarHBondContact ND2-O 3.05Å; Y249-W260 HydrophobicContact CD2-CB 4.27Å; Y249-W260 AromaticContact CD2-CD1 3.41Å; Y249-W260 VanDerWaalsContact CD2-CD1 3.41Å; Y249-W260 AromaticContact CD2-CG 3.99Å; Y249-W260 HydrophobicContact CD2-CG 3.99Å; Y249-W260 HydrophobicContact CE2-CB 3.5Å; Y249-W260 AromaticContact CE2-CD1 3.51Å; Y249-W260 AromaticContact CE2-CG 3.59Å; Y249-W260 HydrophobicContact CE2-CG 3.59Å; N255-W260 HydrophobicContact CB-CB 4.16Å; N255-W260 WeakPolarHBondContact OD1-CA 3.01Å; W260-E262 PolarHBondContact NE1-OE1 3.37Å
261	L	95.4	Very high	94.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	136.8	174.1	-60.2	-170.4	0	0	0	111.7	L170 N176 A178 Y180 W208 L250 N252 N255	L170-L261 HydrophobicContact CD1-CD2 4.5Å; L170-L261 HydrophobicContact CD2-CD2 3.66Å; L170-L261 HydrophobicContact CD2-CG 4.36Å; N176-L261 HydrophobicContact CB-CD2 3.94Å; N176-L261 WeakPolarHBondContact O-CA 3.23Å; A178-L261 HydrophobicContact CB-CD1 4.32Å; A178-L261 HydrophobicContact CB-CD2 4.36Å; Y180-L261 HydrophobicContact CE1-CD1 4.18Å; W208-L261 HydrophobicContact CH2-CD2 3.86Å; W208-L261 HydrophobicContact CZ3-CD2 3.51Å; L250-L261 HydrophobicContact CB-CB 3.9Å; L250-L261 PolarHBondContact N-O 3.32Å; N252-L261 HydrophobicContact CB-CD1 3.7Å; N252-L261 HydrophobicContact CB-CG 4.16Å; N255-L261 PolarHBondContact OD1-N 2.65Å
262	E	94.6	Very high	94.4	Very high	54 Å²	54	21.3 Å²	21.3	25%	0.252	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	151.4	168.2	-72.5	-173.3	-173.7	0	0	110.7	Y159 A175 N176 A177 A178 G248 W260	Y159-E262 WeakPolarHBondContact CE2-OE1 3.25Å; Y159-E262 PolarHBondContact OH-OE1 2.88Å; A175-E262 HydrophobicContact CB-CB 4.16Å; A175-E262 HydrophobicContact CB-CG 3.8Å; A175-E262 WeakPolarHBondContact CB-OE2 3.43Å; N176-E262 PolarHBondContact O-N 3.15Å; A177-E262 CarbonylContact C-O 3.48Å; A177-E262 VanDerWaalsContact CA-O 3.25Å; A177-E262 WeakPolarHBondContact CA-O 3.32Å; A178-E262 PolarHBondContact N-O 2.94Å; G248-E262 CarbonylContact O-C 2.9Å; G248-E262 VanDerWaalsContact O-CA 3.31Å; G248-E262 WeakPolarHBondContact O-CA 3.48Å; W260-E262 PolarHBondContact NE1-OE1 3.37Å
263	G	94.6	Very high	93.8	Very high	12 Å²	12	26.8 Å²	26.8	12%	0.124	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.6	-139.3	172.8	0	0	0	0	0	111	A178 V247 G248	A178-G263 VanDerWaalsContact O-CA 3.31Å; A178-G263 WeakPolarHBondContact O-CA 3.12Å; V247-G263 CarbonylContact C-O 3.49Å; V247-G263 VanDerWaalsContact CA-O 3.27Å; V247-G263 WeakPolarHBondContact CA-O 3.36Å; G248-G263 PolarHBondContact N-O 2.97Å; G248-G263 PolarHBondContact O-N 2.94Å
264	A	95.1	Very high	93.4	Very high	3 Å²	3	33 Å²	33	3%	0.025	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	151.7	-170.8	0	0	0	0	0	113.3	A178 L179 Y180 I214 H246 V247 I266	A178-A264 PolarHBondContact O-N 3.13Å; L179-A264 HydrophobicContact CD1-CB 4.31Å; Y180-A264 PolarHBondContact N-O 2.8Å; I214-A264 HydrophobicContact CG1-CB 3.98Å; H246-A264 CarbonylContact O-C 3.43Å; H246-A264 VanDerWaalsContact O-CA 3.24Å; H246-A264 WeakPolarHBondContact O-CA 3.34Å; V247-A264 HydrophobicContact CG2-CB 4.21Å; A264-I266 HydrophobicContact CB-CD1 4.04Å; A264-I266 HydrophobicContact CB-CG1 4.21Å
265	I	97.1	Very high	93	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	108.5	163	-50.3	175.9	0	0	0	107.4	Y180 L182 L204 Y245 H246 L250 A306 F309	Y180-I265 HydrophobicContact CD2-CG1 4.37Å; Y180-I265 WeakPolarHBondContact O-CA 3.41Å; L182-I265 HydrophobicContact CB-CG2 4.38Å; L204-I265 HydrophobicContact CD1-CG2 4.06Å; Y245-I265 PolarHBondContact N-O 2.99Å; H246-I265 HydrophobicContact CB-CB 3.99Å; H246-I265 HydrophobicContact CB-CD1 3.78Å; H246-I265 HydrophobicContact CB-CG1 3.87Å; H246-I265 PolarHBondContact N-O 3.17Å; H246-I265 PolarHBondContact O-N 3.09Å; L250-I265 HydrophobicContact CD2-CD1 4.06Å; L250-I265 HydrophobicContact CD2-CG1 3.6Å; I265-A306 WeakPolarHBondContact CD1-O 3.36Å; I265-A306 HydrophobicContact CG2-CB 3.88Å; I265-F309 HydrophobicContact CD1-CB 3.79Å
266	I	97.3	Very high	92.8	Very high	9 Å²	9	32.7 Å²	32.7	5%	0.046	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.7	179.5	-58.2	-58.2	0	0	0	108.8	L179 Y180 L181 L182 I214 I219 R242 A264 L268	L179-I266 HydrophobicContact CD1-CB 4.2Å; L179-I266 HydrophobicContact CD1-CG1 3.58Å; Y180-I266 PolarHBondContact O-N 3.49Å; L181-I266 HydrophobicContact CD2-CB 4.24Å; L182-I266 PolarHBondContact N-O 2.76Å; I214-I266 HydrophobicContact CG2-CG1 4.11Å; I219-I266 HydrophobicContact CD1-CG1 4.34Å; I219-I266 HydrophobicContact CD1-CG2 4.07Å; R242-I266 HydrophobicContact CB-CG2 4.02Å; R242-I266 HydrophobicContact CG-CG2 4.46Å; A264-I266 HydrophobicContact CB-CD1 4.04Å; A264-I266 HydrophobicContact CB-CG1 4.21Å; I266-L268 HydrophobicContact CG2-CD2 4.17Å; I266-L268 HydrophobicContact CG2-CG 4.43Å
267	H	97.9	Very high	92.7	Very high	17 Å²	17	33 Å²	33	8%	0.079	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.8	173.4	172	-114	0	0	0	111	L182 T184 R242 Q243 Y245	L182-H267 CarbonylContact O-C 3.47Å; L182-H267 VanDerWaalsContact O-CA 3.28Å; L182-H267 WeakPolarHBondContact O-CA 3.4Å; L182-H267 PolarHBondContact O-CD2 3.27Å; T184-H267 WeakPolarHBondContact CG2-NE2 3.28Å; T184-H267 PolarHBondContact OG1-NE2 3.02Å; R242-H267 WeakPolarHBondContact CA-O 3.3Å; Q243-H267 HydrophobicContact CB-CB 4.36Å; Q243-H267 PolarHBondContact N-O 3.34Å; Q243-H267 PolarHBondContact O-N 2.05Å; Y245-H267 HydrophobicContact CD1-CB 4.26Å; Y245-H267 HydrophobicContact CD2-CB 3.54Å; Y245-H267 HydrophobicContact CE1-CB 4.05Å; Y245-H267 HydrophobicContact CE2-CB 3.29Å; Y245-H267 AromaticContact CE2-CG 3.42Å; Y245-H267 VanDerWaalsContact CE2-CG 3.42Å; Y245-H267 AromaticContact CE2-ND1 3.87Å; Y245-H267 HydrophobicContact CG-CB 4.03Å; Y245-H267 AromaticContact CZ-CG 3.54Å; Y245-H267 AromaticContact CZ-ND1 3.49Å; Y245-H267 PolarHBondContact OH-ND1 3.23Å
268	L	97.4	Very high	92.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.5	175.2	-57.3	172.6	0	0	0	107.7	L181 L182 I183 T184 I219 V223 M238 V239 R242 I266	L181-L268 HydrophobicContact CD1-CD1 4.45Å; L181-L268 HydrophobicContact CD2-CD1 4.28Å; L182-L268 PolarHBondContact O-N 2.91Å; I183-L268 VanDerWaalsContact CA-O 3.3Å; I183-L268 WeakPolarHBondContact CA-O 3.15Å; I183-L268 HydrophobicContact CG1-CB 4.15Å; I183-L268 HydrophobicContact CG1-CD1 4.23Å; T184-L268 PolarHBondContact N-O 2.79Å; I219-L268 HydrophobicContact CG2-CD1 4.12Å; I219-L268 HydrophobicContact CG2-CD2 4.22Å; V223-L268 HydrophobicContact CG2-CD1 3.27Å; M238-L268 WeakPolarHBondContact O-CD2 3.34Å; V239-L268 HydrophobicContact CG2-CD2 4.43Å; R242-L268 HydrophobicContact CB-CD2 3.61Å; I266-L268 HydrophobicContact CG2-CD2 4.17Å; I266-L268 HydrophobicContact CG2-CG 4.43Å
269	H	95.9	Very high	92	Very high	55 Å²	55	37.4 Å²	37.4	26%	0.255	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119.1	177.1	-169.3	34.1	0	0	0	110.3	T184 M238 N271	T184-H269 PolarHBondContact O-ND1 3.32Å; T184-H269 PolarHBondContact OG1-ND1 2.81Å; M238-H269 WeakPolarHBondContact CG-O 3.47Å; H269-N271 PolarHBondContact CD2-OD1 2.89Å; H269-N271 PolarHBondContact NE2-OD1 3.14Å; H269-N271 PolarHBondContact O-N 3Å; H269-N271 VanDerWaalsContact O-N 3.12Å
270	D	94.5	Very high	91.8	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.032	23%	0.227	C	C	.	.			trans	-74.6	98.8	173.4	-177	5.9	0	0	0	109.7	T184 R185 M238 S272 G275 C276 F277	T184-D270 PolarHBondContact O-N 2.81Å; R185-D270 HydrophobicContact CB-CB 4.39Å; M238-D270 HydrophobicContact SD-CB 4.15Å; D270-S272 WeakPolarHBondContact OD1-CB 3.06Å; D270-S272 PolarHBondContact OD1-N 2.86Å; D270-S272 VanDerWaalsContact OD1-N 3.1Å; D270-S272 PolarHBondContact OD1-OG 3.12Å; D270-G275 WeakPolarHBondContact OD2-CA 3.05Å; D270-C276 PolarHBondContact OD2-N 2.82Å; D270-C276 VanDerWaalsContact OD2-N 3.08Å; D270-F277 HydrophobicContact CB-CD2 4.22Å; D270-F277 HydrophobicContact CB-CE2 4.34Å
271	N	88.9	Confident	91.7	Very high	94 Å²	94	44.9 Å²	44.9	50%	0.503	23%	0.226	S	C	.	.			trans	-93.4	5.7	178.2	-75.8	-18.6	0	0	0	113.4	H269	H269-N271 PolarHBondContact CD2-OD1 2.89Å; H269-N271 PolarHBondContact NE2-OD1 3.14Å; H269-N271 PolarHBondContact O-N 3Å; H269-N271 VanDerWaalsContact O-N 3.12Å
272	S	86.7	Confident	91.4	Very high	21 Å²	21	48.5 Å²	48.5	15%	0.147	25%	0.248	C	C	.	.			trans	-69.7	142.6	178.8	61.8	0	0	0	0	110.7	E234 D270 Y274 G275 C276	E234-S272 WeakPolarHBondContact OE1-CB 3.42Å; D270-S272 WeakPolarHBondContact OD1-CB 3.06Å; D270-S272 PolarHBondContact OD1-N 2.86Å; D270-S272 VanDerWaalsContact OD1-N 3.1Å; D270-S272 PolarHBondContact OD1-OG 3.12Å; S272-Y274 PolarHBondContact O-N 3.32Å; S272-Y274 VanDerWaalsContact O-N 3.11Å; S272-G275 PolarHBondContact O-N 3.04Å; S272-G275 VanDerWaalsContact O-N 3.08Å; S272-G275 VanDerWaalsContact OG-C 3.24Å; S272-G275 WeakPolarHBondContact OG-CA 3.3Å; S272-G275 PolarHBondContact OG-N 3.49Å; S272-G275 VanDerWaalsContact OG-N 3.15Å; S272-C276 PolarHBondContact OG-N 3.07Å
273	D	80	Confident	91.3	Very high	149 Å²	149	46 Å²	46	80%	0.797	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-40.4	-173	-63.2	-32.1	0	0	0	112.4
274	Y	80.8	Confident	91.1	Very high	209 Å²	209	49.1 Å²	49.1	82%	0.82	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-2.6	-178.3	-57	-70.7	0	0	0	114.3	R185 S272	R185-Y274 VanDerWaalsContact CZ-C 3.42Å; R185-Y274 PolarHBondContact NH1-O 3.47Å; R185-Y274 PolarHBondContact NH2-O 3.19Å; S272-Y274 PolarHBondContact O-N 3.32Å; S272-Y274 VanDerWaalsContact O-N 3.11Å
275	G	85.1	Confident	90.8	Very high	16 Å²	16	53 Å²	53	17%	0.165	27%	0.274	C	S	.	.			trans	69.7	117.3	-170.7	0	0	0	0	0	111.9	R185 D270 S272 F277	R185-G275 VanDerWaalsContact CZ-N 3.34Å; D270-G275 WeakPolarHBondContact OD2-CA 3.05Å; S272-G275 PolarHBondContact O-N 3.04Å; S272-G275 VanDerWaalsContact O-N 3.08Å; S272-G275 VanDerWaalsContact OG-C 3.24Å; S272-G275 WeakPolarHBondContact OG-CA 3.3Å; S272-G275 PolarHBondContact OG-N 3.49Å; S272-G275 VanDerWaalsContact OG-N 3.15Å; G275-F277 VanDerWaalsContact C-N 3.35Å
276	C	91	Very high	90.4	Very high	10 Å²	10	53.6 Å²	53.6	7%	0.068	28%	0.279	C	S	.	.	S	Bend	trans	-82.3	-20.8	-171.6	78.5	0	0	0	0	111.7	C230 D270 S272	C230-C276 HydrophobicContact CB-CB 3.7Å; C230-C276 WeakPolarHBondContact CB-SG 3.47Å; C230-C276 WeakPolarHBondContact SG-CB 3.39Å; C230-C276 PolarHBondContact SG-O 2.86Å; C230-C276 VanDerWaalsContact SG-O 3.34Å; C230-C276 CovalentContact SG-SG 2.05Å; C230-C276 PolarHBondContact SG-SG 2.93Å; D270-C276 PolarHBondContact OD2-N 2.82Å; D270-C276 VanDerWaalsContact OD2-N 3.08Å; S272-C276 PolarHBondContact OG-N 3.07Å
277	F	92.1	Very high	89.8	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.026	31%	0.312	C	S	.	.	S	Bend	trans	-78.1	138.1	172	-65.2	-90.3	0	0	0	110.9	I183 I194 V223 N227 M238 D270 G275 P281 W293	I183-F277 HydrophobicContact CD1-CE1 3.84Å; I183-F277 HydrophobicContact CD1-CE2 4.38Å; I183-F277 HydrophobicContact CD1-CZ 3.65Å; I183-F277 HydrophobicContact CG1-CZ 4.44Å; I183-F277 HydrophobicContact CG2-CD2 4.13Å; I183-F277 HydrophobicContact CG2-CE2 3.72Å; I183-F277 HydrophobicContact CG2-CZ 4.11Å; I194-F277 HydrophobicContact CD1-CB 4.16Å; I194-F277 HydrophobicContact CD1-CD1 3.83Å; I194-F277 HydrophobicContact CD1-CD2 4.31Å; I194-F277 HydrophobicContact CD1-CE1 4.29Å; I194-F277 HydrophobicContact CD1-CG 3.84Å; V223-F277 HydrophobicContact CG1-CE1 4.31Å; V223-F277 HydrophobicContact CG1-CZ 3.85Å; N227-F277 HydrophobicContact CB-CD1 3.61Å; N227-F277 HydrophobicContact CB-CE1 3.65Å; M238-F277 HydrophobicContact CE-CE2 3.7Å; M238-F277 HydrophobicContact CE-CZ 4.02Å; M238-F277 HydrophobicContact SD-CE2 3.74Å; M238-F277 HydrophobicContact SD-CZ 4.36Å; D270-F277 HydrophobicContact CB-CD2 4.22Å; D270-F277 HydrophobicContact CB-CE2 4.34Å; G275-F277 VanDerWaalsContact C-N 3.35Å; F277-P281 HydrophobicContact CB-CG 4.46Å; F277-W293 HydrophobicContact CB-CZ2 3.98Å
278	S	88.7	Confident	89.3	Confident	16 Å²	16	63.5 Å²	63.5	11%	0.112	35%	0.345	C	S	.	.			trans	-60.7	159.1	172.1	48.5	0	0	0	0	111.9	Y280 P281 W293	S278-Y280 PolarHBondContact O-N 3.21Å; S278-Y280 VanDerWaalsContact O-N 3.11Å; S278-Y280 PolarHBondContact OG-O 2.92Å; S278-P281 WeakPolarHBondContact O-CD 3.5Å; S278-P281 WeakPolarHBondContact OG-CA 3.18Å; S278-W293 PolarHBondContact O-NE1 3.29Å
279	P	87.8	Confident	88.8	Confident	96 Å²	96	66 Å²	66	62%	0.623	35%	0.354	S	S	*	.	S	Bend	trans	-53.9	-29.7	170.6	-27.5	35.6	0	0	0	113.3
280	Y	91.1	Very high	88.7	Confident	164 Å²	164	72.5 Å²	72.5	64%	0.643	38%	0.377	S	S	*	.	S	Bend	trans	-122.2	88.8	173.3	-54.8	-76.2	0	0	0	109.6	S278 Y291 R292	S278-Y280 PolarHBondContact O-N 3.21Å; S278-Y280 VanDerWaalsContact O-N 3.11Å; S278-Y280 PolarHBondContact OG-O 2.92Å; Y280-Y291 WeakPolarHBondContact CA-O 3.28Å; Y280-R292 HydrophobicContact CD1-CB 4.4Å
281	P	92.7	Very high	88.6	Confident	6 Å²	6	72.4 Å²	72.4	4%	0.039	38%	0.376	C	S	.	.			trans	-58.5	145.8	177.5	-24.7	35.2	0	0	0	111.8	I194 L226 F277 S278	I194-P281 HydrophobicContact CD1-CB 4.3Å; I194-P281 HydrophobicContact CD1-CG 3.65Å; I194-P281 HydrophobicContact CG1-CG 4.03Å; I194-P281 HydrophobicContact CG2-CB 4.33Å; I194-P281 HydrophobicContact CG2-CG 3.95Å; L226-P281 WeakPolarHBondContact O-CB 3.48Å; F277-P281 HydrophobicContact CB-CG 4.46Å; S278-P281 WeakPolarHBondContact O-CD 3.5Å; S278-P281 WeakPolarHBondContact OG-CA 3.18Å
282	V	90.9	Very high	88.9	Confident	76 Å²	76	71.8 Å²	71.8	46%	0.461	37%	0.367	S	S	.	.			trans	-108.6	129.2	-175.7	177.8	0	0	0	0	109.4	L226	L226-V282 CarbonylContact C-O 3.51Å; L226-V282 WeakPolarHBondContact CA-O 3.43Å; L226-V282 PolarHBondContact O-N 3.34Å
283	H	92.3	Very high	89.2	Confident	2 Å²	2	73 Å²	73	1%	0.009	37%	0.368	C	S	.	.			trans	-105	96.8	176.8	-165.7	-52.8	0	0	0	110.9	R206 F207 K225 L226 E285 A286 A287 Y291	R206-H283 PolarHBondContact O-NE2 3.23Å; F207-H283 AromaticContact CD1-CE1 3.63Å; F207-H283 AromaticContact CD1-NE2 3.62Å; F207-H283 AromaticContact CE1-CD2 3.92Å; F207-H283 AromaticContact CE1-CE1 3.33Å; F207-H283 WeakPolarHBondContact CE1-CE1 3.47Å; F207-H283 AromaticContact CE1-NE2 3.22Å; F207-H283 WeakPolarHBondContact CE1-NE2 3.25Å; F207-H283 AromaticContact CE2-NE2 3.97Å; F207-H283 AromaticContact CZ-CD2 3.77Å; F207-H283 AromaticContact CZ-CE1 3.96Å; F207-H283 AromaticContact CZ-NE2 3.39Å; F207-H283 WeakPolarHBondContact CZ-NE2 3.31Å; K225-H283 CarbonylContact O-C 3.57Å; K225-H283 WeakPolarHBondContact O-CA 3.41Å; L226-H283 HydrophobicContact CD1-CB 4.05Å; H283-E285 VanDerWaalsContact C-N 3.28Å; H283-E285 PolarHBondContact ND1-N 2.99Å; H283-E285 PolarHBondContact O-N 3.3Å; H283-A286 HydrophobicContact CB-CB 4.49Å; H283-A286 PolarHBondContact ND1-N 2.94Å; H283-A286 CarbonylContact O-C 3.6Å; H283-A286 PolarHBondContact O-N 3.17Å; H283-A287 PolarHBondContact O-N 3.12Å; H283-Y291 HydrophobicContact CB-CD2 4.02Å; H283-Y291 HydrophobicContact CB-CE2 3.45Å; H283-Y291 VanDerWaalsContact CB-CE2 3.45Å; H283-Y291 AromaticContact CD2-CE2 3.79Å; H283-Y291 AromaticContact CD2-CZ 3.86Å; H283-Y291 AromaticContact CG-CE2 3.98Å
284	S	89.8	Confident	89.8	Confident	77 Å²	77	69.3 Å²	69.3	54%	0.538	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-28.9	-172.7	59.4	0	0	0	0	114.4	K225 A286	K225-S284 WeakPolarHBondContact CB-OG 3.2Å; K225-S284 WeakPolarHBondContact CG-OG 3.48Å; K225-S284 PolarHBondContact O-N 3.03Å; K225-S284 PolarHBondContact O-OG 3.47Å; S284-A286 VanDerWaalsContact C-N 3.33Å
285	E	89.1	Confident	90.4	Very high	83 Å²	83	66 Å²	66	39%	0.388	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-8.9	173.7	-73.9	178.2	179.8	0	0	113.9	K222 K225 H283	K222-E285 IonicContact NZ-OE1 2.86Å; K222-E285 PolarHBondContact NZ-OE1 3.29Å; K222-E285 IonicContact NZ-OE2 2.95Å; K222-E285 PolarHBondContact NZ-OE2 2.68Å; K225-E285 HydrophobicContact CD-CG 3.93Å; K225-E285 WeakPolarHBondContact CD-OE1 3.28Å; K225-E285 WeakPolarHBondContact CE-OE1 3.28Å; K225-E285 IonicContact NZ-OE1 3.87Å; K225-E285 PolarHBondContact NZ-OE1 3.41Å; H283-E285 VanDerWaalsContact C-N 3.28Å; H283-E285 PolarHBondContact ND1-N 2.99Å; H283-E285 PolarHBondContact O-N 3.3Å
286	A	88.2	Confident	90.8	Very high	13 Å²	13	65.5 Å²	65.5	11%	0.107	33%	0.327	C	S	.	.			trans	-149.1	57.6	-175	0	0	0	0	0	110.2	H283 S284 N288 R289	H283-A286 HydrophobicContact CB-CB 4.49Å; H283-A286 PolarHBondContact ND1-N 2.94Å; H283-A286 CarbonylContact O-C 3.6Å; H283-A286 PolarHBondContact O-N 3.17Å; S284-A286 VanDerWaalsContact C-N 3.33Å; A286-N288 PolarHBondContact O-N 3.12Å; A286-R289 HydrophobicContact CB-CB 4.47Å; A286-R289 HydrophobicContact CB-CG 4.11Å; A286-R289 WeakPolarHBondContact O-CB 3.43Å; A286-R289 PolarHBondContact O-N 3.47Å
287	A	85.3	Confident	90.9	Very high	90 Å²	90	68.7 Å²	68.7	74%	0.744	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-18.9	-170.4	0	0	0	0	0	114.8	H283 R289	H283-A287 PolarHBondContact O-N 3.12Å; A287-R289 VanDerWaalsContact C-N 3.31Å
288	N	86.8	Confident	90.7	Very high	144 Å²	144	75 Å²	75	77%	0.77	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.6	174.4	64.7	-14.3	0	0	0	113.6	A286	A286-N288 PolarHBondContact O-N 3.12Å
289	R	88.1	Confident	90.9	Very high	52 Å²	52	80.7 Å²	80.7	20%	0.196	42%	0.415	C	S	.	.			trans	-85.1	132.5	176.4	-64.2	-175.3	-175.8	153.8	8.6	110	E196 A286 A287 Y291	E196-R289 HydrophobicContact CG-CB 4.35Å; E196-R289 IonicContact OE2-NE 2.83Å; A286-R289 HydrophobicContact CB-CB 4.47Å; A286-R289 HydrophobicContact CB-CG 4.11Å; A286-R289 WeakPolarHBondContact O-CB 3.43Å; A286-R289 PolarHBondContact O-N 3.47Å; A287-R289 VanDerWaalsContact C-N 3.31Å; R289-Y291 HydrophobicContact CB-CD2 4.45Å; R289-Y291 HydrophobicContact CB-CE2 3.62Å; R289-Y291 VanDerWaalsContact CD-OH 3.22Å; R289-Y291 WeakPolarHBondContact CD-OH 3.33Å
290	R	92.2	Very high	91.2	Very high	193 Å²	193	78.3 Å²	78.3	73%	0.728	40%	0.399	S	S	*	.			trans	-99.9	140.9	174.3	-64.1	-177.9	-178.8	-179.1	0.1	108.6	E196 D197	E196-R290 CarbonylContact C-O 3.59Å; E196-R290 WeakPolarHBondContact CA-O 3.29Å; D197-R290 HydrophobicContact CB-CB 4.03Å; D197-R290 PolarHBondContact N-O 3.06Å
291	Y	94.1	Very high	91.3	Very high	4 Å²	4	73.7 Å²	73.7	2%	0.016	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	144.9	177.5	-67.5	-85.6	0	0	0	109.6	I194 A195 E196 P205 L226 Y280 H283 R289	I194-Y291 HydrophobicContact CG2-CD1 4.15Å; I194-Y291 HydrophobicContact CG2-CG 4.42Å; A195-Y291 WeakPolarHBondContact O-CA 3.48Å; E196-Y291 HydrophobicContact CB-CD1 4.15Å; E196-Y291 HydrophobicContact CB-CE1 3.75Å; E196-Y291 HydrophobicContact CG-CE1 4.18Å; P205-Y291 HydrophobicContact CB-CE1 4.01Å; P205-Y291 HydrophobicContact CG-CD1 3.88Å; P205-Y291 HydrophobicContact CG-CE1 3.73Å; L226-Y291 HydrophobicContact CD1-CD2 4.34Å; L226-Y291 HydrophobicContact CD1-CE2 4.45Å; Y280-Y291 WeakPolarHBondContact CA-O 3.28Å; H283-Y291 HydrophobicContact CB-CD2 4.02Å; H283-Y291 HydrophobicContact CB-CE2 3.45Å; H283-Y291 VanDerWaalsContact CB-CE2 3.45Å; H283-Y291 AromaticContact CD2-CE2 3.79Å; H283-Y291 AromaticContact CD2-CZ 3.86Å; H283-Y291 AromaticContact CG-CE2 3.98Å; R289-Y291 HydrophobicContact CB-CD2 4.45Å; R289-Y291 HydrophobicContact CB-CE2 3.62Å; R289-Y291 VanDerWaalsContact CD-OH 3.22Å; R289-Y291 WeakPolarHBondContact CD-OH 3.33Å
292	R	93.6	Very high	91.4	Very high	81 Å²	81	74.8 Å²	74.8	31%	0.306	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	161	173.3	62	172.1	161.7	170.6	-17.2	111.4	A195 D197 Y280 R294	A195-R292 PolarHBondContact N-O 3.28Å; A195-R292 PolarHBondContact O-N 3.48Å; D197-R292 HydrophobicContact CB-CG 4.12Å; D197-R292 IonicContact OD1-CZ 3.11Å; D197-R292 IonicContact OD1-NE 2.58Å; D197-R292 PolarHBondContact OD1-NE 2.83Å; D197-R292 IonicContact OD1-NH2 3.9Å; D197-R292 PolarHBondContact OD1-NH2 3.06Å; D197-R292 IonicContact OD2-CZ 3.49Å; D197-R292 IonicContact OD2-NE 3.59Å; D197-R292 PolarHBondContact OD2-NE 2.64Å; D197-R292 IonicContact OD2-NH2 3.42Å; Y280-R292 HydrophobicContact CD1-CB 4.4Å; R292-R294 VanDerWaalsContact NE-NE 3.18Å
293	W	93.1	Very high	91.7	Very high	46 Å²	46	75.9 Å²	75.9	17%	0.174	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	130	168.2	-68.6	96.1	0	0	0	110.7	I183 R185 K192 I193 I194 F277 S278	I183-W293 HydrophobicContact CG2-CH2 4.1Å; R185-W293 HydrophobicContact CB-CE3 4.44Å; R185-W293 HydrophobicContact CB-CH2 3.46Å; R185-W293 VanDerWaalsContact CB-CH2 3.46Å; R185-W293 HydrophobicContact CB-CZ2 4.25Å; R185-W293 HydrophobicContact CB-CZ3 3.59Å; K192-W293 HydrophobicContact CB-CB 4.41Å; K192-W293 HydrophobicContact CB-CD2 4.41Å; K192-W293 HydrophobicContact CB-CE3 3.62Å; K192-W293 HydrophobicContact CB-CZ3 4.26Å; K192-W293 HydrophobicContact CD-CB 4.44Å; I193-W293 CarbonylContact O-C 3.51Å; I193-W293 VanDerWaalsContact O-CA 3.28Å; I193-W293 WeakPolarHBondContact O-CA 3.42Å; I194-W293 HydrophobicContact CD1-CH2 3.98Å; I194-W293 HydrophobicContact CD1-CZ2 3.82Å; I194-W293 HydrophobicContact CG1-CD2 3.92Å; I194-W293 HydrophobicContact CG1-CE3 3.88Å; I194-W293 HydrophobicContact CG1-CH2 3.74Å; I194-W293 HydrophobicContact CG1-CZ2 3.75Å; I194-W293 HydrophobicContact CG1-CZ3 3.79Å; F277-W293 HydrophobicContact CB-CZ2 3.98Å; S278-W293 PolarHBondContact O-NE1 3.29Å
294	R	93.2	Very high	91.8	Very high	71 Å²	71	79.2 Å²	79.2	27%	0.268	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142	173.3	-63.6	-66.6	-163.2	152.3	9.3	109.2	K192 I193 A195 D197 R292	K192-R294 CarbonylContact C-O 3.55Å; K192-R294 WeakPolarHBondContact CA-O 3.46Å; I193-R294 HydrophobicContact CG1-CB 4.04Å; I193-R294 PolarHBondContact N-O 3.03Å; I193-R294 PolarHBondContact O-N 3.25Å; A195-R294 HydrophobicContact CB-CG 3.99Å; D197-R294 IonicContact OD1-NH2 2.69Å; D197-R294 PolarHBondContact OD1-NH2 3.23Å; R292-R294 VanDerWaalsContact NE-NE 3.18Å
295	F	93.6	Very high	92	Very high	140 Å²	140	76.8 Å²	76.8	61%	0.614	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	134.2	172.3	-65.5	-82	0	0	0	110	T190 K192	T190-F295 HydrophobicContact CG2-CD1 4.48Å; K192-F295 HydrophobicContact CD-CE1 4.28Å; K192-F295 HydrophobicContact CG-CD1 3.99Å; K192-F295 HydrophobicContact CG-CE1 4.22Å
296	L	93.6	Very high	92.3	Very high	6 Å²	6	72.8 Å²	72.8	3%	0.031	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.8	167.1	-173	66.9	0	0	0	107.5	T191 I193 T300 P302 F305	T191-L296 HydrophobicContact CG2-CB 4.34Å; T191-L296 HydrophobicContact CG2-CD2 4.15Å; T191-L296 WeakPolarHBondContact O-CB 3.35Å; T191-L296 PolarHBondContact O-N 2.68Å; I193-L296 HydrophobicContact CG2-CB 4.34Å; I193-L296 HydrophobicContact CG2-CD2 4.47Å; L296-T300 HydrophobicContact CD1-CG2 4.09Å; L296-T300 VanDerWaalsContact CD2-O 3.26Å; L296-T300 WeakPolarHBondContact CD2-O 3.49Å; L296-T300 WeakPolarHBondContact CG-O 3.46Å; L296-P302 HydrophobicContact CD2-CG 3.99Å; L296-F305 HydrophobicContact CD1-CB 3.75Å; L296-F305 HydrophobicContact CD1-CD1 4.44Å; L296-F305 HydrophobicContact CD1-CD2 3.71Å; L296-F305 HydrophobicContact CD1-CE2 4.46Å; L296-F305 HydrophobicContact CD1-CG 3.69Å
297	P	92.5	Very high	92.5	Very high	76 Å²	76	78.3 Å²	78.3	49%	0.494	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-57.8	141.5	177.1	-23.8	33.9	0	0	0	111.5	T299 T300	P297-T299 PolarHBondContact O-N 3.28Å; P297-T300 PolarHBondContact O-N 2.77Å
298	D	88.7	Confident	92.8	Very high	140 Å²	140	77.7 Å²	77.7	75%	0.749	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.7	-177.6	-59.9	-32.6	0	0	0	113.3	T300	D298-T300 VanDerWaalsContact C-N 3.28Å; D298-T300 PolarHBondContact O-N 3.1Å
299	T	92.8	Very high	93.2	Very high	134 Å²	134	71.9 Å²	71.9	82%	0.822	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-6.8	174.7	57.7	0	0	0	0	113.9	P297	P297-T299 PolarHBondContact O-N 3.28Å
300	T	93.1	Very high	93.2	Very high	46 Å²	46	69.8 Å²	69.8	28%	0.282	34%	0.337	S	S	.	.	S	Bend	trans	-123	118.8	-174.5	-55.5	0	0	0	0	110.4	L296 P297 D298 D304 F305	L296-T300 HydrophobicContact CD1-CG2 4.09Å; L296-T300 VanDerWaalsContact CD2-O 3.26Å; L296-T300 WeakPolarHBondContact CD2-O 3.49Å; L296-T300 WeakPolarHBondContact CG-O 3.46Å; P297-T300 PolarHBondContact O-N 2.77Å; D298-T300 VanDerWaalsContact C-N 3.28Å; D298-T300 PolarHBondContact O-N 3.1Å; T300-D304 HydrophobicContact CG2-CB 4.21Å; T300-F305 HydrophobicContact CG2-CB 3.92Å
301	T	94.4	Very high	92.8	Very high	68 Å²	68	62.6 Å²	62.6	42%	0.417	31%	0.313	S	S	.	.			trans	-73.4	155.2	173.9	74.3	0	0	0	0	111	R303 D304 F305	T301-R303 PolarHBondContact O-N 2.86Å; T301-R303 VanDerWaalsContact O-N 3.13Å; T301-R303 PolarHBondContact OG1-N 2.97Å; T301-D304 WeakPolarHBondContact CB-OD2 3.18Å; T301-D304 PolarHBondContact O-N 3.48Å; T301-D304 VanDerWaalsContact O-N 3.09Å; T301-D304 PolarHBondContact OG1-N 2.9Å; T301-D304 VanDerWaalsContact OG1-N 3.11Å; T301-D304 PolarHBondContact OG1-OD2 2.58Å; T301-F305 PolarHBondContact O-N 3.04Å
302	P	95.1	Very high	91.3	Very high	28 Å²	28	66.4 Å²	66.4	18%	0.182	34%	0.34	C	S	.	.	H	α-helix	trans	-52.2	-34.8	172	-30.9	37.7	0	0	0	113.5	L182 T184 T191 Y245 L296 A306	L182-P302 HydrophobicContact CD2-CB 3.98Å; L182-P302 WeakPolarHBondContact CD2-O 3.48Å; T184-P302 HydrophobicContact CG2-CB 3.94Å; T184-P302 HydrophobicContact CG2-CG 3.95Å; T191-P302 HydrophobicContact CG2-CG 4.44Å; Y245-P302 HydrophobicContact CE2-CB 3.92Å; L296-P302 HydrophobicContact CD2-CG 3.99Å; P302-A306 WeakPolarHBondContact O-CB 3.43Å; P302-A306 PolarHBondContact O-N 2.84Å
303	R	95.7	Very high	89.5	Confident	100 Å²	100	68.7 Å²	68.7	38%	0.377	36%	0.356	S	S	.	.	H	α-helix	trans	-68.1	-45.4	177.2	-178.3	-178.2	-70.9	-116.5	0.9	112	Y245 T301 F305 A306 R307	Y245-R303 HydrophobicContact CD1-CB 4.41Å; Y245-R303 HydrophobicContact CD1-CG 4.3Å; Y245-R303 HydrophobicContact CD2-CB 4.17Å; Y245-R303 HydrophobicContact CE1-CB 4.23Å; Y245-R303 HydrophobicContact CE2-CB 3.97Å; Y245-R303 HydrophobicContact CG-CB 4.38Å; Y245-R303 HydrophobicContact CG-CG 4.32Å; T301-R303 PolarHBondContact O-N 2.86Å; T301-R303 VanDerWaalsContact O-N 3.13Å; T301-R303 PolarHBondContact OG1-N 2.97Å; R303-F305 VanDerWaalsContact C-N 3.32Å; R303-A306 PolarHBondContact O-N 2.97Å; R303-R307 WeakPolarHBondContact O-CG 3.35Å; R303-R307 PolarHBondContact O-N 3.08Å
304	D	94.4	Very high	87.2	Confident	71 Å²	71	79.8 Å²	79.8	38%	0.38	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-41	178.6	-60.2	-39.6	0	0	0	110.8	T300 T301 R307 T308	T300-D304 HydrophobicContact CG2-CB 4.21Å; T301-D304 WeakPolarHBondContact CB-OD2 3.18Å; T301-D304 PolarHBondContact O-N 3.48Å; T301-D304 VanDerWaalsContact O-N 3.09Å; T301-D304 PolarHBondContact OG1-N 2.9Å; T301-D304 VanDerWaalsContact OG1-N 3.11Å; T301-D304 PolarHBondContact OG1-OD2 2.58Å; D304-R307 PolarHBondContact O-N 3.15Å; D304-R307 IonicContact OD1-NH1 3.86Å; D304-T308 PolarHBondContact O-N 2.84Å
305	F	94.8	Very high	86.9	Confident	26 Å²	26	80.2 Å²	80.2	11%	0.114	41%	0.412	C	S	.	.	H	α-helix	trans	-60	-47.5	173.2	-176.1	-100.9	0	0	0	112.2	L182 I193 I202 L204 L296 T300 T301 R303 R307 T308 F309	L182-F305 HydrophobicContact CD1-CD1 3.98Å; L182-F305 HydrophobicContact CD1-CE1 4.21Å; I193-F305 HydrophobicContact CD1-CD1 3.84Å; I193-F305 HydrophobicContact CD1-CE1 3.13Å; I193-F305 HydrophobicContact CD1-CE2 4.08Å; I193-F305 HydrophobicContact CD1-CZ 3.27Å; I202-F305 HydrophobicContact CG2-CZ 4.06Å; L204-F305 HydrophobicContact CD2-CE1 4.08Å; L296-F305 HydrophobicContact CD1-CB 3.75Å; L296-F305 HydrophobicContact CD1-CD1 4.44Å; L296-F305 HydrophobicContact CD1-CD2 3.71Å; L296-F305 HydrophobicContact CD1-CE2 4.46Å; L296-F305 HydrophobicContact CD1-CG 3.69Å; T300-F305 HydrophobicContact CG2-CB 3.92Å; T301-F305 PolarHBondContact O-N 3.04Å; R303-F305 VanDerWaalsContact C-N 3.32Å; F305-R307 VanDerWaalsContact C-N 3.28Å; F305-R307 PolarHBondContact O-N 3.08Å; F305-T308 WeakPolarHBondContact O-CB 3.5Å; F305-T308 WeakPolarHBondContact O-CG2 3.37Å; F305-T308 PolarHBondContact O-N 2.91Å; F305-T308 VanDerWaalsContact O-N 3.09Å; F305-T308 PolarHBondContact O-OG1 2.81Å; F305-F309 HydrophobicContact CD1-CE2 4.12Å; F305-F309 HydrophobicContact CE1-CD2 4.48Å; F305-F309 AromaticContact CE1-CE2 3.51Å; F305-F309 HydrophobicContact CE1-CE2 3.51Å; F305-F309 HydrophobicContact CE1-CZ 4.18Å; F305-F309 HydrophobicContact CE2-CE2 4.24Å; F305-F309 AromaticContact CZ-CE2 3.59Å; F305-F309 HydrophobicContact CZ-CE2 3.59Å; F305-F309 AromaticContact CZ-CZ 3.94Å; F305-F309 HydrophobicContact CZ-CZ 3.94Å; F305-F309 WeakPolarHBondContact O-CD2 2.99Å
306	A	95	Very high	86.5	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-57	-40.9	176.1	0	0	0	0	0	112.4	L182 Y245 I265 P302 R303 T308 F309	L182-A306 HydrophobicContact CD2-CB 3.99Å; Y245-A306 HydrophobicContact CD2-CB 3.67Å; Y245-A306 HydrophobicContact CG-CB 4.28Å; I265-A306 WeakPolarHBondContact CD1-O 3.36Å; I265-A306 HydrophobicContact CG2-CB 3.88Å; P302-A306 WeakPolarHBondContact O-CB 3.43Å; P302-A306 PolarHBondContact O-N 2.84Å; R303-A306 PolarHBondContact O-N 2.97Å; A306-T308 PolarHBondContact O-N 2.89Å; A306-F309 WeakPolarHBondContact O-CB 3.26Å; A306-F309 PolarHBondContact O-N 2.85Å
307	R	92.2	Very high	86.1	Confident	128 Å²	128	81 Å²	81	48%	0.483	42%	0.422	S	S	.	.	H	α-helix	trans	-62.7	-21.6	179.4	-75	169.7	169.5	176.9	-8	113.3	R303 D304 F305 F309 G310	R303-R307 WeakPolarHBondContact O-CG 3.35Å; R303-R307 PolarHBondContact O-N 3.08Å; D304-R307 PolarHBondContact O-N 3.15Å; D304-R307 IonicContact OD1-NH1 3.86Å; F305-R307 VanDerWaalsContact C-N 3.28Å; F305-R307 PolarHBondContact O-N 3.08Å; R307-F309 PolarHBondContact O-N 3.22Å; R307-G310 PolarHBondContact O-N 3.11Å; R307-G310 VanDerWaalsContact O-N 3.17Å
308	T	92.6	Very high	85.7	Confident	78 Å²	78	81.3 Å²	81.3	48%	0.479	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.9	172.4	72.3	0	0	0	0	113	K251 D304 F305 A306	K251-T308 WeakPolarHBondContact CD-O 3.47Å; D304-T308 PolarHBondContact O-N 2.84Å; F305-T308 WeakPolarHBondContact O-CB 3.5Å; F305-T308 WeakPolarHBondContact O-CG2 3.37Å; F305-T308 PolarHBondContact O-N 2.91Å; F305-T308 VanDerWaalsContact O-N 3.09Å; F305-T308 PolarHBondContact O-OG1 2.81Å; A306-T308 PolarHBondContact O-N 2.89Å
309	F	93.7	Very high	85.5	Confident	22 Å²	22	77.6 Å²	77.6	10%	0.096	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-0.6	177.5	-62.1	-88.5	0	0	0	113.8	Y180 I202 L204 L250 K251 I265 F305 A306 R307	Y180-F309 HydrophobicContact CD2-CB 4.17Å; Y180-F309 HydrophobicContact CE2-CB 4.12Å; Y180-F309 HydrophobicContact CE2-CD1 4.21Å; I202-F309 HydrophobicContact CG2-CZ 4.27Å; I202-F309 WeakPolarHBondContact O-CE1 3.17Å; L204-F309 HydrophobicContact CD1-CD2 3.87Å; L204-F309 HydrophobicContact CD1-CE2 4.21Å; L204-F309 HydrophobicContact CD1-CG 4.11Å; L204-F309 HydrophobicContact CG-CD1 4.49Å; L204-F309 HydrophobicContact CG-CD2 4.18Å; L204-F309 HydrophobicContact CG-CE1 4.37Å; L204-F309 HydrophobicContact CG-CE2 4.07Å; L204-F309 HydrophobicContact CG-CG 4.4Å; L204-F309 HydrophobicContact CG-CZ 4.16Å; L250-F309 CarbonylContact C-O 3.58Å; L250-F309 WeakPolarHBondContact CA-O 3.29Å; K251-F309 PolarHBondContact N-O 2.76Å; I265-F309 HydrophobicContact CD1-CB 3.79Å; F305-F309 HydrophobicContact CD1-CE2 4.12Å; F305-F309 HydrophobicContact CE1-CD2 4.48Å; F305-F309 AromaticContact CE1-CE2 3.51Å; F305-F309 HydrophobicContact CE1-CE2 3.51Å; F305-F309 HydrophobicContact CE1-CZ 4.18Å; F305-F309 HydrophobicContact CE2-CE2 4.24Å; F305-F309 AromaticContact CZ-CE2 3.59Å; F305-F309 HydrophobicContact CZ-CE2 3.59Å; F305-F309 AromaticContact CZ-CZ 3.94Å; F305-F309 HydrophobicContact CZ-CZ 3.94Å; F305-F309 WeakPolarHBondContact O-CD2 2.99Å; A306-F309 WeakPolarHBondContact O-CB 3.26Å; A306-F309 PolarHBondContact O-N 2.85Å; R307-F309 PolarHBondContact O-N 3.22Å
310	G	89.5	Confident	85.1	Confident	7 Å²	7	73.9 Å²	73.9	7%	0.072	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	158.2	178.8	0	0	0	0	0	112.5	Y249 K251 R307	Y249-G310 WeakPolarHBondContact O-CA 3.17Å; K251-G310 WeakPolarHBondContact CE-O 3.42Å; R307-G310 PolarHBondContact O-N 3.11Å; R307-G310 VanDerWaalsContact O-N 3.17Å
311	I	82.2	Confident	84.5	Confident	43 Å²	43	75.9 Å²	75.9	22%	0.221	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	116.7	156.5	-58.4	178.3	0	0	0	106.3	Y159 E160 H246 Y249 K251	Y159-I311 HydrophobicContact CD1-CG2 4.36Å; E160-I311 HydrophobicContact CG-CD1 4.48Å; H246-I311 PolarHBondContact CE1-O 3.06Å; Y249-I311 HydrophobicContact CD1-CB 3.78Å; Y249-I311 HydrophobicContact CD1-CD1 3.6Å; Y249-I311 HydrophobicContact CD1-CG1 3.66Å; Y249-I311 HydrophobicContact CE1-CD1 3.54Å; Y249-I311 HydrophobicContact CE1-CG1 4.05Å; Y249-I311 HydrophobicContact CG-CB 4.37Å; Y249-I311 PolarHBondContact O-N 3.19Å; Y249-I311 VanDerWaalsContact O-N 3.11Å; K251-I311 HydrophobicContact CD-CG1 4.23Å; K251-I311 HydrophobicContact CG-CD1 4.25Å; K251-I311 HydrophobicContact CG-CG1 3.93Å
312	S	64.5	Low	83.7	Confident	84 Å²	84	76.5 Å²	76.5	59%	0.587	37%	0.372	S	S	*	.			trans	-75	130.6	167.4	-56.6	0	0	0	0	107.8	K314	S312-K314 PolarHBondContact O-N 3.39Å
313	M	55.8	Low	82.8	Confident	128 Å²	128	80.5 Å²	80.5	63%	0.631	39%	0.388	S	S	*	.			trans	-59.4	132	160	-67.6	-156.7	-161.5	0	0	107	Y159	Y159-M313 HydrophobicContact CD1-CG 4.05Å; Y159-M313 HydrophobicContact CE1-CE 3.58Å; Y159-M313 HydrophobicContact CE1-CG 3.36Å; Y159-M313 HydrophobicContact CE1-SD 4.25Å; Y159-M313 HydrophobicContact CE2-CE 4.02Å; Y159-M313 WeakPolarHBondContact OH-CE 3.28Å
314	K	43	Very low	81.6	Confident	279 Å²	279	78.7 Å²	78.7	100%	1.213	39%	0.389	S	S	*	.			trans	-70.6	0	163.8	-78.4	-172.4	177.1	-178.1	0	109.4	S312	S312-K314 PolarHBondContact O-N 3.39Å

Retrieved 314 of 314 residues in 176.3 ms (Link to these results)

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