A0A077ZKI7_TRITR Loading...

Collagen and OLF domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZKI7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 440 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	51.5	Low	58.8	Low	229 Å²	229	119.6 Å²	119.6	100%	1.128	63%	0.628	S	S	*	*				0	-40.1	0	-65.7	-176.2	-175.4	0	0	112.7	G3 N4	M1-G3 PolarHBondContact O-N 2.96Å; M1-G3 VanDerWaalsContact O-N 3.11Å; M1-N4 PolarHBondContact O-N 3.24Å
2	A	52.5	Low	58.7	Low	83 Å²	83	120.2 Å²	120.2	69%	0.686	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.2	-44	-174.1	0	0	0	0	0	117.4	N4 D5	A2-N4 PolarHBondContact O-N 3.11Å; A2-D5 PolarHBondContact O-N 3.08Å; A2-D5 VanDerWaalsContact O-N 3.12Å
3	G	55.2	Low	58.3	Low	56 Å²	56	125.4 Å²	125.4	58%	0.577	63%	0.628	S	S	*	*	H	α-helix	trans	-61.6	-11.5	-175.3	0	0	0	0	0	116.3	M1	M1-G3 PolarHBondContact O-N 2.96Å; M1-G3 VanDerWaalsContact O-N 3.11Å
4	N	57.7	Low	58	Low	107 Å²	107	121.6 Å²	121.6	57%	0.572	61%	0.608	S	S	*	*	H	α-helix	trans	-84.6	-17	178.3	-156	14.5	0	0	0	113.3	M1 A2 K8	M1-N4 PolarHBondContact O-N 3.24Å; A2-N4 PolarHBondContact O-N 3.11Å; N4-K8 WeakPolarHBondContact O-CE 3.41Å; N4-K8 WeakPolarHBondContact O-CG 3.42Å
5	D	59.7	Low	57.3	Low	94 Å²	94	120.7 Å²	120.7	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-95.2	-30.2	179.2	-64	-42.8	0	0	0	112.2	A2 H7 K8 S9	A2-D5 PolarHBondContact O-N 3.08Å; A2-D5 VanDerWaalsContact O-N 3.12Å; D5-H7 VanDerWaalsContact C-N 3.34Å; D5-K8 PolarHBondContact O-N 3.05Å; D5-K8 IonicContact OD1-NZ 2.74Å; D5-K8 PolarHBondContact OD1-NZ 3.33Å; D5-S9 PolarHBondContact O-N 3.12Å
6	E	58.3	Low	56.5	Low	145 Å²	145	118.9 Å²	118.9	68%	0.678	59%	0.594	S	S	*	*	H	α-helix	trans	-62.5	-40.6	168.4	-172.7	171.8	-160.3	0	0	111.6	K8 S9 R10	E6-K8 VanDerWaalsContact C-N 3.3Å; E6-K8 PolarHBondContact O-N 2.79Å; E6-S9 PolarHBondContact O-N 2.99Å; E6-S9 PolarHBondContact O-OG 3.48Å; E6-S9 VanDerWaalsContact O-OG 3.08Å; E6-R10 WeakPolarHBondContact O-CB 3.48Å; E6-R10 PolarHBondContact O-N 3.08Å
7	H	59.9	Low	55.9	Low	134 Å²	134	116.6 Å²	116.6	62%	0.62	58%	0.584	S	S	*	*	H	α-helix	trans	-66	-31.6	175.7	-156.9	-51.3	0	0	0	112.7	D5 F11	D5-H7 VanDerWaalsContact C-N 3.34Å; H7-F11 VanDerWaalsContact O-CB 3.29Å; H7-F11 WeakPolarHBondContact O-CB 3.41Å; H7-F11 PolarHBondContact O-N 3.38Å; H7-F11 VanDerWaalsContact O-N 3.08Å
8	K	59.2	Low	55.2	Low	115 Å²	115	118.4 Å²	118.4	50%	0.5	58%	0.582	S	S	.	*	H	α-helix	trans	-73	-42.7	173.3	-70.3	170.1	-161.6	156.7	0	112.2	N4 D5 E6 R10 F11 K12	N4-K8 WeakPolarHBondContact O-CE 3.41Å; N4-K8 WeakPolarHBondContact O-CG 3.42Å; D5-K8 PolarHBondContact O-N 3.05Å; D5-K8 IonicContact OD1-NZ 2.74Å; D5-K8 PolarHBondContact OD1-NZ 3.33Å; E6-K8 VanDerWaalsContact C-N 3.3Å; E6-K8 PolarHBondContact O-N 2.79Å; K8-R10 VanDerWaalsContact C-N 3.33Å; K8-F11 PolarHBondContact O-N 3Å; K8-K12 WeakPolarHBondContact O-CB 3.29Å; K8-K12 PolarHBondContact O-N 3.39Å
9	S	64.3	Low	54.4	Low	76 Å²	76	118.8 Å²	118.8	53%	0.531	58%	0.581	S	S	.	*	H	α-helix	trans	-65.1	-40.7	-179.8	77	0	0	0	0	111	D5 E6 R13	D5-S9 PolarHBondContact O-N 3.12Å; E6-S9 PolarHBondContact O-N 2.99Å; E6-S9 PolarHBondContact O-OG 3.48Å; E6-S9 VanDerWaalsContact O-OG 3.08Å; S9-R13 WeakPolarHBondContact O-CB 3.41Å; S9-R13 PolarHBondContact O-N 3.33Å
10	R	66.2	Low	53.6	Low	165 Å²	165	116.7 Å²	116.7	62%	0.623	57%	0.569	S	S	*	*	H	α-helix	trans	-61.4	-51.7	171.9	-178.4	175.4	172.1	165.1	1.5	112.1	E6 K8 K12 R13 E14	E6-R10 WeakPolarHBondContact O-CB 3.48Å; E6-R10 PolarHBondContact O-N 3.08Å; K8-R10 VanDerWaalsContact C-N 3.33Å; R10-K12 VanDerWaalsContact C-N 3.31Å; R10-K12 PolarHBondContact O-N 3.26Å; R10-R13 PolarHBondContact O-N 2.74Å; R10-R13 VanDerWaalsContact O-N 3.11Å; R10-E14 IonicContact CZ-OE1 3.37Å; R10-E14 IonicContact NE-OE1 3.55Å; R10-E14 PolarHBondContact NE-OE1 2.97Å; R10-E14 IonicContact NH2-OE1 3.08Å; R10-E14 PolarHBondContact NH2-OE1 3.08Å; R10-E14 VanDerWaalsContact NH2-OE1 3.08Å; R10-E14 WeakPolarHBondContact O-CG 3.43Å; R10-E14 PolarHBondContact O-N 2.94Å
11	F	62.2	Low	53	Low	112 Å²	112	119.4 Å²	119.4	49%	0.491	57%	0.574	S	S	.	*	H	α-helix	trans	-59.4	-41.4	179.7	-176.8	-101.3	0	0	0	112.1	H7 K8 E14 Q15	H7-F11 VanDerWaalsContact O-CB 3.29Å; H7-F11 WeakPolarHBondContact O-CB 3.41Å; H7-F11 PolarHBondContact O-N 3.38Å; H7-F11 VanDerWaalsContact O-N 3.08Å; K8-F11 PolarHBondContact O-N 3Å; F11-E14 PolarHBondContact O-N 2.79Å; F11-Q15 HydrophobicContact CD1-CG 4.4Å; F11-Q15 VanDerWaalsContact CE1-CD 3.46Å; F11-Q15 HydrophobicContact CE1-CG 4.08Å; F11-Q15 HydrophobicContact CZ-CG 4.32Å; F11-Q15 WeakPolarHBondContact O-CG 3.4Å; F11-Q15 PolarHBondContact O-N 3.43Å
12	K	57.5	Low	52.7	Low	126 Å²	126	110.1 Å²	110.1	55%	0.548	53%	0.533	S	S	.	.	H	α-helix	trans	-62.1	-46.1	173.5	-174.2	-179.4	174.7	-175.5	0	111.7	K8 R10 E14 Q15 D16	K8-K12 WeakPolarHBondContact O-CB 3.29Å; K8-K12 PolarHBondContact O-N 3.39Å; R10-K12 VanDerWaalsContact C-N 3.31Å; R10-K12 PolarHBondContact O-N 3.26Å; K12-E14 VanDerWaalsContact C-N 3.27Å; K12-E14 PolarHBondContact O-N 3.34Å; K12-Q15 WeakPolarHBondContact O-CB 3.35Å; K12-Q15 PolarHBondContact O-N 3.28Å; K12-Q15 VanDerWaalsContact O-N 3.08Å; K12-D16 WeakPolarHBondContact CE-OD2 3.34Å; K12-D16 PolarHBondContact O-N 3.1Å
13	R	53.4	Low	52.6	Low	188 Å²	188	107.8 Å²	107.8	71%	0.709	51%	0.508	S	S	*	.	H	α-helix	trans	-60.7	-37.3	178.1	-169.2	176.9	-176.3	-179.5	0.9	112	S9 R10 L17	S9-R13 WeakPolarHBondContact O-CB 3.41Å; S9-R13 PolarHBondContact O-N 3.33Å; R10-R13 PolarHBondContact O-N 2.74Å; R10-R13 VanDerWaalsContact O-N 3.11Å; R13-L17 HydrophobicContact CG-CD1 4.36Å; R13-L17 WeakPolarHBondContact O-CB 3.36Å; R13-L17 WeakPolarHBondContact O-CD1 3.46Å; R13-L17 VanDerWaalsContact O-CG 3.24Å; R13-L17 WeakPolarHBondContact O-CG 3.42Å; R13-L17 PolarHBondContact O-N 3.08Å
14	E	53.9	Low	52.4	Low	73 Å²	73	107 Å²	107	34%	0.341	49%	0.49	S	S	.	.	H	α-helix	trans	-69.6	-33.7	174.2	-70.5	175.8	-173	0	0	112.5	R10 F11 K12 R18	R10-E14 IonicContact CZ-OE1 3.37Å; R10-E14 IonicContact NE-OE1 3.55Å; R10-E14 PolarHBondContact NE-OE1 2.97Å; R10-E14 IonicContact NH2-OE1 3.08Å; R10-E14 PolarHBondContact NH2-OE1 3.08Å; R10-E14 VanDerWaalsContact NH2-OE1 3.08Å; R10-E14 WeakPolarHBondContact O-CG 3.43Å; R10-E14 PolarHBondContact O-N 2.94Å; F11-E14 PolarHBondContact O-N 2.79Å; K12-E14 VanDerWaalsContact C-N 3.27Å; K12-E14 PolarHBondContact O-N 3.34Å; E14-R18 VanDerWaalsContact O-CG 3.3Å; E14-R18 WeakPolarHBondContact O-CG 3.45Å; E14-R18 PolarHBondContact O-N 3.4Å; E14-R18 VanDerWaalsContact O-N 3.12Å
15	Q	48.9	Very low	52.2	Low	107 Å²	107	104.8 Å²	104.8	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-68.8	-47.4	170.4	-73.8	-172.9	-41.3	0	0	112.6	F11 K12 L17 R18 F19	F11-Q15 HydrophobicContact CD1-CG 4.4Å; F11-Q15 VanDerWaalsContact CE1-CD 3.46Å; F11-Q15 HydrophobicContact CE1-CG 4.08Å; F11-Q15 HydrophobicContact CZ-CG 4.32Å; F11-Q15 WeakPolarHBondContact O-CG 3.4Å; F11-Q15 PolarHBondContact O-N 3.43Å; K12-Q15 WeakPolarHBondContact O-CB 3.35Å; K12-Q15 PolarHBondContact O-N 3.28Å; K12-Q15 VanDerWaalsContact O-N 3.08Å; Q15-L17 VanDerWaalsContact C-N 3.29Å; Q15-L17 PolarHBondContact O-N 3.04Å; Q15-R18 PolarHBondContact O-N 3.33Å; Q15-F19 PolarHBondContact O-N 3.06Å
16	D	44.6	Very low	51.9	Low	92 Å²	92	106.8 Å²	106.8	49%	0.492	49%	0.491	S	S	.	.	H	α-helix	trans	-59.6	-40.2	178.6	-68	-24.3	0	0	0	110.7	K12 F19 H20	K12-D16 WeakPolarHBondContact CE-OD2 3.34Å; K12-D16 PolarHBondContact O-N 3.1Å; D16-F19 PolarHBondContact O-N 2.91Å; D16-H20 PolarHBondContact O-N 3.4Å
17	L	45	Very low	51.9	Low	81 Å²	81	100.5 Å²	100.5	42%	0.424	46%	0.463	S	S	.	.	H	α-helix	trans	-64.6	-46.2	173.5	-77.8	166.8	0	0	0	112.9	R13 Q15 F19 H20 W21	R13-L17 HydrophobicContact CG-CD1 4.36Å; R13-L17 WeakPolarHBondContact O-CB 3.36Å; R13-L17 WeakPolarHBondContact O-CD1 3.46Å; R13-L17 VanDerWaalsContact O-CG 3.24Å; R13-L17 WeakPolarHBondContact O-CG 3.42Å; R13-L17 PolarHBondContact O-N 3.08Å; Q15-L17 VanDerWaalsContact C-N 3.29Å; Q15-L17 PolarHBondContact O-N 3.04Å; L17-F19 VanDerWaalsContact C-N 3.29Å; L17-F19 PolarHBondContact O-N 3.16Å; L17-H20 WeakPolarHBondContact O-CB 3.24Å; L17-H20 PolarHBondContact O-N 3.04Å; L17-H20 VanDerWaalsContact O-N 3.17Å; L17-W21 PolarHBondContact O-N 3.38Å
18	R	43.7	Very low	51.9	Low	148 Å²	148	98.4 Å²	98.4	56%	0.558	45%	0.453	S	S	*	.	H	α-helix	trans	-60.7	-39.2	176.3	-75.7	177.1	-172.4	-155.5	5	111.9	E14 Q15 A22	E14-R18 VanDerWaalsContact O-CG 3.3Å; E14-R18 WeakPolarHBondContact O-CG 3.45Å; E14-R18 PolarHBondContact O-N 3.4Å; E14-R18 VanDerWaalsContact O-N 3.12Å; Q15-R18 PolarHBondContact O-N 3.33Å; R18-A22 WeakPolarHBondContact O-CB 3.3Å; R18-A22 PolarHBondContact O-N 3.35Å
19	F	40.7	Very low	52.2	Low	127 Å²	127	98.2 Å²	98.2	56%	0.557	45%	0.454	S	S	*	.	H	α-helix	trans	-66.6	-38.9	175.7	-170.4	-96.6	0	0	0	111.7	Q15 D16 L17 K23	Q15-F19 PolarHBondContact O-N 3.06Å; D16-F19 PolarHBondContact O-N 2.91Å; L17-F19 VanDerWaalsContact C-N 3.29Å; L17-F19 PolarHBondContact O-N 3.16Å; F19-K23 VanDerWaalsContact O-CB 3.26Å; F19-K23 WeakPolarHBondContact O-CB 3.47Å; F19-K23 PolarHBondContact O-N 2.91Å
20	H	37.3	Very low	52.1	Low	75 Å²	75	95.9 Å²	95.9	35%	0.347	44%	0.437	S	S	.	.	H	α-helix	trans	-62.4	-47.5	174.8	-159.5	-57.2	0	0	0	112	D16 L17 K23 D24	D16-H20 PolarHBondContact O-N 3.4Å; L17-H20 WeakPolarHBondContact O-CB 3.24Å; L17-H20 PolarHBondContact O-N 3.04Å; L17-H20 VanDerWaalsContact O-N 3.17Å; H20-K23 WeakPolarHBondContact O-CB 3.45Å; H20-K23 PolarHBondContact O-N 3.01Å; H20-D24 IonicContact CE1-OD1 3.85Å; H20-D24 IonicContact CE1-OD2 2.82Å; H20-D24 PolarHBondContact CE1-OD2 3.43Å; H20-D24 IonicContact CG-OD2 3.92Å; H20-D24 IonicContact ND1-OD1 3.63Å; H20-D24 IonicContact ND1-OD2 2.62Å; H20-D24 PolarHBondContact ND1-OD2 2.99Å; H20-D24 PolarHBondContact O-N 2.92Å
21	W	41.4	Very low	52	Low	174 Å²	174	88.5 Å²	88.5	66%	0.659	41%	0.41	S	S	*	.	H	α-helix	trans	-65.7	-39.8	178.5	-64	-16.5	0	0	0	113	L17 K23 D24 A25	L17-W21 PolarHBondContact O-N 3.38Å; W21-K23 VanDerWaalsContact C-N 3.34Å; W21-D24 PolarHBondContact O-N 3.08Å; W21-A25 WeakPolarHBondContact O-CB 3.48Å; W21-A25 PolarHBondContact O-N 2.96Å
22	A	44.3	Very low	52.1	Low	34 Å²	34	85.8 Å²	85.8	28%	0.281	41%	0.408	S	S	.	.	H	α-helix	trans	-64.6	-38.8	174.4	0	0	0	0	0	111.9	R18 F26	R18-A22 WeakPolarHBondContact O-CB 3.3Å; R18-A22 PolarHBondContact O-N 3.35Å; A22-F26 VanDerWaalsContact O-CB 3.3Å; A22-F26 WeakPolarHBondContact O-CB 3.37Å; A22-F26 PolarHBondContact O-N 3.35Å; A22-F26 VanDerWaalsContact O-N 3.07Å
23	K	51.5	Low	52.5	Low	34 Å²	34	83.4 Å²	83.4	15%	0.148	40%	0.404	C	S	.	.	H	α-helix	trans	-62	-51.4	172.7	172.7	-170.4	168.5	-166.1	0	111.2	F19 H20 W21 F26 I27 N408 Y426	F19-K23 VanDerWaalsContact O-CB 3.26Å; F19-K23 WeakPolarHBondContact O-CB 3.47Å; F19-K23 PolarHBondContact O-N 2.91Å; H20-K23 WeakPolarHBondContact O-CB 3.45Å; H20-K23 PolarHBondContact O-N 3.01Å; W21-K23 VanDerWaalsContact C-N 3.34Å; K23-F26 PolarHBondContact O-N 3.11Å; K23-I27 HydrophobicContact CD-CD1 4.36Å; K23-I27 HydrophobicContact CG-CD1 3.66Å; K23-I27 WeakPolarHBondContact O-CD1 3.36Å; K23-I27 VanDerWaalsContact O-CG1 3.23Å; K23-I27 WeakPolarHBondContact O-CG1 3.37Å; K23-I27 PolarHBondContact O-N 3.37Å; K23-N408 VanDerWaalsContact CE-OD1 3.27Å; K23-N408 WeakPolarHBondContact CE-OD1 3.49Å; K23-N408 PolarHBondContact NZ-OD1 3.38Å; K23-Y426 HydrophobicContact CD-CE2 4.5Å
24	D	50.7	Low	52.9	Low	39 Å²	39	76.3 Å²	76.3	21%	0.209	38%	0.379	C	S	.	.	H	α-helix	trans	-61.4	-48.1	-178.8	-66.8	-39.2	0	0	0	111.1	H20 W21 F26 I27 E28 R378	H20-D24 IonicContact CE1-OD1 3.85Å; H20-D24 IonicContact CE1-OD2 2.82Å; H20-D24 PolarHBondContact CE1-OD2 3.43Å; H20-D24 IonicContact CG-OD2 3.92Å; H20-D24 IonicContact ND1-OD1 3.63Å; H20-D24 IonicContact ND1-OD2 2.62Å; H20-D24 PolarHBondContact ND1-OD2 2.99Å; H20-D24 PolarHBondContact O-N 2.92Å; W21-D24 PolarHBondContact O-N 3.08Å; D24-F26 VanDerWaalsContact C-N 3.31Å; D24-F26 PolarHBondContact O-N 3.48Å; D24-I27 PolarHBondContact O-N 3.11Å; D24-I27 VanDerWaalsContact O-N 3.11Å; D24-E28 WeakPolarHBondContact O-CG 3.38Å; D24-E28 PolarHBondContact O-N 2.95Å; D24-R378 IonicContact OD1-NH1 2.79Å
25	A	53	Low	53.3	Low	62 Å²	62	75.6 Å²	75.6	51%	0.512	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-38.3	178.5	0	0	0	0	0	112.9	W21 Q29	W21-A25 WeakPolarHBondContact O-CB 3.48Å; W21-A25 PolarHBondContact O-N 2.96Å; A25-Q29 WeakPolarHBondContact O-CB 3.43Å; A25-Q29 PolarHBondContact O-N 3.29Å
26	F	54.5	Low	54.1	Low	135 Å²	135	75.3 Å²	75.3	59%	0.592	37%	0.37	S	S	*	.	H	α-helix	trans	-65.5	-42	173.7	-178.6	-96.4	0	0	0	111.9	A22 K23 D24 Q29 C30	A22-F26 VanDerWaalsContact O-CB 3.3Å; A22-F26 WeakPolarHBondContact O-CB 3.37Å; A22-F26 PolarHBondContact O-N 3.35Å; A22-F26 VanDerWaalsContact O-N 3.07Å; K23-F26 PolarHBondContact O-N 3.11Å; D24-F26 VanDerWaalsContact C-N 3.31Å; D24-F26 PolarHBondContact O-N 3.48Å; F26-Q29 PolarHBondContact O-N 3.02Å; F26-C30 VanDerWaalsContact CE1-SG 3.58Å; F26-C30 WeakPolarHBondContact O-CB 3.49Å; F26-C30 PolarHBondContact O-N 3.04Å; F26-C30 PolarHBondContact O-SG 3.41Å; F26-C30 VanDerWaalsContact O-SG 3.39Å
27	I	58.6	Low	54.8	Low	14 Å²	14	72.9 Å²	72.9	7%	0.072	36%	0.361	C	S	.	.	H	α-helix	trans	-62.9	-47.2	177.1	-68	159.7	0	0	0	111	K23 D24 Q29 C30 I31 Y205	K23-I27 HydrophobicContact CD-CD1 4.36Å; K23-I27 HydrophobicContact CG-CD1 3.66Å; K23-I27 WeakPolarHBondContact O-CD1 3.36Å; K23-I27 VanDerWaalsContact O-CG1 3.23Å; K23-I27 WeakPolarHBondContact O-CG1 3.37Å; K23-I27 PolarHBondContact O-N 3.37Å; D24-I27 PolarHBondContact O-N 3.11Å; D24-I27 VanDerWaalsContact O-N 3.11Å; I27-Q29 VanDerWaalsContact C-N 3.34Å; I27-Q29 PolarHBondContact O-N 3.21Å; I27-C30 WeakPolarHBondContact O-CB 3.36Å; I27-C30 PolarHBondContact O-N 3.38Å; I27-I31 HydrophobicContact CG2-CD1 3.75Å; I27-I31 HydrophobicContact CG2-CG1 4.42Å; I27-I31 WeakPolarHBondContact O-CG1 3.48Å; I27-I31 PolarHBondContact O-N 3.31Å; I27-Y205 WeakPolarHBondContact CD1-OH 3.48Å; I27-Y205 WeakPolarHBondContact CG1-OH 3.48Å
28	E	59.3	Low	55.5	Low	89 Å²	89	69.8 Å²	69.8	42%	0.416	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-41.5	178.8	-64.1	-72.4	116.7	0	0	111.3	D24 I31 A32 R310	D24-E28 WeakPolarHBondContact O-CG 3.38Å; D24-E28 PolarHBondContact O-N 2.95Å; E28-I31 PolarHBondContact O-N 2.97Å; E28-A32 PolarHBondContact O-N 3.23Å; E28-R310 IonicContact OE1-CZ 3.37Å; E28-R310 IonicContact OE1-NH1 3.37Å; E28-R310 PolarHBondContact OE1-NH1 2.88Å; E28-R310 IonicContact OE2-CZ 3.21Å; E28-R310 IonicContact OE2-NH1 2.82Å; E28-R310 PolarHBondContact OE2-NH1 3.17Å
29	Q	65.1	Low	56.4	Low	112 Å²	112	68.1 Å²	68.1	52%	0.523	35%	0.345	S	S	.	.	H	α-helix	trans	-70.6	-33.3	176.5	-170.6	164.6	7.4	0	0	112.7	A25 F26 I27 V33	A25-Q29 WeakPolarHBondContact O-CB 3.43Å; A25-Q29 PolarHBondContact O-N 3.29Å; F26-Q29 PolarHBondContact O-N 3.02Å; I27-Q29 VanDerWaalsContact C-N 3.34Å; I27-Q29 PolarHBondContact O-N 3.21Å; Q29-V33 WeakPolarHBondContact O-CG2 3.35Å; Q29-V33 PolarHBondContact O-N 3.02Å
30	C	62.6	Low	57.3	Low	26 Å²	26	66.9 Å²	66.9	18%	0.176	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-50.6	167.8	-78.5	0	0	0	0	111	F26 I27 A32 V33 H34	F26-C30 VanDerWaalsContact CE1-SG 3.58Å; F26-C30 WeakPolarHBondContact O-CB 3.49Å; F26-C30 PolarHBondContact O-N 3.04Å; F26-C30 PolarHBondContact O-SG 3.41Å; F26-C30 VanDerWaalsContact O-SG 3.39Å; I27-C30 WeakPolarHBondContact O-CB 3.36Å; I27-C30 PolarHBondContact O-N 3.38Å; C30-A32 VanDerWaalsContact C-N 3.33Å; C30-A32 PolarHBondContact O-N 3.3Å; C30-V33 CarbonylContact O-C 3.59Å; C30-V33 WeakPolarHBondContact O-CA 3.35Å; C30-V33 WeakPolarHBondContact O-CB 3.35Å; C30-V33 PolarHBondContact O-N 3.47Å; C30-H34 PolarHBondContact O-CD2 3.37Å; C30-H34 PolarHBondContact O-N 3.23Å
31	I	63.2	Low	58.2	Low	11 Å²	11	67.1 Å²	67.1	6%	0.056	34%	0.341	C	S	.	.	H	α-helix	trans	-55.4	-47.6	179.7	-72.4	166.6	0	0	0	110.8	I27 E28 V33 H34 E35 F229 Y305 R310	I27-I31 HydrophobicContact CG2-CD1 3.75Å; I27-I31 HydrophobicContact CG2-CG1 4.42Å; I27-I31 WeakPolarHBondContact O-CG1 3.48Å; I27-I31 PolarHBondContact O-N 3.31Å; E28-I31 PolarHBondContact O-N 2.97Å; I31-V33 VanDerWaalsContact C-N 3.28Å; I31-V33 PolarHBondContact O-N 2.72Å; I31-H34 WeakPolarHBondContact O-CA 3.39Å; I31-H34 PolarHBondContact O-N 2.69Å; I31-E35 HydrophobicContact CG2-CG 4.47Å; I31-E35 WeakPolarHBondContact O-CG 3.45Å; I31-E35 PolarHBondContact O-N 3Å; I31-F229 HydrophobicContact CG1-CZ 4.18Å; I31-Y305 VanDerWaalsContact CG2-OH 3.31Å; I31-Y305 WeakPolarHBondContact CG2-OH 3.46Å; I31-R310 HydrophobicContact CD1-CB 3.86Å
32	A	66	Low	58.8	Low	54 Å²	54	61.6 Å²	61.6	45%	0.446	34%	0.338	S	S	.	.	H	α-helix	trans	-60.1	-34.8	177	0	0	0	0	0	113.4	E28 C30 Y36	E28-A32 PolarHBondContact O-N 3.23Å; C30-A32 VanDerWaalsContact C-N 3.33Å; C30-A32 PolarHBondContact O-N 3.3Å; A32-Y36 PolarHBondContact O-N 2.94Å
33	V	65.4	Low	58.7	Low	77 Å²	77	67 Å²	67	47%	0.467	36%	0.361	S	S	.	.	H	α-helix	trans	-70.7	-38.3	172.3	171.2	0	0	0	0	111.4	Q29 C30 I31 Y36 C37	Q29-V33 WeakPolarHBondContact O-CG2 3.35Å; Q29-V33 PolarHBondContact O-N 3.02Å; C30-V33 CarbonylContact O-C 3.59Å; C30-V33 WeakPolarHBondContact O-CA 3.35Å; C30-V33 WeakPolarHBondContact O-CB 3.35Å; C30-V33 PolarHBondContact O-N 3.47Å; I31-V33 VanDerWaalsContact C-N 3.28Å; I31-V33 PolarHBondContact O-N 2.72Å; V33-Y36 PolarHBondContact O-N 3.48Å; V33-C37 WeakPolarHBondContact O-CB 3.3Å; V33-C37 PolarHBondContact O-N 2.97Å; V33-C37 PolarHBondContact O-SG 3.11Å
34	H	60.7	Low	58.5	Low	38 Å²	38	73.4 Å²	73.4	18%	0.176	39%	0.391	C	S	.	.	H	α-helix	trans	-67.2	-38.7	176.3	-74.4	-67.7	0	0	0	112.9	C30 I31 C37 A38 H228 F229 Y230	C30-H34 PolarHBondContact O-CD2 3.37Å; C30-H34 PolarHBondContact O-N 3.23Å; I31-H34 WeakPolarHBondContact O-CA 3.39Å; I31-H34 PolarHBondContact O-N 2.69Å; H34-C37 PolarHBondContact O-N 3.17Å; H34-A38 VanDerWaalsContact O-CB 3.25Å; H34-A38 WeakPolarHBondContact O-CB 3.42Å; H34-A38 PolarHBondContact O-N 2.82Å; H34-H228 AromaticContact CE1-CE1 3.87Å; H34-H228 AromaticContact CE1-ND1 3.83Å; H34-H228 AromaticContact NE2-CE1 3.2Å; H34-H228 PolarHBondContact NE2-CE1 2.7Å; H34-H228 AromaticContact NE2-ND1 3.62Å; H34-F229 HydrophobicContact CB-CE2 4.17Å; H34-F229 AromaticContact CD2-CE2 3.29Å; H34-F229 WeakPolarHBondContact CD2-CE2 3.23Å; H34-F229 AromaticContact CD2-CZ 3.34Å; H34-F229 WeakPolarHBondContact CD2-CZ 3.32Å; H34-F229 AromaticContact CG-CE2 3.68Å; H34-F229 AromaticContact NE2-CE2 3.85Å; H34-F229 AromaticContact NE2-CZ 3.76Å; H34-Y230 WeakPolarHBondContact ND1-CB 3.41Å; H34-Y230 AromaticContact ND1-CD2 3.88Å; H34-Y230 AromaticContact ND1-CG 3.52Å
35	E	62.4	Low	58.5	Low	58 Å²	58	78 Å²	78	27%	0.271	41%	0.406	S	S	.	.	H	α-helix	trans	-60.4	-47.5	172.6	-69.2	-177.6	145.1	0	0	111	I31 C37 A38 E39 Y302	I31-E35 HydrophobicContact CG2-CG 4.47Å; I31-E35 WeakPolarHBondContact O-CG 3.45Å; I31-E35 PolarHBondContact O-N 3Å; E35-C37 PolarHBondContact O-N 3.01Å; E35-A38 PolarHBondContact O-N 2.96Å; E35-E39 PolarHBondContact O-N 3.42Å; E35-Y302 VanDerWaalsContact OE1-CA 3.22Å; E35-Y302 WeakPolarHBondContact OE1-CA 3.25Å
36	Y	66.5	Low	58	Low	101 Å²	101	78.2 Å²	78.2	40%	0.396	41%	0.414	S	S	.	.	H	α-helix	trans	-60.5	-45	175.7	176.3	-97.4	0	0	0	112.7	A32 V33 E39 K40 C96	A32-Y36 PolarHBondContact O-N 2.94Å; V33-Y36 PolarHBondContact O-N 3.48Å; Y36-E39 PolarHBondContact O-N 3.4Å; Y36-K40 HydrophobicContact CE1-CG 4.17Å; Y36-K40 HydrophobicContact CE2-CG 4.45Å; Y36-K40 WeakPolarHBondContact O-CG 3.14Å; Y36-K40 PolarHBondContact O-N 3.01Å; Y36-K40 VanDerWaalsContact OH-CE 3.27Å; Y36-K40 WeakPolarHBondContact OH-CE 3.26Å; Y36-C96 PolarHBondContact OH-SG 2.83Å
37	C	59.8	Low	57.5	Low	42 Å²	42	76.1 Å²	76.1	28%	0.284	42%	0.422	S	S	.	.	H	α-helix	trans	-66.1	-40.4	177.4	-70.8	0	0	0	0	111.9	V33 H34 E35 E39 K40 E41	V33-C37 WeakPolarHBondContact O-CB 3.3Å; V33-C37 PolarHBondContact O-N 2.97Å; V33-C37 PolarHBondContact O-SG 3.11Å; H34-C37 PolarHBondContact O-N 3.17Å; E35-C37 PolarHBondContact O-N 3.01Å; C37-E39 VanDerWaalsContact C-N 3.33Å; C37-E39 PolarHBondContact O-N 3.2Å; C37-K40 PolarHBondContact O-N 3.05Å; C37-K40 VanDerWaalsContact O-N 3.08Å; C37-E41 WeakPolarHBondContact O-CB 3.21Å; C37-E41 PolarHBondContact O-N 3.12Å
38	A	58.7	Low	57	Low	16 Å²	16	81.7 Å²	81.7	13%	0.132	46%	0.459	C	S	.	.	H	α-helix	trans	-64.2	-35.5	176.3	0	0	0	0	0	112.7	H34 E35 K40 G42 Y230	H34-A38 VanDerWaalsContact O-CB 3.25Å; H34-A38 WeakPolarHBondContact O-CB 3.42Å; H34-A38 PolarHBondContact O-N 2.82Å; E35-A38 PolarHBondContact O-N 2.96Å; A38-K40 VanDerWaalsContact C-N 3.3Å; A38-K40 PolarHBondContact O-N 2.67Å; A38-G42 PolarHBondContact O-N 3.38Å; A38-Y230 HydrophobicContact CB-CE2 4.33Å
39	E	62.1	Low	56.5	Low	112 Å²	112	80.5 Å²	80.5	52%	0.523	47%	0.471	S	S	.	.	H	α-helix	trans	-70.8	-22.6	172.6	-70.4	-165.2	158.4	0	0	113.3	E35 Y36 C37 K301 Y302	E35-E39 PolarHBondContact O-N 3.42Å; Y36-E39 PolarHBondContact O-N 3.4Å; C37-E39 VanDerWaalsContact C-N 3.33Å; C37-E39 PolarHBondContact O-N 3.2Å; E39-K301 IonicContact OE1-NZ 3.41Å; E39-K301 PolarHBondContact OE1-NZ 3.48Å; E39-Y302 WeakPolarHBondContact OE1-CE1 3.22Å; E39-Y302 PolarHBondContact OE1-OH 2.8Å
40	K	61	Low	56	Low	102 Å²	102	80.9 Å²	80.9	44%	0.443	48%	0.483	S	S	.	.	H	α-helix	trans	-88.3	-39.5	175.6	-67.1	-72.3	-179.1	165.4	0	113.5	Y36 C37 A38 G42	Y36-K40 HydrophobicContact CE1-CG 4.17Å; Y36-K40 HydrophobicContact CE2-CG 4.45Å; Y36-K40 WeakPolarHBondContact O-CG 3.14Å; Y36-K40 PolarHBondContact O-N 3.01Å; Y36-K40 VanDerWaalsContact OH-CE 3.27Å; Y36-K40 WeakPolarHBondContact OH-CE 3.26Å; C37-K40 PolarHBondContact O-N 3.05Å; C37-K40 VanDerWaalsContact O-N 3.08Å; A38-K40 VanDerWaalsContact C-N 3.3Å; A38-K40 PolarHBondContact O-N 2.67Å; K40-G42 PolarHBondContact O-N 2.71Å
41	E	55.9	Low	56	Low	80 Å²	80	85.9 Å²	85.9	37%	0.374	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	14.1	179.7	-65.8	-163.6	179.3	0	0	114.1	C37 L43 Y230 M257	C37-E41 WeakPolarHBondContact O-CB 3.21Å; C37-E41 PolarHBondContact O-N 3.12Å; E41-L43 PolarHBondContact O-N 3.07Å; E41-Y230 PolarHBondContact OE2-OH 3Å; E41-M257 VanDerWaalsContact OE2-CE 3.3Å; E41-M257 WeakPolarHBondContact OE2-CE 3.37Å; E41-M257 VanDerWaalsContact OE2-CG 3.25Å; E41-M257 WeakPolarHBondContact OE2-CG 3.3Å
42	G	52.6	Low	55.6	Low	58 Å²	58	88.5 Å²	88.5	60%	0.598	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-8.1	162	0	0	0	0	0	113.8	A38 K40	A38-G42 PolarHBondContact O-N 3.38Å; K40-G42 PolarHBondContact O-N 2.71Å
43	L	42.6	Very low	55.7	Low	147 Å²	147	97.7 Å²	97.7	77%	0.77	57%	0.568	S	S	*	*	S	Bend	trans	-81.2	130.8	170.5	-71	163.7	0	0	0	110.7	E41	E41-L43 PolarHBondContact O-N 3.07Å
44	E	48.3	Very low	56	Low	168 Å²	168	100.7 Å²	100.7	79%	0.785	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-64.7	138.1	-172.3	-59.1	177.4	144.9	0	0	112.6	G46	E44-G46 PolarHBondContact O-N 3.07Å
45	R	49.7	Very low	56.1	Low	136 Å²	136	101.7 Å²	101.7	51%	0.513	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-57	128.7	167.8	-175.7	-179.5	-173	173.4	3.6	108.4	L254 P255 Y256	R45-L254 PolarHBondContact NH1-O 2.76Å; R45-P255 WeakPolarHBondContact CD-O 3.34Å; R45-P255 PolarHBondContact NH1-O 3.35Å; R45-Y256 HydrophobicContact CB-CD1 4.38Å; R45-Y256 HydrophobicContact CB-CE1 4.18Å
46	G	43.4	Very low	56.5	Low	67 Å²	67	108.3 Å²	108.3	69%	0.691	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-50.4	140.2	-176.7	0	0	0	0	0	112.9	E44	E44-G46 PolarHBondContact O-N 3.07Å
47	A	43.6	Very low	56.9	Low	91 Å²	91	112.8 Å²	112.8	75%	0.752	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-52.7	145.6	-173.7	0	0	0	0	0	112.5	G49	A47-G49 PolarHBondContact O-N 3.35Å
48	P	48.5	Very low	57.4	Low	130 Å²	130	113.9 Å²	113.9	84%	0.844	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-50	134.8	179.2	-28.8	35.4	0	0	0	112.6
49	G	48.3	Very low	58.3	Low	64 Å²	64	124.9 Å²	124.9	66%	0.66	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-56.4	149.2	-178.1	0	0	0	0	0	112.5	A47	A47-G49 PolarHBondContact O-N 3.35Å
50	P	55.9	Low	59	Low	121 Å²	121	131.1 Å²	131.1	79%	0.786	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-58.9	143.6	-177	25.1	-34.7	0	0	0	111.1	G52	P50-G52 PolarHBondContact O-N 3.11Å
51	P	62	Low	59.5	Low	131 Å²	131	128.7 Å²	128.7	85%	0.851	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-50.5	135	-179.3	-29.7	35.6	0	0	0	113
52	G	54.6	Low	60.5	Low	66 Å²	66	130.7 Å²	130.7	68%	0.68	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-54.9	141.4	-179.6	0	0	0	0	0	112.2	P50 T54	P50-G52 PolarHBondContact O-N 3.11Å; G52-T54 PolarHBondContact O-N 2.97Å
53	R	67.4	Low	61.6	Low	247 Å²	247	134.1 Å²	134.1	93%	0.932	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-53.6	129.4	-179.5	-75.5	-177.8	169.5	-176.7	-3.4	110.8	G55	R53-G55 PolarHBondContact O-N 2.88Å
54	T	72.8	Confident	62.7	Low	140 Å²	140	130.5 Å²	130.5	86%	0.859	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-48.4	125.2	172.9	-46.3	0	0	0	0	110.3	G52	G52-T54 PolarHBondContact O-N 2.97Å
55	G	62.5	Low	63.6	Low	59 Å²	59	130.4 Å²	130.4	61%	0.608	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-56.7	144.5	179.2	0	0	0	0	0	111.8	R53 Q57	R53-G55 PolarHBondContact O-N 2.88Å; G55-Q57 PolarHBondContact O-N 3.14Å
56	Q	71.3	Confident	64.3	Low	197 Å²	197	136.3 Å²	136.3	92%	0.921	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-58.7	131.3	178.8	-65.1	-174	16.9	0	0	110.1	G58	Q56-G58 PolarHBondContact O-N 2.69Å
57	Q	74.7	Confident	65.2	Low	194 Å²	194	136.2 Å²	136.2	91%	0.907	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-59.2	126.6	176.9	-172.4	176	13	0	0	109.7	G55 R59	G55-Q57 PolarHBondContact O-N 3.14Å; Q57-R59 PolarHBondContact O-N 2.93Å
58	G	70.5	Confident	66.3	Low	65 Å²	65	142.2 Å²	142.2	67%	0.67	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-54.2	137.9	179.7	0	0	0	0	0	111.6	Q56 R60	Q56-G58 PolarHBondContact O-N 2.69Å; G58-R60 PolarHBondContact O-N 2.93Å
59	R	76.3	Confident	66.9	Low	247 Å²	247	145.4 Å²	145.4	93%	0.932	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-56.5	130.4	-179.9	-69	-176.6	177.9	-175.1	-0.5	109.7	Q57 G61	Q57-R59 PolarHBondContact O-N 2.93Å; R59-G61 PolarHBondContact O-N 3.28Å
60	R	76.8	Confident	67.7	Low	244 Å²	244	145.4 Å²	145.4	92%	0.921	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-54.4	125.7	171	-176.1	179.7	180	174.1	1.2	108.6	G58	G58-R60 PolarHBondContact O-N 2.93Å
61	G	72	Confident	68.6	Low	50 Å²	50	144 Å²	144	52%	0.515	81%	0.809	S	S	.	*	P	Polyproline II helix	trans	-58.6	156.9	176.2	0	0	0	0	0	112	R59	R59-G61 PolarHBondContact O-N 3.28Å
62	P	76.1	Confident	69.5	Low	123 Å²	123	144 Å²	144	80%	0.799	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-57.7	150.3	176	26.8	-34.8	0	0	0	110.6	G64	P62-G64 PolarHBondContact O-N 2.68Å; P62-G64 VanDerWaalsContact O-N 3.16Å
63	P	76.7	Confident	70.4	Confident	130 Å²	130	144.4 Å²	144.4	84%	0.844	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-56.9	121.2	170.7	-21.1	32.9	0	0	0	109.7
64	G	64.7	Low	71	Confident	71 Å²	71	141.9 Å²	141.9	73%	0.732	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-72.8	151.6	172.3	0	0	0	0	0	111.1	P62	P62-G64 PolarHBondContact O-N 2.68Å; P62-G64 VanDerWaalsContact O-N 3.16Å
65	D	67.6	Low	71.4	Confident	165 Å²	165	146.7 Å²	146.7	88%	0.882	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58	159.4	169.9	-70.5	-60.3	0	0	0	111.8	G67	D65-G67 VanDerWaalsContact C-N 3.26Å; D65-G67 PolarHBondContact O-N 2.7Å
66	R	64.1	Low	72.1	Confident	261 Å²	261	146.4 Å²	146.4	99%	0.985	81%	0.812	S	S	*	*	S	Bend	trans	-72.1	67.9	-165.1	-164.5	-176.2	-174.1	178.1	2.5	114
67	G	63.6	Low	72.4	Confident	65 Å²	65	142.8 Å²	142.8	67%	0.67	81%	0.805	S	S	*	*			trans	-95.7	-176.2	171.1	0	0	0	0	0	113.8	D65	D65-G67 VanDerWaalsContact C-N 3.26Å; D65-G67 PolarHBondContact O-N 2.7Å
68	F	65.5	Low	72.6	Confident	217 Å²	217	139.4 Å²	139.4	95%	0.952	80%	0.8	S	S	*	*	S	Bend	trans	-64.2	150	173	-65.1	-84.9	0	0	0	111.4	G70	F68-G70 PolarHBondContact O-N 2.88Å
69	Q	62.5	Low	72.8	Confident	197 Å²	197	139 Å²	139	92%	0.921	80%	0.796	S	S	*	*			trans	-62.5	108.3	-178.3	-178.1	176	-7.4	0	0	111
70	G	64.4	Low	72.8	Confident	63 Å²	63	133.1 Å²	133.1	65%	0.649	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-66.1	158.5	175.1	0	0	0	0	0	112.8	F68	F68-G70 PolarHBondContact O-N 2.88Å
71	A	74.4	Confident	72.7	Confident	93 Å²	93	127.5 Å²	127.5	77%	0.769	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-60.6	151.8	172.8	0	0	0	0	0	111.3	G73	A71-G73 PolarHBondContact O-N 2.73Å
72	P	80.2	Confident	72.5	Confident	130 Å²	130	127.7 Å²	127.7	84%	0.844	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-55.3	133.2	173.5	-24.5	34.6	0	0	0	111.5
73	G	74.1	Confident	72.2	Confident	74 Å²	74	127.7 Å²	127.7	76%	0.763	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.4	150.3	178.8	0	0	0	0	0	112.6	A71	A71-G73 PolarHBondContact O-N 2.73Å
74	E	80.3	Confident	71.4	Confident	194 Å²	194	127.2 Å²	127.2	91%	0.907	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-60.1	148.7	-178.6	-61.7	-174.2	151.4	0	0	112.4	G76	E74-G76 PolarHBondContact O-N 2.65Å
75	R	80.9	Confident	70.9	Confident	241 Å²	241	127 Å²	127	91%	0.909	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-68.6	123	173.7	-177.1	-178	-68.3	-171.8	-0.5	108.5
76	G	77.2	Confident	70.2	Confident	54 Å²	54	127.5 Å²	127.5	56%	0.557	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-57	157.6	175.2	0	0	0	0	0	112.9	E74	E74-G76 PolarHBondContact O-N 2.65Å
77	P	77.2	Confident	69.4	Low	121 Å²	121	122.6 Å²	122.6	79%	0.786	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-60.8	154.6	-175.7	26.2	-35.4	0	0	0	112.1
78	P	79.4	Confident	68.2	Low	123 Å²	123	122.5 Å²	122.5	80%	0.799	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-52.8	148.1	169.7	-24.8	34.8	0	0	0	112
79	G	75.5	Confident	66.9	Low	57 Å²	57	120.9 Å²	120.9	59%	0.588	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-63.9	159	172.4	0	0	0	0	0	111.9
80	P	75.8	Confident	65.7	Low	122 Å²	122	118.4 Å²	118.4	79%	0.792	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-59.9	153	172.9	28.2	-35.3	0	0	0	110.6
81	P	74.9	Confident	64.1	Low	126 Å²	126	120.1 Å²	120.1	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-51.9	151.2	169.9	-26	35.2	0	0	0	111.9
82	G	68.1	Low	62.2	Low	55 Å²	55	122.3 Å²	122.3	57%	0.567	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-61.1	158.2	169.7	0	0	0	0	0	111.3
83	P	68.4	Low	59.9	Low	122 Å²	122	118 Å²	118	79%	0.792	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-58.1	154.1	167.6	29.1	-35.2	0	0	0	109.8
84	P	61.6	Low	58.1	Low	121 Å²	121	119.8 Å²	119.8	79%	0.786	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-50	152.1	168.1	-26.1	35.3	0	0	0	111.7
85	G	53.4	Low	56.3	Low	65 Å²	65	116.8 Å²	116.8	67%	0.67	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-58.9	158.1	165.5	0	0	0	0	0	110.4	D87	G85-D87 PolarHBondContact O-N 3.21Å
86	L	53.5	Low	54.1	Low	177 Å²	177	107.9 Å²	107.9	93%	0.927	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-60.8	137.7	164.5	-65.3	173.6	0	0	0	108.2
87	D	45.9	Very low	52.3	Low	157 Å²	157	112.9 Å²	112.9	84%	0.84	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-55.8	141.4	172.3	-59.1	-58.6	0	0	0	109.6	G85 L89	G85-D87 PolarHBondContact O-N 3.21Å; D87-L89 PolarHBondContact O-N 1.9Å
88	G	38.4	Very low	50.2	Low	64 Å²	64	114.7 Å²	114.7	66%	0.66	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-61.6	136.2	175.6	0	0	0	0	0	109.5	D90	G88-D90 PolarHBondContact O-N 3.14Å; G88-D90 VanDerWaalsContact O-N 3.1Å
89	L	38.9	Very low	47.9	Very low	182 Å²	182	112.3 Å²	112.3	95%	0.953	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-58.8	118.7	171.2	-74	170.1	0	0	0	108.6	D87 A91	D87-L89 PolarHBondContact O-N 1.9Å; L89-A91 PolarHBondContact O-N 3.31Å
90	D	36.7	Very low	46.2	Very low	145 Å²	145	117.1 Å²	117.1	78%	0.775	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-51.7	140.7	176	-69.4	-67.1	0	0	0	110.7	G88 N92	G88-D90 PolarHBondContact O-N 3.14Å; G88-D90 VanDerWaalsContact O-N 3.1Å; D90-N92 VanDerWaalsContact C-N 3.25Å; D90-N92 PolarHBondContact O-N 3.49Å
91	A	31.2	Very low	44.2	Very low	99 Å²	99	118.9 Å²	118.9	82%	0.818	72%	0.72	S	S	*	*			trans	-68.7	84.2	179.8	0	0	0	0	0	110	L89 C93	L89-A91 PolarHBondContact O-N 3.31Å; A91-C93 VanDerWaalsContact C-N 3.31Å; A91-C93 PolarHBondContact O-N 3.37Å
92	N	34.5	Very low	42.2	Very low	140 Å²	140	119.2 Å²	119.2	75%	0.749	72%	0.715	S	S	*	*			trans	-58.6	91.9	178.9	-178	-12.5	0	0	0	110	D90 S94	D90-N92 VanDerWaalsContact C-N 3.25Å; D90-N92 PolarHBondContact O-N 3.49Å; N92-S94 PolarHBondContact O-N 2.99Å
93	C	31.6	Very low	40.7	Very low	40 Å²	40	123 Å²	123	27%	0.27	72%	0.721	S	S	.	*			trans	-81.6	68.9	-174.5	-158.9	0	0	0	0	109.2	A91 T95 C96	A91-C93 VanDerWaalsContact C-N 3.31Å; A91-C93 PolarHBondContact O-N 3.37Å; C93-T95 PolarHBondContact O-N 3.2Å; C93-C96 HydrophobicContact CB-CB 4.32Å; C93-C96 PolarHBondContact O-N 3.07Å
94	S	37	Very low	38.6	Very low	110 Å²	110	122.8 Å²	122.8	77%	0.769	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	6.2	-174.6	56.3	0	0	0	0	115.6	N92	N92-S94 PolarHBondContact O-N 2.99Å
95	T	42.9	Very low	37	Very low	131 Å²	131	122.1 Å²	122.1	80%	0.804	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	-0.2	170.9	44.2	0	0	0	0	114.2	C93	C93-T95 PolarHBondContact O-N 3.2Å
96	C	33.1	Very low	35.9	Very low	55 Å²	55	124.3 Å²	124.3	37%	0.372	72%	0.715	S	S	.	*	S	Bend	trans	-121.3	116.9	174.6	-64.2	0	0	0	0	110.1	Y36 C93 F98	Y36-C96 PolarHBondContact OH-SG 2.83Å; C93-C96 HydrophobicContact CB-CB 4.32Å; C93-C96 PolarHBondContact O-N 3.07Å; C96-F98 PolarHBondContact O-N 3.22Å
97	Q	39.5	Very low	34.6	Very low	159 Å²	159	121.9 Å²	121.9	74%	0.743	71%	0.71	S	S	*	*			trans	-80.9	44.4	-171.6	-155.8	-177.6	13.6	0	0	113.8
98	F	34.5	Very low	33.9	Very low	158 Å²	158	121.4 Å²	121.4	69%	0.693	71%	0.706	S	S	*	*			trans	-133	93.2	178.3	-71.8	-72.4	0	0	0	110.5	C96	C96-F98 PolarHBondContact O-N 3.22Å
99	A	31.6	Very low	33.8	Very low	73 Å²	73	127.1 Å²	127.1	60%	0.603	72%	0.716	S	S	*	*			trans	-86.3	123.5	163.7	0	0	0	0	0	108.8	E101	A99-E101 PolarHBondContact O-N 3.08Å
100	M	38.4	Very low	33.3	Very low	159 Å²	159	126 Å²	126	78%	0.783	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-77.1	-7	-176.6	-74.3	179.2	59.2	0	0	114.3	N102	M100-N102 PolarHBondContact O-N 3.02Å
101	E	34.9	Very low	33	Very low	158 Å²	158	125.7 Å²	125.7	74%	0.738	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-62.7	-17.6	-168.6	-59	179	127.9	0	0	115.3	A99	A99-E101 PolarHBondContact O-N 3.08Å
102	N	32.5	Very low	32.9	Very low	133 Å²	133	129.1 Å²	129.1	71%	0.711	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-102.6	4.2	-171.5	-73.2	-52.1	0	0	0	115.7	M100	M100-N102 PolarHBondContact O-N 3.02Å
103	I	35.8	Very low	32.6	Very low	134 Å²	134	128.9 Å²	128.9	69%	0.687	72%	0.717	S	S	*	*	S	Bend	trans	-81.7	-20.1	-172.7	-64.5	176.6	0	0	0	113.3
104	C	25.6	Very low	32.4	Very low	118 Å²	118	133.6 Å²	133.6	80%	0.797	75%	0.749	S	S	*	*	S	Bend	trans	-124.4	20.2	-161.9	-65.8	0	0	0	0	116.8
105	T	27.6	Very low	32	Very low	107 Å²	107	138.1 Å²	138.1	66%	0.656	75%	0.754	S	S	*	*			trans	-138.6	24.9	-167.9	42.5	0	0	0	0	117.5
106	V	28.9	Very low	31.5	Very low	111 Å²	111	137.7 Å²	137.7	67%	0.673	76%	0.757	S	S	*	*			trans	-135.2	119.1	171.5	-156.2	0	0	0	0	113.8	I108	V106-I108 HydrophobicContact CB-CD1 4.38Å; V106-I108 HydrophobicContact CB-CG1 4.09Å; V106-I108 HydrophobicContact CG1-CD1 4Å; V106-I108 HydrophobicContact CG1-CG1 3.53Å; V106-I108 PolarHBondContact O-N 3.22Å
107	P	27.1	Very low	31.4	Very low	126 Å²	126	140.1 Å²	140.1	82%	0.818	78%	0.781	S	S	*	*			trans	-87.1	90.1	170.2	33.7	-31.1	0	0	0	110.7
108	I	31.4	Very low	31	Very low	148 Å²	148	137.1 Å²	137.1	76%	0.759	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-91.1	131.8	178.8	-56	-177.1	0	0	0	110.1	V106	V106-I108 HydrophobicContact CB-CD1 4.38Å; V106-I108 HydrophobicContact CB-CG1 4.09Å; V106-I108 HydrophobicContact CG1-CD1 4Å; V106-I108 HydrophobicContact CG1-CG1 3.53Å; V106-I108 PolarHBondContact O-N 3.22Å
109	Q	35.8	Very low	30.9	Very low	184 Å²	184	137 Å²	137	86%	0.86	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-82	162.3	178.9	-68.4	-161.6	-13.1	0	0	112.7
110	L	28.5	Very low	31.1	Very low	157 Å²	157	140.5 Å²	140.5	82%	0.822	80%	0.798	S	S	*	*	S	Bend	trans	-69.6	148.1	-175.7	-155	75.3	0	0	0	112.3
111	N	30	Very low	30.7	Very low	140 Å²	140	137.2 Å²	137.2	75%	0.749	81%	0.805	S	S	*	*			trans	93	95.7	174.7	-52.3	-21.9	0	0	0	116.5
112	D	29.7	Very low	30.8	Very low	170 Å²	170	132.5 Å²	132.5	91%	0.909	79%	0.793	S	S	*	*				-156.7	159.2	114.2	-109.7	-28.1	0	0	0	110
113	T	28.1	Very low	31	Very low	136 Å²	136	135.6 Å²	135.6	83%	0.834	80%	0.803	S	S	*	*			trans	-120	132	-179.3	48.9	0	0	0	0	112.6
114	C	26.9	Very low	31.2	Very low	139 Å²	139	132.8 Å²	132.8	94%	0.939	79%	0.789	S	S	*	*			trans	-111.2	154.8	171.8	-83.8	0	0	0	0	111.9
115	K	29.6	Very low	31.8	Very low	204 Å²	204	130.8 Å²	130.8	89%	0.887	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-95.2	154.8	-163.7	-64.8	168.4	-177	170.6	0	111.9
116	S	31.2	Very low	32.5	Very low	122 Å²	122	134.3 Å²	134.3	85%	0.853	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-63.3	134.2	171.1	42	0	0	0	0	111.6
117	A	31.3	Very low	33.1	Very low	106 Å²	106	131.8 Å²	131.8	88%	0.876	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-97.7	128.2	156.9	0	0	0	0	0	107.6
118	A	30.8	Very low	33.7	Very low	96 Å²	96	128.9 Å²	128.9	79%	0.793	75%	0.75	S	S	*	*			trans	-109.8	130.2	171.8	0	0	0	0	0	108.6
119	D	32.8	Very low	34.2	Very low	156 Å²	156	124.1 Å²	124.1	83%	0.834	73%	0.733	S	S	*	*				-159.1	174.2	125	-121.2	-34.3	0	0	0	110.3
120	D	36.3	Very low	34.7	Very low	146 Å²	146	117.1 Å²	117.1	78%	0.781	71%	0.711	S	S	*	*	S	Bend	trans	57.6	94	171.9	-70.8	-28.3	0	0	0	118.8	A122	D120-A122 PolarHBondContact O-N 3.37Å
121	G	30.8	Very low	35.3	Very low	90 Å²	90	116.6 Å²	116.6	93%	0.928	70%	0.699	S	S	*	*	S	Bend		90.2	6.5	115.6	0	0	0	0	0	119.1
122	A	36.6	Very low	35.8	Very low	59 Å²	59	113.6 Å²	113.6	49%	0.488	68%	0.682	S	S	.	*			trans	-147.7	119	166.6	0	0	0	0	0	111.9	D120 I124	D120-A122 PolarHBondContact O-N 3.37Å; A122-I124 PolarHBondContact O-N 3.46Å
123	Q	36.9	Very low	36.4	Very low	198 Å²	198	109.8 Å²	109.8	93%	0.925	67%	0.669	S	S	*	*			trans	-74.1	92.1	172.3	-74.7	-172.3	-14.9	0	0	110	P125	Q123-P125 WeakPolarHBondContact O-CD 3.35Å
124	I	38.8	Very low	37.2	Very low	76 Å²	76	107.6 Å²	107.6	39%	0.39	66%	0.66	S	S	.	*			trans	-61.2	123.8	167.3	-59.8	176.2	0	0	0	107.4	A122 E126 V128	A122-I124 PolarHBondContact O-N 3.46Å; I124-E126 PolarHBondContact O-N 3.24Å; I124-V128 HydrophobicContact CG2-CB 3.81Å; I124-V128 HydrophobicContact CG2-CG1 3.83Å
125	P	39.6	Very low	37.8	Very low	76 Å²	76	106.4 Å²	106.4	49%	0.494	64%	0.642	S	S	.	*			trans	-57.8	140.8	177	-25.4	34.7	0	0	0	111.2	Q123 S127 V128 A129	Q123-P125 WeakPolarHBondContact O-CD 3.35Å; P125-S127 PolarHBondContact O-N 3.32Å; P125-S127 VanDerWaalsContact O-N 3.08Å; P125-V128 HydrophobicContact CB-CG2 4.21Å; P125-V128 HydrophobicContact CG-CG2 4.34Å; P125-V128 WeakPolarHBondContact O-CA 3.42Å; P125-V128 WeakPolarHBondContact O-CB 3.2Å; P125-V128 PolarHBondContact O-N 2.86Å; P125-A129 PolarHBondContact O-N 3.26Å
126	E	40.9	Very low	38.3	Very low	181 Å²	181	104.1 Å²	104.1	85%	0.846	64%	0.639	S	S	*	*	H	α-helix	trans	-59.2	-28	-175.1	-156.2	168.6	-140.5	0	0	112.5	I124 G130	I124-E126 PolarHBondContact O-N 3.24Å; E126-G130 PolarHBondContact O-N 3.39Å
127	S	41.9	Very low	38.9	Very low	57 Å²	57	103.8 Å²	103.8	40%	0.399	63%	0.627	S	S	.	*	H	α-helix	trans	-64.3	-33	170.2	48.7	0	0	0	0	114.5	P125 Y131	P125-S127 PolarHBondContact O-N 3.32Å; P125-S127 VanDerWaalsContact O-N 3.08Å; S127-Y131 PolarHBondContact O-N 2.87Å
128	V	39.7	Very low	39.4	Very low	65 Å²	65	108.3 Å²	108.3	39%	0.394	63%	0.629	S	S	.	*	H	α-helix	trans	-82	-38.7	177.3	179.4	0	0	0	0	110.1	I124 P125 G130 Y131 L132	I124-V128 HydrophobicContact CG2-CB 3.81Å; I124-V128 HydrophobicContact CG2-CG1 3.83Å; P125-V128 HydrophobicContact CB-CG2 4.21Å; P125-V128 HydrophobicContact CG-CG2 4.34Å; P125-V128 WeakPolarHBondContact O-CA 3.42Å; P125-V128 WeakPolarHBondContact O-CB 3.2Å; P125-V128 PolarHBondContact O-N 2.86Å; V128-G130 VanDerWaalsContact C-N 3.29Å; V128-G130 PolarHBondContact O-N 3.46Å; V128-Y131 PolarHBondContact O-N 3.43Å; V128-Y131 VanDerWaalsContact O-N 3.16Å; V128-L132 HydrophobicContact CG1-CD1 4.05Å; V128-L132 HydrophobicContact CG1-CG 4.35Å; V128-L132 WeakPolarHBondContact O-CG 3.4Å; V128-L132 PolarHBondContact O-N 2.92Å
129	A	42.7	Very low	40.2	Very low	48 Å²	48	106 Å²	106	40%	0.397	60%	0.604	S	S	.	*	H	α-helix	trans	-57.3	-42.6	171.8	0	0	0	0	0	111.8	P125 L132 S133	P125-A129 PolarHBondContact O-N 3.26Å; A129-L132 PolarHBondContact O-N 3.36Å; A129-S133 WeakPolarHBondContact O-CB 3.02Å; A129-S133 PolarHBondContact O-N 2.82Å
130	G	45.5	Very low	41.1	Very low	38 Å²	38	102.9 Å²	102.9	39%	0.392	59%	0.594	S	S	.	*	H	α-helix	trans	-59	-47.2	172.4	0	0	0	0	0	113.1	E126 V128 S133 S134	E126-G130 PolarHBondContact O-N 3.39Å; V128-G130 VanDerWaalsContact C-N 3.29Å; V128-G130 PolarHBondContact O-N 3.46Å; G130-S133 PolarHBondContact O-N 3.11Å; G130-S133 PolarHBondContact O-OG 3.02Å; G130-S134 PolarHBondContact O-N 3.02Å
131	Y	41.3	Very low	41.8	Very low	145 Å²	145	101.7 Å²	101.7	57%	0.569	58%	0.582	S	S	*	*	H	α-helix	trans	-60.6	-48.7	177.4	-118.2	-93	0	0	0	112.1	S127 V128 S133 S134	S127-Y131 PolarHBondContact O-N 2.87Å; V128-Y131 PolarHBondContact O-N 3.43Å; V128-Y131 VanDerWaalsContact O-N 3.16Å; Y131-S133 VanDerWaalsContact C-N 3.31Å; Y131-S133 PolarHBondContact O-N 2.88Å; Y131-S134 PolarHBondContact O-N 2.89Å; Y131-S134 VanDerWaalsContact O-N 3.11Å; Y131-S134 PolarHBondContact O-OG 3.37Å
132	L	40.2	Very low	42.6	Very low	77 Å²	77	100.1 Å²	100.1	40%	0.403	55%	0.552	S	S	.	*	H	α-helix	trans	-58.5	-41.2	176.7	-69	169	0	0	0	112	V128 A129 S134 M135 L143	V128-L132 HydrophobicContact CG1-CD1 4.05Å; V128-L132 HydrophobicContact CG1-CG 4.35Å; V128-L132 WeakPolarHBondContact O-CG 3.4Å; V128-L132 PolarHBondContact O-N 2.92Å; A129-L132 PolarHBondContact O-N 3.36Å; L132-S134 VanDerWaalsContact C-N 3.25Å; L132-S134 PolarHBondContact O-N 3.4Å; L132-M135 PolarHBondContact O-N 3.38Å; L132-L143 HydrophobicContact CD1-CD1 3.95Å; L132-L143 HydrophobicContact CD2-CD1 4.2Å
133	S	43.2	Very low	43.1	Very low	91 Å²	91	100.3 Å²	100.3	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-63.5	-28.6	177.6	75.5	0	0	0	0	113.6	A129 G130 Y131	A129-S133 WeakPolarHBondContact O-CB 3.02Å; A129-S133 PolarHBondContact O-N 2.82Å; G130-S133 PolarHBondContact O-N 3.11Å; G130-S133 PolarHBondContact O-OG 3.02Å; Y131-S133 VanDerWaalsContact C-N 3.31Å; Y131-S133 PolarHBondContact O-N 2.88Å
134	S	44.4	Very low	43.9	Very low	90 Å²	90	97.8 Å²	97.8	63%	0.629	53%	0.533	S	S	*	.	H	α-helix	trans	-77.7	-16.5	178.6	70.6	0	0	0	0	114.5	G130 Y131 L132	G130-S134 PolarHBondContact O-N 3.02Å; Y131-S134 PolarHBondContact O-N 2.89Å; Y131-S134 VanDerWaalsContact O-N 3.11Å; Y131-S134 PolarHBondContact O-OG 3.37Å; L132-S134 VanDerWaalsContact C-N 3.25Å; L132-S134 PolarHBondContact O-N 3.4Å
135	M	38.9	Very low	44.1	Very low	114 Å²	114	98.2 Å²	98.2	56%	0.562	54%	0.541	S	S	*	.	H	α-helix	trans	-90.3	-19.4	-177	-72.7	-173.6	67	0	0	114.4	L132 I137	L132-M135 PolarHBondContact O-N 3.38Å; M135-I137 WeakPolarHBondContact O-CG1 3.39Å; M135-I137 PolarHBondContact O-N 2.97Å
136	N	40.7	Very low	44.4	Very low	155 Å²	155	98.2 Å²	98.2	83%	0.829	54%	0.537	S	S	*	.			trans	50.1	29	171.8	-153.7	38.4	0	0	0	116.6
137	I	43.8	Very low	44.8	Very low	116 Å²	116	94 Å²	94	60%	0.595	52%	0.515	S	S	*	.			trans	-113.1	123.4	176.6	-62.4	154.5	0	0	0	108.4	M135 N139	M135-I137 WeakPolarHBondContact O-CG1 3.39Å; M135-I137 PolarHBondContact O-N 2.97Å; I137-N139 HydrophobicContact CG2-CB 3.99Å; I137-N139 PolarHBondContact O-N 2.76Å
138	E	41.5	Very low	45.1	Very low	200 Å²	200	93.9 Å²	93.9	94%	0.935	52%	0.518	S	S	*	.			trans	-69.2	74.7	174.4	-71	-164.9	122	0	0	111.8
139	N	48.8	Very low	45.1	Very low	49 Å²	49	95.3 Å²	95.3	26%	0.262	53%	0.53	S	S	.	.			trans	-108.4	54.5	-172.9	-136.7	-24.6	0	0	0	112.7	I137 K141 L142 L143	I137-N139 HydrophobicContact CG2-CB 3.99Å; I137-N139 PolarHBondContact O-N 2.76Å; N139-K141 PolarHBondContact O-N 2.89Å; N139-L142 HydrophobicContact CB-CB 3.8Å; N139-L142 HydrophobicContact CB-CD2 4.28Å; N139-L142 WeakPolarHBondContact O-CB 3.37Å; N139-L142 PolarHBondContact O-N 3.42Å; N139-L142 WeakPolarHBondContact OD1-CB 3.38Å; N139-L142 PolarHBondContact OD1-N 3.24Å; N139-L143 PolarHBondContact O-N 3.28Å
140	S	51.7	Low	45	Very low	90 Å²	90	98.8 Å²	98.8	63%	0.629	54%	0.541	S	S	*	.	H	α-helix	trans	-55.4	-33.3	177.3	55.7	0	0	0	0	113.1	L143 Q144	S140-L143 WeakPolarHBondContact O-CB 3.31Å; S140-L143 PolarHBondContact O-N 3.36Å; S140-Q144 PolarHBondContact O-N 2.84Å; S140-Q144 VanDerWaalsContact O-N 3.11Å
141	K	49.2	Very low	44.8	Very low	121 Å²	121	104.9 Å²	104.9	53%	0.526	56%	0.559	S	S	.	*	H	α-helix	trans	-67.2	-43.1	172.9	-64.2	-175.1	179.1	-173.4	0	112.7	N139 L143 Q144 C145	N139-K141 PolarHBondContact O-N 2.89Å; K141-L143 VanDerWaalsContact C-N 3.3Å; K141-L143 PolarHBondContact O-N 2.85Å; K141-Q144 PolarHBondContact O-N 2.95Å; K141-C145 PolarHBondContact O-N 3.22Å
142	L	47.7	Very low	44.8	Very low	57 Å²	57	106.6 Å²	106.6	30%	0.298	57%	0.573	S	S	.	*	H	α-helix	trans	-63.3	-38.4	173.5	-177.3	68.3	0	0	0	110.9	N139 Q144 C145 I146	N139-L142 HydrophobicContact CB-CB 3.8Å; N139-L142 HydrophobicContact CB-CD2 4.28Å; N139-L142 WeakPolarHBondContact O-CB 3.37Å; N139-L142 PolarHBondContact O-N 3.42Å; N139-L142 WeakPolarHBondContact OD1-CB 3.38Å; N139-L142 PolarHBondContact OD1-N 3.24Å; L142-Q144 VanDerWaalsContact C-N 3.32Å; L142-Q144 PolarHBondContact O-N 3.42Å; L142-C145 WeakPolarHBondContact O-CB 3.4Å; L142-C145 PolarHBondContact O-N 2.81Å; L142-I146 HydrophobicContact CD1-CD1 4.3Å; L142-I146 HydrophobicContact CD1-CG1 4.47Å; L142-I146 HydrophobicContact CD2-CD1 4.42Å; L142-I146 HydrophobicContact CG-CD1 3.88Å; L142-I146 HydrophobicContact CG-CG1 4.43Å; L142-I146 WeakPolarHBondContact O-CG1 3.22Å; L142-I146 PolarHBondContact O-N 3.33Å
143	L	47.5	Very low	44.6	Very low	63 Å²	63	111.1 Å²	111.1	33%	0.33	59%	0.594	S	S	.	*	H	α-helix	trans	-62.4	-37.6	176.2	-152.6	89.1	0	0	0	112.4	L132 N139 S140 K141 K147	L132-L143 HydrophobicContact CD1-CD1 3.95Å; L132-L143 HydrophobicContact CD2-CD1 4.2Å; N139-L143 PolarHBondContact O-N 3.28Å; S140-L143 WeakPolarHBondContact O-CB 3.31Å; S140-L143 PolarHBondContact O-N 3.36Å; K141-L143 VanDerWaalsContact C-N 3.3Å; K141-L143 PolarHBondContact O-N 2.85Å; L143-K147 WeakPolarHBondContact O-CB 3.46Å; L143-K147 WeakPolarHBondContact O-CG 3.33Å; L143-K147 PolarHBondContact O-N 2.91Å
144	Q	53.5	Low	44.1	Very low	144 Å²	144	115 Å²	115	67%	0.673	60%	0.602	S	S	*	*	H	α-helix	trans	-67.2	-42.8	171.5	-76.9	-177	-35.1	0	0	112.2	S140 K141 L142 K147 A148	S140-Q144 PolarHBondContact O-N 2.84Å; S140-Q144 VanDerWaalsContact O-N 3.11Å; K141-Q144 PolarHBondContact O-N 2.95Å; L142-Q144 VanDerWaalsContact C-N 3.32Å; L142-Q144 PolarHBondContact O-N 3.42Å; Q144-K147 PolarHBondContact O-N 3.09Å; Q144-A148 PolarHBondContact O-N 2.76Å
145	C	43.4	Very low	43.5	Very low	85 Å²	85	117.1 Å²	117.1	57%	0.574	61%	0.611	S	S	*	*	H	α-helix	trans	-61.6	-45.2	178.3	-163.5	0	0	0	0	111.9	K141 L142 A148 C149	K141-C145 PolarHBondContact O-N 3.22Å; L142-C145 WeakPolarHBondContact O-CB 3.4Å; L142-C145 PolarHBondContact O-N 2.81Å; C145-A148 PolarHBondContact O-N 3.35Å; C145-C149 WeakPolarHBondContact O-CB 3.2Å; C145-C149 PolarHBondContact O-N 2.79Å
146	I	46.7	Very low	43.1	Very low	76 Å²	76	118.5 Å²	118.5	39%	0.39	63%	0.626	S	S	.	*	H	α-helix	trans	-63.6	-43	175.1	-67.4	168.5	0	0	0	111	L142 A148 C149 L150	L142-I146 HydrophobicContact CD1-CD1 4.3Å; L142-I146 HydrophobicContact CD1-CG1 4.47Å; L142-I146 HydrophobicContact CD2-CD1 4.42Å; L142-I146 HydrophobicContact CG-CD1 3.88Å; L142-I146 HydrophobicContact CG-CG1 4.43Å; L142-I146 WeakPolarHBondContact O-CG1 3.22Å; L142-I146 PolarHBondContact O-N 3.33Å; I146-A148 VanDerWaalsContact C-N 3.34Å; I146-A148 PolarHBondContact O-N 3.28Å; I146-C149 PolarHBondContact O-N 3.36Å; I146-L150 HydrophobicContact CG2-CD1 3.8Å; I146-L150 HydrophobicContact CG2-CG 4.36Å; I146-L150 WeakPolarHBondContact O-CG 3.48Å; I146-L150 PolarHBondContact O-N 2.97Å
147	K	48	Very low	42.7	Very low	92 Å²	92	116.5 Å²	116.5	40%	0.4	62%	0.622	S	S	.	*	H	α-helix	trans	-59.7	-41.2	176	-83.7	-175.8	173.3	-170.1	0	112.5	L143 Q144 Q151	L143-K147 WeakPolarHBondContact O-CB 3.46Å; L143-K147 WeakPolarHBondContact O-CG 3.33Å; L143-K147 PolarHBondContact O-N 2.91Å; Q144-K147 PolarHBondContact O-N 3.09Å; K147-Q151 WeakPolarHBondContact O-CG 3.43Å
148	A	49.2	Very low	42.3	Very low	56 Å²	56	119.7 Å²	119.7	46%	0.463	63%	0.634	S	S	.	*	H	α-helix	trans	-66.4	-47.7	176.9	0	0	0	0	0	111.9	Q144 C145 I146 L150 Q151	Q144-A148 PolarHBondContact O-N 2.76Å; C145-A148 PolarHBondContact O-N 3.35Å; I146-A148 VanDerWaalsContact C-N 3.34Å; I146-A148 PolarHBondContact O-N 3.28Å; A148-L150 VanDerWaalsContact C-N 3.3Å; A148-L150 PolarHBondContact O-N 2.99Å; A148-Q151 PolarHBondContact O-N 2.83Å; A148-Q151 VanDerWaalsContact O-N 3.1Å
149	C	38.5	Very low	42	Very low	95 Å²	95	115.9 Å²	115.9	64%	0.642	63%	0.625	S	S	*	*	H	α-helix	trans	-62.4	-35	-178.4	-164.3	0	0	0	0	112.9	C145 I146 Q151	C145-C149 WeakPolarHBondContact O-CB 3.2Å; C145-C149 PolarHBondContact O-N 2.79Å; I146-C149 PolarHBondContact O-N 3.36Å; C149-Q151 VanDerWaalsContact C-N 3.29Å; C149-Q151 PolarHBondContact O-N 2.9Å
150	L	42.4	Very low	41.4	Very low	121 Å²	121	119.8 Å²	119.8	63%	0.634	65%	0.651	S	S	*	*	H	α-helix	trans	-71.6	-17.8	176.8	-71.7	171.4	0	0	0	114.2	I146 A148	I146-L150 HydrophobicContact CG2-CD1 3.8Å; I146-L150 HydrophobicContact CG2-CG 4.36Å; I146-L150 WeakPolarHBondContact O-CG 3.48Å; I146-L150 PolarHBondContact O-N 2.97Å; A148-L150 VanDerWaalsContact C-N 3.3Å; A148-L150 PolarHBondContact O-N 2.99Å
151	Q	41.5	Very low	40.4	Very low	165 Å²	165	119.8 Å²	119.8	77%	0.771	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-7.7	-177.1	-76.2	-177.6	-47.2	0	0	114.4	K147 A148 C149	K147-Q151 WeakPolarHBondContact O-CG 3.43Å; A148-Q151 PolarHBondContact O-N 2.83Å; A148-Q151 VanDerWaalsContact O-N 3.1Å; C149-Q151 VanDerWaalsContact C-N 3.29Å; C149-Q151 PolarHBondContact O-N 2.9Å
152	E	40.8	Very low	39.9	Very low	181 Å²	181	123.3 Å²	123.3	85%	0.846	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-0.2	178.4	-62.7	-164.2	151.9	0	0	114.4
153	M	35.6	Very low	39.4	Very low	173 Å²	173	127.1 Å²	127.1	85%	0.852	70%	0.703	S	S	*	*			trans	-103.7	4.4	-174.4	-75	-153.9	158.3	0	0	116.6
154	E	32.8	Very low	38.6	Very low	173 Å²	173	130.4 Å²	130.4	81%	0.808	73%	0.725	S	S	*	*			trans	-100.4	96.1	174.6	-69	-166.4	160	0	0	112.5
155	T	31.8	Very low	37.9	Very low	134 Å²	134	130.3 Å²	130.3	82%	0.822	73%	0.734	S	S	*	*			trans	170.8	105.3	131.6	29.2	0	0	0	0	114
156	T	30.4	Very low	37.6	Very low	143 Å²	143	130.6 Å²	130.6	88%	0.877	74%	0.742	S	S	*	*				175.6	123.7	126.6	23.2	0	0	0	0	111.8
157	P	32.9	Very low	37.5	Very low	112 Å²	112	132.8 Å²	132.8	73%	0.727	76%	0.762	S	S	*	*			trans	-103.9	151.7	177.7	37.6	-32	0	0	0	113.9
158	E	33.7	Very low	36.9	Very low	183 Å²	183	137.2 Å²	137.2	86%	0.855	78%	0.784	S	S	*	*			trans	54.6	153.2	154.2	-58.9	178	174.6	0	0	117.9
159	T	35.9	Very low	36.3	Very low	121 Å²	121	141.2 Å²	141.2	74%	0.742	80%	0.802	S	S	*	*			cis	-150.7	178.8	13.6	-13.6	0	0	0	0	106.4
160	T	35.7	Very low	36.2	Very low	131 Å²	131	142.6 Å²	142.6	80%	0.804	81%	0.808	S	S	*	*			cis	-152.1	164.3	16.3	-36.9	0	0	0	0	109.4
161	A	30.6	Very low	35.9	Very low	90 Å²	90	145.5 Å²	145.5	74%	0.744	82%	0.818	S	S	*	*			trans	-83.8	154.2	171.3	0	0	0	0	0	113.8
162	M	39	Very low	36	Very low	195 Å²	195	142.6 Å²	142.6	96%	0.961	81%	0.814	S	S	*	*			trans	-142.1	164.1	160	-90.2	-155.9	166.8	0	0	112
163	T	37.1	Very low	35.8	Very low	137 Å²	137	140.3 Å²	140.3	84%	0.84	81%	0.812	S	S	*	*			trans	-95.8	153.1	-150.2	-29.6	0	0	0	0	115
164	T	31.1	Very low	36.2	Very low	132 Å²	132	138.9 Å²	138.9	81%	0.81	80%	0.804	S	S	*	*			trans	-65.7	137.8	174.4	50.6	0	0	0	0	114.2
165	V	40	Very low	37.2	Very low	142 Å²	142	135 Å²	135	86%	0.861	79%	0.786	S	S	*	*			trans	-132.2	131.1	151.6	-178.9	0	0	0	0	107
166	A	36.8	Very low	37.7	Very low	90 Å²	90	134.3 Å²	134.3	74%	0.744	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-93.1	134.2	179.4	0	0	0	0	0	110.8
167	P	43.2	Very low	38.5	Very low	123 Å²	123	131.1 Å²	131.1	80%	0.799	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-77.6	153.7	167.5	32.9	-33.2	0	0	0	111.2
168	E	35.5	Very low	39.2	Very low	185 Å²	185	129.4 Å²	129.4	86%	0.864	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-85.3	137	-177	-167	167.2	-156.3	0	0	111.1	T170	E168-T170 PolarHBondContact O-N 3.17Å
169	V	37.5	Very low	39.9	Very low	139 Å²	139	129.2 Å²	129.2	84%	0.842	76%	0.758	S	S	*	*			trans	-80.3	103.6	-173.2	-178.8	0	0	0	0	110.8
170	T	35.9	Very low	41	Very low	125 Å²	125	125.3 Å²	125.3	77%	0.767	73%	0.732	S	S	*	*			trans	-90.1	131.2	167	43.9	0	0	0	0	110.9	E168	E168-T170 PolarHBondContact O-N 3.17Å
171	E	36.9	Very low	42.2	Very low	181 Å²	181	126.9 Å²	126.9	85%	0.846	73%	0.728	S	S	*	*			trans	-65.2	137.5	175.6	-68.1	-170.9	119.4	0	0	111	T173	E171-T173 PolarHBondContact O-N 3.19Å
172	P	43.3	Very low	44.3	Very low	105 Å²	105	127.5 Å²	127.5	68%	0.682	72%	0.719	S	S	*	*			trans	-75.6	108.9	176.5	-7.6	23.5	0	0	0	110.5	E174	P172-E174 PolarHBondContact O-N 2.83Å
173	T	36.6	Very low	46	Very low	132 Å²	132	119.6 Å²	119.6	81%	0.81	68%	0.684	S	S	*	*			trans	-51.6	130.4	170.3	-44.7	0	0	0	0	110.7	E171 E175	E171-T173 PolarHBondContact O-N 3.19Å; T173-E175 PolarHBondContact O-N 2.84Å
174	E	44.6	Very low	48	Very low	144 Å²	144	118.9 Å²	118.9	67%	0.673	68%	0.68	S	S	*	*			trans	-72.9	112.5	-176.3	-64	-165.5	131.7	0	0	111.8	P172	P172-E174 PolarHBondContact O-N 2.83Å
175	E	52.1	Low	50.4	Low	92 Å²	92	113.4 Å²	113.4	43%	0.43	65%	0.648	S	S	.	*			trans	-66.4	134.4	167.4	-65.8	168.1	128.2	0	0	109.5	T173 K394 R396	T173-E175 PolarHBondContact O-N 2.84Å; E175-K394 IonicContact OE1-NZ 2.74Å; E175-K394 PolarHBondContact OE1-NZ 2.96Å; E175-K394 IonicContact OE2-NZ 2.79Å; E175-K394 PolarHBondContact OE2-NZ 2.96Å; E175-R396 IonicContact OE2-NH2 2.67Å; E175-R396 PolarHBondContact OE2-NH2 2.84Å
176	P	42	Very low	52.5	Low	118 Å²	118	108.1 Å²	108.1	77%	0.766	61%	0.614	S	S	*	*			trans	-52.3	147	-176.5	-28.9	35.1	0	0	0	114.3	A178	P176-A178 VanDerWaalsContact C-N 3.29Å; P176-A178 PolarHBondContact O-N 3.5Å
177	T	47.5	Very low	55.1	Low	77 Å²	77	103.9 Å²	103.9	47%	0.472	58%	0.578	S	S	.	*			trans	-74.8	79.9	175.7	40	0	0	0	0	111.6	E179 R439 A440	T177-E179 PolarHBondContact O-N 2.62Å; T177-R439 HydrophobicContact CG2-CB 4.48Å; T177-A440 VanDerWaalsContact CB-O 3.29Å; T177-A440 WeakPolarHBondContact CB-O 3.37Å; T177-A440 WeakPolarHBondContact CG2-O 3.44Å; T177-A440 PolarHBondContact OG1-O 2.87Å
178	A	47.9	Very low	57.4	Low	76 Å²	76	98.5 Å²	98.5	63%	0.628	54%	0.544	S	S	*	.			trans	-57.9	130.1	156.8	0	0	0	0	0	109.1	P176 I180	P176-A178 VanDerWaalsContact C-N 3.29Å; P176-A178 PolarHBondContact O-N 3.5Å; A178-I180 PolarHBondContact O-N 3.32Å; A178-I180 VanDerWaalsContact O-N 3.16Å
179	E	48.9	Very low	60.2	Low	179 Å²	179	90.2 Å²	90.2	84%	0.836	51%	0.505	S	S	*	.			trans	-56.4	117.7	-178.3	-67.3	-178.6	147	0	0	111	T177 K181	T177-E179 PolarHBondContact O-N 2.62Å; E179-K181 PolarHBondContact O-N 3.36Å; E179-K181 VanDerWaalsContact O-N 3.16Å
180	I	59.6	Low	62.9	Low	38 Å²	38	88.9 Å²	88.9	20%	0.195	49%	0.488	C	S	.	.			trans	-78.9	102.4	176	-60.4	-177.5	0	0	0	108.3	A178 A183 H186 Y391 R392	A178-I180 PolarHBondContact O-N 3.32Å; A178-I180 VanDerWaalsContact O-N 3.16Å; I180-A183 HydrophobicContact CB-CB 4.08Å; I180-A183 HydrophobicContact CG2-CB 3.54Å; I180-H186 HydrophobicContact CD1-CB 4.31Å; I180-H186 VanDerWaalsContact CD1-CD2 3.43Å; I180-H186 WeakPolarHBondContact CD1-CD2 3.26Å; I180-Y391 VanDerWaalsContact CG2-CB 3.48Å; I180-Y391 HydrophobicContact CG2-CD1 3.54Å; I180-Y391 HydrophobicContact CG2-CE1 4.4Å; I180-Y391 HydrophobicContact CG2-CG 3.63Å; I180-R392 HydrophobicContact CD1-CG 4.18Å
181	K	60.4	Low	65.7	Low	165 Å²	165	89.6 Å²	89.6	72%	0.717	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	142.5	169.7	-63.1	-176.7	-179.8	-179.2	0	109.7	E179 A183	E179-K181 PolarHBondContact O-N 3.36Å; E179-K181 VanDerWaalsContact O-N 3.16Å; K181-A183 VanDerWaalsContact C-N 3.27Å; K181-A183 PolarHBondContact O-N 2.89Å
182	D	74.2	Confident	68.6	Low	103 Å²	103	82.4 Å²	82.4	55%	0.551	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	5.4	179.9	-30.7	-39.1	0	0	0	116.3	R349 Y391	D182-R349 IonicContact OD2-CZ 3.64Å; D182-R349 IonicContact OD2-NH1 2.68Å; D182-R349 PolarHBondContact OD2-NH1 3.07Å; D182-R349 IonicContact OD2-NH2 3.71Å; D182-R349 PolarHBondContact OD2-NH2 3.02Å; D182-Y391 VanDerWaalsContact C-CE1 3.48Å; D182-Y391 HydrophobicContact CB-CE1 4.27Å; D182-Y391 VanDerWaalsContact O-CE1 3.3Å; D182-Y391 WeakPolarHBondContact O-CE1 3.11Å; D182-Y391 PolarHBondContact O-OH 2.77Å
183	A	74.9	Confident	71.1	Confident	29 Å²	29	78.9 Å²	78.9	24%	0.24	43%	0.426	C	S	.	.			trans	-95.2	131.6	168.9	0	0	0	0	0	111.1	I180 K181 Y391	I180-A183 HydrophobicContact CB-CB 4.08Å; I180-A183 HydrophobicContact CG2-CB 3.54Å; K181-A183 VanDerWaalsContact C-N 3.27Å; K181-A183 PolarHBondContact O-N 2.89Å; A183-Y391 HydrophobicContact CB-CD1 4.1Å; A183-Y391 HydrophobicContact CB-CD2 4.29Å; A183-Y391 HydrophobicContact CB-CE1 3.84Å; A183-Y391 HydrophobicContact CB-CE2 4.03Å; A183-Y391 HydrophobicContact CB-CG 4.31Å
184	V	79.6	Confident	73.9	Confident	122 Å²	122	81.5 Å²	81.5	74%	0.739	43%	0.426	S	S	*	.	S	Bend	trans	-78.1	-33.4	168.9	-179.6	0	0	0	0	110.4	N321	V184-N321 PolarHBondContact N-OD1 3.18Å
185	A	81.4	Confident	76.4	Confident	17 Å²	17	76.8 Å²	76.8	14%	0.14	41%	0.408	C	S	.	.			trans	-151.5	130.8	-172.5	0	0	0	0	0	111.7	E320 N321 W438	A185-E320 HydrophobicContact CB-CB 3.37Å; A185-E320 HydrophobicContact CB-CG 4.14Å; A185-N321 PolarHBondContact N-OD1 3.47Å; A185-N321 PolarHBondContact O-ND2 2.84Å; A185-N321 PolarHBondContact O-OD1 2.94Å; A185-W438 HydrophobicContact CB-CZ3 4.17Å
186	H	84.3	Confident	78.6	Confident	31 Å²	31	75.5 Å²	75.5	14%	0.144	40%	0.403	C	S	.	.			trans	-128	116.6	178.9	170.8	-122	0	0	0	109.5	I180 R392 R439	I180-H186 HydrophobicContact CD1-CB 4.31Å; I180-H186 VanDerWaalsContact CD1-CD2 3.43Å; I180-H186 WeakPolarHBondContact CD1-CD2 3.26Å; H186-R392 PolarHBondContact CE1-NH2 3.36Å; H186-R439 WeakPolarHBondContact CE1-CD 3.32Å; H186-R439 WeakPolarHBondContact NE2-CD 3.32Å; H186-R439 PolarHBondContact NE2-NH1 3.49Å; H186-R439 PolarHBondContact O-N 3.39Å
187	C	91.1	Very high	81.2	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	177.6	-176.2	78.1	0	0	0	0	110.3	C368 I436 H437 W438	C187-C368 HydrophobicContact CB-CB 3.77Å; C187-C368 WeakPolarHBondContact CB-SG 3.36Å; C187-C368 WeakPolarHBondContact SG-CB 3.39Å; C187-C368 CovalentContact SG-SG 2.02Å; C187-C368 PolarHBondContact SG-SG 3.4Å; C187-I436 HydrophobicContact CB-CG2 3.68Å; C187-I436 WeakPolarHBondContact SG-CG2 3.41Å; C187-H437 CarbonylContact C-O 3.33Å; C187-H437 WeakPolarHBondContact CA-O 3.43Å; C187-H437 WeakPolarHBondContact CB-O 3.07Å; C187-W438 HydrophobicContact CB-CD2 4.11Å; C187-W438 HydrophobicContact CB-CE3 3.69Å; C187-W438 HydrophobicContact CB-CZ3 3.99Å
188	S	90.9	Very high	83.5	Confident	11 Å²	11	71.5 Å²	71.5	8%	0.077	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	134.2	177.2	50.3	0	0	0	0	111.1	H437	S188-H437 PolarHBondContact N-O 3.4Å; S188-H437 PolarHBondContact O-N 3.23Å; S188-H437 PolarHBondContact OG-O 3Å
189	L	94.3	Very high	85.8	Confident	10 Å²	10	68 Å²	68	5%	0.052	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	129.7	167.5	-178.9	71.3	0	0	0	109	R191 F192 F365 Y372 I400 A434	L189-R191 WeakPolarHBondContact CD1-O 3.33Å; L189-F192 HydrophobicContact CD1-CE1 4.41Å; L189-F192 HydrophobicContact CD2-CD1 4.32Å; L189-F192 HydrophobicContact CD2-CE1 3.54Å; L189-F192 HydrophobicContact CD2-CE2 4.37Å; L189-F192 HydrophobicContact CD2-CZ 3.6Å; L189-F365 HydrophobicContact CD2-CE2 4.13Å; L189-F365 HydrophobicContact CD2-CZ 3.92Å; L189-Y372 HydrophobicContact CB-CD1 4.3Å; L189-Y372 HydrophobicContact CB-CE1 3.56Å; L189-Y372 HydrophobicContact CD2-CD1 4.03Å; L189-Y372 HydrophobicContact CD2-CE1 4.13Å; L189-Y372 HydrophobicContact CG-CE1 4.48Å; L189-Y372 PolarHBondContact N-OH 2.69Å; L189-Y372 VanDerWaalsContact N-OH 3.07Å; L189-I400 HydrophobicContact CD2-CD1 4.08Å; L189-I400 HydrophobicContact CG-CD1 4.37Å; L189-A434 HydrophobicContact CD1-CB 3.79Å
190	K	93.7	Very high	88	Confident	111 Å²	111	65.7 Å²	65.7	48%	0.483	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-42.2	174.7	-66.4	-71.8	-176.8	171.2	0	111.9	E435 H437	K190-E435 PolarHBondContact N-O 3.38Å; K190-H437 HydrophobicContact CD-CB 4.12Å; K190-H437 HydrophobicContact CG-CB 3.61Å
191	R	95.7	Very high	89.7	Confident	141 Å²	141	64.5 Å²	64.5	53%	0.532	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	171.3	175.8	62.7	177.1	175.2	-142	-14.5	111.9	L189 E435	L189-R191 WeakPolarHBondContact CD1-O 3.33Å; R191-E435 HydrophobicContact CG-CB 3.83Å; R191-E435 HydrophobicContact CG-CG 4.44Å; R191-E435 IonicContact CZ-OE1 3.6Å; R191-E435 IonicContact CZ-OE2 3.46Å; R191-E435 VanDerWaalsContact NE-CD 3.29Å; R191-E435 IonicContact NE-OE1 3.78Å; R191-E435 PolarHBondContact NE-OE1 3.05Å; R191-E435 IonicContact NE-OE2 3.35Å; R191-E435 PolarHBondContact NE-OE2 3.03Å; R191-E435 IonicContact NH2-OE1 3.21Å; R191-E435 PolarHBondContact NH2-OE1 3.16Å; R191-E435 IonicContact NH2-OE2 2.74Å; R191-E435 PolarHBondContact NH2-OE2 2.73Å; R191-E435 WeakPolarHBondContact O-CB 3.4Å; R191-E435 PolarHBondContact O-N 3.34Å
192	F	97.2	Very high	91.1	Very high	30 Å²	30	64.2 Å²	64.2	13%	0.132	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	148.3	169.2	-55.1	-71.9	0	0	0	111.8	L189 F365 V384 I400 P401 W402 L421 V432	L189-F192 HydrophobicContact CD1-CE1 4.41Å; L189-F192 HydrophobicContact CD2-CD1 4.32Å; L189-F192 HydrophobicContact CD2-CE1 3.54Å; L189-F192 HydrophobicContact CD2-CE2 4.37Å; L189-F192 HydrophobicContact CD2-CZ 3.6Å; F192-F365 HydrophobicContact CE1-CE1 4.31Å; F192-F365 AromaticContact CE1-CZ 3.79Å; F192-F365 HydrophobicContact CE1-CZ 3.79Å; F192-F365 HydrophobicContact CZ-CE1 4.17Å; F192-F365 AromaticContact CZ-CZ 3.79Å; F192-F365 HydrophobicContact CZ-CZ 3.79Å; F192-V384 HydrophobicContact CE2-CG2 4.25Å; F192-V384 HydrophobicContact CZ-CG2 3.87Å; F192-I400 HydrophobicContact CD2-CG2 3.8Å; F192-I400 HydrophobicContact CE2-CB 4.23Å; F192-I400 HydrophobicContact CE2-CG2 3.55Å; F192-I400 HydrophobicContact CZ-CG2 4.39Å; F192-P401 VanDerWaalsContact CD2-O 3.25Å; F192-P401 WeakPolarHBondContact CD2-O 3.35Å; F192-W402 AromaticContact CD1-CE3 4Å; F192-W402 HydrophobicContact CD1-CE3 4Å; F192-W402 AromaticContact CD1-CZ3 3.82Å; F192-W402 HydrophobicContact CD1-CZ3 3.82Å; F192-W402 AromaticContact CD2-CE3 3.92Å; F192-W402 HydrophobicContact CD2-CE3 3.92Å; F192-W402 AromaticContact CE1-CE3 3.79Å; F192-W402 HydrophobicContact CE1-CE3 3.79Å; F192-W402 AromaticContact CE1-CZ3 3.71Å; F192-W402 HydrophobicContact CE1-CZ3 3.71Å; F192-W402 HydrophobicContact CE2-CB 4.4Å; F192-W402 AromaticContact CE2-CE3 3.7Å; F192-W402 HydrophobicContact CE2-CE3 3.7Å; F192-W402 HydrophobicContact CE2-CZ3 4.45Å; F192-W402 HydrophobicContact CG-CE3 4.04Å; F192-W402 HydrophobicContact CG-CZ3 4.23Å; F192-W402 AromaticContact CZ-CE3 3.61Å; F192-W402 HydrophobicContact CZ-CE3 3.61Å; F192-W402 HydrophobicContact CZ-CZ3 4.02Å; F192-L421 HydrophobicContact CD1-CD1 4.02Å; F192-L421 HydrophobicContact CE1-CD1 3.49Å; F192-L421 VanDerWaalsContact CE1-CD1 3.49Å; F192-L421 HydrophobicContact CZ-CD1 4.48Å; F192-V432 HydrophobicContact CB-CG1 3.72Å; F192-V432 HydrophobicContact CD1-CG1 4.06Å; F192-V432 HydrophobicContact CG-CG1 4.2Å
193	G	96.1	Very high	91.9	Very high	31 Å²	31	60.2 Å²	60.2	32%	0.32	30%	0.296	S	S	.	.			trans	-77.8	-179.3	164.2	0	0	0	0	0	112.2	P433	G193-P433 PolarHBondContact N-O 3.32Å
194	K	96	Very high	92.7	Very high	187 Å²	187	64 Å²	64	81%	0.813	31%	0.305	S	S	*	.			trans	-68.9	135.8	173.4	-65.5	-177.1	178.8	-178.5	0	110.2	P433	K194-P433 WeakPolarHBondContact O-CD 3.27Å
195	P	96.6	Very high	93.3	Very high	45 Å²	45	58.9 Å²	58.9	29%	0.292	27%	0.272	S	S	.	.			trans	-58.8	142.2	171.9	-23.3	32.9	0	0	0	112.4	L405 T431 V432	P195-L405 HydrophobicContact CB-CD1 3.85Å; P195-L405 HydrophobicContact CG-CD1 4.14Å; P195-T431 CarbonylContact C-O 3.56Å; P195-T431 WeakPolarHBondContact CA-O 3.12Å; P195-V432 HydrophobicContact CB-CG2 4.12Å; P195-V432 HydrophobicContact CG-CG2 4.13Å
196	I	97.4	Very high	94	Very high	64 Å²	64	58 Å²	58	33%	0.328	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.8	-178.7	-56.9	172.4	0	0	0	107.6	H198 L430 T431 P433	I196-H198 PolarHBondContact O-CD2 2.88Å; I196-L430 CarbonylContact O-C 3.54Å; I196-L430 VanDerWaalsContact O-CA 3.23Å; I196-L430 WeakPolarHBondContact O-CA 3.41Å; I196-T431 PolarHBondContact N-O 3.32Å; I196-T431 PolarHBondContact O-N 3.22Å; I196-P433 HydrophobicContact CD1-CG 4.2Å
197	F	97.1	Very high	94.6	Very high	103 Å²	103	56.6 Å²	56.6	45%	0.452	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	127.3	175.6	171.8	-100.9	0	0	0	111.4	A199 R200 Y428 L430	F197-A199 VanDerWaalsContact CE2-C 3.41Å; F197-A199 WeakPolarHBondContact CE2-O 3.29Å; F197-A199 VanDerWaalsContact CZ-C 3.44Å; F197-R200 HydrophobicContact CE2-CB 4.45Å; F197-R200 HydrophobicContact CZ-CB 4.37Å; F197-Y428 HydrophobicContact CD2-CD1 4.07Å; F197-Y428 AromaticContact CE2-CD1 3.67Å; F197-Y428 HydrophobicContact CE2-CD1 3.67Å; F197-Y428 HydrophobicContact CE2-CE1 4.43Å; F197-L430 HydrophobicContact CB-CD2 4.06Å; F197-L430 HydrophobicContact CD2-CD2 3.94Å
198	H	96.7	Very high	94.9	Very high	9 Å²	9	56.6 Å²	56.6	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-63.8	176.7	-67.4	-93.7	0	0	0	111.6	I196 W208 E240 M243 R244 L429 T431	I196-H198 PolarHBondContact O-CD2 2.88Å; H198-W208 HydrophobicContact CB-CH2 3.87Å; H198-W208 HydrophobicContact CB-CZ2 4.43Å; H198-W208 HydrophobicContact CB-CZ3 4.39Å; H198-W208 AromaticContact CD2-CH2 3.71Å; H198-W208 AromaticContact CG-CH2 3.61Å; H198-E240 IonicContact CE1-OE1 3.5Å; H198-E240 IonicContact CE1-OE2 2.69Å; H198-E240 IonicContact CG-OE2 3.14Å; H198-E240 IonicContact ND1-OE1 2.65Å; H198-E240 PolarHBondContact ND1-OE1 3.18Å; H198-E240 IonicContact ND1-OE2 3.98Å; H198-E240 PolarHBondContact ND1-OE2 3.31Å; H198-M243 HydrophobicContact CB-CE 4Å; H198-R244 WeakPolarHBondContact O-CD 3.34Å; H198-R244 WeakPolarHBondContact O-CG 3.47Å; H198-R244 PolarHBondContact O-NE 3.1Å; H198-R244 PolarHBondContact O-NH2 2.97Å; H198-L429 WeakPolarHBondContact CB-O 2.91Å; H198-L429 PolarHBondContact N-O 3.31Å; H198-T431 PolarHBondContact CD2-N 3.01Å; H198-T431 WeakPolarHBondContact NE2-CG2 3.36Å; H198-T431 PolarHBondContact NE2-OG1 3.29Å
199	A	96.5	Very high	95.1	Very high	2 Å²	2	56.5 Å²	56.5	2%	0.017	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	177	-179.3	0	0	0	0	0	111.4	F197 M243 R244 L429	F197-A199 VanDerWaalsContact CE2-C 3.41Å; F197-A199 WeakPolarHBondContact CE2-O 3.29Å; F197-A199 VanDerWaalsContact CZ-C 3.44Å; A199-M243 HydrophobicContact CB-CE 3.86Å; A199-M243 HydrophobicContact CB-CG 4.17Å; A199-R244 HydrophobicContact CB-CB 4.49Å; A199-R244 HydrophobicContact CB-CG 3.89Å; A199-L429 HydrophobicContact CB-CD1 4.24Å; A199-L429 WeakPolarHBondContact O-CB 3.33Å; A199-L429 PolarHBondContact O-N 3.04Å
200	R	95.4	Very high	95.2	Very high	131 Å²	131	57.9 Å²	57.9	49%	0.494	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.6	172	-172.1	-177.7	-177.3	-170.9	1.5	109	F197 G427	F197-R200 HydrophobicContact CE2-CB 4.45Å; F197-R200 HydrophobicContact CZ-CB 4.37Å; R200-G427 CarbonylContact C-O 3.59Å; R200-G427 VanDerWaalsContact CA-O 3.3Å; R200-G427 WeakPolarHBondContact CA-O 3.35Å; R200-G427 WeakPolarHBondContact CG-O 3.38Å
201	A	94.5	Very high	95.4	Very high	13 Å²	13	52.6 Å²	52.6	11%	0.107	24%	0.239	C	C	.	.			trans	-89	163.4	174.6	0	0	0	0	0	111.7	T203 M225 F424 G427	A201-T203 VanDerWaalsContact C-N 3.28Å; A201-T203 HydrophobicContact CB-CG2 4.27Å; A201-M225 HydrophobicContact CB-CE 3.82Å; A201-M225 HydrophobicContact CB-SD 4.07Å; A201-F424 HydrophobicContact CB-CE2 4.33Å; A201-F424 HydrophobicContact CB-CZ 3.94Å; A201-G427 PolarHBondContact N-O 3.38Å
202	K	90.5	Very high	95.4	Very high	158 Å²	158	46 Å²	46	69%	0.687	22%	0.215	S	C	*	.	S	Bend	trans	-77.8	-10.1	173.1	-85	168.9	174.4	152.4	0	114.4	E246	K202-E246 VanDerWaalsContact CE-CD 3.49Å; K202-E246 WeakPolarHBondContact CE-OE1 3.47Å; K202-E246 WeakPolarHBondContact CE-OE2 3.5Å; K202-E246 WeakPolarHBondContact CG-OE1 3.42Å; K202-E246 IonicContact NZ-OE1 2.71Å; K202-E246 IonicContact NZ-OE2 2.69Å; K202-E246 PolarHBondContact NZ-OE2 2.81Å
203	T	90.9	Very high	95.2	Very high	20 Å²	20	49.9 Å²	49.9	12%	0.123	23%	0.232	C	C	.	.	S	Bend	trans	-114.2	147.3	179.3	168.9	0	0	0	0	110.8	A201 Y205 E227 F424 G427	A201-T203 VanDerWaalsContact C-N 3.28Å; A201-T203 HydrophobicContact CB-CG2 4.27Å; T203-Y205 VanDerWaalsContact C-N 3.28Å; T203-Y205 WeakPolarHBondContact CB-O 3.49Å; T203-Y205 WeakPolarHBondContact CG2-O 3.27Å; T203-Y205 PolarHBondContact OG1-N 3.04Å; T203-Y205 VanDerWaalsContact OG1-N 3.13Å; T203-Y205 PolarHBondContact OG1-O 2.88Å; T203-E227 HydrophobicContact CG2-CB 3.93Å; T203-E227 HydrophobicContact CG2-CG 3.87Å; T203-F424 HydrophobicContact CG2-CZ 4.31Å; T203-G427 WeakPolarHBondContact O-CA 3.47Å
204	Y	91.2	Very high	95.2	Very high	108 Å²	108	49.1 Å²	49.1	42%	0.424	22%	0.221	S	C	.	.	S	Bend	trans	-76.5	-17.3	174.4	-56.1	-66.3	0	0	0	113.4	N410 F424 Y426 G427	Y204-N410 PolarHBondContact O-ND2 2.73Å; Y204-N410 VanDerWaalsContact O-ND2 3.17Å; Y204-F424 WeakPolarHBondContact O-CE1 3.46Å; Y204-Y426 HydrophobicContact CD1-CD1 4.16Å; Y204-Y426 AromaticContact CD1-CD2 3.66Å; Y204-Y426 HydrophobicContact CD1-CD2 3.66Å; Y204-Y426 AromaticContact CD1-CE1 3.87Å; Y204-Y426 HydrophobicContact CD1-CE1 3.87Å; Y204-Y426 AromaticContact CD1-CE2 3.31Å; Y204-Y426 HydrophobicContact CD1-CE2 3.31Å; Y204-Y426 HydrophobicContact CD1-CG 4.06Å; Y204-Y426 AromaticContact CD1-CZ 3.42Å; Y204-Y426 VanDerWaalsContact CD1-CZ 3.42Å; Y204-Y426 HydrophobicContact CE1-CD1 4.43Å; Y204-Y426 HydrophobicContact CE1-CD2 4.5Å; Y204-Y426 AromaticContact CE1-CE1 3.78Å; Y204-Y426 HydrophobicContact CE1-CE1 3.78Å; Y204-Y426 AromaticContact CE1-CE2 3.85Å; Y204-Y426 HydrophobicContact CE1-CE2 3.85Å; Y204-Y426 AromaticContact CE1-CZ 3.43Å; Y204-Y426 VanDerWaalsContact CE1-CZ 3.43Å; Y204-Y426 WeakPolarHBondContact CE1-OH 3.21Å; Y204-Y426 HydrophobicContact CG-CD2 4.11Å; Y204-Y426 AromaticContact CG-CE2 3.72Å; Y204-Y426 HydrophobicContact CG-CE2 3.72Å; Y204-G427 PolarHBondContact O-N 3.3Å
205	Y	92.1	Very high	95	Very high	14 Å²	14	45.4 Å²	45.4	6%	0.055	20%	0.202	C	C	.	.	S	Bend	trans	-127.1	147.3	-177.8	-58.7	-77.4	0	0	0	111.5	I27 T203 H228 F229 F311 N408 N410	I27-Y205 WeakPolarHBondContact CD1-OH 3.48Å; I27-Y205 WeakPolarHBondContact CG1-OH 3.48Å; T203-Y205 VanDerWaalsContact C-N 3.28Å; T203-Y205 WeakPolarHBondContact CB-O 3.49Å; T203-Y205 WeakPolarHBondContact CG2-O 3.27Å; T203-Y205 PolarHBondContact OG1-N 3.04Å; T203-Y205 VanDerWaalsContact OG1-N 3.13Å; T203-Y205 PolarHBondContact OG1-O 2.88Å; Y205-H228 VanDerWaalsContact O-CA 3.31Å; Y205-H228 WeakPolarHBondContact O-CA 3.29Å; Y205-H228 PolarHBondContact O-N 2.85Å; Y205-F229 HydrophobicContact CD1-CD1 4.46Å; Y205-F229 HydrophobicContact CD2-CD1 4.26Å; Y205-F229 HydrophobicContact CD2-CE1 4.43Å; Y205-F229 HydrophobicContact CG-CD1 4.01Å; Y205-F311 HydrophobicContact CD1-CD1 4.38Å; Y205-F311 HydrophobicContact CD1-CE1 4.18Å; Y205-F311 HydrophobicContact CE1-CD1 4.08Å; Y205-F311 AromaticContact CE1-CE1 3.45Å; Y205-F311 HydrophobicContact CE1-CE1 3.45Å; Y205-F311 VanDerWaalsContact CE1-CE1 3.45Å; Y205-F311 HydrophobicContact CE1-CE2 4.33Å; Y205-F311 AromaticContact CE1-CZ 3.61Å; Y205-F311 HydrophobicContact CE1-CZ 3.61Å; Y205-N408 WeakPolarHBondContact CE1-ND2 3.42Å; Y205-N408 PolarHBondContact OH-ND2 3.37Å; Y205-N410 WeakPolarHBondContact CA-OD1 3.26Å; Y205-N410 HydrophobicContact CD1-CB 3.99Å; Y205-N410 HydrophobicContact CE1-CB 4.39Å
206	G	95.5	Very high	94.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.6	-170.2	177.7	0	0	0	0	0	110.4	T226 N410 F424	G206-T226 VanDerWaalsContact CA-O 3.3Å; G206-T226 WeakPolarHBondContact CA-O 3.36Å; G206-N410 PolarHBondContact N-OD1 2.88Å; G206-N410 PolarHBondContact O-OD1 2.96Å; G206-F424 WeakPolarHBondContact O-CB 3.34Å; G206-F424 VanDerWaalsContact O-CD2 3.31Å; G206-F424 WeakPolarHBondContact O-CD2 3.48Å; G206-F424 VanDerWaalsContact O-CG 3.24Å; G206-F424 WeakPolarHBondContact O-CG 3.39Å
207	A	97.2	Very high	94.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	152.3	173.8	0	0	0	0	0	110.9	F209 M225 T226 T261 M411	A207-F209 HydrophobicContact CB-CE1 3.89Å; A207-F209 HydrophobicContact CB-CE2 4.21Å; A207-F209 HydrophobicContact CB-CZ 3.4Å; A207-F209 VanDerWaalsContact CB-CZ 3.4Å; A207-M225 CarbonylContact O-C 3.56Å; A207-M225 VanDerWaalsContact O-CA 3.29Å; A207-M225 WeakPolarHBondContact O-CA 3.47Å; A207-M225 VanDerWaalsContact O-CG 3.28Å; A207-M225 WeakPolarHBondContact O-CG 3.34Å; A207-T226 PolarHBondContact N-O 2.85Å; A207-T226 PolarHBondContact N-OG1 3.05Å; A207-T226 PolarHBondContact O-N 2.94Å; A207-T226 PolarHBondContact O-OG1 3.13Å; A207-T261 WeakPolarHBondContact CB-O 3.35Å; A207-M411 HydrophobicContact CB-CB 4.15Å; A207-M411 HydrophobicContact CB-CE 4.04Å; A207-M411 HydrophobicContact CB-CG 3.73Å; A207-M411 HydrophobicContact CB-SD 4.26Å
208	W	97.7	Very high	94.2	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.4	-172.6	80	-72.9	0	0	0	111.2	H198 W224 M225 M243 M411 Y422 V423 L429 L430 T431	H198-W208 HydrophobicContact CB-CH2 3.87Å; H198-W208 HydrophobicContact CB-CZ2 4.43Å; H198-W208 HydrophobicContact CB-CZ3 4.39Å; H198-W208 AromaticContact CD2-CH2 3.71Å; H198-W208 AromaticContact CG-CH2 3.61Å; W208-W224 CarbonylContact C-O 3.58Å; W208-W224 VanDerWaalsContact CA-O 3.31Å; W208-W224 WeakPolarHBondContact CA-O 3.29Å; W208-M225 HydrophobicContact CB-CB 4.48Å; W208-M225 HydrophobicContact CB-CG 3.96Å; W208-M243 HydrophobicContact CE3-CE 3.79Å; W208-M243 HydrophobicContact CE3-SD 3.87Å; W208-M243 HydrophobicContact CH2-CE 4.47Å; W208-M243 HydrophobicContact CZ3-CE 3.66Å; W208-M243 HydrophobicContact CZ3-SD 4.28Å; W208-M411 VanDerWaalsContact O-CE 3.25Å; W208-M411 WeakPolarHBondContact O-CE 3.41Å; W208-Y422 HydrophobicContact CD2-CD1 4Å; W208-Y422 AromaticContact CE2-CD1 3.75Å; W208-Y422 AromaticContact CE3-CD1 4Å; W208-Y422 HydrophobicContact CE3-CD1 4Å; W208-Y422 HydrophobicContact CE3-CE1 4.25Å; W208-Y422 AromaticContact CH2-CD1 3.57Å; W208-Y422 HydrophobicContact CH2-CD1 3.57Å; W208-Y422 AromaticContact CH2-CE1 3.6Å; W208-Y422 HydrophobicContact CH2-CE1 3.6Å; W208-Y422 AromaticContact CZ2-CD1 3.55Å; W208-Y422 HydrophobicContact CZ2-CD1 3.55Å; W208-Y422 HydrophobicContact CZ2-CE1 4.08Å; W208-Y422 HydrophobicContact CZ2-CG 4.35Å; W208-Y422 AromaticContact CZ3-CD1 3.79Å; W208-Y422 HydrophobicContact CZ3-CD1 3.79Å; W208-Y422 AromaticContact CZ3-CE1 3.69Å; W208-Y422 HydrophobicContact CZ3-CE1 3.69Å; W208-V423 PolarHBondContact NE1-O 2.84Å; W208-L429 HydrophobicContact CB-CD1 4.14Å; W208-L429 HydrophobicContact CB-CD2 4.29Å; W208-L429 HydrophobicContact CD2-CB 3.96Å; W208-L429 HydrophobicContact CD2-CD1 4.17Å; W208-L429 HydrophobicContact CD2-CG 4.47Å; W208-L429 HydrophobicContact CE3-CD1 4.46Å; W208-L429 HydrophobicContact CG-CB 4.18Å; W208-L429 HydrophobicContact CG-CD1 4.03Å; W208-L429 HydrophobicContact CG-CD2 3.97Å; W208-L429 HydrophobicContact CG-CG 4.28Å; W208-L429 HydrophobicContact CZ2-CB 4.13Å; W208-L430 WeakPolarHBondContact CZ2-O 3.34Å; W208-T431 HydrophobicContact CH2-CG2 3.7Å; W208-T431 HydrophobicContact CZ2-CG2 3.7Å
209	F	95.4	Very high	94.1	Very high	10 Å²	10	57.7 Å²	57.7	4%	0.044	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	155.2	-161.8	-41.3	-76.8	0	0	0	112.3	A207 R223 W224 T226 L234 H263 F265 L270 M411	A207-F209 HydrophobicContact CB-CE1 3.89Å; A207-F209 HydrophobicContact CB-CE2 4.21Å; A207-F209 HydrophobicContact CB-CZ 3.4Å; A207-F209 VanDerWaalsContact CB-CZ 3.4Å; F209-R223 WeakPolarHBondContact O-CA 3.44Å; F209-W224 HydrophobicContact CB-CB 4.34Å; F209-W224 HydrophobicContact CD2-CB 4.11Å; F209-W224 PolarHBondContact N-O 3.12Å; F209-W224 PolarHBondContact O-N 2.9Å; F209-T226 HydrophobicContact CE2-CG2 4.42Å; F209-L234 HydrophobicContact CE2-CD1 4.41Å; F209-H263 HydrophobicContact CE1-CB 4.2Å; F209-H263 VanDerWaalsContact CE1-O 3.29Å; F209-H263 WeakPolarHBondContact CE1-O 3.43Å; F209-H263 HydrophobicContact CZ-CB 3.81Å; F209-H263 AromaticContact CZ-CD2 3.91Å; F209-F265 HydrophobicContact CB-CB 3.81Å; F209-F265 HydrophobicContact CD1-CB 4.29Å; F209-F265 HydrophobicContact CD2-CB 4.39Å; F209-F265 HydrophobicContact CG-CB 3.9Å; F209-L270 HydrophobicContact CE2-CD1 4.31Å; F209-M411 HydrophobicContact CD1-CE 3.96Å; F209-M411 HydrophobicContact CE1-CE 3.69Å
210	K	96.3	Very high	93.9	Very high	38 Å²	38	62 Å²	62	17%	0.165	26%	0.262	C	S	.	.			trans	-129.2	126.8	158.8	171	-165.6	165.6	-166.2	0	106.1	P212 N415 D418 Y422	K210-P212 WeakPolarHBondContact O-CD 3.28Å; K210-N415 PolarHBondContact O-ND2 3.39Å; K210-D418 WeakPolarHBondContact CD-OD2 3.41Å; K210-D418 IonicContact NZ-OD2 3.69Å; K210-D418 PolarHBondContact NZ-OD2 2.83Å; K210-Y422 HydrophobicContact CB-CE1 3.89Å; K210-Y422 WeakPolarHBondContact CD-OH 3.21Å
211	D	97.3	Very high	93.9	Very high	0 Å²	0	63 Å²	63	0%	0	27%	0.27	C	S	.	.			trans	-57.5	122.4	171.2	-164.2	-26.3	0	0	0	110	F213 P214 W224 F265 N267 G268	D211-F213 VanDerWaalsContact C-N 3.32Å; D211-F213 VanDerWaalsContact OD1-C 3.26Å; D211-F213 PolarHBondContact OD1-N 3.34Å; D211-P214 HydrophobicContact CB-CB 4.07Å; D211-P214 HydrophobicContact CB-CG 4.37Å; D211-P214 WeakPolarHBondContact OD2-CA 3.38Å; D211-W224 HydrophobicContact CB-CH2 3.82Å; D211-W224 HydrophobicContact CB-CZ3 3.81Å; D211-W224 VanDerWaalsContact N-CZ3 3.33Å; D211-F265 HydrophobicContact CB-CD1 3.82Å; D211-F265 HydrophobicContact CB-CE1 3.85Å; D211-N267 VanDerWaalsContact CG-N 3.26Å; D211-N267 PolarHBondContact OD1-N 3.11Å; D211-N267 VanDerWaalsContact OD2-CA 3.32Å; D211-N267 WeakPolarHBondContact OD2-CA 3.28Å; D211-N267 PolarHBondContact OD2-N 3.2Å; D211-G268 PolarHBondContact OD2-N 3.45Å
212	P	95.3	Very high	94	Very high	3 Å²	3	64 Å²	64	2%	0.019	27%	0.272	C	S	.	.	S	Bend	trans	-68.9	-30.3	175	28.5	-34.9	0	0	0	112.4	K210 F265 F266 P416 A417	K210-P212 WeakPolarHBondContact O-CD 3.28Å; P212-F265 WeakPolarHBondContact CD-O 3.44Å; P212-F266 HydrophobicContact CG-CD2 3.77Å; P212-F266 HydrophobicContact CG-CE2 4.46Å; P212-P416 HydrophobicContact CB-CG 4.29Å; P212-A417 HydrophobicContact CB-CB 3.55Å; P212-A417 WeakPolarHBondContact O-CB 3.37Å
213	F	94.3	Very high	94.4	Very high	112 Å²	112	57.5 Å²	57.5	49%	0.491	24%	0.243	S	C	.	.	S	Bend	trans	-142.7	64.2	-173	-59.6	-75.5	0	0	0	112.4	D211 F266 N267 P416 A417	D211-F213 VanDerWaalsContact C-N 3.32Å; D211-F213 VanDerWaalsContact OD1-C 3.26Å; D211-F213 PolarHBondContact OD1-N 3.34Å; F213-F266 HydrophobicContact CB-CE2 4.46Å; F213-F266 HydrophobicContact CD2-CD2 4.26Å; F213-F266 AromaticContact CD2-CE2 3.62Å; F213-F266 HydrophobicContact CD2-CE2 3.62Å; F213-F266 HydrophobicContact CD2-CZ 4.38Å; F213-F266 HydrophobicContact CE2-CE2 4.39Å; F213-F266 HydrophobicContact CG-CE2 4.47Å; F213-N267 WeakPolarHBondContact O-CA 3.27Å; F213-P416 HydrophobicContact CE2-CG 4.4Å; F213-A417 HydrophobicContact CE1-CB 4.47Å; F213-A417 HydrophobicContact CE2-CB 4.5Å; F213-A417 HydrophobicContact CZ-CB 4.24Å
214	P	94.9	Very high	94.7	Very high	15 Å²	15	56.6 Å²	56.6	10%	0.097	24%	0.237	C	C	.	.			trans	-68.2	150.9	-178.6	27	-35.1	0	0	0	114.1	D211 R216 D219 F220	D211-P214 HydrophobicContact CB-CB 4.07Å; D211-P214 HydrophobicContact CB-CG 4.37Å; D211-P214 WeakPolarHBondContact OD2-CA 3.38Å; P214-R216 VanDerWaalsContact C-N 3.28Å; P214-R216 PolarHBondContact O-N 3.45Å; P214-D219 HydrophobicContact CB-CB 3.71Å; P214-D219 HydrophobicContact CG-CB 4.33Å; P214-F220 VanDerWaalsContact CD-CE1 3.48Å; P214-F220 HydrophobicContact CG-CD1 3.57Å; P214-F220 HydrophobicContact CG-CD2 4.12Å; P214-F220 HydrophobicContact CG-CE1 3.66Å; P214-F220 HydrophobicContact CG-CE2 4.17Å; P214-F220 HydrophobicContact CG-CG 3.8Å; P214-F220 HydrophobicContact CG-CZ 3.95Å
215	R	92.9	Very high	95	Very high	108 Å²	108	51.6 Å²	51.6	41%	0.408	22%	0.217	S	C	.	.	S	Bend	trans	-66.7	-23.4	179.4	-60.3	-177.6	-165.6	166.5	9.2	114.5	N267 D284	R215-N267 WeakPolarHBondContact CG-OD1 3.37Å; R215-N267 PolarHBondContact NE-O 3.2Å; R215-N267 PolarHBondContact NE-OD1 2.9Å; R215-N267 PolarHBondContact NH2-O 2.86Å; R215-D284 IonicContact CZ-OD2 3.39Å; R215-D284 IonicContact NH1-OD1 2.7Å; R215-D284 PolarHBondContact NH1-OD1 3.4Å; R215-D284 IonicContact NH1-OD2 2.67Å; R215-D284 PolarHBondContact NH1-OD2 2.96Å; R215-D284 IonicContact NH2-OD2 2.83Å; R215-D284 PolarHBondContact NH2-OD2 2.83Å
216	R	92.8	Very high	95.2	Very high	127 Å²	127	50.9 Å²	50.9	48%	0.479	22%	0.215	S	C	.	.	S	Bend	trans	-128.3	139.8	-173.8	-42.9	177.3	-178.2	-177.5	2	109.7	P214 E218 D219	P214-R216 VanDerWaalsContact C-N 3.28Å; P214-R216 PolarHBondContact O-N 3.45Å; R216-E218 PolarHBondContact O-N 2.85Å; R216-D219 WeakPolarHBondContact CB-OD2 3.27Å; R216-D219 WeakPolarHBondContact CG-OD2 3.47Å; R216-D219 PolarHBondContact O-N 2.78Å; R216-D219 VanDerWaalsContact O-N 3.07Å
217	Y	90	Very high	95.1	Very high	203 Å²	203	53.7 Å²	53.7	80%	0.796	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-60.2	-32	-178.6	-178.8	-99.6	0	0	0	113.4	D219 F220	Y217-D219 VanDerWaalsContact C-N 3.25Å; Y217-D219 PolarHBondContact O-N 2.84Å; Y217-F220 HydrophobicContact CD2-CD2 4.05Å; Y217-F220 HydrophobicContact CD2-CE2 4.24Å; Y217-F220 WeakPolarHBondContact O-CD2 3.49Å
218	E	91	Very high	94.9	Very high	149 Å²	149	56.2 Å²	56.2	70%	0.696	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-61.8	-31.2	176.8	-68.8	155.1	-137.6	0	0	113	R216 F220	R216-E218 PolarHBondContact O-N 2.85Å; E218-F220 PolarHBondContact O-N 2.93Å
219	D	94.1	Very high	94.4	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-78.4	-16.3	-172.4	-60.8	-40.2	0	0	0	113	P214 R216 Y217 K221 K222 W224 Y286	P214-D219 HydrophobicContact CB-CB 3.71Å; P214-D219 HydrophobicContact CG-CB 4.33Å; R216-D219 WeakPolarHBondContact CB-OD2 3.27Å; R216-D219 WeakPolarHBondContact CG-OD2 3.47Å; R216-D219 PolarHBondContact O-N 2.78Å; R216-D219 VanDerWaalsContact O-N 3.07Å; Y217-D219 VanDerWaalsContact C-N 3.25Å; Y217-D219 PolarHBondContact O-N 2.84Å; D219-K221 PolarHBondContact O-N 3.17Å; D219-K221 VanDerWaalsContact O-N 3.08Å; D219-K222 HydrophobicContact CB-CD 4.26Å; D219-K222 WeakPolarHBondContact O-CB 3.47Å; D219-K222 PolarHBondContact O-N 3.33Å; D219-K222 WeakPolarHBondContact OD1-CD 3.49Å; D219-K222 WeakPolarHBondContact OD1-CE 3.35Å; D219-K222 IonicContact OD1-NZ 3.07Å; D219-K222 PolarHBondContact OD1-NZ 3.22Å; D219-W224 HydrophobicContact CB-CH2 4.28Å; D219-Y286 PolarHBondContact OD1-OH 3.23Å; D219-Y286 PolarHBondContact OD2-OH 2.94Å
220	F	93.2	Very high	94.1	Very high	93 Å²	93	57.4 Å²	57.4	41%	0.408	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-57.9	-25.3	177.9	-81.2	-67.8	0	0	0	114.1	P214 Y217 E218	P214-F220 VanDerWaalsContact CD-CE1 3.48Å; P214-F220 HydrophobicContact CG-CD1 3.57Å; P214-F220 HydrophobicContact CG-CD2 4.12Å; P214-F220 HydrophobicContact CG-CE1 3.66Å; P214-F220 HydrophobicContact CG-CE2 4.17Å; P214-F220 HydrophobicContact CG-CG 3.8Å; P214-F220 HydrophobicContact CG-CZ 3.95Å; Y217-F220 HydrophobicContact CD2-CD2 4.05Å; Y217-F220 HydrophobicContact CD2-CE2 4.24Å; Y217-F220 WeakPolarHBondContact O-CD2 3.49Å; E218-F220 PolarHBondContact O-N 2.93Å
221	K	94.9	Very high	93.8	Very high	151 Å²	151	56.3 Å²	56.3	66%	0.657	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-83.8	-26.9	176.8	-70.9	-175.1	178.3	-179.8	0	113.2	D219 R223 V238 D239	D219-K221 PolarHBondContact O-N 3.17Å; D219-K221 VanDerWaalsContact O-N 3.08Å; K221-R223 PolarHBondContact O-NH1 3.43Å; K221-V238 CarbonylContact C-O 3.44Å; K221-D239 HydrophobicContact CB-CB 4.37Å; K221-D239 WeakPolarHBondContact O-CA 3.48Å
222	K	97.1	Very high	93.7	Very high	34 Å²	34	58.6 Å²	58.6	15%	0.148	26%	0.256	C	S	.	.			trans	-64.6	156.1	-171.1	-66.9	-178.1	-179.6	177.8	0	112.4	D219 W224 E236 Y237 V238	D219-K222 HydrophobicContact CB-CD 4.26Å; D219-K222 WeakPolarHBondContact O-CB 3.47Å; D219-K222 PolarHBondContact O-N 3.33Å; D219-K222 WeakPolarHBondContact OD1-CD 3.49Å; D219-K222 WeakPolarHBondContact OD1-CE 3.35Å; D219-K222 IonicContact OD1-NZ 3.07Å; D219-K222 PolarHBondContact OD1-NZ 3.22Å; K222-W224 HydrophobicContact CB-CE3 4.46Å; K222-W224 HydrophobicContact CB-CH2 3.6Å; K222-W224 HydrophobicContact CB-CZ2 3.84Å; K222-W224 HydrophobicContact CB-CZ3 3.9Å; K222-W224 HydrophobicContact CD-CZ2 4.11Å; K222-W224 WeakPolarHBondContact O-CZ3 3.49Å; K222-E236 HydrophobicContact CD-CG 4.14Å; K222-E236 WeakPolarHBondContact CD-OE1 3.22Å; K222-E236 WeakPolarHBondContact CE-OE1 3.5Å; K222-E236 IonicContact NZ-OE1 2.7Å; K222-E236 PolarHBondContact NZ-OE1 2.98Å; K222-Y237 VanDerWaalsContact CA-O 3.26Å; K222-Y237 WeakPolarHBondContact CA-O 3.44Å; K222-Y237 WeakPolarHBondContact CB-O 3.38Å; K222-V238 WeakPolarHBondContact CA-O 3.44Å; K222-V238 PolarHBondContact N-O 3.17Å
223	R	97.4	Very high	93.7	Very high	22 Å²	22	59.7 Å²	59.7	8%	0.083	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.6	167.8	-60.9	-64	176.4	-93.7	-4.3	108.6	F209 K221 Y237 E240 M243	F209-R223 WeakPolarHBondContact O-CA 3.44Å; K221-R223 PolarHBondContact O-NH1 3.43Å; R223-Y237 PolarHBondContact N-O 3.36Å; R223-Y237 VanDerWaalsContact N-O 3.1Å; R223-Y237 PolarHBondContact O-N 3.2Å; R223-E240 HydrophobicContact CG-CG 3.95Å; R223-E240 IonicContact CZ-OE1 3.69Å; R223-E240 IonicContact NE-OE1 3.67Å; R223-E240 PolarHBondContact NE-OE1 3.49Å; R223-E240 IonicContact NH2-OE1 2.88Å; R223-E240 PolarHBondContact NH2-OE1 2.81Å; R223-M243 HydrophobicContact CB-SD 3.65Å; R223-M243 HydrophobicContact CG-CE 4.31Å; R223-M243 HydrophobicContact CG-SD 3.93Å
224	W	97.8	Very high	93.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	147.9	175.2	-60.9	-98.3	0	0	0	108.9	W208 F209 D211 D219 K222 L234 F235 F265	W208-W224 CarbonylContact C-O 3.58Å; W208-W224 VanDerWaalsContact CA-O 3.31Å; W208-W224 WeakPolarHBondContact CA-O 3.29Å; F209-W224 HydrophobicContact CB-CB 4.34Å; F209-W224 HydrophobicContact CD2-CB 4.11Å; F209-W224 PolarHBondContact N-O 3.12Å; F209-W224 PolarHBondContact O-N 2.9Å; D211-W224 HydrophobicContact CB-CH2 3.82Å; D211-W224 HydrophobicContact CB-CZ3 3.81Å; D211-W224 VanDerWaalsContact N-CZ3 3.33Å; D219-W224 HydrophobicContact CB-CH2 4.28Å; K222-W224 HydrophobicContact CB-CE3 4.46Å; K222-W224 HydrophobicContact CB-CH2 3.6Å; K222-W224 HydrophobicContact CB-CZ2 3.84Å; K222-W224 HydrophobicContact CB-CZ3 3.9Å; K222-W224 HydrophobicContact CD-CZ2 4.11Å; K222-W224 WeakPolarHBondContact O-CZ3 3.49Å; W224-L234 HydrophobicContact CB-CD1 4.09Å; W224-L234 HydrophobicContact CB-CG 4.42Å; W224-F235 CarbonylContact C-O 3.52Å; W224-F235 WeakPolarHBondContact CA-O 3.1Å; W224-F265 HydrophobicContact CD2-CD1 4.2Å; W224-F265 AromaticContact CD2-CE1 3.86Å; W224-F265 HydrophobicContact CD2-CE1 3.86Å; W224-F265 HydrophobicContact CD2-CZ 4.12Å; W224-F265 AromaticContact CE2-CE1 3.72Å; W224-F265 AromaticContact CE2-CZ 3.79Å; W224-F265 HydrophobicContact CE3-CD1 4.21Å; W224-F265 HydrophobicContact CE3-CE1 4.15Å; W224-F265 HydrophobicContact CG-CE1 4.41Å; W224-F265 HydrophobicContact CG-CE2 4.41Å; W224-F265 HydrophobicContact CG-CZ 4.3Å; W224-F265 HydrophobicContact CH2-CE1 4.17Å; W224-F265 AromaticContact CZ2-CE1 3.87Å; W224-F265 HydrophobicContact CZ2-CE1 3.87Å; W224-F265 HydrophobicContact CZ2-CZ 4.21Å; W224-F265 HydrophobicContact CZ3-CE1 4.33Å; W224-F265 AromaticContact NE1-CZ 3.79Å
225	M	97.6	Very high	94	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.015	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	145	177.8	-158.4	173.6	88.4	0	0	111.1	A201 A207 W208 E227 F235 Y237 F424 L429	A201-M225 HydrophobicContact CB-CE 3.82Å; A201-M225 HydrophobicContact CB-SD 4.07Å; A207-M225 CarbonylContact O-C 3.56Å; A207-M225 VanDerWaalsContact O-CA 3.29Å; A207-M225 WeakPolarHBondContact O-CA 3.47Å; A207-M225 VanDerWaalsContact O-CG 3.28Å; A207-M225 WeakPolarHBondContact O-CG 3.34Å; W208-M225 HydrophobicContact CB-CB 4.48Å; W208-M225 HydrophobicContact CB-CG 3.96Å; M225-E227 HydrophobicContact CE-CG 3.54Å; M225-F235 PolarHBondContact N-O 2.76Å; M225-F235 WeakPolarHBondContact O-CD2 3.33Å; M225-F235 PolarHBondContact O-N 2.69Å; M225-Y237 HydrophobicContact CB-CE2 3.92Å; M225-F424 HydrophobicContact SD-CE2 4.37Å; M225-L429 HydrophobicContact SD-CD1 3.85Å; M225-L429 HydrophobicContact SD-CD2 4.48Å
226	T	97.3	Very high	94.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.1	162.8	45.8	0	0	0	0	108.8	G206 A207 F209 L234 Y258 H263	G206-T226 VanDerWaalsContact CA-O 3.3Å; G206-T226 WeakPolarHBondContact CA-O 3.36Å; A207-T226 PolarHBondContact N-O 2.85Å; A207-T226 PolarHBondContact N-OG1 3.05Å; A207-T226 PolarHBondContact O-N 2.94Å; A207-T226 PolarHBondContact O-OG1 3.13Å; F209-T226 HydrophobicContact CE2-CG2 4.42Å; T226-L234 HydrophobicContact CG2-CD1 3.85Å; T226-Y258 WeakPolarHBondContact CB-OH 3.43Å; T226-Y258 HydrophobicContact CG2-CD1 4.24Å; T226-Y258 HydrophobicContact CG2-CE1 3.59Å; T226-H263 PolarHBondContact OG1-CD2 3.12Å; T226-H263 VanDerWaalsContact OG1-CD2 3.26Å; T226-H263 PolarHBondContact OG1-NE2 3.26Å
227	E	93.5	Very high	94.5	Very high	59 Å²	59	44.1 Å²	44.1	28%	0.276	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	139.7	177.4	-71.1	-167.6	138.7	0	0	110.3	T203 M225 F235 Y258	T203-E227 HydrophobicContact CG2-CB 3.93Å; T203-E227 HydrophobicContact CG2-CG 3.87Å; M225-E227 HydrophobicContact CE-CG 3.54Å; E227-F235 HydrophobicContact CB-CE2 3.95Å; E227-F235 HydrophobicContact CB-CZ 4.46Å; E227-F235 HydrophobicContact CG-CD2 4.17Å; E227-F235 HydrophobicContact CG-CE2 3.69Å; E227-F235 HydrophobicContact CG-CZ 4.08Å; E227-F235 WeakPolarHBondContact OE2-CZ 3.39Å; E227-Y258 PolarHBondContact N-OH 3.13Å; E227-Y258 PolarHBondContact O-OH 3.32Å
228	H	91.5	Very high	94.8	Very high	53 Å²	53	38 Å²	38	25%	0.245	18%	0.183	C	C	.	.	S	Bend	trans	63.4	178	-172.9	-145	-103.9	0	0	0	113.8	H34 Y205 Y230	H34-H228 AromaticContact CE1-CE1 3.87Å; H34-H228 AromaticContact CE1-ND1 3.83Å; H34-H228 AromaticContact NE2-CE1 3.2Å; H34-H228 PolarHBondContact NE2-CE1 2.7Å; H34-H228 AromaticContact NE2-ND1 3.62Å; Y205-H228 VanDerWaalsContact O-CA 3.31Å; Y205-H228 WeakPolarHBondContact O-CA 3.29Å; Y205-H228 PolarHBondContact O-N 2.85Å; H228-Y230 VanDerWaalsContact C-N 3.33Å
229	F	88.8	Confident	95.1	Very high	8 Å²	8	33.5 Å²	33.5	4%	0.035	16%	0.164	C	C	.	.	S	Bend	trans	-92.4	9.5	169.5	61.4	-97.3	0	0	0	112.9	I31 H34 Y205 D259 G260 T261	I31-F229 HydrophobicContact CG1-CZ 4.18Å; H34-F229 HydrophobicContact CB-CE2 4.17Å; H34-F229 AromaticContact CD2-CE2 3.29Å; H34-F229 WeakPolarHBondContact CD2-CE2 3.23Å; H34-F229 AromaticContact CD2-CZ 3.34Å; H34-F229 WeakPolarHBondContact CD2-CZ 3.32Å; H34-F229 AromaticContact CG-CE2 3.68Å; H34-F229 AromaticContact NE2-CE2 3.85Å; H34-F229 AromaticContact NE2-CZ 3.76Å; Y205-F229 HydrophobicContact CD1-CD1 4.46Å; Y205-F229 HydrophobicContact CD2-CD1 4.26Å; Y205-F229 HydrophobicContact CD2-CE1 4.43Å; Y205-F229 HydrophobicContact CG-CD1 4.01Å; F229-D259 CarbonylContact O-C 3.56Å; F229-D259 WeakPolarHBondContact O-CA 3.46Å; F229-G260 CarbonylContact C-O 3.53Å; F229-G260 WeakPolarHBondContact CA-O 3.37Å; F229-G260 PolarHBondContact O-N 2.91Å; F229-T261 HydrophobicContact CB-CG2 3.88Å
230	Y	88.5	Confident	95.1	Very high	27 Å²	27	35.1 Å²	35.1	11%	0.106	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	130.1	177.5	-165.6	-78.5	0	0	0	109.4	H34 A38 E41 H228 M257 Y258 D259 A275	H34-Y230 WeakPolarHBondContact ND1-CB 3.41Å; H34-Y230 AromaticContact ND1-CD2 3.88Å; H34-Y230 AromaticContact ND1-CG 3.52Å; A38-Y230 HydrophobicContact CB-CE2 4.33Å; E41-Y230 PolarHBondContact OE2-OH 3Å; H228-Y230 VanDerWaalsContact C-N 3.33Å; Y230-M257 HydrophobicContact CE1-CB 3.94Å; Y230-M257 HydrophobicContact CE1-CE 4.46Å; Y230-M257 HydrophobicContact CE1-CG 3.72Å; Y230-M257 HydrophobicContact CE1-SD 4.05Å; Y230-Y258 WeakPolarHBondContact CA-O 3.21Å; Y230-D259 HydrophobicContact CD2-CB 4.12Å; Y230-D259 HydrophobicContact CE2-CB 4.39Å; Y230-A275 HydrophobicContact CD2-CB 4.43Å; Y230-A275 HydrophobicContact CE2-CB 3.66Å
231	G	89.9	Confident	95.2	Very high	14 Å²	14	32.5 Å²	32.5	14%	0.144	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.5	-176.6	-179.9	0	0	0	0	0	112.8	M257 Y258	G231-M257 CarbonylContact O-C 3.58Å; G231-M257 VanDerWaalsContact O-CA 3.23Å; G231-M257 WeakPolarHBondContact O-CA 3.34Å; G231-Y258 PolarHBondContact N-O 2.98Å; G231-Y258 WeakPolarHBondContact O-CD1 3.21Å; G231-Y258 VanDerWaalsContact O-CE1 3.28Å; G231-Y258 WeakPolarHBondContact O-CE1 3.39Å; G231-Y258 VanDerWaalsContact O-CG 3.29Å; G231-Y258 PolarHBondContact O-N 2.67Å
232	N	93.9	Very high	95.3	Very high	49 Å²	49	26.5 Å²	26.5	26%	0.262	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	8.8	-178.9	60.7	9.2	0	0	0	113.5	L254 M257	N232-L254 VanDerWaalsContact O-CB 3.31Å; N232-L254 WeakPolarHBondContact O-CB 3.3Å; N232-L254 VanDerWaalsContact O-CG 3.31Å; N232-L254 WeakPolarHBondContact O-CG 3.43Å; N232-L254 PolarHBondContact O-N 2.9Å; N232-M257 HydrophobicContact CB-SD 3.58Å; N232-M257 VanDerWaalsContact CB-SD 3.58Å
233	T	96.7	Very high	95.2	Very high	25 Å²	25	25.1 Å²	25.1	15%	0.153	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124	-176.7	-53.3	0	0	0	0	111.1	F235 K251	T233-F235 HydrophobicContact CG2-CD1 4.36Å; T233-F235 HydrophobicContact CG2-CD2 3.85Å; T233-F235 HydrophobicContact CG2-CE1 4.16Å; T233-F235 HydrophobicContact CG2-CE2 3.59Å; T233-F235 HydrophobicContact CG2-CG 4.24Å; T233-F235 HydrophobicContact CG2-CZ 3.77Å; T233-K251 HydrophobicContact CG2-CB 4.02Å; T233-K251 HydrophobicContact CG2-CD 4.17Å; T233-K251 HydrophobicContact CG2-CG 4.19Å
234	L	97.9	Very high	95.1	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.8	162.8	-175.5	72.5	0	0	0	108.9	F209 W224 T226 I252 L254 F265 L270 I285	F209-L234 HydrophobicContact CE2-CD1 4.41Å; W224-L234 HydrophobicContact CB-CD1 4.09Å; W224-L234 HydrophobicContact CB-CG 4.42Å; T226-L234 HydrophobicContact CG2-CD1 3.85Å; L234-I252 HydrophobicContact CB-CB 4.24Å; L234-I252 HydrophobicContact CD2-CD1 4.24Å; L234-I252 PolarHBondContact N-O 2.8Å; L234-I252 WeakPolarHBondContact O-CB 3.42Å; L234-I252 PolarHBondContact O-N 2.6Å; L234-L254 HydrophobicContact CB-CD2 4.5Å; L234-F265 HydrophobicContact CD2-CD2 4.2Å; L234-F265 HydrophobicContact CD2-CE2 3.79Å; L234-L270 HydrophobicContact CD1-CD1 4.1Å; L234-L270 HydrophobicContact CD1-CD2 4.23Å; L234-L270 HydrophobicContact CD2-CB 4.34Å; L234-L270 HydrophobicContact CD2-CD2 4.38Å; L234-I285 HydrophobicContact CD2-CG2 4.11Å
235	F	97.9	Very high	95	Very high	13 Å²	13	37.7 Å²	37.7	6%	0.057	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.6	-179.6	-61.9	-104.4	0	0	0	109.8	W224 M225 E227 T233 Y237 V248 K251	W224-F235 CarbonylContact C-O 3.52Å; W224-F235 WeakPolarHBondContact CA-O 3.1Å; M225-F235 PolarHBondContact N-O 2.76Å; M225-F235 WeakPolarHBondContact O-CD2 3.33Å; M225-F235 PolarHBondContact O-N 2.69Å; E227-F235 HydrophobicContact CB-CE2 3.95Å; E227-F235 HydrophobicContact CB-CZ 4.46Å; E227-F235 HydrophobicContact CG-CD2 4.17Å; E227-F235 HydrophobicContact CG-CE2 3.69Å; E227-F235 HydrophobicContact CG-CZ 4.08Å; E227-F235 WeakPolarHBondContact OE2-CZ 3.39Å; T233-F235 HydrophobicContact CG2-CD1 4.36Å; T233-F235 HydrophobicContact CG2-CD2 3.85Å; T233-F235 HydrophobicContact CG2-CE1 4.16Å; T233-F235 HydrophobicContact CG2-CE2 3.59Å; T233-F235 HydrophobicContact CG2-CG 4.24Å; T233-F235 HydrophobicContact CG2-CZ 3.77Å; F235-Y237 HydrophobicContact CB-CE2 4Å; F235-V248 HydrophobicContact CB-CG1 4.46Å; F235-V248 HydrophobicContact CD1-CG1 4.02Å; F235-V248 HydrophobicContact CD1-CG2 3.82Å; F235-K251 HydrophobicContact CD1-CG 4.17Å; F235-K251 HydrophobicContact CE1-CD 4.18Å; F235-K251 HydrophobicContact CE1-CG 4.32Å
236	E	97.9	Very high	94.8	Very high	12 Å²	12	41.5 Å²	41.5	6%	0.056	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	132.1	176.9	-179.2	-178.5	151.1	0	0	110.3	K222 A249 R250 I252	K222-E236 HydrophobicContact CD-CG 4.14Å; K222-E236 WeakPolarHBondContact CD-OE1 3.22Å; K222-E236 WeakPolarHBondContact CE-OE1 3.5Å; K222-E236 IonicContact NZ-OE1 2.7Å; K222-E236 PolarHBondContact NZ-OE1 2.98Å; E236-A249 WeakPolarHBondContact O-CA 3.17Å; E236-A249 WeakPolarHBondContact O-CB 3.26Å; E236-A249 PolarHBondContact O-N 3.13Å; E236-R250 HydrophobicContact CB-CB 4.13Å; E236-R250 PolarHBondContact N-O 2.8Å; E236-R250 PolarHBondContact O-N 3.29Å; E236-R250 IonicContact OE2-CZ 3.34Å; E236-R250 IonicContact OE2-NE 3.89Å; E236-R250 PolarHBondContact OE2-NE 3.32Å; E236-R250 IonicContact OE2-NH2 2.7Å; E236-R250 PolarHBondContact OE2-NH2 3.5Å; E236-I252 HydrophobicContact CB-CD1 4.42Å
237	Y	98	Very high	94.7	Very high	10 Å²	10	44.8 Å²	44.8	4%	0.039	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	141.4	174.7	-56.9	-91.4	0	0	0	109.6	K222 R223 M225 F235 D239 M243 T247 V248	K222-Y237 VanDerWaalsContact CA-O 3.26Å; K222-Y237 WeakPolarHBondContact CA-O 3.44Å; K222-Y237 WeakPolarHBondContact CB-O 3.38Å; R223-Y237 PolarHBondContact N-O 3.36Å; R223-Y237 VanDerWaalsContact N-O 3.1Å; R223-Y237 PolarHBondContact O-N 3.2Å; M225-Y237 HydrophobicContact CB-CE2 3.92Å; F235-Y237 HydrophobicContact CB-CE2 4Å; Y237-D239 VanDerWaalsContact C-N 3.31Å; Y237-D239 PolarHBondContact O-N 2.87Å; Y237-M243 HydrophobicContact CD1-CB 4.16Å; Y237-M243 HydrophobicContact CD2-CB 4.37Å; Y237-M243 HydrophobicContact CD2-CG 4.15Å; Y237-M243 HydrophobicContact CE2-CG 4.31Å; Y237-M243 HydrophobicContact CG-CB 3.99Å; Y237-M243 HydrophobicContact CG-CG 4.26Å; Y237-T247 WeakPolarHBondContact CD1-O 3.43Å; Y237-V248 HydrophobicContact CE1-CB 4.41Å; Y237-V248 HydrophobicContact CE1-CG2 3.72Å
238	V	97	Very high	94.9	Very high	74 Å²	74	44.5 Å²	44.5	45%	0.448	22%	0.223	S	C	.	.	S	Bend	trans	-61.9	-41.1	-179	-171.9	0	0	0	0	111.4	K221 K222 D242 A249	K221-V238 CarbonylContact C-O 3.44Å; K222-V238 WeakPolarHBondContact CA-O 3.44Å; K222-V238 PolarHBondContact N-O 3.17Å; V238-D242 WeakPolarHBondContact CB-OD2 3.32Å; V238-D242 WeakPolarHBondContact CG2-OD2 3.49Å; V238-A249 HydrophobicContact CG2-CB 3.69Å
239	D	95.6	Very high	95.2	Very high	56 Å²	56	44.7 Å²	44.7	30%	0.299	23%	0.234	S	C	.	.	S	Bend	trans	-156.3	-173.1	172.5	69.1	21.1	0	0	0	112.4	K221 Y237 A241 D242 M243	K221-D239 HydrophobicContact CB-CB 4.37Å; K221-D239 WeakPolarHBondContact O-CA 3.48Å; Y237-D239 VanDerWaalsContact C-N 3.31Å; Y237-D239 PolarHBondContact O-N 2.87Å; D239-A241 VanDerWaalsContact C-N 3.31Å; D239-A241 PolarHBondContact O-N 2.75Å; D239-A241 WeakPolarHBondContact OD1-CA 3.34Å; D239-A241 VanDerWaalsContact OD1-CB 3.29Å; D239-A241 WeakPolarHBondContact OD1-CB 3.32Å; D239-A241 PolarHBondContact OD1-N 3.08Å; D239-D242 PolarHBondContact O-N 3.49Å; D239-D242 PolarHBondContact OD1-N 2.83Å; D239-M243 PolarHBondContact O-N 3.06Å
240	E	94.3	Very high	95.6	Very high	35 Å²	35	48.8 Å²	48.8	16%	0.164	25%	0.249	C	C	.	.	H	α-helix	trans	-68.8	-21.5	176.9	-64.7	-178.1	-165.8	0	0	114.7	H198 R223 M243 R244	H198-E240 IonicContact CE1-OE1 3.5Å; H198-E240 IonicContact CE1-OE2 2.69Å; H198-E240 IonicContact CG-OE2 3.14Å; H198-E240 IonicContact ND1-OE1 2.65Å; H198-E240 PolarHBondContact ND1-OE1 3.18Å; H198-E240 IonicContact ND1-OE2 3.98Å; H198-E240 PolarHBondContact ND1-OE2 3.31Å; R223-E240 HydrophobicContact CG-CG 3.95Å; R223-E240 IonicContact CZ-OE1 3.69Å; R223-E240 IonicContact NE-OE1 3.67Å; R223-E240 PolarHBondContact NE-OE1 3.49Å; R223-E240 IonicContact NH2-OE1 2.88Å; R223-E240 PolarHBondContact NH2-OE1 2.81Å; E240-M243 HydrophobicContact CG-CE 4.34Å; E240-R244 WeakPolarHBondContact O-CB 3.44Å; E240-R244 WeakPolarHBondContact O-CG 3.44Å; E240-R244 PolarHBondContact O-N 3.48Å; E240-R244 IonicContact OE2-CZ 3.32Å; E240-R244 IonicContact OE2-NH1 2.69Å; E240-R244 IonicContact OE2-NH2 2.76Å; E240-R244 PolarHBondContact OE2-NH2 3.34Å
241	A	96.2	Very high	96	Very high	37 Å²	37	53.7 Å²	53.7	31%	0.306	27%	0.271	S	S	.	.	H	α-helix	trans	-76	-33.6	175.5	0	0	0	0	0	110.9	D239 R245	D239-A241 VanDerWaalsContact C-N 3.31Å; D239-A241 PolarHBondContact O-N 2.75Å; D239-A241 WeakPolarHBondContact OD1-CA 3.34Å; D239-A241 VanDerWaalsContact OD1-CB 3.29Å; D239-A241 WeakPolarHBondContact OD1-CB 3.32Å; D239-A241 PolarHBondContact OD1-N 3.08Å; A241-R245 WeakPolarHBondContact O-CB 3.25Å; A241-R245 VanDerWaalsContact O-CG 3.27Å; A241-R245 WeakPolarHBondContact O-CG 3.33Å; A241-R245 PolarHBondContact O-N 2.85Å; A241-R245 PolarHBondContact O-NE 3.44Å
242	D	96.5	Very high	96.4	Very high	26 Å²	26	53.5 Å²	53.5	14%	0.139	27%	0.267	C	S	.	.	H	α-helix	trans	-71.3	-39.9	168.3	-78.1	-2.9	0	0	0	111.9	V238 D239 R244 R245 E246 T247	V238-D242 WeakPolarHBondContact CB-OD2 3.32Å; V238-D242 WeakPolarHBondContact CG2-OD2 3.49Å; D239-D242 PolarHBondContact O-N 3.49Å; D239-D242 PolarHBondContact OD1-N 2.83Å; D242-R244 PolarHBondContact O-N 2.94Å; D242-R245 CarbonylContact O-C 3.56Å; D242-R245 PolarHBondContact O-N 2.79Å; D242-R245 IonicContact OD1-CZ 3.19Å; D242-R245 IonicContact OD1-NE 3.13Å; D242-R245 IonicContact OD1-NH2 2.72Å; D242-R245 PolarHBondContact OD1-NH2 2.9Å; D242-E246 PolarHBondContact O-N 2.87Å; D242-T247 PolarHBondContact O-N 2.94Å
243	M	95.7	Very high	96.5	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-60.1	-41.9	172.1	-165.8	178.1	70	0	0	112.3	H198 A199 W208 R223 Y237 D239 E240 R245 E246 L429	H198-M243 HydrophobicContact CB-CE 4Å; A199-M243 HydrophobicContact CB-CE 3.86Å; A199-M243 HydrophobicContact CB-CG 4.17Å; W208-M243 HydrophobicContact CE3-CE 3.79Å; W208-M243 HydrophobicContact CE3-SD 3.87Å; W208-M243 HydrophobicContact CH2-CE 4.47Å; W208-M243 HydrophobicContact CZ3-CE 3.66Å; W208-M243 HydrophobicContact CZ3-SD 4.28Å; R223-M243 HydrophobicContact CB-SD 3.65Å; R223-M243 HydrophobicContact CG-CE 4.31Å; R223-M243 HydrophobicContact CG-SD 3.93Å; Y237-M243 HydrophobicContact CD1-CB 4.16Å; Y237-M243 HydrophobicContact CD2-CB 4.37Å; Y237-M243 HydrophobicContact CD2-CG 4.15Å; Y237-M243 HydrophobicContact CE2-CG 4.31Å; Y237-M243 HydrophobicContact CG-CB 3.99Å; Y237-M243 HydrophobicContact CG-CG 4.26Å; D239-M243 PolarHBondContact O-N 3.06Å; E240-M243 HydrophobicContact CG-CE 4.34Å; M243-R245 PolarHBondContact O-N 2.79Å; M243-E246 PolarHBondContact O-N 2.84Å; M243-L429 HydrophobicContact CE-CD1 3.93Å; M243-L429 HydrophobicContact CG-CD1 4.24Å; M243-L429 HydrophobicContact SD-CD1 3.74Å
244	R	95.3	Very high	96.5	Very high	123 Å²	123	54.5 Å²	54.5	46%	0.464	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-25.9	172.5	-79.1	170.2	-169.5	110.4	15.7	114.2	H198 A199 E240 D242	H198-R244 WeakPolarHBondContact O-CD 3.34Å; H198-R244 WeakPolarHBondContact O-CG 3.47Å; H198-R244 PolarHBondContact O-NE 3.1Å; H198-R244 PolarHBondContact O-NH2 2.97Å; A199-R244 HydrophobicContact CB-CB 4.49Å; A199-R244 HydrophobicContact CB-CG 3.89Å; E240-R244 WeakPolarHBondContact O-CB 3.44Å; E240-R244 WeakPolarHBondContact O-CG 3.44Å; E240-R244 PolarHBondContact O-N 3.48Å; E240-R244 IonicContact OE2-CZ 3.32Å; E240-R244 IonicContact OE2-NH1 2.69Å; E240-R244 IonicContact OE2-NH2 2.76Å; E240-R244 PolarHBondContact OE2-NH2 3.34Å; D242-R244 PolarHBondContact O-N 2.94Å
245	R	95.7	Very high	96.4	Very high	162 Å²	162	55.9 Å²	55.9	61%	0.611	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	9.2	179	-67.6	179.8	-66.7	-171.5	2.9	112.4	A241 D242 M243 T247	A241-R245 WeakPolarHBondContact O-CB 3.25Å; A241-R245 VanDerWaalsContact O-CG 3.27Å; A241-R245 WeakPolarHBondContact O-CG 3.33Å; A241-R245 PolarHBondContact O-N 2.85Å; A241-R245 PolarHBondContact O-NE 3.44Å; D242-R245 CarbonylContact O-C 3.56Å; D242-R245 PolarHBondContact O-N 2.79Å; D242-R245 IonicContact OD1-CZ 3.19Å; D242-R245 IonicContact OD1-NE 3.13Å; D242-R245 IonicContact OD1-NH2 2.72Å; D242-R245 PolarHBondContact OD1-NH2 2.9Å; M243-R245 PolarHBondContact O-N 2.79Å; R245-T247 PolarHBondContact O-N 2.79Å; R245-T247 PolarHBondContact O-OG1 2.93Å; R245-T247 VanDerWaalsContact O-OG1 3.13Å
246	E	92.4	Very high	96.1	Very high	83 Å²	83	58.1 Å²	58.1	39%	0.388	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	24	-177.1	-53.4	171.5	155.3	0	0	113.4	K202 D242 M243 V248	K202-E246 VanDerWaalsContact CE-CD 3.49Å; K202-E246 WeakPolarHBondContact CE-OE1 3.47Å; K202-E246 WeakPolarHBondContact CE-OE2 3.5Å; K202-E246 WeakPolarHBondContact CG-OE1 3.42Å; K202-E246 IonicContact NZ-OE1 2.71Å; K202-E246 IonicContact NZ-OE2 2.69Å; K202-E246 PolarHBondContact NZ-OE2 2.81Å; D242-E246 PolarHBondContact O-N 2.87Å; M243-E246 PolarHBondContact O-N 2.84Å; E246-V248 PolarHBondContact O-N 2.85Å; E246-V248 VanDerWaalsContact O-N 3.07Å
247	T	96.7	Very high	95.8	Very high	69 Å²	69	59.4 Å²	59.4	42%	0.423	30%	0.295	S	S	.	.			trans	-85.2	83.7	-173.7	-56.9	0	0	0	0	109.4	Y237 D242 R245 A249	Y237-T247 WeakPolarHBondContact CD1-O 3.43Å; D242-T247 PolarHBondContact O-N 2.94Å; R245-T247 PolarHBondContact O-N 2.79Å; R245-T247 PolarHBondContact O-OG1 2.93Å; R245-T247 VanDerWaalsContact O-OG1 3.13Å; T247-A249 PolarHBondContact O-N 3.05Å
248	V	96.8	Very high	95.7	Very high	53 Å²	53	59 Å²	59	32%	0.321	29%	0.294	S	S	.	.			trans	-64.4	122.6	178.2	-179.6	0	0	0	0	110	F235 Y237 E246 R250 K251	F235-V248 HydrophobicContact CB-CG1 4.46Å; F235-V248 HydrophobicContact CD1-CG1 4.02Å; F235-V248 HydrophobicContact CD1-CG2 3.82Å; Y237-V248 HydrophobicContact CE1-CB 4.41Å; Y237-V248 HydrophobicContact CE1-CG2 3.72Å; E246-V248 PolarHBondContact O-N 2.85Å; E246-V248 VanDerWaalsContact O-N 3.07Å; V248-R250 WeakPolarHBondContact CG1-O 3.25Å; V248-K251 HydrophobicContact CG1-CG 3.99Å
249	A	97.4	Very high	95.4	Very high	58 Å²	58	56.2 Å²	56.2	48%	0.479	28%	0.276	S	S	.	.	S	Bend	trans	-84.9	-37.8	179.2	0	0	0	0	0	112.4	E236 V238 T247	E236-A249 WeakPolarHBondContact O-CA 3.17Å; E236-A249 WeakPolarHBondContact O-CB 3.26Å; E236-A249 PolarHBondContact O-N 3.13Å; V238-A249 HydrophobicContact CG2-CB 3.69Å; T247-A249 PolarHBondContact O-N 3.05Å
250	R	97.2	Very high	95.3	Very high	93 Å²	93	53.6 Å²	53.6	35%	0.351	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	138.9	174.4	177.6	169.5	66.8	141.8	-5	109.8	E236 V248 I252 I285	E236-R250 HydrophobicContact CB-CB 4.13Å; E236-R250 PolarHBondContact N-O 2.8Å; E236-R250 PolarHBondContact O-N 3.29Å; E236-R250 IonicContact OE2-CZ 3.34Å; E236-R250 IonicContact OE2-NE 3.89Å; E236-R250 PolarHBondContact OE2-NE 3.32Å; E236-R250 IonicContact OE2-NH2 2.7Å; E236-R250 PolarHBondContact OE2-NH2 3.5Å; V248-R250 WeakPolarHBondContact CG1-O 3.25Å; R250-I252 HydrophobicContact CG-CG1 3.91Å; R250-I285 PolarHBondContact NH1-O 3Å
251	K	97.6	Very high	95.4	Very high	131 Å²	131	52 Å²	52	57%	0.57	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	138.9	159.7	-66.5	-168.7	178.6	-158.5	0	108.3	T233 F235 V248	T233-K251 HydrophobicContact CG2-CB 4.02Å; T233-K251 HydrophobicContact CG2-CD 4.17Å; T233-K251 HydrophobicContact CG2-CG 4.19Å; F235-K251 HydrophobicContact CD1-CG 4.17Å; F235-K251 HydrophobicContact CE1-CD 4.18Å; F235-K251 HydrophobicContact CE1-CG 4.32Å; V248-K251 HydrophobicContact CG1-CG 3.99Å
252	I	97.9	Very high	95.4	Very high	9 Å²	9	50.3 Å²	50.3	5%	0.046	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	107.1	-178.9	-54.5	166.2	0	0	0	106.8	L234 E236 R250 L254 Y283 I285	L234-I252 HydrophobicContact CB-CB 4.24Å; L234-I252 HydrophobicContact CD2-CD1 4.24Å; L234-I252 PolarHBondContact N-O 2.8Å; L234-I252 WeakPolarHBondContact O-CB 3.42Å; L234-I252 PolarHBondContact O-N 2.6Å; E236-I252 HydrophobicContact CB-CD1 4.42Å; R250-I252 HydrophobicContact CG-CG1 3.91Å; I252-L254 PolarHBondContact O-N 2.56Å; I252-Y283 HydrophobicContact CG2-CE1 3.86Å; I252-I285 HydrophobicContact CD1-CB 4.12Å; I252-I285 HydrophobicContact CD1-CD1 4.06Å; I252-I285 HydrophobicContact CD1-CG2 4.07Å; I252-I285 HydrophobicContact CG2-CG2 4.3Å
253	D	96.4	Very high	95.5	Very high	95 Å²	95	49.2 Å²	49.2	51%	0.508	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115.1	177	-53.9	-33.8	0	0	0	108.9
254	L	96.6	Very high	95.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	154.1	173.5	-58.8	173.7	0	0	0	109.6	R45 N232 L234 I252 Y256 Y258 L270 Y272 Y283	R45-L254 PolarHBondContact NH1-O 2.76Å; N232-L254 VanDerWaalsContact O-CB 3.31Å; N232-L254 WeakPolarHBondContact O-CB 3.3Å; N232-L254 VanDerWaalsContact O-CG 3.31Å; N232-L254 WeakPolarHBondContact O-CG 3.43Å; N232-L254 PolarHBondContact O-N 2.9Å; L234-L254 HydrophobicContact CB-CD2 4.5Å; I252-L254 PolarHBondContact O-N 2.56Å; L254-Y256 WeakPolarHBondContact CB-O 3.25Å; L254-Y256 PolarHBondContact O-N 2.99Å; L254-Y258 HydrophobicContact CD1-CD1 3.65Å; L254-Y258 HydrophobicContact CD1-CE1 4.12Å; L254-L270 HydrophobicContact CD1-CD2 3.73Å; L254-L270 HydrophobicContact CD2-CD2 3.8Å; L254-L270 HydrophobicContact CG-CD2 4.41Å; L254-Y272 HydrophobicContact CD1-CE1 4.29Å; L254-Y272 HydrophobicContact CD2-CE1 4.41Å; L254-Y283 HydrophobicContact CD2-CD1 3.47Å; L254-Y283 VanDerWaalsContact CD2-CD1 3.47Å; L254-Y283 HydrophobicContact CD2-CE1 4.14Å; L254-Y283 HydrophobicContact CD2-CG 4.13Å
255	P	94.6	Very high	95.7	Very high	29 Å²	29	43.5 Å²	43.5	19%	0.188	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	-34.7	174.8	-28.6	37.4	0	0	0	113	R45 Y283 Y290	R45-P255 WeakPolarHBondContact CD-O 3.34Å; R45-P255 PolarHBondContact NH1-O 3.35Å; P255-Y283 VanDerWaalsContact CD-CD2 3.47Å; P255-Y283 HydrophobicContact CG-CD2 3.57Å; P255-Y283 HydrophobicContact CG-CE2 3.6Å; P255-Y283 HydrophobicContact CG-CG 4.36Å; P255-Y290 HydrophobicContact CB-CD2 4.13Å; P255-Y290 HydrophobicContact CB-CE2 4.48Å; P255-Y290 HydrophobicContact CB-CG 4.41Å; P255-Y290 HydrophobicContact CG-CD2 3.78Å; P255-Y290 HydrophobicContact CG-CG 4.1Å
256	Y	92.5	Very high	95.7	Very high	61 Å²	61	37.4 Å²	37.4	24%	0.239	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	169.6	-175.7	-59.2	-72.1	0	0	0	112.4	R45 L254 R274 Y290	R45-Y256 HydrophobicContact CB-CD1 4.38Å; R45-Y256 HydrophobicContact CB-CE1 4.18Å; L254-Y256 WeakPolarHBondContact CB-O 3.25Å; L254-Y256 PolarHBondContact O-N 2.99Å; Y256-R274 VanDerWaalsContact CB-NE 3.27Å; Y256-R274 VanDerWaalsContact CG-NE 3.3Å; Y256-Y290 AromaticContact CD2-CE1 3.98Å; Y256-Y290 HydrophobicContact CD2-CE1 3.98Å; Y256-Y290 AromaticContact CD2-CE2 3.88Å; Y256-Y290 HydrophobicContact CD2-CE2 3.88Å; Y256-Y290 AromaticContact CD2-CZ 3.49Å; Y256-Y290 VanDerWaalsContact CD2-CZ 3.49Å; Y256-Y290 WeakPolarHBondContact CD2-OH 3.07Å; Y256-Y290 HydrophobicContact CE2-CD1 4.28Å; Y256-Y290 AromaticContact CE2-CE1 3.63Å; Y256-Y290 HydrophobicContact CE2-CE1 3.63Å; Y256-Y290 HydrophobicContact CE2-CE2 4.33Å; Y256-Y290 AromaticContact CE2-CZ 3.66Å
257	M	92	Very high	95.9	Very high	38 Å²	38	36.2 Å²	36.2	19%	0.187	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	140.1	173	-58.4	-64.2	-172.2	0	0	112.5	E41 Y230 G231 N232 A275	E41-M257 VanDerWaalsContact OE2-CE 3.3Å; E41-M257 WeakPolarHBondContact OE2-CE 3.37Å; E41-M257 VanDerWaalsContact OE2-CG 3.25Å; E41-M257 WeakPolarHBondContact OE2-CG 3.3Å; Y230-M257 HydrophobicContact CE1-CB 3.94Å; Y230-M257 HydrophobicContact CE1-CE 4.46Å; Y230-M257 HydrophobicContact CE1-CG 3.72Å; Y230-M257 HydrophobicContact CE1-SD 4.05Å; G231-M257 CarbonylContact O-C 3.58Å; G231-M257 VanDerWaalsContact O-CA 3.23Å; G231-M257 WeakPolarHBondContact O-CA 3.34Å; N232-M257 HydrophobicContact CB-SD 3.58Å; N232-M257 VanDerWaalsContact CB-SD 3.58Å; M257-A275 HydrophobicContact CB-CB 3.76Å; M257-A275 WeakPolarHBondContact O-CB 3.38Å; M257-A275 PolarHBondContact O-N 3.39Å
258	Y	94.6	Very high	95.9	Very high	3 Å²	3	33 Å²	33	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	157.3	158.4	58.4	-105.1	0	0	0	111.5	T226 E227 Y230 G231 L254 H263 H273	T226-Y258 WeakPolarHBondContact CB-OH 3.43Å; T226-Y258 HydrophobicContact CG2-CD1 4.24Å; T226-Y258 HydrophobicContact CG2-CE1 3.59Å; E227-Y258 PolarHBondContact N-OH 3.13Å; E227-Y258 PolarHBondContact O-OH 3.32Å; Y230-Y258 WeakPolarHBondContact CA-O 3.21Å; G231-Y258 PolarHBondContact N-O 2.98Å; G231-Y258 WeakPolarHBondContact O-CD1 3.21Å; G231-Y258 VanDerWaalsContact O-CE1 3.28Å; G231-Y258 WeakPolarHBondContact O-CE1 3.39Å; G231-Y258 VanDerWaalsContact O-CG 3.29Å; G231-Y258 PolarHBondContact O-N 2.67Å; L254-Y258 HydrophobicContact CD1-CD1 3.65Å; L254-Y258 HydrophobicContact CD1-CE1 4.12Å; Y258-H263 AromaticContact CD2-CE1 3.67Å; Y258-H263 AromaticContact CD2-NE2 3.57Å; Y258-H263 AromaticContact CE2-NE2 3.89Å; Y258-H263 AromaticContact CG-CE1 3.83Å; Y258-H263 AromaticContact CG-NE2 3.76Å; Y258-H273 VanDerWaalsContact CA-O 3.31Å; Y258-H273 WeakPolarHBondContact CA-O 3.44Å
259	D	92.1	Very high	95.9	Very high	15 Å²	15	30.5 Å²	30.5	8%	0.08	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	132	171.2	175.2	25.7	0	0	0	109.5	F229 Y230 H273 A275 Y313	F229-D259 CarbonylContact O-C 3.56Å; F229-D259 WeakPolarHBondContact O-CA 3.46Å; Y230-D259 HydrophobicContact CD2-CB 4.12Å; Y230-D259 HydrophobicContact CE2-CB 4.39Å; D259-H273 PolarHBondContact N-O 3.22Å; D259-H273 PolarHBondContact O-ND1 2.98Å; D259-H273 IonicContact OD2-CE1 3.74Å; D259-H273 PolarHBondContact OD2-CE1 3.07Å; D259-H273 IonicContact OD2-ND1 2.7Å; D259-A275 HydrophobicContact CB-CB 3.64Å; D259-Y313 VanDerWaalsContact OD2-CE2 3.29Å; D259-Y313 WeakPolarHBondContact OD2-CE2 3.42Å
260	G	94	Very high	96	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.01	13%	0.131	C	C	.	.	S	Bend	trans	92.3	-174.1	-164.1	0	0	0	0	0	114.4	F229 H263 F311 N312	F229-G260 CarbonylContact C-O 3.53Å; F229-G260 WeakPolarHBondContact CA-O 3.37Å; F229-G260 PolarHBondContact O-N 2.91Å; G260-H263 PolarHBondContact O-CE1 2.8Å; G260-F311 WeakPolarHBondContact CA-O 3.3Å; G260-N312 WeakPolarHBondContact CA-OD1 3.37Å
261	T	96.2	Very high	96	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	-122.5	-29	-177.4	44.7	0	0	0	0	112.3	A207 F229 H263 N312 N410	A207-T261 WeakPolarHBondContact CB-O 3.35Å; F229-T261 HydrophobicContact CB-CG2 3.88Å; T261-H263 PolarHBondContact O-N 2.86Å; T261-N312 PolarHBondContact N-OD1 2.9Å; T261-N312 PolarHBondContact OG1-ND2 3.29Å; T261-N312 PolarHBondContact OG1-OD1 2.78Å; T261-N410 WeakPolarHBondContact CB-O 3.36Å; T261-N410 PolarHBondContact OG1-O 2.84Å
262	S	96.1	Very high	96.1	Very high	3 Å²	3	17.3 Å²	17.3	2%	0.021	9%	0.088	C	C	.	.			trans	-78	66.6	-174.2	-65.3	0	0	0	0	113	N312 D315 F316	S262-N312 PolarHBondContact N-OD1 3.1Å; S262-N312 PolarHBondContact OG-ND2 2.62Å; S262-D315 VanDerWaalsContact CB-OD1 3.27Å; S262-D315 WeakPolarHBondContact CB-OD1 3.32Å; S262-F316 WeakPolarHBondContact O-CD2 3.29Å; S262-F316 PolarHBondContact O-N 3.2Å
263	H	97.4	Very high	96	Very high	3 Å²	3	17 Å²	17	1%	0.014	9%	0.086	C	C	.	.			trans	-88	164.1	172.9	-37.1	-39.6	0	0	0	111.3	F209 T226 Y258 G260 T261 L270 Y271	F209-H263 HydrophobicContact CE1-CB 4.2Å; F209-H263 VanDerWaalsContact CE1-O 3.29Å; F209-H263 WeakPolarHBondContact CE1-O 3.43Å; F209-H263 HydrophobicContact CZ-CB 3.81Å; F209-H263 AromaticContact CZ-CD2 3.91Å; T226-H263 PolarHBondContact OG1-CD2 3.12Å; T226-H263 VanDerWaalsContact OG1-CD2 3.26Å; T226-H263 PolarHBondContact OG1-NE2 3.26Å; Y258-H263 AromaticContact CD2-CE1 3.67Å; Y258-H263 AromaticContact CD2-NE2 3.57Å; Y258-H263 AromaticContact CE2-NE2 3.89Å; Y258-H263 AromaticContact CG-CE1 3.83Å; Y258-H263 AromaticContact CG-NE2 3.76Å; G260-H263 PolarHBondContact O-CE1 2.8Å; T261-H263 PolarHBondContact O-N 2.86Å; H263-L270 HydrophobicContact CB-CD1 4.16Å; H263-Y271 WeakPolarHBondContact CA-O 3.39Å; H263-Y271 WeakPolarHBondContact CB-O 3.31Å
264	A	97.8	Very high	96	Very high	4 Å²	4	13.4 Å²	13.4	3%	0.033	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.6	169.5	0	0	0	0	0	111.7	Y271 F316 L318 L323	A264-Y271 PolarHBondContact N-O 2.91Å; A264-Y271 PolarHBondContact O-N 3Å; A264-F316 HydrophobicContact CB-CB 3.63Å; A264-F316 HydrophobicContact CB-CG 4.46Å; A264-L318 HydrophobicContact CB-CD1 3.9Å; A264-L318 HydrophobicContact CB-CG 3.95Å; A264-L323 HydrophobicContact CB-CD1 3.96Å
265	F	97.7	Very high	95.7	Very high	4 Å²	4	13.6 Å²	13.6	2%	0.018	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120	174.6	-166.2	-87.4	0	0	0	110.6	F209 D211 P212 W224 L234 S269 L270 I285	F209-F265 HydrophobicContact CB-CB 3.81Å; F209-F265 HydrophobicContact CD1-CB 4.29Å; F209-F265 HydrophobicContact CD2-CB 4.39Å; F209-F265 HydrophobicContact CG-CB 3.9Å; D211-F265 HydrophobicContact CB-CD1 3.82Å; D211-F265 HydrophobicContact CB-CE1 3.85Å; P212-F265 WeakPolarHBondContact CD-O 3.44Å; W224-F265 HydrophobicContact CD2-CD1 4.2Å; W224-F265 AromaticContact CD2-CE1 3.86Å; W224-F265 HydrophobicContact CD2-CE1 3.86Å; W224-F265 HydrophobicContact CD2-CZ 4.12Å; W224-F265 AromaticContact CE2-CE1 3.72Å; W224-F265 AromaticContact CE2-CZ 3.79Å; W224-F265 HydrophobicContact CE3-CD1 4.21Å; W224-F265 HydrophobicContact CE3-CE1 4.15Å; W224-F265 HydrophobicContact CG-CE1 4.41Å; W224-F265 HydrophobicContact CG-CE2 4.41Å; W224-F265 HydrophobicContact CG-CZ 4.3Å; W224-F265 HydrophobicContact CH2-CE1 4.17Å; W224-F265 AromaticContact CZ2-CE1 3.87Å; W224-F265 HydrophobicContact CZ2-CE1 3.87Å; W224-F265 HydrophobicContact CZ2-CZ 4.21Å; W224-F265 HydrophobicContact CZ3-CE1 4.33Å; W224-F265 AromaticContact NE1-CZ 3.79Å; L234-F265 HydrophobicContact CD2-CD2 4.2Å; L234-F265 HydrophobicContact CD2-CE2 3.79Å; F265-S269 WeakPolarHBondContact CA-O 3.39Å; F265-L270 HydrophobicContact CD2-CB 3.93Å; F265-L270 HydrophobicContact CD2-CD1 3.97Å; F265-L270 HydrophobicContact CE2-CB 4.25Å; F265-I285 HydrophobicContact CE2-CD1 4.33Å; F265-I285 HydrophobicContact CE2-CG2 4.23Å; F265-I285 HydrophobicContact CZ-CD1 3.74Å; F265-I285 HydrophobicContact CZ-CG1 4.3Å
266	F	96.8	Very high	95.3	Very high	34 Å²	34	13.2 Å²	13.2	15%	0.149	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	131.1	-173.2	175	-82.9	0	0	0	111	P212 F213 G268 S269 Y271 L318 M342	P212-F266 HydrophobicContact CG-CD2 3.77Å; P212-F266 HydrophobicContact CG-CE2 4.46Å; F213-F266 HydrophobicContact CB-CE2 4.46Å; F213-F266 HydrophobicContact CD2-CD2 4.26Å; F213-F266 AromaticContact CD2-CE2 3.62Å; F213-F266 HydrophobicContact CD2-CE2 3.62Å; F213-F266 HydrophobicContact CD2-CZ 4.38Å; F213-F266 HydrophobicContact CE2-CE2 4.39Å; F213-F266 HydrophobicContact CG-CE2 4.47Å; F266-G268 VanDerWaalsContact C-N 3.31Å; F266-G268 PolarHBondContact O-N 2.99Å; F266-S269 PolarHBondContact N-O 3.04Å; F266-S269 PolarHBondContact O-N 3.49Å; F266-Y271 HydrophobicContact CB-CE2 4.05Å; F266-L318 HydrophobicContact CB-CD1 3.94Å; F266-L318 HydrophobicContact CB-CD2 4.15Å; F266-L318 HydrophobicContact CD2-CD2 4.05Å; F266-L318 HydrophobicContact CG-CD2 4.33Å; F266-M342 HydrophobicContact CD1-CE 4.19Å; F266-M342 HydrophobicContact CD1-SD 3.7Å; F266-M342 HydrophobicContact CD2-CE 4Å; F266-M342 HydrophobicContact CD2-SD 4.5Å; F266-M342 HydrophobicContact CE1-CE 4.06Å; F266-M342 HydrophobicContact CE1-SD 3.32Å; F266-M342 WeakPolarHBondContact CE1-SD 3.49Å; F266-M342 HydrophobicContact CE2-CE 3.82Å; F266-M342 HydrophobicContact CE2-SD 4.16Å; F266-M342 HydrophobicContact CG-CE 4.19Å; F266-M342 HydrophobicContact CG-SD 4.31Å; F266-M342 HydrophobicContact CZ-CE 3.88Å; F266-M342 HydrophobicContact CZ-SD 3.59Å; F266-M342 VanDerWaalsContact CZ-SD 3.59Å
267	N	95.6	Very high	95.3	Very high	58 Å²	58	11.8 Å²	11.8	31%	0.31	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	45.7	172.5	-173.6	11.6	0	0	0	112.6	D211 F213 R215 S269	D211-N267 VanDerWaalsContact CG-N 3.26Å; D211-N267 PolarHBondContact OD1-N 3.11Å; D211-N267 VanDerWaalsContact OD2-CA 3.32Å; D211-N267 WeakPolarHBondContact OD2-CA 3.28Å; D211-N267 PolarHBondContact OD2-N 3.2Å; F213-N267 WeakPolarHBondContact O-CA 3.27Å; R215-N267 WeakPolarHBondContact CG-OD1 3.37Å; R215-N267 PolarHBondContact NE-O 3.2Å; R215-N267 PolarHBondContact NE-OD1 2.9Å; R215-N267 PolarHBondContact NH2-O 2.86Å; N267-S269 VanDerWaalsContact C-N 3.3Å; N267-S269 PolarHBondContact O-N 2.81Å
268	G	96.4	Very high	95.5	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	16.2	-177.3	0	0	0	0	0	115.8	D211 F266 I285	D211-G268 PolarHBondContact OD2-N 3.45Å; F266-G268 VanDerWaalsContact C-N 3.31Å; F266-G268 PolarHBondContact O-N 2.99Å; G268-I285 WeakPolarHBondContact O-CG1 3.3Å; G268-I285 PolarHBondContact O-N 3.42Å
269	S	98	Very high	95.6	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.007	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.9	176.4	-57.8	0	0	0	0	111.9	F265 F266 N267 Y271 K282 Y283	F265-S269 WeakPolarHBondContact CA-O 3.39Å; F266-S269 PolarHBondContact N-O 3.04Å; F266-S269 PolarHBondContact O-N 3.49Å; N267-S269 VanDerWaalsContact C-N 3.3Å; N267-S269 PolarHBondContact O-N 2.81Å; S269-Y271 WeakPolarHBondContact O-CD2 3.23Å; S269-Y271 WeakPolarHBondContact O-CE2 3.41Å; S269-K282 WeakPolarHBondContact OG-CE 3.3Å; S269-Y283 CarbonylContact C-O 3.58Å; S269-Y283 VanDerWaalsContact CA-O 3.25Å; S269-Y283 WeakPolarHBondContact CA-O 3.37Å
270	L	98.3	Very high	95.9	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.5	168.2	-176.1	73.9	0	0	0	109.3	F209 L234 L254 H263 F265 Y272 K282 Y283	F209-L270 HydrophobicContact CE2-CD1 4.31Å; L234-L270 HydrophobicContact CD1-CD1 4.1Å; L234-L270 HydrophobicContact CD1-CD2 4.23Å; L234-L270 HydrophobicContact CD2-CB 4.34Å; L234-L270 HydrophobicContact CD2-CD2 4.38Å; L254-L270 HydrophobicContact CD1-CD2 3.73Å; L254-L270 HydrophobicContact CD2-CD2 3.8Å; L254-L270 HydrophobicContact CG-CD2 4.41Å; H263-L270 HydrophobicContact CB-CD1 4.16Å; F265-L270 HydrophobicContact CD2-CB 3.93Å; F265-L270 HydrophobicContact CD2-CD1 3.97Å; F265-L270 HydrophobicContact CE2-CB 4.25Å; L270-Y272 HydrophobicContact CD2-CD1 3.9Å; L270-Y272 HydrophobicContact CD2-CE1 4.43Å; L270-Y272 HydrophobicContact CD2-CG 4.5Å; L270-Y272 HydrophobicContact CG-CD1 4.06Å; L270-K282 CarbonylContact O-C 3.58Å; L270-K282 VanDerWaalsContact O-CA 3.3Å; L270-K282 WeakPolarHBondContact O-CA 3.5Å; L270-Y283 PolarHBondContact N-O 3.24Å; L270-Y283 PolarHBondContact O-N 3.3Å
271	Y	98.6	Very high	96.1	Very high	5 Å²	5	13.5 Å²	13.5	2%	0.02	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.2	176.4	-58.9	-101.3	0	0	0	108.6	H263 A264 F266 S269 A281 K282 L323 M342 L345	H263-Y271 WeakPolarHBondContact CA-O 3.39Å; H263-Y271 WeakPolarHBondContact CB-O 3.31Å; A264-Y271 PolarHBondContact N-O 2.91Å; A264-Y271 PolarHBondContact O-N 3Å; F266-Y271 HydrophobicContact CB-CE2 4.05Å; S269-Y271 WeakPolarHBondContact O-CD2 3.23Å; S269-Y271 WeakPolarHBondContact O-CE2 3.41Å; Y271-A281 CarbonylContact C-O 3.56Å; Y271-A281 VanDerWaalsContact CA-O 3.29Å; Y271-A281 WeakPolarHBondContact CA-O 3.24Å; Y271-K282 HydrophobicContact CD1-CB 3.99Å; Y271-K282 HydrophobicContact CD1-CD 4.46Å; Y271-K282 HydrophobicContact CD1-CG 4.06Å; Y271-K282 HydrophobicContact CE1-CB 4.04Å; Y271-K282 HydrophobicContact CE1-CD 3.67Å; Y271-K282 HydrophobicContact CE1-CG 3.69Å; Y271-L323 HydrophobicContact CD1-CD2 3.43Å; Y271-L323 VanDerWaalsContact CD1-CD2 3.43Å; Y271-L323 HydrophobicContact CE1-CD2 3.63Å; Y271-L323 HydrophobicContact CG-CD2 4Å; Y271-M342 PolarHBondContact OH-O 2.89Å; Y271-L345 HydrophobicContact CD1-CD2 3.85Å; Y271-L345 HydrophobicContact CE1-CD2 3.98Å
272	Y	97.9	Very high	96.2	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	162.6	-170.3	65.9	-85	0	0	0	112.9	L254 L270 A281 Y290 F316	L254-Y272 HydrophobicContact CD1-CE1 4.29Å; L254-Y272 HydrophobicContact CD2-CE1 4.41Å; L270-Y272 HydrophobicContact CD2-CD1 3.9Å; L270-Y272 HydrophobicContact CD2-CE1 4.43Å; L270-Y272 HydrophobicContact CD2-CG 4.5Å; L270-Y272 HydrophobicContact CG-CD1 4.06Å; Y272-A281 HydrophobicContact CD1-CB 4.35Å; Y272-A281 HydrophobicContact CD2-CB 4.33Å; Y272-A281 HydrophobicContact CE1-CB 4.09Å; Y272-A281 HydrophobicContact CE2-CB 4.08Å; Y272-A281 HydrophobicContact CG-CB 4.49Å; Y272-A281 PolarHBondContact N-O 2.96Å; Y272-A281 PolarHBondContact O-N 2.82Å; Y272-Y290 WeakPolarHBondContact OH-CE2 3.36Å; Y272-F316 WeakPolarHBondContact O-CZ 3.25Å
273	H	97.6	Very high	96.3	Very high	2 Å²	2	16.7 Å²	16.7	1%	0.009	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	123.2	173.2	158.2	-129.7	0	0	0	109.4	Y258 D259 A275 T277 Y313 F314	Y258-H273 VanDerWaalsContact CA-O 3.31Å; Y258-H273 WeakPolarHBondContact CA-O 3.44Å; D259-H273 PolarHBondContact N-O 3.22Å; D259-H273 PolarHBondContact O-ND1 2.98Å; D259-H273 IonicContact OD2-CE1 3.74Å; D259-H273 PolarHBondContact OD2-CE1 3.07Å; D259-H273 IonicContact OD2-ND1 2.7Å; H273-A275 PolarHBondContact O-N 3.07Å; H273-T277 PolarHBondContact CD2-O 2.82Å; H273-T277 PolarHBondContact NE2-O 2.86Å; H273-T277 VanDerWaalsContact NE2-O 3.1Å; H273-Y313 AromaticContact CE1-CD2 3.72Å; H273-F314 HydrophobicContact CB-CB 4.15Å; H273-F314 HydrophobicContact CB-CD2 3.86Å; H273-F314 HydrophobicContact CB-CG 4.31Å; H273-F314 AromaticContact CD2-CD2 3.3Å; H273-F314 WeakPolarHBondContact CD2-CD2 3.41Å; H273-F314 AromaticContact CD2-CE2 3.34Å; H273-F314 WeakPolarHBondContact CD2-CE2 3.45Å; H273-F314 AromaticContact CG-CD2 3.47Å; H273-F314 VanDerWaalsContact CG-CD2 3.47Å; H273-F314 AromaticContact NE2-CD2 3.81Å; H273-F314 AromaticContact NE2-CE2 3.61Å
274	R	95.1	Very high	96.3	Very high	21 Å²	21	17 Å²	17	8%	0.079	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	109.5	178.8	168.6	64.5	-172.3	98.8	0.5	109	Y256 G276 T277 K279 A281	Y256-R274 VanDerWaalsContact CB-NE 3.27Å; Y256-R274 VanDerWaalsContact CG-NE 3.3Å; R274-G276 PolarHBondContact O-N 3.38Å; R274-T277 HydrophobicContact CG-CG2 4.28Å; R274-T277 WeakPolarHBondContact CG-OG1 3.08Å; R274-T277 PolarHBondContact O-N 2.8Å; R274-T277 VanDerWaalsContact O-N 3.16Å; R274-T277 PolarHBondContact O-OG1 2.91Å; R274-K279 HydrophobicContact CB-CB 4.1Å; R274-K279 PolarHBondContact N-O 2.85Å; R274-A281 HydrophobicContact CB-CB 4.38Å
275	A	90.1	Very high	96.2	Very high	4 Å²	4	17.1 Å²	17.1	3%	0.033	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	134.2	-171.4	0	0	0	0	0	114	Y230 M257 D259 H273 T277	Y230-A275 HydrophobicContact CD2-CB 4.43Å; Y230-A275 HydrophobicContact CE2-CB 3.66Å; M257-A275 HydrophobicContact CB-CB 3.76Å; M257-A275 WeakPolarHBondContact O-CB 3.38Å; M257-A275 PolarHBondContact O-N 3.39Å; D259-A275 HydrophobicContact CB-CB 3.64Å; H273-A275 PolarHBondContact O-N 3.07Å; A275-T277 VanDerWaalsContact C-N 3.29Å; A275-T277 PolarHBondContact O-N 2.8Å
276	G	86.2	Confident	96.1	Very high	21 Å²	21	19.4 Å²	19.4	22%	0.216	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	16	178.3	0	0	0	0	0	115.1	R274 Y300	R274-G276 PolarHBondContact O-N 3.38Å; G276-Y300 WeakPolarHBondContact O-CD2 3.38Å; G276-Y300 WeakPolarHBondContact O-CE2 3.3Å
277	T	92.9	Very high	96	Very high	31 Å²	31	21.8 Å²	21.8	19%	0.19	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.9	154.8	-178.7	74.5	0	0	0	0	113	H273 R274 A275 K279 Y300	H273-T277 PolarHBondContact CD2-O 2.82Å; H273-T277 PolarHBondContact NE2-O 2.86Å; H273-T277 VanDerWaalsContact NE2-O 3.1Å; R274-T277 HydrophobicContact CG-CG2 4.28Å; R274-T277 WeakPolarHBondContact CG-OG1 3.08Å; R274-T277 PolarHBondContact O-N 2.8Å; R274-T277 VanDerWaalsContact O-N 3.16Å; R274-T277 PolarHBondContact O-OG1 2.91Å; A275-T277 VanDerWaalsContact C-N 3.29Å; A275-T277 PolarHBondContact O-N 2.8Å; T277-K279 PolarHBondContact O-N 2.82Å; T277-K279 WeakPolarHBondContact OG1-CB 3.46Å; T277-K279 PolarHBondContact OG1-N 2.84Å; T277-Y300 WeakPolarHBondContact O-CB 3.36Å
278	S	95.6	Very high	96.1	Very high	26 Å²	26	20.9 Å²	20.9	18%	0.182	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	28.7	171.9	61.4	0	0	0	0	113.9	S294 I295 Y300	S278-S294 CarbonylContact O-C 3.54Å; S278-S294 WeakPolarHBondContact O-CA 3.4Å; S278-S294 PolarHBondContact OG-OG 2.74Å; S278-I295 PolarHBondContact O-N 3.31Å; S278-Y300 VanDerWaalsContact N-CD1 3.29Å
279	K	97.1	Very high	96.1	Very high	66 Å²	66	25.8 Å²	25.8	29%	0.287	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.3	-172.4	-56.1	174.7	-179.5	-179.7	0	112	R274 T277 E292 R293	R274-K279 HydrophobicContact CB-CB 4.1Å; R274-K279 PolarHBondContact N-O 2.85Å; T277-K279 PolarHBondContact O-N 2.82Å; T277-K279 WeakPolarHBondContact OG1-CB 3.46Å; T277-K279 PolarHBondContact OG1-N 2.84Å; K279-E292 WeakPolarHBondContact CD-OE1 3.44Å; K279-E292 WeakPolarHBondContact CE-OE1 3.23Å; K279-E292 IonicContact NZ-OE1 3.51Å; K279-E292 PolarHBondContact NZ-OE1 3.37Å; K279-E292 IonicContact NZ-OE2 2.67Å; K279-R293 VanDerWaalsContact CA-O 3.31Å; K279-R293 WeakPolarHBondContact CA-O 3.18Å
280	I	98.1	Very high	96.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	145.6	159.2	54.3	166.8	0	0	0	109.4	E292 R293 I295 F314 F316 I325 V340 L345 L347	I280-E292 CarbonylContact O-C 3.54Å; I280-E292 VanDerWaalsContact O-CA 3.28Å; I280-E292 WeakPolarHBondContact O-CA 3.31Å; I280-R293 HydrophobicContact CG1-CB 4.19Å; I280-R293 WeakPolarHBondContact CG1-O 3.48Å; I280-R293 PolarHBondContact N-O 2.92Å; I280-R293 PolarHBondContact O-N 2.8Å; I280-I295 HydrophobicContact CD1-CD1 4.11Å; I280-I295 HydrophobicContact CG1-CD1 4.18Å; I280-I295 HydrophobicContact CG1-CG1 4.26Å; I280-I295 HydrophobicContact CG2-CD1 3.92Å; I280-F314 HydrophobicContact CG2-CD1 4.15Å; I280-F316 HydrophobicContact CB-CE1 4.19Å; I280-F316 HydrophobicContact CB-CZ 3.7Å; I280-F316 HydrophobicContact CG2-CE1 4.09Å; I280-F316 HydrophobicContact CG2-CE2 4.2Å; I280-F316 HydrophobicContact CG2-CZ 3.48Å; I280-F316 VanDerWaalsContact CG2-CZ 3.48Å; I280-I325 HydrophobicContact CG2-CD1 4.17Å; I280-I325 HydrophobicContact CG2-CG1 4.13Å; I280-V340 HydrophobicContact CD1-CG1 3.95Å; I280-L345 HydrophobicContact CD1-CB 3.95Å; I280-L345 HydrophobicContact CD1-CD1 4.46Å; I280-L345 HydrophobicContact CD1-CD2 4.45Å; I280-L345 HydrophobicContact CG1-CB 4.38Å; I280-L345 HydrophobicContact CG1-CD1 4.28Å; I280-L347 HydrophobicContact CD1-CD2 4.44Å
281	A	98.1	Very high	96	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.4	-176.4	0	0	0	0	0	111.5	Y271 Y272 R274 Y290 V291 E292	Y271-A281 CarbonylContact C-O 3.56Å; Y271-A281 VanDerWaalsContact CA-O 3.29Å; Y271-A281 WeakPolarHBondContact CA-O 3.24Å; Y272-A281 HydrophobicContact CD1-CB 4.35Å; Y272-A281 HydrophobicContact CD2-CB 4.33Å; Y272-A281 HydrophobicContact CE1-CB 4.09Å; Y272-A281 HydrophobicContact CE2-CB 4.08Å; Y272-A281 HydrophobicContact CG-CB 4.49Å; Y272-A281 PolarHBondContact N-O 2.96Å; Y272-A281 PolarHBondContact O-N 2.82Å; R274-A281 HydrophobicContact CB-CB 4.38Å; A281-Y290 HydrophobicContact CB-CE2 3.75Å; A281-V291 CarbonylContact C-O 3.52Å; A281-V291 WeakPolarHBondContact CA-O 3.36Å; A281-E292 HydrophobicContact CB-CB 4.37Å
282	K	98.4	Very high	96	Very high	33 Å²	33	33.9 Å²	33.9	14%	0.143	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.9	175.3	173.6	-169.7	171.6	-175.4	0	108.6	S269 L270 Y271 Y290 V291 M342 Q343 L345	S269-K282 WeakPolarHBondContact OG-CE 3.3Å; L270-K282 CarbonylContact O-C 3.58Å; L270-K282 VanDerWaalsContact O-CA 3.3Å; L270-K282 WeakPolarHBondContact O-CA 3.5Å; Y271-K282 HydrophobicContact CD1-CB 3.99Å; Y271-K282 HydrophobicContact CD1-CD 4.46Å; Y271-K282 HydrophobicContact CD1-CG 4.06Å; Y271-K282 HydrophobicContact CE1-CB 4.04Å; Y271-K282 HydrophobicContact CE1-CD 3.67Å; Y271-K282 HydrophobicContact CE1-CG 3.69Å; K282-Y290 WeakPolarHBondContact O-CA 3.17Å; K282-V291 HydrophobicContact CB-CB 4.5Å; K282-V291 PolarHBondContact N-O 2.78Å; K282-V291 PolarHBondContact O-N 3.23Å; K282-M342 WeakPolarHBondContact CE-O 3.22Å; K282-M342 PolarHBondContact NZ-O 2.74Å; K282-Q343 PolarHBondContact NZ-O 3.48Å; K282-L345 HydrophobicContact CB-CD1 3.96Å; K282-L345 HydrophobicContact CB-CD2 4.2Å; K282-L345 HydrophobicContact CB-CG 4.34Å
283	Y	98.3	Very high	96	Very high	37 Å²	37	38.4 Å²	38.4	15%	0.145	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.5	174.8	-178.5	-113.6	0	0	0	111.8	I252 L254 P255 S269 L270 I285 G288 D289 Y290	I252-Y283 HydrophobicContact CG2-CE1 3.86Å; L254-Y283 HydrophobicContact CD2-CD1 3.47Å; L254-Y283 VanDerWaalsContact CD2-CD1 3.47Å; L254-Y283 HydrophobicContact CD2-CE1 4.14Å; L254-Y283 HydrophobicContact CD2-CG 4.13Å; P255-Y283 VanDerWaalsContact CD-CD2 3.47Å; P255-Y283 HydrophobicContact CG-CD2 3.57Å; P255-Y283 HydrophobicContact CG-CE2 3.6Å; P255-Y283 HydrophobicContact CG-CG 4.36Å; S269-Y283 CarbonylContact C-O 3.58Å; S269-Y283 VanDerWaalsContact CA-O 3.25Å; S269-Y283 WeakPolarHBondContact CA-O 3.37Å; L270-Y283 PolarHBondContact N-O 3.24Å; L270-Y283 PolarHBondContact O-N 3.3Å; Y283-I285 HydrophobicContact CD1-CG2 4.37Å; Y283-G288 WeakPolarHBondContact CE2-O 3.4Å; Y283-D289 WeakPolarHBondContact CA-O 3.26Å; Y283-Y290 HydrophobicContact CD2-CD2 4.47Å
284	D	97.7	Very high	96	Very high	9 Å²	9	41 Å²	41	5%	0.048	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.1	179.9	-169.3	-58.5	0	0	0	111.8	R215 Y286 T287 G288 D289	R215-D284 IonicContact CZ-OD2 3.39Å; R215-D284 IonicContact NH1-OD1 2.7Å; R215-D284 PolarHBondContact NH1-OD1 3.4Å; R215-D284 IonicContact NH1-OD2 2.67Å; R215-D284 PolarHBondContact NH1-OD2 2.96Å; R215-D284 IonicContact NH2-OD2 2.83Å; R215-D284 PolarHBondContact NH2-OD2 2.83Å; D284-Y286 PolarHBondContact O-N 2.76Å; D284-Y286 WeakPolarHBondContact OD1-CA 3.47Å; D284-Y286 WeakPolarHBondContact OD1-CB 3.47Å; D284-Y286 PolarHBondContact OD1-N 3.01Å; D284-T287 VanDerWaalsContact CB-OG1 3.3Å; D284-T287 WeakPolarHBondContact CB-OG1 3.43Å; D284-T287 PolarHBondContact OD1-N 3.16Å; D284-T287 PolarHBondContact OD1-OG1 3.39Å; D284-G288 VanDerWaalsContact O-CA 3.29Å; D284-G288 WeakPolarHBondContact O-CA 3.3Å; D284-G288 PolarHBondContact O-N 3.39Å; D284-D289 HydrophobicContact CB-CB 4.24Å; D284-D289 PolarHBondContact N-O 3.36Å
285	I	96.4	Very high	96.1	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.041	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	1.7	-174.1	74.4	167.2	0	0	0	114.5	L234 R250 I252 F265 G268 Y283	L234-I285 HydrophobicContact CD2-CG2 4.11Å; R250-I285 PolarHBondContact NH1-O 3Å; I252-I285 HydrophobicContact CD1-CB 4.12Å; I252-I285 HydrophobicContact CD1-CD1 4.06Å; I252-I285 HydrophobicContact CD1-CG2 4.07Å; I252-I285 HydrophobicContact CG2-CG2 4.3Å; F265-I285 HydrophobicContact CE2-CD1 4.33Å; F265-I285 HydrophobicContact CE2-CG2 4.23Å; F265-I285 HydrophobicContact CZ-CD1 3.74Å; F265-I285 HydrophobicContact CZ-CG1 4.3Å; G268-I285 WeakPolarHBondContact O-CG1 3.3Å; G268-I285 PolarHBondContact O-N 3.42Å; Y283-I285 HydrophobicContact CD1-CG2 4.37Å
286	Y	94.9	Very high	96.4	Very high	52 Å²	52	47.7 Å²	47.7	20%	0.204	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-35.6	179.9	-59.1	-54.1	0	0	0	113.5	D219 D284	D219-Y286 PolarHBondContact OD1-OH 3.23Å; D219-Y286 PolarHBondContact OD2-OH 2.94Å; D284-Y286 PolarHBondContact O-N 2.76Å; D284-Y286 WeakPolarHBondContact OD1-CA 3.47Å; D284-Y286 WeakPolarHBondContact OD1-CB 3.47Å; D284-Y286 PolarHBondContact OD1-N 3.01Å
287	T	95.9	Very high	96.8	Very high	83 Å²	83	52.4 Å²	52.4	51%	0.509	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-26.6	175.3	61.6	0	0	0	0	113	D284 D289	D284-T287 VanDerWaalsContact CB-OG1 3.3Å; D284-T287 WeakPolarHBondContact CB-OG1 3.43Å; D284-T287 PolarHBondContact OD1-N 3.16Å; D284-T287 PolarHBondContact OD1-OG1 3.39Å; T287-D289 VanDerWaalsContact C-N 3.3Å; T287-D289 WeakPolarHBondContact CB-OD2 3.16Å; T287-D289 WeakPolarHBondContact OG1-CB 3.13Å; T287-D289 PolarHBondContact OG1-N 2.87Å; T287-D289 PolarHBondContact OG1-OD2 3.36Å
288	G	95.9	Very high	97	Very high	39 Å²	39	51 Å²	51	40%	0.402	26%	0.261	S	S	.	.			trans	81	7	-169.5	0	0	0	0	0	113.9	Y283 D284	Y283-G288 WeakPolarHBondContact CE2-O 3.4Å; D284-G288 VanDerWaalsContact O-CA 3.29Å; D284-G288 WeakPolarHBondContact O-CA 3.3Å; D284-G288 PolarHBondContact O-N 3.39Å
289	D	96.8	Very high	97.1	Very high	103 Å²	103	49.7 Å²	49.7	55%	0.551	25%	0.253	S	S	*	.			trans	-64.1	136.1	177.8	-65.8	-48.3	0	0	0	111	Y283 D284 T287	Y283-D289 WeakPolarHBondContact CA-O 3.26Å; D284-D289 HydrophobicContact CB-CB 4.24Å; D284-D289 PolarHBondContact N-O 3.36Å; T287-D289 VanDerWaalsContact C-N 3.3Å; T287-D289 WeakPolarHBondContact CB-OD2 3.16Å; T287-D289 WeakPolarHBondContact OG1-CB 3.13Å; T287-D289 PolarHBondContact OG1-N 2.87Å; T287-D289 PolarHBondContact OG1-OD2 3.36Å
290	Y	97.7	Very high	96.9	Very high	57 Å²	57	49.4 Å²	49.4	22%	0.224	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.1	177.2	176.9	-96	0	0	0	110.1	P255 Y256 Y272 A281 K282 Y283 E292	P255-Y290 HydrophobicContact CB-CD2 4.13Å; P255-Y290 HydrophobicContact CB-CE2 4.48Å; P255-Y290 HydrophobicContact CB-CG 4.41Å; P255-Y290 HydrophobicContact CG-CD2 3.78Å; P255-Y290 HydrophobicContact CG-CG 4.1Å; Y256-Y290 AromaticContact CD2-CE1 3.98Å; Y256-Y290 HydrophobicContact CD2-CE1 3.98Å; Y256-Y290 AromaticContact CD2-CE2 3.88Å; Y256-Y290 HydrophobicContact CD2-CE2 3.88Å; Y256-Y290 AromaticContact CD2-CZ 3.49Å; Y256-Y290 VanDerWaalsContact CD2-CZ 3.49Å; Y256-Y290 WeakPolarHBondContact CD2-OH 3.07Å; Y256-Y290 HydrophobicContact CE2-CD1 4.28Å; Y256-Y290 AromaticContact CE2-CE1 3.63Å; Y256-Y290 HydrophobicContact CE2-CE1 3.63Å; Y256-Y290 HydrophobicContact CE2-CE2 4.33Å; Y256-Y290 AromaticContact CE2-CZ 3.66Å; Y272-Y290 WeakPolarHBondContact OH-CE2 3.36Å; A281-Y290 HydrophobicContact CB-CE2 3.75Å; K282-Y290 WeakPolarHBondContact O-CA 3.17Å; Y283-Y290 HydrophobicContact CD2-CD2 4.47Å; Y290-E292 HydrophobicContact CE1-CB 3.85Å; Y290-E292 HydrophobicContact CE1-CG 3.68Å; Y290-E292 WeakPolarHBondContact CE1-OE2 3.47Å; Y290-E292 PolarHBondContact OH-OE2 2.87Å
291	V	97.6	Very high	96.4	Very high	51 Å²	51	51.9 Å²	51.9	31%	0.309	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	137.9	176.7	-179.4	0	0	0	0	108.2	A281 K282 L345	A281-V291 CarbonylContact C-O 3.52Å; A281-V291 WeakPolarHBondContact CA-O 3.36Å; K282-V291 HydrophobicContact CB-CB 4.5Å; K282-V291 PolarHBondContact N-O 2.78Å; K282-V291 PolarHBondContact O-N 3.23Å; V291-L345 HydrophobicContact CG1-CD1 4.4Å; V291-L345 HydrophobicContact CG1-CG 4.42Å
292	E	97.7	Very high	95.8	Very high	68 Å²	68	56.4 Å²	56.4	32%	0.318	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	151.2	175.4	58.1	169.1	-134.1	0	0	112	K279 I280 A281 Y290	K279-E292 WeakPolarHBondContact CD-OE1 3.44Å; K279-E292 WeakPolarHBondContact CE-OE1 3.23Å; K279-E292 IonicContact NZ-OE1 3.51Å; K279-E292 PolarHBondContact NZ-OE1 3.37Å; K279-E292 IonicContact NZ-OE2 2.67Å; I280-E292 CarbonylContact O-C 3.54Å; I280-E292 VanDerWaalsContact O-CA 3.28Å; I280-E292 WeakPolarHBondContact O-CA 3.31Å; A281-E292 HydrophobicContact CB-CB 4.37Å; Y290-E292 HydrophobicContact CE1-CB 3.85Å; Y290-E292 HydrophobicContact CE1-CG 3.68Å; Y290-E292 WeakPolarHBondContact CE1-OE2 3.47Å; Y290-E292 PolarHBondContact OH-OE2 2.87Å
293	R	97.8	Very high	95.1	Very high	95 Å²	95	58.8 Å²	58.8	36%	0.358	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	125	178.3	-179.3	54	162.1	-85.5	-6.6	110.7	K279 I280 L345 N346	K279-R293 VanDerWaalsContact CA-O 3.31Å; K279-R293 WeakPolarHBondContact CA-O 3.18Å; I280-R293 HydrophobicContact CG1-CB 4.19Å; I280-R293 WeakPolarHBondContact CG1-O 3.48Å; I280-R293 PolarHBondContact N-O 2.92Å; I280-R293 PolarHBondContact O-N 2.8Å; R293-L345 HydrophobicContact CB-CB 3.72Å; R293-L345 WeakPolarHBondContact CG-O 3.06Å; R293-N346 PolarHBondContact NH1-OD1 3.16Å; R293-N346 PolarHBondContact NH2-OD1 2.74Å
294	S	97.6	Very high	94.8	Very high	57 Å²	57	58.7 Å²	58.7	40%	0.399	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.4	169.1	-174.4	0	0	0	0	110.8	S278	S278-S294 CarbonylContact O-C 3.54Å; S278-S294 WeakPolarHBondContact O-CA 3.4Å; S278-S294 PolarHBondContact OG-OG 2.74Å
295	I	97.8	Very high	94.7	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.015	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-93.5	121.9	169.3	-58.6	-172.2	0	0	0	107.5	S278 I280 A298 F314 I325 Y327 L347	S278-I295 PolarHBondContact O-N 3.31Å; I280-I295 HydrophobicContact CD1-CD1 4.11Å; I280-I295 HydrophobicContact CG1-CD1 4.18Å; I280-I295 HydrophobicContact CG1-CG1 4.26Å; I280-I295 HydrophobicContact CG2-CD1 3.92Å; I295-A298 HydrophobicContact CB-CB 3.98Å; I295-A298 HydrophobicContact CG2-CB 3.75Å; I295-F314 HydrophobicContact CB-CE1 4.45Å; I295-F314 HydrophobicContact CD1-CD1 4.38Å; I295-F314 HydrophobicContact CD1-CE1 4.02Å; I295-I325 HydrophobicContact CD1-CG1 4.47Å; I295-I325 HydrophobicContact CD1-CG2 4.09Å; I295-Y327 HydrophobicContact CD1-CE1 4.38Å; I295-Y327 HydrophobicContact CG2-CD2 4.33Å; I295-Y327 HydrophobicContact CG2-CE1 4.31Å; I295-Y327 HydrophobicContact CG2-CE2 3.65Å; I295-L347 HydrophobicContact CD1-CD1 4.26Å; I295-L347 HydrophobicContact CD1-CD2 4.09Å; I295-L347 HydrophobicContact CG1-CD1 4.15Å; I295-L347 HydrophobicContact CG1-CD2 4.44Å; I295-L347 HydrophobicContact CG2-CD1 4.03Å
296	Q	95.5	Very high	94.7	Very high	163 Å²	163	58.4 Å²	58.4	76%	0.762	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	144.8	-179.3	-67.6	-175.1	-8.3	0	0	111	A298	Q296-A298 PolarHBondContact O-N 3.34Å
297	M	95.2	Very high	94.8	Very high	120 Å²	120	56 Å²	56	59%	0.591	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	-6.2	-179.5	-50.1	-175.8	-61.1	0	0	116.6	Y329 W330	M297-Y329 HydrophobicContact CB-CD1 3.67Å; M297-Y329 HydrophobicContact CB-CE1 4.09Å; M297-Y329 HydrophobicContact CB-CG 4.24Å; M297-Y329 HydrophobicContact CE-CD1 4.36Å; M297-Y329 HydrophobicContact CE-CE1 3.9Å; M297-Y329 HydrophobicContact CE-CE2 4.14Å; M297-Y329 CarbonylContact O-C 3.59Å; M297-Y329 VanDerWaalsContact O-CA 3.25Å; M297-Y329 WeakPolarHBondContact O-CA 3.36Å; M297-W330 PolarHBondContact O-N 3.29Å
298	A	97.6	Very high	94.7	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-63.8	139.2	176.3	0	0	0	0	0	111.6	I295 Q296 F314 Y327 R328 W330	I295-A298 HydrophobicContact CB-CB 3.98Å; I295-A298 HydrophobicContact CG2-CB 3.75Å; Q296-A298 PolarHBondContact O-N 3.34Å; A298-F314 HydrophobicContact CB-CE1 3.7Å; A298-F314 HydrophobicContact CB-CZ 3.66Å; A298-Y327 HydrophobicContact CB-CD2 3.67Å; A298-Y327 HydrophobicContact CB-CE2 3.96Å; A298-R328 WeakPolarHBondContact CA-O 3.32Å; A298-W330 PolarHBondContact O-NE1 2.66Å
299	A	96.5	Very high	94.5	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.257	C	S	.	.			trans	-88.9	146.9	176.4	0	0	0	0	0	111.7	H304 R328 W330	A299-H304 HydrophobicContact CB-CB 3.49Å; A299-H304 VanDerWaalsContact CB-CB 3.49Å; A299-R328 PolarHBondContact N-O 3.26Å; A299-W330 HydrophobicContact CB-CD2 3.76Å; A299-W330 HydrophobicContact CB-CE3 3.85Å; A299-W330 HydrophobicContact CB-CG 4.27Å; A299-W330 HydrophobicContact CB-CH2 4.09Å; A299-W330 HydrophobicContact CB-CZ2 4.04Å; A299-W330 HydrophobicContact CB-CZ3 4Å
300	Y	92.8	Very high	94.1	Very high	60 Å²	60	54.7 Å²	54.7	24%	0.235	25%	0.251	C	S	.	.			trans	-152.4	7.1	-168.7	62.7	-95.9	0	0	0	114.5	G276 T277 S278 W330	G276-Y300 WeakPolarHBondContact O-CD2 3.38Å; G276-Y300 WeakPolarHBondContact O-CE2 3.3Å; T277-Y300 WeakPolarHBondContact O-CB 3.36Å; S278-Y300 VanDerWaalsContact N-CD1 3.29Å; Y300-W330 AromaticContact CD1-CZ2 3.63Å; Y300-W330 HydrophobicContact CD1-CZ2 3.63Å; Y300-W330 AromaticContact CE1-CZ2 3.62Å; Y300-W330 HydrophobicContact CE1-CZ2 3.62Å; Y300-W330 HydrophobicContact CG-CZ2 4.24Å
301	K	87.4	Confident	93.6	Very high	52 Å²	52	52.4 Å²	52.4	23%	0.226	24%	0.242	C	C	.	.	S	Bend	trans	-153.9	169.2	174.4	83.3	-120.6	-162.9	71.2	0	111.2	E39 Y313 W330	E39-K301 IonicContact OE1-NZ 3.41Å; E39-K301 PolarHBondContact OE1-NZ 3.48Å; K301-Y313 WeakPolarHBondContact CA-OH 2.94Å; K301-W330 HydrophobicContact CD-CH2 3.9Å; K301-W330 HydrophobicContact CD-CZ2 4.36Å; K301-W330 HydrophobicContact CG-CH2 3.96Å
302	Y	85.6	Confident	93.4	Very high	94 Å²	94	50 Å²	50	37%	0.369	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	-162.2	-177.4	-47.5	-39.7	0	0	0	112.2	E35 E39 H304 Y313	E35-Y302 VanDerWaalsContact OE1-CA 3.22Å; E35-Y302 WeakPolarHBondContact OE1-CA 3.25Å; E39-Y302 WeakPolarHBondContact OE1-CE1 3.22Å; E39-Y302 PolarHBondContact OE1-OH 2.8Å; Y302-H304 PolarHBondContact O-N 3.36Å; Y302-Y313 PolarHBondContact N-OH 3.14Å; Y302-Y313 WeakPolarHBondContact O-CE1 3.43Å; Y302-Y313 PolarHBondContact O-OH 3.37Å; Y302-Y313 VanDerWaalsContact O-OH 3.07Å
303	D	85.3	Confident	93.4	Very high	83 Å²	83	47.1 Å²	47.1	44%	0.444	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	8.1	-176.3	77.7	-56.5	0	0	0	114.8	Y305	D303-Y305 PolarHBondContact O-N 3.26Å; D303-Y305 VanDerWaalsContact O-N 3.08Å
304	H	91.6	Very high	93.4	Very high	35 Å²	35	42.7 Å²	42.7	16%	0.162	20%	0.197	C	C	.	.			trans	-80.6	22.8	-172.7	-64.5	61.5	0	0	0	116.3	A299 Y302 R328 W330 N331	A299-H304 HydrophobicContact CB-CB 3.49Å; A299-H304 VanDerWaalsContact CB-CB 3.49Å; Y302-H304 PolarHBondContact O-N 3.36Å; H304-R328 VanDerWaalsContact CA-NH2 3.29Å; H304-R328 PolarHBondContact CD2-NH2 2.79Å; H304-R328 PolarHBondContact O-NE 2.94Å; H304-W330 HydrophobicContact CB-CE3 4.5Å; H304-W330 HydrophobicContact CB-CZ3 4.14Å; H304-W330 AromaticContact CD2-CE3 3.49Å; H304-W330 VanDerWaalsContact CD2-CE3 3.49Å; H304-W330 AromaticContact CD2-CZ3 3.82Å; H304-W330 AromaticContact CG-CE3 3.85Å; H304-W330 AromaticContact CG-CZ3 3.68Å; H304-W330 AromaticContact ND1-CZ3 3.91Å; H304-N331 PolarHBondContact CD2-N 3.23Å; H304-N331 WeakPolarHBondContact NE2-CA 3.23Å; H304-N331 PolarHBondContact NE2-N 2.93Å; H304-N331 VanDerWaalsContact NE2-N 3.14Å; H304-N331 PolarHBondContact NE2-OD1 2.8Å
305	Y	94.6	Very high	93.4	Very high	11 Å²	11	40.2 Å²	40.2	4%	0.043	18%	0.179	C	C	.	.			trans	-46.5	151.5	170.2	-58.4	-77.7	0	0	0	113.3	I31 D303 Y307 R310 N312 Y313 R328 R358	I31-Y305 VanDerWaalsContact CG2-OH 3.31Å; I31-Y305 WeakPolarHBondContact CG2-OH 3.46Å; D303-Y305 PolarHBondContact O-N 3.26Å; D303-Y305 VanDerWaalsContact O-N 3.08Å; Y305-Y307 VanDerWaalsContact C-N 3.33Å; Y305-Y307 PolarHBondContact O-N 2.93Å; Y305-R310 HydrophobicContact CD2-CB 3.91Å; Y305-R310 HydrophobicContact CD2-CG 3.82Å; Y305-R310 VanDerWaalsContact CE1-C 3.49Å; Y305-R310 HydrophobicContact CE1-CB 4.43Å; Y305-R310 HydrophobicContact CE2-CB 3.63Å; Y305-R310 HydrophobicContact CE2-CG 3.75Å; Y305-R310 HydrophobicContact CG-CB 4.42Å; Y305-N312 CarbonylContact C-O 3.24Å; Y305-N312 VanDerWaalsContact CA-O 3.3Å; Y305-N312 WeakPolarHBondContact CA-O 3.36Å; Y305-N312 WeakPolarHBondContact CB-O 3.46Å; Y305-Y313 HydrophobicContact CD1-CD1 4.25Å; Y305-Y313 AromaticContact CD1-CE1 3.96Å; Y305-Y313 HydrophobicContact CD1-CE1 3.96Å; Y305-Y313 HydrophobicContact CD1-CE2 4.27Å; Y305-Y313 AromaticContact CD1-CZ 3.98Å; Y305-Y313 HydrophobicContact CE1-CE1 4.08Å; Y305-Y313 AromaticContact CE1-CE2 3.88Å; Y305-Y313 HydrophobicContact CE1-CE2 3.88Å; Y305-Y313 AromaticContact CE1-CZ 3.63Å; Y305-Y313 HydrophobicContact CG-CE1 4.32Å; Y305-R328 PolarHBondContact O-NE 3.1Å; Y305-R358 VanDerWaalsContact O-CD 3.26Å; Y305-R358 WeakPolarHBondContact O-CD 3.34Å; Y305-R358 PolarHBondContact O-NE 2.97Å
306	V	96.7	Very high	93.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-69.3	-28.8	-178	68.1	0	0	0	0	112.9	N312 I326 L335 R358	V306-N312 HydrophobicContact CG1-CB 4.01Å; V306-N312 WeakPolarHBondContact CG1-O 3.36Å; V306-N312 PolarHBondContact N-O 2.85Å; V306-I326 HydrophobicContact CG2-CG2 4.02Å; V306-L335 HydrophobicContact CG2-CD2 3.88Å; V306-L335 WeakPolarHBondContact O-CD2 3.23Å; V306-R358 VanDerWaalsContact O-CB 3.32Å; V306-R358 WeakPolarHBondContact O-CB 3.09Å; V306-R358 WeakPolarHBondContact O-CD 3.35Å
307	Y	96.4	Very high	93.6	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	15%	0.145	C	C	.	.	S	Bend	trans	-123.3	-177.9	-177	-59.4	-37.6	0	0	0	112.5	Y305 T309 D315 I326 L335 R358 V361 E363 S364	Y305-Y307 VanDerWaalsContact C-N 3.33Å; Y305-Y307 PolarHBondContact O-N 2.93Å; Y307-T309 WeakPolarHBondContact CB-OG1 3.2Å; Y307-T309 PolarHBondContact O-N 2.82Å; Y307-D315 HydrophobicContact CE2-CB 4.21Å; Y307-D315 PolarHBondContact OH-OD2 3Å; Y307-I326 HydrophobicContact CE1-CG2 4.38Å; Y307-I326 WeakPolarHBondContact OH-CG2 3.41Å; Y307-L335 HydrophobicContact CD1-CD2 4.01Å; Y307-L335 HydrophobicContact CE1-CD1 3.99Å; Y307-L335 HydrophobicContact CE1-CD2 3.86Å; Y307-R358 CarbonylContact C-O 3.59Å; Y307-R358 WeakPolarHBondContact O-CD 3.31Å; Y307-R358 VanDerWaalsContact O-CZ 3.32Å; Y307-R358 PolarHBondContact O-NE 2.77Å; Y307-R358 PolarHBondContact O-NH1 2.91Å; Y307-V361 HydrophobicContact CD1-CB 3.96Å; Y307-V361 HydrophobicContact CD1-CG1 3.46Å; Y307-V361 VanDerWaalsContact CD1-CG1 3.46Å; Y307-V361 HydrophobicContact CE1-CG1 3.76Å; Y307-V361 HydrophobicContact CG-CG1 4.11Å; Y307-E363 VanDerWaalsContact CE2-OE2 3.26Å; Y307-E363 WeakPolarHBondContact CE2-OE2 3.39Å; Y307-S364 VanDerWaalsContact OH-CB 3.23Å; Y307-S364 WeakPolarHBondContact OH-CB 3.28Å; Y307-S364 PolarHBondContact OH-OG 2.89Å
308	K	94.7	Very high	93.7	Very high	81 Å²	81	27.5 Å²	27.5	35%	0.352	12%	0.12	S	C	.	.	S	Bend	trans	-70.5	-14	170.9	88.8	-168	-160.7	-173	0	112.7	R358 S359 V361 A362 D375 D376	K308-R358 PolarHBondContact N-O 3.04Å; K308-S359 VanDerWaalsContact CD-O 3.32Å; K308-S359 WeakPolarHBondContact CD-O 3.36Å; K308-V361 WeakPolarHBondContact CB-O 3.05Å; K308-V361 WeakPolarHBondContact CG-O 3.31Å; K308-V361 PolarHBondContact N-O 2.72Å; K308-A362 HydrophobicContact CD-CB 4.23Å; K308-A362 HydrophobicContact CG-CB 4.21Å; K308-D375 WeakPolarHBondContact CE-O 3.49Å; K308-D375 PolarHBondContact NZ-O 3.48Å; K308-D376 WeakPolarHBondContact CE-OD2 3.44Å; K308-D376 IonicContact NZ-OD2 3.88Å; K308-D376 PolarHBondContact NZ-OD2 2.98Å
309	T	91.6	Very high	93.6	Very high	6 Å²	6	27.9 Å²	27.9	4%	0.037	12%	0.122	C	C	.	.	S	Bend	trans	-85.6	131.9	172.3	44.9	0	0	0	0	110.6	Y307 F311 A362 T377	Y307-T309 WeakPolarHBondContact CB-OG1 3.2Å; Y307-T309 PolarHBondContact O-N 2.82Å; T309-F311 VanDerWaalsContact C-N 3.27Å; T309-F311 HydrophobicContact CG2-CD2 4.41Å; T309-F311 HydrophobicContact CG2-CE2 4.26Å; T309-F311 PolarHBondContact O-N 3.24Å; T309-F311 VanDerWaalsContact O-N 3.11Å; T309-A362 HydrophobicContact CG2-CB 4.18Å; T309-A362 WeakPolarHBondContact CG2-O 3.4Å; T309-A362 PolarHBondContact OG1-O 2.84Å; T309-T377 WeakPolarHBondContact CG2-OG1 3.33Å
310	R	88.9	Confident	93.5	Very high	111 Å²	111	29.5 Å²	29.5	42%	0.419	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	53.4	-175.6	-66.4	179.8	166.7	164.7	-13.5	112.4	E28 I31 Y305	E28-R310 IonicContact OE1-CZ 3.37Å; E28-R310 IonicContact OE1-NH1 3.37Å; E28-R310 PolarHBondContact OE1-NH1 2.88Å; E28-R310 IonicContact OE2-CZ 3.21Å; E28-R310 IonicContact OE2-NH1 2.82Å; E28-R310 PolarHBondContact OE2-NH1 3.17Å; I31-R310 HydrophobicContact CD1-CB 3.86Å; Y305-R310 HydrophobicContact CD2-CB 3.91Å; Y305-R310 HydrophobicContact CD2-CG 3.82Å; Y305-R310 VanDerWaalsContact CE1-C 3.49Å; Y305-R310 HydrophobicContact CE1-CB 4.43Å; Y305-R310 HydrophobicContact CE2-CB 3.63Å; Y305-R310 HydrophobicContact CE2-CG 3.75Å; Y305-R310 HydrophobicContact CG-CB 4.42Å
311	F	86.3	Confident	93.6	Very high	9 Å²	9	27.2 Å²	27.2	4%	0.039	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-39	-175.5	-52.7	-46.6	0	0	0	113.6	Y205 G260 T309 N410	Y205-F311 HydrophobicContact CD1-CD1 4.38Å; Y205-F311 HydrophobicContact CD1-CE1 4.18Å; Y205-F311 HydrophobicContact CE1-CD1 4.08Å; Y205-F311 AromaticContact CE1-CE1 3.45Å; Y205-F311 HydrophobicContact CE1-CE1 3.45Å; Y205-F311 VanDerWaalsContact CE1-CE1 3.45Å; Y205-F311 HydrophobicContact CE1-CE2 4.33Å; Y205-F311 AromaticContact CE1-CZ 3.61Å; Y205-F311 HydrophobicContact CE1-CZ 3.61Å; G260-F311 WeakPolarHBondContact CA-O 3.3Å; T309-F311 VanDerWaalsContact C-N 3.27Å; T309-F311 HydrophobicContact CG2-CD2 4.41Å; T309-F311 HydrophobicContact CG2-CE2 4.26Å; T309-F311 PolarHBondContact O-N 3.24Å; T309-F311 VanDerWaalsContact O-N 3.11Å; F311-N410 HydrophobicContact CD2-CB 3.91Å; F311-N410 HydrophobicContact CE2-CB 4.11Å; F311-N410 HydrophobicContact CG-CB 4.49Å
312	N	94.7	Very high	94	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.011	12%	0.119	C	C	.	.			trans	-122.6	138.2	-171.6	-67.5	-55.8	0	0	0	112	G260 T261 S262 Y305 V306	G260-N312 WeakPolarHBondContact CA-OD1 3.37Å; T261-N312 PolarHBondContact N-OD1 2.9Å; T261-N312 PolarHBondContact OG1-ND2 3.29Å; T261-N312 PolarHBondContact OG1-OD1 2.78Å; S262-N312 PolarHBondContact N-OD1 3.1Å; S262-N312 PolarHBondContact OG-ND2 2.62Å; Y305-N312 CarbonylContact C-O 3.24Å; Y305-N312 VanDerWaalsContact CA-O 3.3Å; Y305-N312 WeakPolarHBondContact CA-O 3.36Å; Y305-N312 WeakPolarHBondContact CB-O 3.46Å; V306-N312 HydrophobicContact CG1-CB 4.01Å; V306-N312 WeakPolarHBondContact CG1-O 3.36Å; V306-N312 PolarHBondContact N-O 2.85Å
313	Y	96.3	Very high	94.5	Very high	6 Å²	6	21.1 Å²	21.1	2%	0.024	10%	0.101	C	C	.	.	S	Bend	trans	-96.8	-28.8	164.1	-62.4	-78.3	0	0	0	112.1	D259 H273 K301 Y302 Y305	D259-Y313 VanDerWaalsContact OD2-CE2 3.29Å; D259-Y313 WeakPolarHBondContact OD2-CE2 3.42Å; H273-Y313 AromaticContact CE1-CD2 3.72Å; K301-Y313 WeakPolarHBondContact CA-OH 2.94Å; Y302-Y313 PolarHBondContact N-OH 3.14Å; Y302-Y313 WeakPolarHBondContact O-CE1 3.43Å; Y302-Y313 PolarHBondContact O-OH 3.37Å; Y302-Y313 VanDerWaalsContact O-OH 3.07Å; Y305-Y313 HydrophobicContact CD1-CD1 4.25Å; Y305-Y313 AromaticContact CD1-CE1 3.96Å; Y305-Y313 HydrophobicContact CD1-CE1 3.96Å; Y305-Y313 HydrophobicContact CD1-CE2 4.27Å; Y305-Y313 AromaticContact CD1-CZ 3.98Å; Y305-Y313 HydrophobicContact CE1-CE1 4.08Å; Y305-Y313 AromaticContact CE1-CE2 3.88Å; Y305-Y313 HydrophobicContact CE1-CE2 3.88Å; Y305-Y313 AromaticContact CE1-CZ 3.63Å; Y305-Y313 HydrophobicContact CG-CE1 4.32Å
314	F	98	Very high	95.2	Very high	3 Å²	3	17.2 Å²	17.2	1%	0.013	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.4	176.4	-59.2	-97.7	0	0	0	108.6	H273 I280 I295 A298 I325 I326 Y327	H273-F314 HydrophobicContact CB-CB 4.15Å; H273-F314 HydrophobicContact CB-CD2 3.86Å; H273-F314 HydrophobicContact CB-CG 4.31Å; H273-F314 AromaticContact CD2-CD2 3.3Å; H273-F314 WeakPolarHBondContact CD2-CD2 3.41Å; H273-F314 AromaticContact CD2-CE2 3.34Å; H273-F314 WeakPolarHBondContact CD2-CE2 3.45Å; H273-F314 AromaticContact CG-CD2 3.47Å; H273-F314 VanDerWaalsContact CG-CD2 3.47Å; H273-F314 AromaticContact NE2-CD2 3.81Å; H273-F314 AromaticContact NE2-CE2 3.61Å; I280-F314 HydrophobicContact CG2-CD1 4.15Å; I295-F314 HydrophobicContact CB-CE1 4.45Å; I295-F314 HydrophobicContact CD1-CD1 4.38Å; I295-F314 HydrophobicContact CD1-CE1 4.02Å; A298-F314 HydrophobicContact CB-CE1 3.7Å; A298-F314 HydrophobicContact CB-CZ 3.66Å; F314-I325 HydrophobicContact CB-CD1 3.76Å; F314-I325 HydrophobicContact CB-CG1 4.3Å; F314-I325 HydrophobicContact CD1-CD1 4.36Å; F314-I325 HydrophobicContact CD1-CG1 4.03Å; F314-I326 CarbonylContact C-O 3.56Å; F314-I326 WeakPolarHBondContact CA-O 3.43Å; F314-Y327 HydrophobicContact CD1-CG 4.14Å; F314-Y327 HydrophobicContact CE1-CD2 4.46Å; F314-Y327 HydrophobicContact CE1-CG 4.2Å
315	D	98.2	Very high	95.5	Very high	4 Å²	4	15.5 Å²	15.5	2%	0.021	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	112.7	-179.3	166.5	22.8	0	0	0	109	S262 Y307 I325 I326 S364	S262-D315 VanDerWaalsContact CB-OD1 3.27Å; S262-D315 WeakPolarHBondContact CB-OD1 3.32Å; Y307-D315 HydrophobicContact CE2-CB 4.21Å; Y307-D315 PolarHBondContact OH-OD2 3Å; D315-I325 CarbonylContact O-C 3.54Å; D315-I325 WeakPolarHBondContact O-CA 3.41Å; D315-I325 WeakPolarHBondContact O-CD1 2.98Å; D315-I326 HydrophobicContact CB-CB 4.23Å; D315-I326 HydrophobicContact CB-CD1 4.5Å; D315-I326 PolarHBondContact N-O 3.37Å; D315-I326 WeakPolarHBondContact O-CD1 3.4Å; D315-I326 PolarHBondContact O-N 2.74Å; D315-S364 PolarHBondContact OD2-OG 3.23Å
316	F	98.4	Very high	95.7	Very high	3 Å²	3	15 Å²	15	1%	0.013	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	117.4	-179.2	-71.2	-99.7	0	0	0	111.1	S262 A264 Y272 I280 L323 W324 I325	S262-F316 WeakPolarHBondContact O-CD2 3.29Å; S262-F316 PolarHBondContact O-N 3.2Å; A264-F316 HydrophobicContact CB-CB 3.63Å; A264-F316 HydrophobicContact CB-CG 4.46Å; Y272-F316 WeakPolarHBondContact O-CZ 3.25Å; I280-F316 HydrophobicContact CB-CE1 4.19Å; I280-F316 HydrophobicContact CB-CZ 3.7Å; I280-F316 HydrophobicContact CG2-CE1 4.09Å; I280-F316 HydrophobicContact CG2-CE2 4.2Å; I280-F316 HydrophobicContact CG2-CZ 3.48Å; I280-F316 VanDerWaalsContact CG2-CZ 3.48Å; F316-L323 HydrophobicContact CD1-CD1 4.21Å; F316-W324 WeakPolarHBondContact CA-O 3.28Å; F316-I325 HydrophobicContact CB-CD1 4.36Å; F316-I325 HydrophobicContact CD1-CD1 3.68Å; F316-I325 HydrophobicContact CD2-CD1 3.48Å; F316-I325 VanDerWaalsContact CD2-CD1 3.48Å; F316-I325 HydrophobicContact CE1-CD1 3.8Å; F316-I325 HydrophobicContact CE2-CD1 3.59Å; F316-I325 HydrophobicContact CG-CD1 3.55Å; F316-I325 HydrophobicContact CZ-CD1 3.78Å
317	A	98.4	Very high	95.8	Very high	4 Å²	4	15.2 Å²	15.2	3%	0.033	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	143.1	174.1	0	0	0	0	0	111.9	W324 I326 I366	A317-W324 HydrophobicContact CB-CB 4.31Å; A317-W324 PolarHBondContact N-O 2.02Å; A317-W324 PolarHBondContact O-N 3.46Å; A317-I326 HydrophobicContact CB-CD1 4Å; A317-I366 HydrophobicContact CB-CB 4Å; A317-I366 HydrophobicContact CB-CD1 4.09Å; A317-I366 HydrophobicContact CB-CG1 4.03Å
318	L	97.4	Very high	95.8	Very high	13 Å²	13	15.3 Å²	15.3	7%	0.068	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.9	170.6	-75.7	166.9	0	0	0	109	A264 F266 L323 M342 Y414	A264-L318 HydrophobicContact CB-CD1 3.9Å; A264-L318 HydrophobicContact CB-CG 3.95Å; F266-L318 HydrophobicContact CB-CD1 3.94Å; F266-L318 HydrophobicContact CB-CD2 4.15Å; F266-L318 HydrophobicContact CD2-CD2 4.05Å; F266-L318 HydrophobicContact CG-CD2 4.33Å; L318-L323 HydrophobicContact CD2-CB 4.28Å; L318-L323 HydrophobicContact CD2-CD1 3.7Å; L318-L323 HydrophobicContact CG-CD1 4.15Å; L318-M342 HydrophobicContact CD2-CE 3.78Å; L318-Y414 VanDerWaalsContact O-CD1 3.32Å; L318-Y414 WeakPolarHBondContact O-CD1 3.22Å
319	D	96.7	Very high	95.9	Very high	8 Å²	8	12.6 Å²	12.6	4%	0.043	6%	0.059	C	C	.	.			trans	-138	-167.9	171.6	89.2	-37.6	0	0	0	111.1	N321 G322 W324 I366 C368 G369 Y414	D319-N321 VanDerWaalsContact CG-N 3.28Å; D319-N321 PolarHBondContact O-N 3.13Å; D319-N321 WeakPolarHBondContact OD1-CA 3.32Å; D319-N321 WeakPolarHBondContact OD1-CB 3.29Å; D319-N321 PolarHBondContact OD1-N 3.24Å; D319-N321 PolarHBondContact OD2-N 2.88Å; D319-N321 PolarHBondContact OD2-ND2 2.76Å; D319-G322 PolarHBondContact N-O 3.48Å; D319-G322 VanDerWaalsContact N-O 3.11Å; D319-G322 PolarHBondContact OD1-N 2.87Å; D319-W324 PolarHBondContact OD1-NE1 2.83Å; D319-I366 HydrophobicContact CB-CG2 4.02Å; D319-C368 VanDerWaalsContact OD2-CA 3.23Å; D319-C368 WeakPolarHBondContact OD2-CA 3.37Å; D319-C368 PolarHBondContact OD2-N 3.45Å; D319-C368 VanDerWaalsContact OD2-N 3.14Å; D319-G369 PolarHBondContact OD2-N 2.9Å; D319-Y414 HydrophobicContact CB-CD1 4.21Å; D319-Y414 HydrophobicContact CB-CE1 4.42Å
320	E	94.3	Very high	96.1	Very high	33 Å²	33	16 Å²	16	15%	0.154	7%	0.072	C	C	.	.	S	Bend	trans	-68.7	-14.8	175.6	-64.3	83.5	-179.4	0	0	115	A185 C368 Y414 P416 K419 W438	A185-E320 HydrophobicContact CB-CB 3.37Å; A185-E320 HydrophobicContact CB-CG 4.14Å; E320-C368 PolarHBondContact OE2-N 3Å; E320-C368 VanDerWaalsContact OE2-N 3.1Å; E320-C368 PolarHBondContact OE2-SG 2.95Å; E320-Y414 WeakPolarHBondContact OE1-CE1 3.29Å; E320-Y414 PolarHBondContact OE1-OH 2.67Å; E320-Y414 WeakPolarHBondContact OE2-CE1 3.33Å; E320-P416 HydrophobicContact CG-CB 4.21Å; E320-K419 IonicContact OE1-NZ 2.65Å; E320-K419 PolarHBondContact OE1-NZ 2.7Å; E320-W438 HydrophobicContact CG-CH2 4.12Å
321	N	94.3	Very high	96.3	Very high	13 Å²	13	16.4 Å²	16.4	7%	0.07	8%	0.082	C	C	.	.	S	Bend	trans	-103	-11.8	-178.8	-61.9	-77	0	0	0	113.3	V184 A185 D319 W324 Q339 C368 G369 Y391	V184-N321 PolarHBondContact N-OD1 3.18Å; A185-N321 PolarHBondContact N-OD1 3.47Å; A185-N321 PolarHBondContact O-ND2 2.84Å; A185-N321 PolarHBondContact O-OD1 2.94Å; D319-N321 VanDerWaalsContact CG-N 3.28Å; D319-N321 PolarHBondContact O-N 3.13Å; D319-N321 WeakPolarHBondContact OD1-CA 3.32Å; D319-N321 WeakPolarHBondContact OD1-CB 3.29Å; D319-N321 PolarHBondContact OD1-N 3.24Å; D319-N321 PolarHBondContact OD2-N 2.88Å; D319-N321 PolarHBondContact OD2-ND2 2.76Å; N321-W324 HydrophobicContact CB-CZ2 3.98Å; N321-Q339 PolarHBondContact O-NE2 2.87Å; N321-C368 VanDerWaalsContact ND2-C 3.3Å; N321-C368 WeakPolarHBondContact ND2-CA 3.39Å; N321-G369 PolarHBondContact ND2-N 3.01Å; N321-Y391 HydrophobicContact CB-CE2 4.4Å
322	G	95	Very high	96.8	Very high	17 Å²	17	19.9 Å²	19.9	18%	0.175	10%	0.098	C	C	.	.			trans	142.8	-143.1	167.5	0	0	0	0	0	114.6	D319	D319-G322 PolarHBondContact N-O 3.48Å; D319-G322 VanDerWaalsContact N-O 3.11Å; D319-G322 PolarHBondContact OD1-N 2.87Å
323	L	97.8	Very high	96.9	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	138.6	178	-177.5	68.5	0	0	0	109.4	A264 Y271 F316 L318 V340 M342	A264-L323 HydrophobicContact CB-CD1 3.96Å; Y271-L323 HydrophobicContact CD1-CD2 3.43Å; Y271-L323 VanDerWaalsContact CD1-CD2 3.43Å; Y271-L323 HydrophobicContact CE1-CD2 3.63Å; Y271-L323 HydrophobicContact CG-CD2 4Å; F316-L323 HydrophobicContact CD1-CD1 4.21Å; L318-L323 HydrophobicContact CD2-CB 4.28Å; L318-L323 HydrophobicContact CD2-CD1 3.7Å; L318-L323 HydrophobicContact CG-CD1 4.15Å; L323-V340 HydrophobicContact CB-CB 4.43Å; L323-V340 HydrophobicContact CD2-CB 4.06Å; L323-V340 HydrophobicContact CD2-CG1 4.04Å; L323-V340 HydrophobicContact CG-CB 4.15Å; L323-V340 PolarHBondContact O-N 3.36Å; L323-M342 HydrophobicContact CB-CE 3.82Å; L323-M342 HydrophobicContact CB-CG 3.82Å; L323-M342 HydrophobicContact CD2-CG 4.34Å
324	W	98.4	Very high	96.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	155	-179.1	-53.4	83.3	0	0	0	110	F316 A317 D319 N321 V337 S338 Q339 W351 I366 L390 Y391	F316-W324 WeakPolarHBondContact CA-O 3.28Å; A317-W324 HydrophobicContact CB-CB 4.31Å; A317-W324 PolarHBondContact N-O 2.02Å; A317-W324 PolarHBondContact O-N 3.46Å; D319-W324 PolarHBondContact OD1-NE1 2.83Å; N321-W324 HydrophobicContact CB-CZ2 3.98Å; W324-V337 HydrophobicContact CE3-CG1 4.09Å; W324-S338 CarbonylContact C-O 3.56Å; W324-S338 VanDerWaalsContact CA-O 3.32Å; W324-S338 WeakPolarHBondContact CA-O 3.28Å; W324-Q339 HydrophobicContact CD2-CB 4.46Å; W324-Q339 HydrophobicContact CD2-CG 4.36Å; W324-Q339 HydrophobicContact CE3-CB 3.87Å; W324-Q339 HydrophobicContact CE3-CG 4.21Å; W324-Q339 HydrophobicContact CH2-CB 4.27Å; W324-Q339 HydrophobicContact CH2-CG 4.17Å; W324-Q339 HydrophobicContact CZ2-CG 4.3Å; W324-Q339 HydrophobicContact CZ3-CB 3.78Å; W324-Q339 HydrophobicContact CZ3-CG 4.13Å; W324-W351 HydrophobicContact CE3-CZ3 4.3Å; W324-W351 HydrophobicContact CH2-CH2 4.02Å; W324-W351 HydrophobicContact CH2-CZ3 4.49Å; W324-W351 HydrophobicContact CZ3-CE3 4.44Å; W324-W351 AromaticContact CZ3-CH2 3.51Å; W324-W351 HydrophobicContact CZ3-CH2 3.51Å; W324-W351 HydrophobicContact CZ3-CZ2 4.4Å; W324-W351 AromaticContact CZ3-CZ3 3.55Å; W324-W351 HydrophobicContact CZ3-CZ3 3.55Å; W324-I366 HydrophobicContact CB-CD1 3.58Å; W324-I366 HydrophobicContact CD2-CD1 3.93Å; W324-I366 HydrophobicContact CE3-CD1 4.28Å; W324-I366 HydrophobicContact CG-CD1 3.61Å; W324-L390 HydrophobicContact CE3-CD1 3.88Å; W324-L390 HydrophobicContact CH2-CD1 4.09Å; W324-L390 HydrophobicContact CZ3-CD1 3.61Å; W324-Y391 HydrophobicContact CH2-CE2 4.08Å; W324-Y391 HydrophobicContact CZ2-CE2 4.28Å
325	I	98.5	Very high	96.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	123.9	173	-167.6	65.4	0	0	0	109.2	I280 I295 F314 D315 F316 Y327 V337 S338 V340 L347	I280-I325 HydrophobicContact CG2-CD1 4.17Å; I280-I325 HydrophobicContact CG2-CG1 4.13Å; I295-I325 HydrophobicContact CD1-CG1 4.47Å; I295-I325 HydrophobicContact CD1-CG2 4.09Å; F314-I325 HydrophobicContact CB-CD1 3.76Å; F314-I325 HydrophobicContact CB-CG1 4.3Å; F314-I325 HydrophobicContact CD1-CD1 4.36Å; F314-I325 HydrophobicContact CD1-CG1 4.03Å; D315-I325 CarbonylContact O-C 3.54Å; D315-I325 WeakPolarHBondContact O-CA 3.41Å; D315-I325 WeakPolarHBondContact O-CD1 2.98Å; F316-I325 HydrophobicContact CB-CD1 4.36Å; F316-I325 HydrophobicContact CD1-CD1 3.68Å; F316-I325 HydrophobicContact CD2-CD1 3.48Å; F316-I325 VanDerWaalsContact CD2-CD1 3.48Å; F316-I325 HydrophobicContact CE1-CD1 3.8Å; F316-I325 HydrophobicContact CE2-CD1 3.59Å; F316-I325 HydrophobicContact CG-CD1 3.55Å; F316-I325 HydrophobicContact CZ-CD1 3.78Å; I325-Y327 HydrophobicContact CG1-CD1 4.29Å; I325-Y327 HydrophobicContact CG2-CD1 4.02Å; I325-Y327 HydrophobicContact CG2-CE1 4.06Å; I325-V337 CarbonylContact O-C 3.56Å; I325-V337 WeakPolarHBondContact O-CA 3.44Å; I325-S338 PolarHBondContact N-O 2.86Å; I325-S338 PolarHBondContact O-N 2.89Å; I325-V340 HydrophobicContact CB-CG2 3.91Å; I325-V340 HydrophobicContact CG2-CG2 3.5Å; I325-L347 HydrophobicContact CG2-CD2 4.31Å
326	I	98.6	Very high	96.9	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.4	170.4	-50.3	84.8	0	0	0	107.4	V306 Y307 F314 D315 A317 L335 V336 V337 I366 L371	V306-I326 HydrophobicContact CG2-CG2 4.02Å; Y307-I326 HydrophobicContact CE1-CG2 4.38Å; Y307-I326 WeakPolarHBondContact OH-CG2 3.41Å; F314-I326 CarbonylContact C-O 3.56Å; F314-I326 WeakPolarHBondContact CA-O 3.43Å; D315-I326 HydrophobicContact CB-CB 4.23Å; D315-I326 HydrophobicContact CB-CD1 4.5Å; D315-I326 PolarHBondContact N-O 3.37Å; D315-I326 WeakPolarHBondContact O-CD1 3.4Å; D315-I326 PolarHBondContact O-N 2.74Å; A317-I326 HydrophobicContact CB-CD1 4Å; I326-L335 HydrophobicContact CG2-CB 4.4Å; I326-L335 HydrophobicContact CG2-CD1 4.43Å; I326-V336 CarbonylContact C-O 3.51Å; I326-V336 WeakPolarHBondContact CA-O 3.41Å; I326-V337 HydrophobicContact CG1-CG1 4.4Å; I326-V337 HydrophobicContact CG1-CG2 4.06Å; I326-V337 HydrophobicContact CG2-CG2 4.24Å; I326-I366 HydrophobicContact CD1-CD1 4.09Å; I326-L371 HydrophobicContact CD1-CD1 4.33Å; I326-L371 HydrophobicContact CG1-CD1 3.98Å
327	Y	98.3	Very high	96.9	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.016	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	-177.5	-176.4	64.2	-82.8	0	0	0	111.2	I295 A298 F314 I325 Y329 V336 S338	I295-Y327 HydrophobicContact CD1-CE1 4.38Å; I295-Y327 HydrophobicContact CG2-CD2 4.33Å; I295-Y327 HydrophobicContact CG2-CE1 4.31Å; I295-Y327 HydrophobicContact CG2-CE2 3.65Å; A298-Y327 HydrophobicContact CB-CD2 3.67Å; A298-Y327 HydrophobicContact CB-CE2 3.96Å; F314-Y327 HydrophobicContact CD1-CG 4.14Å; F314-Y327 HydrophobicContact CE1-CD2 4.46Å; F314-Y327 HydrophobicContact CE1-CG 4.2Å; I325-Y327 HydrophobicContact CG1-CD1 4.29Å; I325-Y327 HydrophobicContact CG2-CD1 4.02Å; I325-Y327 HydrophobicContact CG2-CE1 4.06Å; Y327-Y329 AromaticContact CE2-CD1 3.93Å; Y327-Y329 HydrophobicContact CE2-CD1 3.93Å; Y327-Y329 AromaticContact CE2-CE1 3.73Å; Y327-Y329 HydrophobicContact CE2-CE1 3.73Å; Y327-V336 HydrophobicContact CD1-CB 4.43Å; Y327-V336 HydrophobicContact CD2-CB 4.18Å; Y327-V336 HydrophobicContact CE1-CB 4.16Å; Y327-V336 HydrophobicContact CE1-CG1 3.86Å; Y327-V336 HydrophobicContact CE2-CB 3.88Å; Y327-V336 HydrophobicContact CE2-CG1 3.86Å; Y327-V336 HydrophobicContact CE2-CG2 4.44Å; Y327-V336 HydrophobicContact CG-CB 4.45Å; Y327-V336 VanDerWaalsContact CZ-CG1 3.43Å; Y327-V336 PolarHBondContact N-O 2.79Å; Y327-V336 PolarHBondContact O-N 3.04Å; Y327-V336 WeakPolarHBondContact OH-CG1 3.24Å; Y327-S338 PolarHBondContact OH-OG 2.75Å
328	R	97.5	Very high	96.9	Very high	3 Å²	3	24.6 Å²	24.6	1%	0.011	12%	0.12	C	C	.	.			trans	-129.3	143.9	179.2	-158.6	174	85.5	136.6	11.3	110.8	A298 A299 H304 Y305 Q332	A298-R328 WeakPolarHBondContact CA-O 3.32Å; A299-R328 PolarHBondContact N-O 3.26Å; H304-R328 VanDerWaalsContact CA-NH2 3.29Å; H304-R328 PolarHBondContact CD2-NH2 2.79Å; H304-R328 PolarHBondContact O-NE 2.94Å; Y305-R328 PolarHBondContact O-NE 3.1Å; R328-Q332 WeakPolarHBondContact CD-O 2.96Å; R328-Q332 WeakPolarHBondContact CG-O 3.42Å; R328-Q332 PolarHBondContact NE-O 2.91Å; R328-Q332 PolarHBondContact NH1-O 2.85Å
329	Y	97.5	Very high	96.9	Very high	24 Å²	24	25.3 Å²	25.3	9%	0.094	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-81.3	158.6	168.4	-63.2	-43.6	0	0	0	111.9	M297 Y327 N331 Q332 F334 V336 E352	M297-Y329 HydrophobicContact CB-CD1 3.67Å; M297-Y329 HydrophobicContact CB-CE1 4.09Å; M297-Y329 HydrophobicContact CB-CG 4.24Å; M297-Y329 HydrophobicContact CE-CD1 4.36Å; M297-Y329 HydrophobicContact CE-CE1 3.9Å; M297-Y329 HydrophobicContact CE-CE2 4.14Å; M297-Y329 CarbonylContact O-C 3.59Å; M297-Y329 VanDerWaalsContact O-CA 3.25Å; M297-Y329 WeakPolarHBondContact O-CA 3.36Å; Y327-Y329 AromaticContact CE2-CD1 3.93Å; Y327-Y329 HydrophobicContact CE2-CD1 3.93Å; Y327-Y329 AromaticContact CE2-CE1 3.73Å; Y327-Y329 HydrophobicContact CE2-CE1 3.73Å; Y329-N331 PolarHBondContact O-N 2.84Å; Y329-Q332 HydrophobicContact CD2-CG 4.38Å; Y329-Q332 PolarHBondContact O-N 2.79Å; Y329-F334 HydrophobicContact CD2-CE2 4.12Å; Y329-F334 HydrophobicContact CD2-CZ 4.22Å; Y329-F334 HydrophobicContact CE2-CE2 4.39Å; Y329-V336 HydrophobicContact CD1-CG2 4.31Å; Y329-V336 HydrophobicContact CD2-CG2 3.76Å; Y329-V336 HydrophobicContact CE1-CG1 4.46Å; Y329-V336 HydrophobicContact CE1-CG2 4.29Å; Y329-V336 HydrophobicContact CE2-CG2 3.73Å; Y329-V336 HydrophobicContact CG-CG2 4.06Å; Y329-E352 HydrophobicContact CE2-CG 4.07Å; Y329-E352 WeakPolarHBondContact CE2-OE1 3.47Å; Y329-E352 PolarHBondContact OH-OE1 3.45Å
330	W	95.5	Very high	96.9	Very high	78 Å²	78	25.1 Å²	25.1	30%	0.295	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	129.3	171.8	-70.9	103.8	0	0	0	112.4	M297 A298 A299 Y300 K301 H304 Q332	M297-W330 PolarHBondContact O-N 3.29Å; A298-W330 PolarHBondContact O-NE1 2.66Å; A299-W330 HydrophobicContact CB-CD2 3.76Å; A299-W330 HydrophobicContact CB-CE3 3.85Å; A299-W330 HydrophobicContact CB-CG 4.27Å; A299-W330 HydrophobicContact CB-CH2 4.09Å; A299-W330 HydrophobicContact CB-CZ2 4.04Å; A299-W330 HydrophobicContact CB-CZ3 4Å; Y300-W330 AromaticContact CD1-CZ2 3.63Å; Y300-W330 HydrophobicContact CD1-CZ2 3.63Å; Y300-W330 AromaticContact CE1-CZ2 3.62Å; Y300-W330 HydrophobicContact CE1-CZ2 3.62Å; Y300-W330 HydrophobicContact CG-CZ2 4.24Å; K301-W330 HydrophobicContact CD-CH2 3.9Å; K301-W330 HydrophobicContact CD-CZ2 4.36Å; K301-W330 HydrophobicContact CG-CH2 3.96Å; H304-W330 HydrophobicContact CB-CE3 4.5Å; H304-W330 HydrophobicContact CB-CZ3 4.14Å; H304-W330 AromaticContact CD2-CE3 3.49Å; H304-W330 VanDerWaalsContact CD2-CE3 3.49Å; H304-W330 AromaticContact CD2-CZ3 3.82Å; H304-W330 AromaticContact CG-CE3 3.85Å; H304-W330 AromaticContact CG-CZ3 3.68Å; H304-W330 AromaticContact ND1-CZ3 3.91Å; W330-Q332 PolarHBondContact O-N 2.64Å
331	N	93.2	Very high	97	Very high	119 Å²	119	25.6 Å²	25.6	64%	0.636	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	9	178.4	-53.1	-29.1	0	0	0	116.3	H304 Y329	H304-N331 PolarHBondContact CD2-N 3.23Å; H304-N331 WeakPolarHBondContact NE2-CA 3.23Å; H304-N331 PolarHBondContact NE2-N 2.93Å; H304-N331 VanDerWaalsContact NE2-N 3.14Å; H304-N331 PolarHBondContact NE2-OD1 2.8Å; Y329-N331 PolarHBondContact O-N 2.84Å
332	Q	96.4	Very high	97.1	Very high	82 Å²	82	26.9 Å²	26.9	38%	0.383	13%	0.131	S	C	.	.			trans	-91.2	149.8	172.9	-58.9	-52.3	-33.3	0	0	111.4	R328 Y329 W330 F334	R328-Q332 WeakPolarHBondContact CD-O 2.96Å; R328-Q332 WeakPolarHBondContact CG-O 3.42Å; R328-Q332 PolarHBondContact NE-O 2.91Å; R328-Q332 PolarHBondContact NH1-O 2.85Å; Y329-Q332 HydrophobicContact CD2-CG 4.38Å; Y329-Q332 PolarHBondContact O-N 2.79Å; W330-Q332 PolarHBondContact O-N 2.64Å; Q332-F334 HydrophobicContact CB-CD1 4.05Å; Q332-F334 HydrophobicContact CB-CE1 3.83Å; Q332-F334 HydrophobicContact CB-CZ 4.11Å; Q332-F334 HydrophobicContact CG-CE1 3.8Å; Q332-F334 HydrophobicContact CG-CZ 3.88Å; Q332-F334 VanDerWaalsContact OE1-CE1 3.27Å
333	Q	95.5	Very high	97	Very high	92 Å²	92	33.2 Å²	33.2	43%	0.43	16%	0.156	S	C	.	.			trans	-105.2	-0.4	176.4	-61.8	-65.9	-7.7	0	0	113.1	R358	Q333-R358 WeakPolarHBondContact O-CB 3.46Å; Q333-R358 PolarHBondContact O-N 2.92Å
334	F	97	Very high	96.9	Very high	30 Å²	30	36.6 Å²	36.6	13%	0.132	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	156.6	177.3	60.7	-100.9	0	0	0	112.7	Y329 Q332 V336 E352 T354 I356	Y329-F334 HydrophobicContact CD2-CE2 4.12Å; Y329-F334 HydrophobicContact CD2-CZ 4.22Å; Y329-F334 HydrophobicContact CE2-CE2 4.39Å; Q332-F334 HydrophobicContact CB-CD1 4.05Å; Q332-F334 HydrophobicContact CB-CE1 3.83Å; Q332-F334 HydrophobicContact CB-CZ 4.11Å; Q332-F334 HydrophobicContact CG-CE1 3.8Å; Q332-F334 HydrophobicContact CG-CZ 3.88Å; Q332-F334 VanDerWaalsContact OE1-CE1 3.27Å; F334-V336 HydrophobicContact CD2-CG2 4.16Å; F334-V336 HydrophobicContact CE2-CG2 3.89Å; F334-E352 HydrophobicContact CD2-CB 4.47Å; F334-E352 HydrophobicContact CE2-CB 3.9Å; F334-E352 HydrophobicContact CE2-CG 4.23Å; F334-T354 HydrophobicContact CD1-CG2 4.03Å; F334-T354 HydrophobicContact CD2-CG2 4.29Å; F334-T354 HydrophobicContact CE1-CG2 4.04Å; F334-T354 HydrophobicContact CE2-CG2 4.3Å; F334-T354 HydrophobicContact CG-CG2 4.16Å; F334-T354 HydrophobicContact CZ-CG2 4.18Å; F334-I356 WeakPolarHBondContact CA-O 3.46Å
335	L	97.5	Very high	96.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	145.1	175	-56.5	-175.2	0	0	0	111.3	V306 Y307 I326 L353 I356 R358 V361 L373	V306-L335 HydrophobicContact CG2-CD2 3.88Å; V306-L335 WeakPolarHBondContact O-CD2 3.23Å; Y307-L335 HydrophobicContact CD1-CD2 4.01Å; Y307-L335 HydrophobicContact CE1-CD1 3.99Å; Y307-L335 HydrophobicContact CE1-CD2 3.86Å; I326-L335 HydrophobicContact CG2-CB 4.4Å; I326-L335 HydrophobicContact CG2-CD1 4.43Å; L335-L353 HydrophobicContact CB-CB 4.33Å; L335-L353 HydrophobicContact CB-CD1 4.29Å; L335-L353 WeakPolarHBondContact O-CB 3.43Å; L335-L353 PolarHBondContact O-N 3Å; L335-I356 HydrophobicContact CD1-CG2 3.98Å; L335-I356 HydrophobicContact CG-CG2 4.15Å; L335-R358 HydrophobicContact CD2-CB 3.91Å; L335-V361 HydrophobicContact CD1-CG2 4.23Å; L335-L373 HydrophobicContact CD1-CD1 4.47Å; L335-L373 HydrophobicContact CD1-CD2 3.91Å
336	V	98.3	Very high	96.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.9	168.8	-171.5	0	0	0	0	108.1	I326 Y327 Y329 F334 T350 W351 E352	I326-V336 CarbonylContact C-O 3.51Å; I326-V336 WeakPolarHBondContact CA-O 3.41Å; Y327-V336 HydrophobicContact CD1-CB 4.43Å; Y327-V336 HydrophobicContact CD2-CB 4.18Å; Y327-V336 HydrophobicContact CE1-CB 4.16Å; Y327-V336 HydrophobicContact CE1-CG1 3.86Å; Y327-V336 HydrophobicContact CE2-CB 3.88Å; Y327-V336 HydrophobicContact CE2-CG1 3.86Å; Y327-V336 HydrophobicContact CE2-CG2 4.44Å; Y327-V336 HydrophobicContact CG-CB 4.45Å; Y327-V336 VanDerWaalsContact CZ-CG1 3.43Å; Y327-V336 PolarHBondContact N-O 2.79Å; Y327-V336 PolarHBondContact O-N 3.04Å; Y327-V336 WeakPolarHBondContact OH-CG1 3.24Å; Y329-V336 HydrophobicContact CD1-CG2 4.31Å; Y329-V336 HydrophobicContact CD2-CG2 3.76Å; Y329-V336 HydrophobicContact CE1-CG1 4.46Å; Y329-V336 HydrophobicContact CE1-CG2 4.29Å; Y329-V336 HydrophobicContact CE2-CG2 3.73Å; Y329-V336 HydrophobicContact CG-CG2 4.06Å; F334-V336 HydrophobicContact CD2-CG2 4.16Å; F334-V336 HydrophobicContact CE2-CG2 3.89Å; V336-T350 HydrophobicContact CG1-CG2 3.58Å; V336-W351 WeakPolarHBondContact CA-O 3.47Å; V336-E352 HydrophobicContact CG1-CG 4.32Å; V336-E352 HydrophobicContact CG2-CG 4.46Å
337	V	98.4	Very high	96.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.4	174.4	-174.9	0	0	0	0	108.5	W324 I325 I326 T350 W351 L353 I366 L371 L390	W324-V337 HydrophobicContact CE3-CG1 4.09Å; I325-V337 CarbonylContact O-C 3.56Å; I325-V337 WeakPolarHBondContact O-CA 3.44Å; I326-V337 HydrophobicContact CG1-CG1 4.4Å; I326-V337 HydrophobicContact CG1-CG2 4.06Å; I326-V337 HydrophobicContact CG2-CG2 4.24Å; V337-T350 CarbonylContact O-C 3.57Å; V337-T350 VanDerWaalsContact O-CA 3.3Å; V337-T350 WeakPolarHBondContact O-CA 3.23Å; V337-W351 HydrophobicContact CB-CB 4.47Å; V337-W351 PolarHBondContact N-O 2.8Å; V337-W351 PolarHBondContact O-N 2.93Å; V337-L353 HydrophobicContact CG2-CD1 3.76Å; V337-L353 HydrophobicContact CG2-CG 4.33Å; V337-I366 HydrophobicContact CG1-CD1 4.23Å; V337-L371 HydrophobicContact CG2-CD2 3.96Å; V337-L390 HydrophobicContact CB-CD2 4.17Å; V337-L390 HydrophobicContact CG1-CD1 4.16Å; V337-L390 HydrophobicContact CG1-CD2 4.13Å; V337-L390 HydrophobicContact CG2-CD2 4.29Å
338	S	98.2	Very high	96.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.7	167	-58.8	0	0	0	0	111.7	W324 I325 Y327 R349 T350	W324-S338 CarbonylContact C-O 3.56Å; W324-S338 VanDerWaalsContact CA-O 3.32Å; W324-S338 WeakPolarHBondContact CA-O 3.28Å; I325-S338 PolarHBondContact N-O 2.86Å; I325-S338 PolarHBondContact O-N 2.89Å; Y327-S338 PolarHBondContact OH-OG 2.75Å; S338-R349 CarbonylContact C-O 3.58Å; S338-R349 WeakPolarHBondContact CA-O 3.36Å; S338-T350 WeakPolarHBondContact OG-CG2 3.47Å; S338-T350 PolarHBondContact OG-OG1 2.87Å
339	Q	97.5	Very high	96.6	Very high	27 Å²	27	50.2 Å²	50.2	13%	0.126	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135.8	165	-165.8	-177.5	20.9	0	0	108.5	N321 W324 L347 L348 R349 W351	N321-Q339 PolarHBondContact O-NE2 2.87Å; W324-Q339 HydrophobicContact CD2-CB 4.46Å; W324-Q339 HydrophobicContact CD2-CG 4.36Å; W324-Q339 HydrophobicContact CE3-CB 3.87Å; W324-Q339 HydrophobicContact CE3-CG 4.21Å; W324-Q339 HydrophobicContact CH2-CB 4.27Å; W324-Q339 HydrophobicContact CH2-CG 4.17Å; W324-Q339 HydrophobicContact CZ2-CG 4.3Å; W324-Q339 HydrophobicContact CZ3-CB 3.78Å; W324-Q339 HydrophobicContact CZ3-CG 4.13Å; Q339-L347 WeakPolarHBondContact O-CA 3.13Å; Q339-L348 HydrophobicContact CB-CB 4.44Å; Q339-L348 HydrophobicContact CG-CD1 4.44Å; Q339-L348 PolarHBondContact O-N 2.86Å; Q339-R349 PolarHBondContact N-O 3.01Å; Q339-W351 HydrophobicContact CB-CH2 4.44Å; Q339-W351 HydrophobicContact CB-CZ3 4.14Å
340	V	97.5	Very high	96.6	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.024	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.9	-169	-174	0	0	0	0	110.7	I280 L323 I325 M342 L345 N346 L347	I280-V340 HydrophobicContact CD1-CG1 3.95Å; L323-V340 HydrophobicContact CB-CB 4.43Å; L323-V340 HydrophobicContact CD2-CB 4.06Å; L323-V340 HydrophobicContact CD2-CG1 4.04Å; L323-V340 HydrophobicContact CG-CB 4.15Å; L323-V340 PolarHBondContact O-N 3.36Å; I325-V340 HydrophobicContact CB-CG2 3.91Å; I325-V340 HydrophobicContact CG2-CG2 3.5Å; V340-M342 PolarHBondContact O-N 3.2Å; V340-L345 HydrophobicContact CG1-CB 4.31Å; V340-L345 HydrophobicContact CG1-CD2 3.94Å; V340-N346 WeakPolarHBondContact CA-O 3.34Å; V340-L347 HydrophobicContact CG2-CD2 3.94Å
341	D	96.9	Very high	96.6	Very high	43 Å²	43	48.4 Å²	48.4	23%	0.23	24%	0.24	C	C	.	.			trans	-68.9	125.5	170.5	-172.7	-84.1	0	0	0	111	Q343 D344 L345 N346 L348	D341-Q343 PolarHBondContact O-N 2.7Å; D341-Q343 VanDerWaalsContact OD1-CA 3.32Å; D341-Q343 WeakPolarHBondContact OD1-CA 3.15Å; D341-Q343 WeakPolarHBondContact OD1-CB 3.31Å; D341-Q343 PolarHBondContact OD1-N 2.83Å; D341-D344 PolarHBondContact OD1-N 2.81Å; D341-L345 VanDerWaalsContact O-CA 3.28Å; D341-L345 WeakPolarHBondContact O-CA 3.47Å; D341-L345 PolarHBondContact O-N 2.74Å; D341-N346 HydrophobicContact CB-CB 4.33Å; D341-N346 PolarHBondContact N-O 2.81Å; D341-L348 HydrophobicContact CB-CD1 4.4Å; D341-L348 HydrophobicContact CB-CD2 4.25Å; D341-L348 HydrophobicContact CB-CG 4.37Å
342	M	95.8	Very high	96.8	Very high	41 Å²	41	47.3 Å²	47.3	20%	0.202	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.9	-177	-70.2	178	174.2	0	0	114.1	F266 Y271 K282 L318 L323 V340	F266-M342 HydrophobicContact CD1-CE 4.19Å; F266-M342 HydrophobicContact CD1-SD 3.7Å; F266-M342 HydrophobicContact CD2-CE 4Å; F266-M342 HydrophobicContact CD2-SD 4.5Å; F266-M342 HydrophobicContact CE1-CE 4.06Å; F266-M342 HydrophobicContact CE1-SD 3.32Å; F266-M342 WeakPolarHBondContact CE1-SD 3.49Å; F266-M342 HydrophobicContact CE2-CE 3.82Å; F266-M342 HydrophobicContact CE2-SD 4.16Å; F266-M342 HydrophobicContact CG-CE 4.19Å; F266-M342 HydrophobicContact CG-SD 4.31Å; F266-M342 HydrophobicContact CZ-CE 3.88Å; F266-M342 HydrophobicContact CZ-SD 3.59Å; F266-M342 VanDerWaalsContact CZ-SD 3.59Å; Y271-M342 PolarHBondContact OH-O 2.89Å; K282-M342 WeakPolarHBondContact CE-O 3.22Å; K282-M342 PolarHBondContact NZ-O 2.74Å; L318-M342 HydrophobicContact CD2-CE 3.78Å; L323-M342 HydrophobicContact CB-CE 3.82Å; L323-M342 HydrophobicContact CB-CG 3.82Å; L323-M342 HydrophobicContact CD2-CG 4.34Å; V340-M342 PolarHBondContact O-N 3.2Å
343	Q	93.5	Very high	96.9	Very high	150 Å²	150	43.6 Å²	43.6	70%	0.701	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-55.9	180	-51.2	-170.5	42	0	0	110.9	K282 D341	K282-Q343 PolarHBondContact NZ-O 3.48Å; D341-Q343 PolarHBondContact O-N 2.7Å; D341-Q343 VanDerWaalsContact OD1-CA 3.32Å; D341-Q343 WeakPolarHBondContact OD1-CA 3.15Å; D341-Q343 WeakPolarHBondContact OD1-CB 3.31Å; D341-Q343 PolarHBondContact OD1-N 2.83Å
344	D	95.9	Very high	96.9	Very high	72 Å²	72	44.1 Å²	44.1	39%	0.385	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	1.6	-168.5	73.3	15.2	0	0	0	115.7	D341 N346	D341-D344 PolarHBondContact OD1-N 2.81Å; D344-N346 PolarHBondContact O-N 3.11Å; D344-N346 WeakPolarHBondContact OD1-CB 3.43Å; D344-N346 PolarHBondContact OD1-N 2.97Å; D344-N346 PolarHBondContact OD1-ND2 2.95Å; D344-N346 PolarHBondContact OD2-ND2 3.35Å
345	L	97.9	Very high	96.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.			trans	62.5	20.6	-179.8	-52.1	178.3	0	0	0	115.1	Y271 I280 K282 V291 R293 V340 D341	Y271-L345 HydrophobicContact CD1-CD2 3.85Å; Y271-L345 HydrophobicContact CE1-CD2 3.98Å; I280-L345 HydrophobicContact CD1-CB 3.95Å; I280-L345 HydrophobicContact CD1-CD1 4.46Å; I280-L345 HydrophobicContact CD1-CD2 4.45Å; I280-L345 HydrophobicContact CG1-CB 4.38Å; I280-L345 HydrophobicContact CG1-CD1 4.28Å; K282-L345 HydrophobicContact CB-CD1 3.96Å; K282-L345 HydrophobicContact CB-CD2 4.2Å; K282-L345 HydrophobicContact CB-CG 4.34Å; V291-L345 HydrophobicContact CG1-CD1 4.4Å; V291-L345 HydrophobicContact CG1-CG 4.42Å; R293-L345 HydrophobicContact CB-CB 3.72Å; R293-L345 WeakPolarHBondContact CG-O 3.06Å; V340-L345 HydrophobicContact CG1-CB 4.31Å; V340-L345 HydrophobicContact CG1-CD2 3.94Å; D341-L345 VanDerWaalsContact O-CA 3.28Å; D341-L345 WeakPolarHBondContact O-CA 3.47Å; D341-L345 PolarHBondContact O-N 2.74Å
346	N	97.6	Very high	96.7	Very high	55 Å²	55	46.2 Å²	46.2	29%	0.294	25%	0.246	S	C	.	.			trans	-58.5	140	166.2	-86.6	-56.4	0	0	0	111.3	R293 V340 D341 D344	R293-N346 PolarHBondContact NH1-OD1 3.16Å; R293-N346 PolarHBondContact NH2-OD1 2.74Å; V340-N346 WeakPolarHBondContact CA-O 3.34Å; D341-N346 HydrophobicContact CB-CB 4.33Å; D341-N346 PolarHBondContact N-O 2.81Å; D344-N346 PolarHBondContact O-N 3.11Å; D344-N346 WeakPolarHBondContact OD1-CB 3.43Å; D344-N346 PolarHBondContact OD1-N 2.97Å; D344-N346 PolarHBondContact OD1-ND2 2.95Å; D344-N346 PolarHBondContact OD2-ND2 3.35Å
347	L	97.1	Very high	96.6	Very high	54 Å²	54	49.2 Å²	49.2	28%	0.283	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.9	170.5	-52.2	-175.3	0	0	0	108.6	I280 I295 I325 Q339 V340	I280-L347 HydrophobicContact CD1-CD2 4.44Å; I295-L347 HydrophobicContact CD1-CD1 4.26Å; I295-L347 HydrophobicContact CD1-CD2 4.09Å; I295-L347 HydrophobicContact CG1-CD1 4.15Å; I295-L347 HydrophobicContact CG1-CD2 4.44Å; I295-L347 HydrophobicContact CG2-CD1 4.03Å; I325-L347 HydrophobicContact CG2-CD2 4.31Å; Q339-L347 WeakPolarHBondContact O-CA 3.13Å; V340-L347 HydrophobicContact CG2-CD2 3.94Å
348	L	95.6	Very high	96.4	Very high	102 Å²	102	51.1 Å²	51.1	53%	0.534	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-37.8	-173.2	-61	176	0	0	0	112.4	Q339 D341	Q339-L348 HydrophobicContact CB-CB 4.44Å; Q339-L348 HydrophobicContact CG-CD1 4.44Å; Q339-L348 PolarHBondContact O-N 2.86Å; D341-L348 HydrophobicContact CB-CD1 4.4Å; D341-L348 HydrophobicContact CB-CD2 4.25Å; D341-L348 HydrophobicContact CB-CG 4.37Å
349	R	95.1	Very high	96.3	Very high	81 Å²	81	54.2 Å²	54.2	31%	0.306	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	147	179.2	-171.9	173	-68.5	169.2	2.1	108.3	D182 S338 Q339 W351	D182-R349 IonicContact OD2-CZ 3.64Å; D182-R349 IonicContact OD2-NH1 2.68Å; D182-R349 PolarHBondContact OD2-NH1 3.07Å; D182-R349 IonicContact OD2-NH2 3.71Å; D182-R349 PolarHBondContact OD2-NH2 3.02Å; S338-R349 CarbonylContact C-O 3.58Å; S338-R349 WeakPolarHBondContact CA-O 3.36Å; Q339-R349 PolarHBondContact N-O 3.01Å; R349-W351 HydrophobicContact CB-CH2 3.66Å; R349-W351 HydrophobicContact CB-CZ2 4.41Å; R349-W351 HydrophobicContact CB-CZ3 3.7Å; R349-W351 HydrophobicContact CG-CD2 4.42Å; R349-W351 HydrophobicContact CG-CE3 4.2Å; R349-W351 HydrophobicContact CG-CH2 3.46Å; R349-W351 VanDerWaalsContact CG-CH2 3.46Å; R349-W351 HydrophobicContact CG-CZ2 3.71Å; R349-W351 HydrophobicContact CG-CZ3 3.71Å; R349-W351 WeakPolarHBondContact O-CZ3 3.34Å
350	T	97.3	Very high	96.2	Very high	58 Å²	58	57.1 Å²	57.1	36%	0.356	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	143	-176.5	-59.3	0	0	0	0	110.4	V336 V337 S338	V336-T350 HydrophobicContact CG1-CG2 3.58Å; V337-T350 CarbonylContact O-C 3.57Å; V337-T350 VanDerWaalsContact O-CA 3.3Å; V337-T350 WeakPolarHBondContact O-CA 3.23Å; S338-T350 WeakPolarHBondContact OG-CG2 3.47Å; S338-T350 PolarHBondContact OG-OG1 2.87Å
351	W	97.5	Very high	96.1	Very high	6 Å²	6	56.9 Å²	56.9	2%	0.023	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.3	-178.8	-65.8	-104.2	0	0	0	109.7	W324 V336 V337 Q339 R349 L353 L390 Y393	W324-W351 HydrophobicContact CE3-CZ3 4.3Å; W324-W351 HydrophobicContact CH2-CH2 4.02Å; W324-W351 HydrophobicContact CH2-CZ3 4.49Å; W324-W351 HydrophobicContact CZ3-CE3 4.44Å; W324-W351 AromaticContact CZ3-CH2 3.51Å; W324-W351 HydrophobicContact CZ3-CH2 3.51Å; W324-W351 HydrophobicContact CZ3-CZ2 4.4Å; W324-W351 AromaticContact CZ3-CZ3 3.55Å; W324-W351 HydrophobicContact CZ3-CZ3 3.55Å; V336-W351 WeakPolarHBondContact CA-O 3.47Å; V337-W351 HydrophobicContact CB-CB 4.47Å; V337-W351 PolarHBondContact N-O 2.8Å; V337-W351 PolarHBondContact O-N 2.93Å; Q339-W351 HydrophobicContact CB-CH2 4.44Å; Q339-W351 HydrophobicContact CB-CZ3 4.14Å; R349-W351 HydrophobicContact CB-CH2 3.66Å; R349-W351 HydrophobicContact CB-CZ2 4.41Å; R349-W351 HydrophobicContact CB-CZ3 3.7Å; R349-W351 HydrophobicContact CG-CD2 4.42Å; R349-W351 HydrophobicContact CG-CE3 4.2Å; R349-W351 HydrophobicContact CG-CH2 3.46Å; R349-W351 VanDerWaalsContact CG-CH2 3.46Å; R349-W351 HydrophobicContact CG-CZ2 3.71Å; R349-W351 HydrophobicContact CG-CZ3 3.71Å; R349-W351 WeakPolarHBondContact O-CZ3 3.34Å; W351-L353 HydrophobicContact CB-CD2 3.96Å; W351-L390 HydrophobicContact CB-CD2 4.32Å; W351-L390 HydrophobicContact CD2-CB 4.45Å; W351-L390 HydrophobicContact CD2-CD2 4.08Å; W351-L390 HydrophobicContact CG-CD2 4Å; W351-L390 HydrophobicContact CZ2-CB 3.96Å; W351-L390 PolarHBondContact NE1-O 2.84Å; W351-Y393 AromaticContact CD1-CD1 3.54Å; W351-Y393 AromaticContact CD1-CE1 3.37Å; W351-Y393 HydrophobicContact CG-CE1 4.43Å; W351-Y393 AromaticContact NE1-CD1 3.64Å; W351-Y393 AromaticContact NE1-CE1 3.22Å; W351-Y393 AromaticContact NE1-CZ 3.56Å
352	E	97.1	Very high	96.1	Very high	97 Å²	97	54.9 Å²	54.9	45%	0.453	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	104.2	176.3	-65.5	179.9	-174.2	0	0	108.6	Y329 F334 V336 T354	Y329-E352 HydrophobicContact CE2-CG 4.07Å; Y329-E352 WeakPolarHBondContact CE2-OE1 3.47Å; Y329-E352 PolarHBondContact OH-OE1 3.45Å; F334-E352 HydrophobicContact CD2-CB 4.47Å; F334-E352 HydrophobicContact CE2-CB 3.9Å; F334-E352 HydrophobicContact CE2-CG 4.23Å; V336-E352 HydrophobicContact CG1-CG 4.32Å; V336-E352 HydrophobicContact CG2-CG 4.46Å; E352-T354 HydrophobicContact CB-CG2 4.4Å; E352-T354 PolarHBondContact O-N 3.43Å
353	L	97.1	Very high	96.2	Very high	4 Å²	4	53 Å²	53	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	56.3	-168.9	-54.4	-171.6	0	0	0	111.4	L335 V337 W351 A355 I356 L371 Y388	L335-L353 HydrophobicContact CB-CB 4.33Å; L335-L353 HydrophobicContact CB-CD1 4.29Å; L335-L353 WeakPolarHBondContact O-CB 3.43Å; L335-L353 PolarHBondContact O-N 3Å; V337-L353 HydrophobicContact CG2-CD1 3.76Å; V337-L353 HydrophobicContact CG2-CG 4.33Å; W351-L353 HydrophobicContact CB-CD2 3.96Å; L353-A355 PolarHBondContact O-N 3.38Å; L353-I356 HydrophobicContact CB-CB 4.39Å; L353-I356 HydrophobicContact CB-CD1 4.12Å; L353-I356 HydrophobicContact CD1-CD1 4.14Å; L353-I356 PolarHBondContact O-N 3.44Å; L353-L371 HydrophobicContact CD1-CD2 3.54Å; L353-Y388 HydrophobicContact CD2-CD1 3.87Å; L353-Y388 HydrophobicContact CD2-CD2 3.98Å; L353-Y388 HydrophobicContact CD2-CE1 3.65Å; L353-Y388 HydrophobicContact CD2-CE2 3.77Å; L353-Y388 HydrophobicContact CD2-CG 4.04Å
354	T	95.8	Very high	96.4	Very high	102 Å²	102	45.9 Å²	45.9	63%	0.626	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-57.5	-18.6	-170.1	55.9	0	0	0	0	115.6	F334 E352	F334-T354 HydrophobicContact CD1-CG2 4.03Å; F334-T354 HydrophobicContact CD2-CG2 4.29Å; F334-T354 HydrophobicContact CE1-CG2 4.04Å; F334-T354 HydrophobicContact CE2-CG2 4.3Å; F334-T354 HydrophobicContact CG-CG2 4.16Å; F334-T354 HydrophobicContact CZ-CG2 4.18Å; E352-T354 HydrophobicContact CB-CG2 4.4Å; E352-T354 PolarHBondContact O-N 3.43Å
355	A	94.9	Very high	96.5	Very high	73 Å²	73	42.5 Å²	42.5	60%	0.603	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84	-10.5	174.9	0	0	0	0	0	114.6	L353	L353-A355 PolarHBondContact O-N 3.38Å
356	I	95.4	Very high	96.5	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117	-177.5	-71.6	154.9	0	0	0	108.7	F334 L335 L353 V361 L373 I386 Y388	F334-I356 WeakPolarHBondContact CA-O 3.46Å; L335-I356 HydrophobicContact CD1-CG2 3.98Å; L335-I356 HydrophobicContact CG-CG2 4.15Å; L353-I356 HydrophobicContact CB-CB 4.39Å; L353-I356 HydrophobicContact CB-CD1 4.12Å; L353-I356 HydrophobicContact CD1-CD1 4.14Å; L353-I356 PolarHBondContact O-N 3.44Å; I356-V361 HydrophobicContact CG2-CG2 4.02Å; I356-L373 HydrophobicContact CD1-CD1 3.83Å; I356-L373 HydrophobicContact CG1-CD1 4.17Å; I356-L373 HydrophobicContact CG2-CD1 3.62Å; I356-I386 HydrophobicContact CD1-CG2 4.05Å; I356-I386 HydrophobicContact CG1-CD1 4.31Å; I356-I386 HydrophobicContact CG1-CG2 4.28Å; I356-Y388 HydrophobicContact CD1-CD2 4.08Å
357	N	96	Very high	96.5	Very high	64 Å²	64	39.9 Å²	39.9	34%	0.342	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	131.4	177	-169.1	-37	0	0	0	110.6	S359 Q360	N357-S359 PolarHBondContact O-N 3.16Å; N357-S359 PolarHBondContact OD1-N 2.86Å; N357-S359 PolarHBondContact OD1-OG 3.32Å; N357-S359 VanDerWaalsContact OD1-OG 3.07Å; N357-Q360 HydrophobicContact CB-CG 4.34Å; N357-Q360 VanDerWaalsContact N-OE1 3.08Å; N357-Q360 WeakPolarHBondContact O-CB 3.29Å; N357-Q360 PolarHBondContact O-N 3.42Å
358	R	95	Very high	96.4	Very high	40 Å²	40	37.4 Å²	37.4	15%	0.151	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-4.3	179.6	87.8	115.1	-161.8	82.1	-8.3	114.9	Y305 V306 Y307 K308 Q333 L335 Q360	Y305-R358 VanDerWaalsContact O-CD 3.26Å; Y305-R358 WeakPolarHBondContact O-CD 3.34Å; Y305-R358 PolarHBondContact O-NE 2.97Å; V306-R358 VanDerWaalsContact O-CB 3.32Å; V306-R358 WeakPolarHBondContact O-CB 3.09Å; V306-R358 WeakPolarHBondContact O-CD 3.35Å; Y307-R358 CarbonylContact C-O 3.59Å; Y307-R358 WeakPolarHBondContact O-CD 3.31Å; Y307-R358 VanDerWaalsContact O-CZ 3.32Å; Y307-R358 PolarHBondContact O-NE 2.77Å; Y307-R358 PolarHBondContact O-NH1 2.91Å; K308-R358 PolarHBondContact N-O 3.04Å; Q333-R358 WeakPolarHBondContact O-CB 3.46Å; Q333-R358 PolarHBondContact O-N 2.92Å; L335-R358 HydrophobicContact CD2-CB 3.91Å; R358-Q360 VanDerWaalsContact C-N 3.35Å
359	S	95.3	Very high	96.4	Very high	64 Å²	64	32.6 Å²	32.6	45%	0.448	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-22.1	167.5	63.9	0	0	0	0	113.1	K308 N357	K308-S359 VanDerWaalsContact CD-O 3.32Å; K308-S359 WeakPolarHBondContact CD-O 3.36Å; N357-S359 PolarHBondContact O-N 3.16Å; N357-S359 PolarHBondContact OD1-N 2.86Å; N357-S359 PolarHBondContact OD1-OG 3.32Å; N357-S359 VanDerWaalsContact OD1-OG 3.07Å
360	Q	95	Very high	96.4	Very high	88 Å²	88	28.9 Å²	28.9	41%	0.411	17%	0.167	S	C	.	.	S	Bend	trans	-88	-16.8	-178.3	-55.9	171.3	-76.9	0	0	112.5	N357 R358 H385	N357-Q360 HydrophobicContact CB-CG 4.34Å; N357-Q360 VanDerWaalsContact N-OE1 3.08Å; N357-Q360 WeakPolarHBondContact O-CB 3.29Å; N357-Q360 PolarHBondContact O-N 3.42Å; R358-Q360 VanDerWaalsContact C-N 3.35Å; Q360-H385 PolarHBondContact O-CE1 3.13Å
361	V	97	Very high	96.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.15	C	C	.	.			trans	-107.8	134.7	-173.3	-173.5	0	0	0	0	110.5	Y307 K308 L335 I356 E363 L373	Y307-V361 HydrophobicContact CD1-CB 3.96Å; Y307-V361 HydrophobicContact CD1-CG1 3.46Å; Y307-V361 VanDerWaalsContact CD1-CG1 3.46Å; Y307-V361 HydrophobicContact CE1-CG1 3.76Å; Y307-V361 HydrophobicContact CG-CG1 4.11Å; K308-V361 WeakPolarHBondContact CB-O 3.05Å; K308-V361 WeakPolarHBondContact CG-O 3.31Å; K308-V361 PolarHBondContact N-O 2.72Å; L335-V361 HydrophobicContact CD1-CG2 4.23Å; I356-V361 HydrophobicContact CG2-CG2 4.02Å; V361-E363 WeakPolarHBondContact CG1-O 3.37Å; V361-L373 HydrophobicContact CG1-CB 4.37Å; V361-L373 HydrophobicContact CG1-CD2 3.94Å; V361-L373 HydrophobicContact CG2-CB 4.22Å; V361-L373 HydrophobicContact CG2-CD1 4Å; V361-L373 HydrophobicContact CG2-CD2 4.23Å; V361-L373 HydrophobicContact CG2-CG 4.39Å
362	A	97.2	Very high	96.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-112.8	-28	175.8	0	0	0	0	0	113.9	K308 T309 I374 D375 T377	K308-A362 HydrophobicContact CD-CB 4.23Å; K308-A362 HydrophobicContact CG-CB 4.21Å; T309-A362 HydrophobicContact CG2-CB 4.18Å; T309-A362 WeakPolarHBondContact CG2-O 3.4Å; T309-A362 PolarHBondContact OG1-O 2.84Å; A362-I374 PolarHBondContact N-O 3.19Å; A362-D375 WeakPolarHBondContact CB-O 3.48Å; A362-T377 HydrophobicContact CB-CG2 3.83Å
363	E	97	Very high	96.6	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.009	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	164.2	169.2	-109.1	-70.3	-130.4	0	0	110.3	Y307 V361 I374 T377 M411 V412	Y307-E363 VanDerWaalsContact CE2-OE2 3.26Å; Y307-E363 WeakPolarHBondContact CE2-OE2 3.39Å; V361-E363 WeakPolarHBondContact CG1-O 3.37Å; E363-I374 HydrophobicContact CB-CB 4.38Å; E363-I374 HydrophobicContact CB-CD1 4.19Å; E363-I374 PolarHBondContact O-N 2.96Å; E363-T377 HydrophobicContact CB-CG2 4.06Å; E363-T377 HydrophobicContact CG-CG2 4.12Å; E363-M411 VanDerWaalsContact OE1-C 3.31Å; E363-M411 VanDerWaalsContact OE1-CA 3.22Å; E363-M411 WeakPolarHBondContact OE1-CA 3.41Å; E363-V412 HydrophobicContact CB-CG2 4.32Å; E363-V412 HydrophobicContact CG-CG2 4.14Å; E363-V412 PolarHBondContact OE1-N 2.72Å
364	S	97.8	Very high	96.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	170.8	173.6	100.6	0	0	0	0	113.3	Y307 D315 Y372	Y307-S364 VanDerWaalsContact OH-CB 3.23Å; Y307-S364 WeakPolarHBondContact OH-CB 3.28Å; Y307-S364 PolarHBondContact OH-OG 2.89Å; D315-S364 PolarHBondContact OD2-OG 3.23Å; S364-Y372 WeakPolarHBondContact CA-O 3.43Å
365	F	98.1	Very high	96.7	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.009	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	163.2	157.3	58.8	-90	0	0	0	110.3	L189 F192 V367 Y372 I374 V384 V412 L421	L189-F365 HydrophobicContact CD2-CE2 4.13Å; L189-F365 HydrophobicContact CD2-CZ 3.92Å; F192-F365 HydrophobicContact CE1-CE1 4.31Å; F192-F365 AromaticContact CE1-CZ 3.79Å; F192-F365 HydrophobicContact CE1-CZ 3.79Å; F192-F365 HydrophobicContact CZ-CE1 4.17Å; F192-F365 AromaticContact CZ-CZ 3.79Å; F192-F365 HydrophobicContact CZ-CZ 3.79Å; F365-V367 HydrophobicContact CD2-CG2 3.81Å; F365-V367 HydrophobicContact CE2-CG2 3.86Å; F365-Y372 HydrophobicContact CD2-CD2 4.05Å; F365-Y372 HydrophobicContact CD2-CG 4.29Å; F365-Y372 VanDerWaalsContact CE2-CB 3.49Å; F365-Y372 HydrophobicContact CE2-CD1 4.39Å; F365-Y372 AromaticContact CE2-CD2 3.65Å; F365-Y372 HydrophobicContact CE2-CD2 3.65Å; F365-Y372 AromaticContact CE2-CG 3.59Å; F365-Y372 HydrophobicContact CE2-CG 3.59Å; F365-Y372 VanDerWaalsContact CZ-CB 3.4Å; F365-Y372 HydrophobicContact CZ-CD1 4.45Å; F365-Y372 HydrophobicContact CZ-CD2 4.37Å; F365-Y372 AromaticContact CZ-CG 3.85Å; F365-Y372 HydrophobicContact CZ-CG 3.85Å; F365-Y372 PolarHBondContact N-O 2.75Å; F365-Y372 VanDerWaalsContact N-O 3.12Å; F365-Y372 PolarHBondContact O-N 3.33Å; F365-I374 HydrophobicContact CD1-CD1 4.22Å; F365-I374 HydrophobicContact CE1-CD1 4.13Å; F365-I374 HydrophobicContact CE1-CG1 4.25Å; F365-V384 HydrophobicContact CE1-CG2 3.98Å; F365-V384 HydrophobicContact CZ-CG2 4.09Å; F365-V412 HydrophobicContact CB-CG1 4.49Å; F365-V412 HydrophobicContact CD1-CG1 3.87Å; F365-V412 HydrophobicContact CG-CG1 4.47Å; F365-L421 HydrophobicContact CB-CD2 3.83Å; F365-L421 HydrophobicContact CD1-CD1 4.04Å; F365-L421 HydrophobicContact CD1-CD2 4Å; F365-L421 HydrophobicContact CD2-CD1 4.32Å; F365-L421 HydrophobicContact CD2-CD2 3.6Å; F365-L421 HydrophobicContact CE1-CD1 3.8Å; F365-L421 HydrophobicContact CE1-CD2 4.49Å; F365-L421 HydrophobicContact CE2-CD1 4.09Å; F365-L421 HydrophobicContact CE2-CD2 4.13Å; F365-L421 HydrophobicContact CG-CD1 4.3Å; F365-L421 HydrophobicContact CG-CD2 3.52Å; F365-L421 HydrophobicContact CZ-CD1 3.83Å
366	I	98	Very high	96.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138.2	176.8	-63.2	176.1	0	0	0	110.5	A317 D319 W324 I326 V337 S370 L371 L390 Y414	A317-I366 HydrophobicContact CB-CB 4Å; A317-I366 HydrophobicContact CB-CD1 4.09Å; A317-I366 HydrophobicContact CB-CG1 4.03Å; D319-I366 HydrophobicContact CB-CG2 4.02Å; W324-I366 HydrophobicContact CB-CD1 3.58Å; W324-I366 HydrophobicContact CD2-CD1 3.93Å; W324-I366 HydrophobicContact CE3-CD1 4.28Å; W324-I366 HydrophobicContact CG-CD1 3.61Å; I326-I366 HydrophobicContact CD1-CD1 4.09Å; V337-I366 HydrophobicContact CG1-CD1 4.23Å; I366-S370 VanDerWaalsContact CA-O 3.32Å; I366-S370 WeakPolarHBondContact CA-O 3.44Å; I366-L371 HydrophobicContact CD1-CD1 4.11Å; I366-L371 HydrophobicContact CG1-CB 4.24Å; I366-L371 HydrophobicContact CG1-CD1 3.58Å; I366-L390 HydrophobicContact CD1-CD1 3.99Å; I366-Y414 WeakPolarHBondContact O-CB 3.41Å; I366-Y414 VanDerWaalsContact O-CD1 3.24Å; I366-Y414 WeakPolarHBondContact O-CD1 3.47Å
367	V	97	Very high	96.7	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	128.3	170.9	-174.7	0	0	0	0	108.7	F365 G369 S370 Y372 Y414 I436	F365-V367 HydrophobicContact CD2-CG2 3.81Å; F365-V367 HydrophobicContact CE2-CG2 3.86Å; V367-G369 VanDerWaalsContact C-N 3.3Å; V367-G369 PolarHBondContact O-N 3.06Å; V367-S370 PolarHBondContact N-O 2.74Å; V367-S370 PolarHBondContact O-N 3.22Å; V367-Y372 HydrophobicContact CB-CD2 4.43Å; V367-Y372 HydrophobicContact CB-CE2 3.82Å; V367-Y372 HydrophobicContact CG2-CD2 4.4Å; V367-Y372 HydrophobicContact CG2-CE2 4.21Å; V367-Y414 HydrophobicContact CB-CD1 4.44Å; V367-Y414 HydrophobicContact CB-CE1 4.28Å; V367-Y414 HydrophobicContact CG1-CE1 3.89Å; V367-Y414 HydrophobicContact CG1-CE2 4.4Å; V367-Y414 HydrophobicContact CG2-CD1 3.94Å; V367-Y414 HydrophobicContact CG2-CD2 3.98Å; V367-Y414 HydrophobicContact CG2-CE1 4.1Å; V367-Y414 HydrophobicContact CG2-CE2 4.13Å; V367-Y414 HydrophobicContact CG2-CG 3.9Å; V367-I436 HydrophobicContact CG1-CD1 3.67Å; V367-I436 HydrophobicContact CG1-CG1 4.2Å
368	C	95	Very high	96.6	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.014	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.1	49.7	-177	-58.7	0	0	0	0	114.9	C187 D319 E320 N321 S370	C187-C368 HydrophobicContact CB-CB 3.77Å; C187-C368 WeakPolarHBondContact CB-SG 3.36Å; C187-C368 WeakPolarHBondContact SG-CB 3.39Å; C187-C368 CovalentContact SG-SG 2.02Å; C187-C368 PolarHBondContact SG-SG 3.4Å; D319-C368 VanDerWaalsContact OD2-CA 3.23Å; D319-C368 WeakPolarHBondContact OD2-CA 3.37Å; D319-C368 PolarHBondContact OD2-N 3.45Å; D319-C368 VanDerWaalsContact OD2-N 3.14Å; E320-C368 PolarHBondContact OE2-N 3Å; E320-C368 VanDerWaalsContact OE2-N 3.1Å; E320-C368 PolarHBondContact OE2-SG 2.95Å; N321-C368 VanDerWaalsContact ND2-C 3.3Å; N321-C368 WeakPolarHBondContact ND2-CA 3.39Å; C368-S370 PolarHBondContact O-N 3.35Å
369	G	95.4	Very high	96.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	12.5	177.8	0	0	0	0	0	115.2	D319 N321 V367 L390	D319-G369 PolarHBondContact OD2-N 2.9Å; N321-G369 PolarHBondContact ND2-N 3.01Å; V367-G369 VanDerWaalsContact C-N 3.3Å; V367-G369 PolarHBondContact O-N 3.06Å; G369-L390 VanDerWaalsContact O-CB 3.28Å; G369-L390 WeakPolarHBondContact O-CB 3.23Å; G369-L390 PolarHBondContact O-N 2.99Å
370	S	96.6	Very high	96.6	Very high	4 Å²	4	21 Å²	21	3%	0.028	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128.6	170.2	-62	0	0	0	0	109.9	I366 V367 C368 Y372 Y388	I366-S370 VanDerWaalsContact CA-O 3.32Å; I366-S370 WeakPolarHBondContact CA-O 3.44Å; V367-S370 PolarHBondContact N-O 2.74Å; V367-S370 PolarHBondContact O-N 3.22Å; C368-S370 PolarHBondContact O-N 3.35Å; S370-Y372 WeakPolarHBondContact O-CD2 3.31Å; S370-Y372 WeakPolarHBondContact O-CE2 3.31Å; S370-Y388 CarbonylContact C-O 3.48Å; S370-Y388 WeakPolarHBondContact CA-O 3.39Å
371	L	98	Very high	96.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	131.7	172.4	-179.7	72.3	0	0	0	109.7	I326 V337 L353 I366 L373 V387 Y388	I326-L371 HydrophobicContact CD1-CD1 4.33Å; I326-L371 HydrophobicContact CG1-CD1 3.98Å; V337-L371 HydrophobicContact CG2-CD2 3.96Å; L353-L371 HydrophobicContact CD1-CD2 3.54Å; I366-L371 HydrophobicContact CD1-CD1 4.11Å; I366-L371 HydrophobicContact CG1-CB 4.24Å; I366-L371 HydrophobicContact CG1-CD1 3.58Å; L371-L373 HydrophobicContact CD1-CD2 4.37Å; L371-L373 HydrophobicContact CD2-CD2 3.79Å; L371-L373 HydrophobicContact CD2-CG 4.4Å; L371-L373 HydrophobicContact CG-CD2 3.85Å; L371-L373 HydrophobicContact CG-CG 4.37Å; L371-V387 CarbonylContact O-C 3.5Å; L371-V387 VanDerWaalsContact O-CA 3.26Å; L371-V387 WeakPolarHBondContact O-CA 3.28Å; L371-Y388 PolarHBondContact N-O 3.21Å; L371-Y388 PolarHBondContact O-N 2.79Å
372	Y	98.3	Very high	96.7	Very high	5 Å²	5	23.9 Å²	23.9	2%	0.02	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.4	179.9	-64.2	-97.4	0	0	0	108.8	L189 S364 F365 V367 S370 V384 V387	L189-Y372 HydrophobicContact CB-CD1 4.3Å; L189-Y372 HydrophobicContact CB-CE1 3.56Å; L189-Y372 HydrophobicContact CD2-CD1 4.03Å; L189-Y372 HydrophobicContact CD2-CE1 4.13Å; L189-Y372 HydrophobicContact CG-CE1 4.48Å; L189-Y372 PolarHBondContact N-OH 2.69Å; L189-Y372 VanDerWaalsContact N-OH 3.07Å; S364-Y372 WeakPolarHBondContact CA-O 3.43Å; F365-Y372 HydrophobicContact CD2-CD2 4.05Å; F365-Y372 HydrophobicContact CD2-CG 4.29Å; F365-Y372 VanDerWaalsContact CE2-CB 3.49Å; F365-Y372 HydrophobicContact CE2-CD1 4.39Å; F365-Y372 AromaticContact CE2-CD2 3.65Å; F365-Y372 HydrophobicContact CE2-CD2 3.65Å; F365-Y372 AromaticContact CE2-CG 3.59Å; F365-Y372 HydrophobicContact CE2-CG 3.59Å; F365-Y372 VanDerWaalsContact CZ-CB 3.4Å; F365-Y372 HydrophobicContact CZ-CD1 4.45Å; F365-Y372 HydrophobicContact CZ-CD2 4.37Å; F365-Y372 AromaticContact CZ-CG 3.85Å; F365-Y372 HydrophobicContact CZ-CG 3.85Å; F365-Y372 PolarHBondContact N-O 2.75Å; F365-Y372 VanDerWaalsContact N-O 3.12Å; F365-Y372 PolarHBondContact O-N 3.33Å; V367-Y372 HydrophobicContact CB-CD2 4.43Å; V367-Y372 HydrophobicContact CB-CE2 3.82Å; V367-Y372 HydrophobicContact CG2-CD2 4.4Å; V367-Y372 HydrophobicContact CG2-CE2 4.21Å; S370-Y372 WeakPolarHBondContact O-CD2 3.31Å; S370-Y372 WeakPolarHBondContact O-CE2 3.31Å; Y372-V384 HydrophobicContact CD1-CG1 4.11Å; Y372-V387 HydrophobicContact CD1-CB 4.36Å; Y372-V387 HydrophobicContact CD1-CG1 3.98Å; Y372-V387 HydrophobicContact CD1-CG2 3.48Å; Y372-V387 VanDerWaalsContact CD1-CG2 3.48Å; Y372-V387 HydrophobicContact CE1-CB 4.4Å; Y372-V387 HydrophobicContact CE1-CG1 3.71Å; Y372-V387 HydrophobicContact CE1-CG2 3.7Å; Y372-V387 HydrophobicContact CG-CG1 4.46Å; Y372-V387 HydrophobicContact CG-CG2 4.36Å
373	L	98.1	Very high	96.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	114.1	-171.2	-60.1	178.3	0	0	0	112.2	L335 I356 V361 L371 V384 H385 I386	L335-L373 HydrophobicContact CD1-CD1 4.47Å; L335-L373 HydrophobicContact CD1-CD2 3.91Å; I356-L373 HydrophobicContact CD1-CD1 3.83Å; I356-L373 HydrophobicContact CG1-CD1 4.17Å; I356-L373 HydrophobicContact CG2-CD1 3.62Å; V361-L373 HydrophobicContact CG1-CB 4.37Å; V361-L373 HydrophobicContact CG1-CD2 3.94Å; V361-L373 HydrophobicContact CG2-CB 4.22Å; V361-L373 HydrophobicContact CG2-CD1 4Å; V361-L373 HydrophobicContact CG2-CD2 4.23Å; V361-L373 HydrophobicContact CG2-CG 4.39Å; L371-L373 HydrophobicContact CD1-CD2 4.37Å; L371-L373 HydrophobicContact CD2-CD2 3.79Å; L371-L373 HydrophobicContact CD2-CG 4.4Å; L371-L373 HydrophobicContact CG-CD2 3.85Å; L371-L373 HydrophobicContact CG-CG 4.37Å; L373-V384 VanDerWaalsContact O-CA 3.32Å; L373-V384 WeakPolarHBondContact O-CA 3.34Å; L373-H385 PolarHBondContact O-N 3.23Å; L373-H385 VanDerWaalsContact O-N 3.09Å; L373-H385 PolarHBondContact O-ND1 3.48Å; L373-I386 HydrophobicContact CB-CB 4.29Å; L373-I386 HydrophobicContact CD1-CB 4.02Å; L373-I386 HydrophobicContact CD1-CG2 3.89Å; L373-I386 PolarHBondContact N-O 2.78Å
374	I	97.9	Very high	96.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	130.2	178.2	-58.5	172.5	0	0	0	109	A362 E363 F365 D376 K383 V384 W402 V412	A362-I374 PolarHBondContact N-O 3.19Å; E363-I374 HydrophobicContact CB-CB 4.38Å; E363-I374 HydrophobicContact CB-CD1 4.19Å; E363-I374 PolarHBondContact O-N 2.96Å; F365-I374 HydrophobicContact CD1-CD1 4.22Å; F365-I374 HydrophobicContact CE1-CD1 4.13Å; F365-I374 HydrophobicContact CE1-CG1 4.25Å; I374-D376 WeakPolarHBondContact CG2-O 3.49Å; I374-K383 WeakPolarHBondContact CA-O 3.47Å; I374-V384 HydrophobicContact CG1-CG2 4.01Å; I374-W402 HydrophobicContact CD1-CD2 4.05Å; I374-W402 HydrophobicContact CD1-CG 4.29Å; I374-W402 HydrophobicContact CD1-CZ2 4.16Å; I374-W402 HydrophobicContact CG2-CG 4.26Å; I374-V412 HydrophobicContact CD1-CG1 4.22Å; I374-V412 HydrophobicContact CD1-CG2 4.17Å
375	D	97.1	Very high	96.7	Very high	40 Å²	40	28.3 Å²	28.3	21%	0.214	14%	0.139	C	C	.	.	S	Bend	trans	-73.2	-39.2	-178.3	63.8	-10.1	0	0	0	113.7	K308 A362 A382 K383 H385	K308-D375 WeakPolarHBondContact CE-O 3.49Å; K308-D375 PolarHBondContact NZ-O 3.48Å; A362-D375 WeakPolarHBondContact CB-O 3.48Å; D375-A382 WeakPolarHBondContact OD1-CA 3.29Å; D375-A382 WeakPolarHBondContact OD1-CB 3.49Å; D375-K383 PolarHBondContact N-O 2.67Å; D375-K383 PolarHBondContact OD1-N 3.11Å; D375-K383 VanDerWaalsContact OD1-O 3.11Å; D375-K383 WeakPolarHBondContact OD2-CG 3.49Å; D375-H385 HydrophobicContact CB-CB 4.45Å
376	D	96.7	Very high	96.6	Very high	30 Å²	30	28.7 Å²	28.7	16%	0.16	14%	0.141	C	C	.	.			trans	-145.7	151.9	-178.7	-150.9	-85.1	0	0	0	115	K308 I374 R378 E379 A382 N404	K308-D376 WeakPolarHBondContact CE-OD2 3.44Å; K308-D376 IonicContact NZ-OD2 3.88Å; K308-D376 PolarHBondContact NZ-OD2 2.98Å; I374-D376 WeakPolarHBondContact CG2-O 3.49Å; D376-R378 WeakPolarHBondContact OD1-CA 3.16Å; D376-R378 WeakPolarHBondContact OD1-CB 3.39Å; D376-R378 PolarHBondContact OD1-N 3.02Å; D376-E379 HydrophobicContact CB-CB 4.31Å; D376-E379 PolarHBondContact OD1-N 2.6Å; D376-A382 HydrophobicContact CB-CB 4.36Å; D376-A382 VanDerWaalsContact O-CB 3.27Å; D376-A382 WeakPolarHBondContact O-CB 3.27Å; D376-N404 PolarHBondContact O-ND2 2.65Å
377	T	95.1	Very high	96.6	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.018	15%	0.147	C	C	.	.	S	Bend	trans	-118.6	-5.6	178.6	53.4	0	0	0	0	114.2	T309 A362 E363 N404 K407 N408 T409	T309-T377 WeakPolarHBondContact CG2-OG1 3.33Å; A362-T377 HydrophobicContact CB-CG2 3.83Å; E363-T377 HydrophobicContact CB-CG2 4.06Å; E363-T377 HydrophobicContact CG-CG2 4.12Å; T377-N404 WeakPolarHBondContact CA-ND2 3.2Å; T377-K407 CarbonylContact O-C 3.48Å; T377-K407 VanDerWaalsContact O-C 3.24Å; T377-N408 PolarHBondContact O-N 3.37Å; T377-T409 VanDerWaalsContact CB-O 3.29Å; T377-T409 WeakPolarHBondContact CB-O 3.31Å; T377-T409 HydrophobicContact CG2-CG2 4.16Å; T377-T409 WeakPolarHBondContact CG2-O 3.37Å; T377-T409 PolarHBondContact O-N 3.19Å
378	R	93.6	Very high	96.6	Very high	104 Å²	104	31.1 Å²	31.1	39%	0.392	15%	0.152	S	C	.	.	S	Bend	trans	-106.7	-28	179.9	-56.5	-179.5	-177.6	-157.6	-2.5	111.9	D24 D376 K407	D24-R378 IonicContact OD1-NH1 2.79Å; D376-R378 WeakPolarHBondContact OD1-CA 3.16Å; D376-R378 WeakPolarHBondContact OD1-CB 3.39Å; D376-R378 PolarHBondContact OD1-N 3.02Å; R378-K407 WeakPolarHBondContact O-CB 3.3Å; R378-K407 WeakPolarHBondContact O-CD 3.38Å; R378-K407 WeakPolarHBondContact O-CG 3.39Å
379	E	95.1	Very high	96.6	Very high	112 Å²	112	31.4 Å²	31.4	52%	0.523	15%	0.154	S	C	.	.	S	Bend	trans	-77.8	141.1	169.3	-76.1	-55.9	154.4	0	0	112.4	D376 N404	D376-E379 HydrophobicContact CB-CB 4.31Å; D376-E379 PolarHBondContact OD1-N 2.6Å; E379-N404 WeakPolarHBondContact O-CB 3.39Å; E379-N404 PolarHBondContact O-ND2 3Å
380	V	95.6	Very high	96.6	Very high	50 Å²	50	31.4 Å²	31.4	30%	0.303	15%	0.154	S	C	.	.	S	Bend	trans	-72.1	-38.5	-179.8	170	0	0	0	0	111.1	V403 N404 K407	V380-V403 HydrophobicContact CG1-CG1 4.35Å; V380-V403 VanDerWaalsContact O-CA 3.28Å; V380-V403 WeakPolarHBondContact O-CA 3.44Å; V380-N404 PolarHBondContact O-N 2.9Å; V380-K407 HydrophobicContact CG2-CD 4.24Å; V380-K407 VanDerWaalsContact CG2-CE 3.42Å; V380-K407 HydrophobicContact CG2-CG 3.81Å
381	N	95.9	Very high	96.4	Very high	141 Å²	141	32.3 Å²	32.3	75%	0.754	16%	0.157	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	87.4	177.7	-61	-30	0	0	0	107.9
382	A	96.9	Very high	96.1	Very high	7 Å²	7	35.2 Å²	35.2	6%	0.058	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-172.7	174.6	0	0	0	0	0	109.1	D375 D376 W402 N404	D375-A382 WeakPolarHBondContact OD1-CA 3.29Å; D375-A382 WeakPolarHBondContact OD1-CB 3.49Å; D376-A382 HydrophobicContact CB-CB 4.36Å; D376-A382 VanDerWaalsContact O-CB 3.27Å; D376-A382 WeakPolarHBondContact O-CB 3.27Å; A382-W402 CarbonylContact C-O 3.41Å; A382-W402 HydrophobicContact CB-CB 4.38Å; A382-W402 PolarHBondContact N-O 2.86Å; A382-W402 PolarHBondContact O-N 3.41Å; A382-N404 WeakPolarHBondContact CB-ND2 3.42Å
383	K	97.5	Very high	95.8	Very high	67 Å²	67	41.2 Å²	41.2	29%	0.291	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	158.4	173.3	52.8	167.7	175.4	172.8	0	113.5	I374 D375 H385 D399 I400	I374-K383 WeakPolarHBondContact CA-O 3.47Å; D375-K383 PolarHBondContact N-O 2.67Å; D375-K383 PolarHBondContact OD1-N 3.11Å; D375-K383 VanDerWaalsContact OD1-O 3.11Å; D375-K383 WeakPolarHBondContact OD2-CG 3.49Å; K383-H385 HydrophobicContact CD-CB 4.17Å; K383-H385 HydrophobicContact CG-CB 4.25Å; K383-H385 PolarHBondContact O-N 2.74Å; K383-D399 WeakPolarHBondContact CD-OD1 3.3Å; K383-D399 WeakPolarHBondContact CE-OD1 3.28Å; K383-D399 IonicContact NZ-OD1 2.66Å; K383-D399 PolarHBondContact NZ-OD1 3.28Å; K383-I400 CarbonylContact C-O 3.55Å; K383-I400 VanDerWaalsContact CA-O 3.28Å; K383-I400 WeakPolarHBondContact CA-O 3.44Å; K383-I400 WeakPolarHBondContact CB-O 3.25Å
384	V	97.9	Very high	95.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	114	153.6	176.2	0	0	0	0	108	F192 F365 Y372 L373 I374 I386 V387 A398 I400	F192-V384 HydrophobicContact CE2-CG2 4.25Å; F192-V384 HydrophobicContact CZ-CG2 3.87Å; F365-V384 HydrophobicContact CE1-CG2 3.98Å; F365-V384 HydrophobicContact CZ-CG2 4.09Å; Y372-V384 HydrophobicContact CD1-CG1 4.11Å; L373-V384 VanDerWaalsContact O-CA 3.32Å; L373-V384 WeakPolarHBondContact O-CA 3.34Å; I374-V384 HydrophobicContact CG1-CG2 4.01Å; V384-I386 WeakPolarHBondContact CG1-O 3.22Å; V384-V387 HydrophobicContact CG1-CG2 4.01Å; V384-A398 CarbonylContact O-C 3.51Å; V384-I400 HydrophobicContact CB-CB 4.24Å; V384-I400 PolarHBondContact N-O 2.79Å; V384-I400 PolarHBondContact O-N 3.36Å; V384-I400 VanDerWaalsContact O-N 3.17Å
385	H	96.5	Very high	95.5	Very high	28 Å²	28	48 Å²	48	13%	0.13	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	-23	-173.8	71.9	-70.9	0	0	0	113.6	Q360 L373 D375 K383 A398	Q360-H385 PolarHBondContact O-CE1 3.13Å; L373-H385 PolarHBondContact O-N 3.23Å; L373-H385 VanDerWaalsContact O-N 3.09Å; L373-H385 PolarHBondContact O-ND1 3.48Å; D375-H385 HydrophobicContact CB-CB 4.45Å; K383-H385 HydrophobicContact CD-CB 4.17Å; K383-H385 HydrophobicContact CG-CB 4.25Å; K383-H385 PolarHBondContact O-N 2.74Å; H385-A398 CarbonylContact C-O 3.54Å; H385-A398 WeakPolarHBondContact CA-O 3.17Å; H385-A398 PolarHBondContact O-N 2.88Å
386	I	97.1	Very high	95.4	Very high	10 Å²	10	49.8 Å²	49.8	5%	0.051	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.2	176.5	-66.7	168.2	0	0	0	108.9	I356 L373 V384 Q395	I356-I386 HydrophobicContact CD1-CG2 4.05Å; I356-I386 HydrophobicContact CG1-CD1 4.31Å; I356-I386 HydrophobicContact CG1-CG2 4.28Å; L373-I386 HydrophobicContact CB-CB 4.29Å; L373-I386 HydrophobicContact CD1-CB 4.02Å; L373-I386 HydrophobicContact CD1-CG2 3.89Å; L373-I386 PolarHBondContact N-O 2.78Å; V384-I386 WeakPolarHBondContact CG1-O 3.22Å; I386-Q395 HydrophobicContact CG2-CG 3.72Å
387	V	97.2	Very high	95.3	Very high	21 Å²	21	56.9 Å²	56.9	13%	0.127	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.5	168.1	-176.1	0	0	0	0	109	L371 Y372 V384 Q395 R396 A398	L371-V387 CarbonylContact O-C 3.5Å; L371-V387 VanDerWaalsContact O-CA 3.26Å; L371-V387 WeakPolarHBondContact O-CA 3.28Å; Y372-V387 HydrophobicContact CD1-CB 4.36Å; Y372-V387 HydrophobicContact CD1-CG1 3.98Å; Y372-V387 HydrophobicContact CD1-CG2 3.48Å; Y372-V387 VanDerWaalsContact CD1-CG2 3.48Å; Y372-V387 HydrophobicContact CE1-CB 4.4Å; Y372-V387 HydrophobicContact CE1-CG1 3.71Å; Y372-V387 HydrophobicContact CE1-CG2 3.7Å; Y372-V387 HydrophobicContact CG-CG1 4.46Å; Y372-V387 HydrophobicContact CG-CG2 4.36Å; V384-V387 HydrophobicContact CG1-CG2 4.01Å; V387-Q395 CarbonylContact O-C 3.57Å; V387-Q395 WeakPolarHBondContact O-CA 3.47Å; V387-R396 PolarHBondContact N-O 3.27Å; V387-R396 PolarHBondContact O-N 3.43Å; V387-A398 HydrophobicContact CG2-CB 3.86Å
388	Y	96.9	Very high	95.2	Very high	30 Å²	30	58 Å²	58	12%	0.118	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	113	176	-167.5	-78.1	0	0	0	110.2	L353 I356 S370 L371 L390 Y393 Q395	L353-Y388 HydrophobicContact CD2-CD1 3.87Å; L353-Y388 HydrophobicContact CD2-CD2 3.98Å; L353-Y388 HydrophobicContact CD2-CE1 3.65Å; L353-Y388 HydrophobicContact CD2-CE2 3.77Å; L353-Y388 HydrophobicContact CD2-CG 4.04Å; I356-Y388 HydrophobicContact CD1-CD2 4.08Å; S370-Y388 CarbonylContact C-O 3.48Å; S370-Y388 WeakPolarHBondContact CA-O 3.39Å; L371-Y388 PolarHBondContact N-O 3.21Å; L371-Y388 PolarHBondContact O-N 2.79Å; Y388-L390 HydrophobicContact CD1-CD2 3.81Å; Y388-L390 HydrophobicContact CD1-CG 4.28Å; Y388-L390 HydrophobicContact CE1-CD2 4.14Å; Y388-L390 PolarHBondContact O-N 3.31Å; Y388-Y393 WeakPolarHBondContact OH-CA 3.48Å; Y388-Y393 PolarHBondContact OH-O 3.02Å; Y388-Q395 HydrophobicContact CD2-CB 3.8Å; Y388-Q395 HydrophobicContact CD2-CG 4.4Å; Y388-Q395 HydrophobicContact CE2-CB 4.22Å
389	D	95.3	Very high	95.4	Very high	7 Å²	7	58.5 Å²	58.5	4%	0.037	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	104.6	173	-173.5	-37.4	0	0	0	108.5	Y391 R392 Y393 K394	D389-Y391 VanDerWaalsContact C-N 3.33Å; D389-Y391 PolarHBondContact O-N 2.94Å; D389-Y391 PolarHBondContact OD1-N 2.9Å; D389-R392 HydrophobicContact CB-CB 4.14Å; D389-R392 PolarHBondContact O-N 2.78Å; D389-R392 WeakPolarHBondContact OD1-CB 3.47Å; D389-R392 WeakPolarHBondContact OD1-CG 3.39Å; D389-R392 PolarHBondContact OD1-N 2.87Å; D389-R392 WeakPolarHBondContact OD2-CD 3.06Å; D389-R392 WeakPolarHBondContact OD2-CG 3.47Å; D389-R392 IonicContact OD2-NE 3.2Å; D389-Y393 WeakPolarHBondContact O-CA 3.2Å; D389-Y393 PolarHBondContact O-N 2.91Å; D389-K394 PolarHBondContact N-O 2.86Å; D389-K394 PolarHBondContact O-N 3.28Å; D389-K394 VanDerWaalsContact O-N 3.11Å
390	L	95.3	Very high	95.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-38.7	-174	-63.6	162.8	0	0	0	110.6	W324 V337 W351 I366 G369 Y388 Y393	W324-L390 HydrophobicContact CE3-CD1 3.88Å; W324-L390 HydrophobicContact CH2-CD1 4.09Å; W324-L390 HydrophobicContact CZ3-CD1 3.61Å; V337-L390 HydrophobicContact CB-CD2 4.17Å; V337-L390 HydrophobicContact CG1-CD1 4.16Å; V337-L390 HydrophobicContact CG1-CD2 4.13Å; V337-L390 HydrophobicContact CG2-CD2 4.29Å; W351-L390 HydrophobicContact CB-CD2 4.32Å; W351-L390 HydrophobicContact CD2-CB 4.45Å; W351-L390 HydrophobicContact CD2-CD2 4.08Å; W351-L390 HydrophobicContact CG-CD2 4Å; W351-L390 HydrophobicContact CZ2-CB 3.96Å; W351-L390 PolarHBondContact NE1-O 2.84Å; I366-L390 HydrophobicContact CD1-CD1 3.99Å; G369-L390 VanDerWaalsContact O-CB 3.28Å; G369-L390 WeakPolarHBondContact O-CB 3.23Å; G369-L390 PolarHBondContact O-N 2.99Å; Y388-L390 HydrophobicContact CD1-CD2 3.81Å; Y388-L390 HydrophobicContact CD1-CG 4.28Å; Y388-L390 HydrophobicContact CE1-CD2 4.14Å; Y388-L390 PolarHBondContact O-N 3.31Å; L390-Y393 PolarHBondContact O-N 2.78Å
391	Y	92.5	Very high	95.5	Very high	24 Å²	24	56.3 Å²	56.3	9%	0.094	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-35	180	-75.5	-83.1	0	0	0	113.3	I180 D182 A183 N321 W324 D389	I180-Y391 VanDerWaalsContact CG2-CB 3.48Å; I180-Y391 HydrophobicContact CG2-CD1 3.54Å; I180-Y391 HydrophobicContact CG2-CE1 4.4Å; I180-Y391 HydrophobicContact CG2-CG 3.63Å; D182-Y391 VanDerWaalsContact C-CE1 3.48Å; D182-Y391 HydrophobicContact CB-CE1 4.27Å; D182-Y391 VanDerWaalsContact O-CE1 3.3Å; D182-Y391 WeakPolarHBondContact O-CE1 3.11Å; D182-Y391 PolarHBondContact O-OH 2.77Å; A183-Y391 HydrophobicContact CB-CD1 4.1Å; A183-Y391 HydrophobicContact CB-CD2 4.29Å; A183-Y391 HydrophobicContact CB-CE1 3.84Å; A183-Y391 HydrophobicContact CB-CE2 4.03Å; A183-Y391 HydrophobicContact CB-CG 4.31Å; N321-Y391 HydrophobicContact CB-CE2 4.4Å; W324-Y391 HydrophobicContact CH2-CE2 4.08Å; W324-Y391 HydrophobicContact CZ2-CE2 4.28Å; D389-Y391 VanDerWaalsContact C-N 3.33Å; D389-Y391 PolarHBondContact O-N 2.94Å; D389-Y391 PolarHBondContact OD1-N 2.9Å
392	R	91.4	Very high	95.6	Very high	61 Å²	61	49.9 Å²	49.9	23%	0.23	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-1.9	176.3	-58.5	-174.4	-173.4	-139.4	-13.1	114	I180 H186 D389 K394	I180-R392 HydrophobicContact CD1-CG 4.18Å; H186-R392 PolarHBondContact CE1-NH2 3.36Å; D389-R392 HydrophobicContact CB-CB 4.14Å; D389-R392 PolarHBondContact O-N 2.78Å; D389-R392 WeakPolarHBondContact OD1-CB 3.47Å; D389-R392 WeakPolarHBondContact OD1-CG 3.39Å; D389-R392 PolarHBondContact OD1-N 2.87Å; D389-R392 WeakPolarHBondContact OD2-CD 3.06Å; D389-R392 WeakPolarHBondContact OD2-CG 3.47Å; D389-R392 IonicContact OD2-NE 3.2Å; R392-K394 HydrophobicContact CB-CB 4.1Å; R392-K394 PolarHBondContact O-N 2.87Å
393	Y	92.9	Very high	95.6	Very high	130 Å²	130	52.2 Å²	52.2	51%	0.51	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	34.7	-174.2	-59.7	-101	0	0	0	112.9	W351 Y388 D389 L390	W351-Y393 AromaticContact CD1-CD1 3.54Å; W351-Y393 AromaticContact CD1-CE1 3.37Å; W351-Y393 HydrophobicContact CG-CE1 4.43Å; W351-Y393 AromaticContact NE1-CD1 3.64Å; W351-Y393 AromaticContact NE1-CE1 3.22Å; W351-Y393 AromaticContact NE1-CZ 3.56Å; Y388-Y393 WeakPolarHBondContact OH-CA 3.48Å; Y388-Y393 PolarHBondContact OH-O 3.02Å; D389-Y393 WeakPolarHBondContact O-CA 3.2Å; D389-Y393 PolarHBondContact O-N 2.91Å; L390-Y393 PolarHBondContact O-N 2.78Å
394	K	94.2	Very high	95.5	Very high	77 Å²	77	49 Å²	49	34%	0.335	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	106.3	-165.7	-169.8	164.8	-176.3	171.9	0	111.6	E175 D389 R392	E175-K394 IonicContact OE1-NZ 2.74Å; E175-K394 PolarHBondContact OE1-NZ 2.96Å; E175-K394 IonicContact OE2-NZ 2.79Å; E175-K394 PolarHBondContact OE2-NZ 2.96Å; D389-K394 PolarHBondContact N-O 2.86Å; D389-K394 PolarHBondContact O-N 3.28Å; D389-K394 VanDerWaalsContact O-N 3.11Å; R392-K394 HydrophobicContact CB-CB 4.1Å; R392-K394 PolarHBondContact O-N 2.87Å
395	Q	94.9	Very high	95.4	Very high	67 Å²	67	52.9 Å²	52.9	31%	0.313	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	145.3	166.4	-169.8	173	-35.1	0	0	110.7	I386 V387 Y388	I386-Q395 HydrophobicContact CG2-CG 3.72Å; V387-Q395 CarbonylContact O-C 3.57Å; V387-Q395 WeakPolarHBondContact O-CA 3.47Å; Y388-Q395 HydrophobicContact CD2-CB 3.8Å; Y388-Q395 HydrophobicContact CD2-CG 4.4Å; Y388-Q395 HydrophobicContact CE2-CB 4.22Å
396	R	94.6	Very high	95.3	Very high	77 Å²	77	55.4 Å²	55.4	29%	0.291	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	143.1	167.8	-57.3	-175.8	-173.3	-130.4	-7.1	108.5	E175 V387	E175-R396 IonicContact OE2-NH2 2.67Å; E175-R396 PolarHBondContact OE2-NH2 2.84Å; V387-R396 PolarHBondContact N-O 3.27Å; V387-R396 PolarHBondContact O-N 3.43Å
397	E	94.9	Very high	95.1	Very high	178 Å²	178	59.8 Å²	59.8	83%	0.832	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	153.2	165.1	-67	-178.5	-177.7	0	0	109.8
398	A	93.9	Very high	94.9	Very high	27 Å²	27	59 Å²	59	22%	0.223	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	164.3	179.5	0	0	0	0	0	111	V384 H385 V387 I400	V384-A398 CarbonylContact O-C 3.51Å; H385-A398 CarbonylContact C-O 3.54Å; H385-A398 WeakPolarHBondContact CA-O 3.17Å; H385-A398 PolarHBondContact O-N 2.88Å; V387-A398 HydrophobicContact CG2-CB 3.86Å; A398-I400 HydrophobicContact CB-CG1 4.37Å
399	D	96	Very high	94.8	Very high	115 Å²	115	57.6 Å²	57.6	62%	0.615	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	58.9	176.4	-156.1	56.2	0	0	0	109.2	K383 P401	K383-D399 WeakPolarHBondContact CD-OD1 3.3Å; K383-D399 WeakPolarHBondContact CE-OD1 3.28Å; K383-D399 IonicContact NZ-OD1 2.66Å; K383-D399 PolarHBondContact NZ-OD1 3.28Å; D399-P401 WeakPolarHBondContact O-CD 3.4Å
400	I	97	Very high	94.7	Very high	20 Å²	20	57.3 Å²	57.3	10%	0.103	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	110.2	-179.3	-45.4	178	0	0	0	108.5	L189 F192 K383 V384 A398 W402	L189-I400 HydrophobicContact CD2-CD1 4.08Å; L189-I400 HydrophobicContact CG-CD1 4.37Å; F192-I400 HydrophobicContact CD2-CG2 3.8Å; F192-I400 HydrophobicContact CE2-CB 4.23Å; F192-I400 HydrophobicContact CE2-CG2 3.55Å; F192-I400 HydrophobicContact CZ-CG2 4.39Å; K383-I400 CarbonylContact C-O 3.55Å; K383-I400 VanDerWaalsContact CA-O 3.28Å; K383-I400 WeakPolarHBondContact CA-O 3.44Å; K383-I400 WeakPolarHBondContact CB-O 3.25Å; V384-I400 HydrophobicContact CB-CB 4.24Å; V384-I400 PolarHBondContact N-O 2.79Å; V384-I400 PolarHBondContact O-N 3.36Å; V384-I400 VanDerWaalsContact O-N 3.17Å; A398-I400 HydrophobicContact CB-CG1 4.37Å; I400-W402 PolarHBondContact O-N 3.1Å
401	P	97.5	Very high	94.8	Very high	96 Å²	96	57.4 Å²	57.4	62%	0.623	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	127.2	-172.4	-22.4	34.6	0	0	0	112.6	F192 D399	F192-P401 VanDerWaalsContact CD2-O 3.25Å; F192-P401 WeakPolarHBondContact CD2-O 3.35Å; D399-P401 WeakPolarHBondContact O-CD 3.4Å
402	W	97.4	Very high	95	Very high	6 Å²	6	56.3 Å²	56.3	2%	0.023	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	150.4	178.3	178.7	-104.8	0	0	0	110.6	F192 I374 A382 I400 N404 V412 L421 V423 V432	F192-W402 AromaticContact CD1-CE3 4Å; F192-W402 HydrophobicContact CD1-CE3 4Å; F192-W402 AromaticContact CD1-CZ3 3.82Å; F192-W402 HydrophobicContact CD1-CZ3 3.82Å; F192-W402 AromaticContact CD2-CE3 3.92Å; F192-W402 HydrophobicContact CD2-CE3 3.92Å; F192-W402 AromaticContact CE1-CE3 3.79Å; F192-W402 HydrophobicContact CE1-CE3 3.79Å; F192-W402 AromaticContact CE1-CZ3 3.71Å; F192-W402 HydrophobicContact CE1-CZ3 3.71Å; F192-W402 HydrophobicContact CE2-CB 4.4Å; F192-W402 AromaticContact CE2-CE3 3.7Å; F192-W402 HydrophobicContact CE2-CE3 3.7Å; F192-W402 HydrophobicContact CE2-CZ3 4.45Å; F192-W402 HydrophobicContact CG-CE3 4.04Å; F192-W402 HydrophobicContact CG-CZ3 4.23Å; F192-W402 AromaticContact CZ-CE3 3.61Å; F192-W402 HydrophobicContact CZ-CE3 3.61Å; F192-W402 HydrophobicContact CZ-CZ3 4.02Å; I374-W402 HydrophobicContact CD1-CD2 4.05Å; I374-W402 HydrophobicContact CD1-CG 4.29Å; I374-W402 HydrophobicContact CD1-CZ2 4.16Å; I374-W402 HydrophobicContact CG2-CG 4.26Å; A382-W402 CarbonylContact C-O 3.41Å; A382-W402 HydrophobicContact CB-CB 4.38Å; A382-W402 PolarHBondContact N-O 2.86Å; A382-W402 PolarHBondContact O-N 3.41Å; I400-W402 PolarHBondContact O-N 3.1Å; W402-N404 PolarHBondContact NE1-OD1 3.4Å; W402-V412 HydrophobicContact CH2-CG1 3.96Å; W402-V412 HydrophobicContact CZ2-CG1 4.12Å; W402-V412 HydrophobicContact CZ2-CG2 3.97Å; W402-L421 HydrophobicContact CH2-CB 4.45Å; W402-L421 HydrophobicContact CH2-CD1 3.88Å; W402-L421 HydrophobicContact CZ3-CD1 3.6Å; W402-V423 HydrophobicContact CH2-CG2 3.73Å; W402-V423 HydrophobicContact CZ2-CG2 3.93Å; W402-V432 HydrophobicContact CH2-CB 4.38Å; W402-V432 HydrophobicContact CH2-CG2 4Å; W402-V432 HydrophobicContact CZ3-CB 4.27Å; W402-V432 HydrophobicContact CZ3-CG1 4.1Å; W402-V432 HydrophobicContact CZ3-CG2 4.22Å
403	V	96.4	Very high	95.3	Very high	56 Å²	56	54.4 Å²	54.4	34%	0.339	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	109.5	-174.7	-176.6	0	0	0	0	112.1	V380 L405	V380-V403 HydrophobicContact CG1-CG1 4.35Å; V380-V403 VanDerWaalsContact O-CA 3.28Å; V380-V403 WeakPolarHBondContact O-CA 3.44Å; V403-L405 HydrophobicContact CG1-CD2 3.67Å; V403-L405 HydrophobicContact CG1-CG 4.14Å; V403-L405 PolarHBondContact O-N 2.76Å
404	N	95.7	Very high	95.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.244	C	C	.	.			trans	-90.3	97.8	170	-51.9	-68.6	0	0	0	108.7	D376 T377 E379 V380 A382 W402 Y406 T409	D376-N404 PolarHBondContact O-ND2 2.65Å; T377-N404 WeakPolarHBondContact CA-ND2 3.2Å; E379-N404 WeakPolarHBondContact O-CB 3.39Å; E379-N404 PolarHBondContact O-ND2 3Å; V380-N404 PolarHBondContact O-N 2.9Å; A382-N404 WeakPolarHBondContact CB-ND2 3.42Å; W402-N404 PolarHBondContact NE1-OD1 3.4Å; N404-Y406 VanDerWaalsContact C-N 3.3Å; N404-Y406 PolarHBondContact O-N 3.44Å; N404-T409 WeakPolarHBondContact OD1-CB 3.5Å; N404-T409 PolarHBondContact OD1-OG1 2.74Å
405	L	95.3	Very high	95.8	Very high	80 Å²	80	45.2 Å²	45.2	42%	0.419	23%	0.23	S	C	.	.	S	Bend	trans	-67	-27.7	-172.3	-73	178.8	0	0	0	113.8	P195 V403 D425 L430	P195-L405 HydrophobicContact CB-CD1 3.85Å; P195-L405 HydrophobicContact CG-CD1 4.14Å; V403-L405 HydrophobicContact CG1-CD2 3.67Å; V403-L405 HydrophobicContact CG1-CG 4.14Å; V403-L405 PolarHBondContact O-N 2.76Å; L405-D425 PolarHBondContact N-OD2 3.35Å; L405-L430 HydrophobicContact CB-CD1 4.44Å; L405-L430 HydrophobicContact CD1-CD1 4.13Å
406	Y	94.8	Very high	95.8	Very high	81 Å²	81	42.3 Å²	42.3	32%	0.318	22%	0.217	S	C	.	.	S	Bend	trans	-122.4	10.1	-174.9	-53	-84.3	0	0	0	113.6	N404 N408 D425 Y428 L430	N404-Y406 VanDerWaalsContact C-N 3.3Å; N404-Y406 PolarHBondContact O-N 3.44Å; Y406-N408 VanDerWaalsContact C-N 3.27Å; Y406-N408 PolarHBondContact O-N 2.93Å; Y406-D425 VanDerWaalsContact C-OD1 3.24Å; Y406-D425 WeakPolarHBondContact CB-OD1 3.43Å; Y406-D425 HydrophobicContact CD2-CB 4.33Å; Y406-D425 PolarHBondContact N-OD2 3.04Å; Y406-Y428 HydrophobicContact CD1-CD1 4.25Å; Y406-Y428 AromaticContact CD1-CD2 3.62Å; Y406-Y428 HydrophobicContact CD1-CD2 3.62Å; Y406-Y428 HydrophobicContact CD1-CE1 4.23Å; Y406-Y428 AromaticContact CD1-CE2 3.6Å; Y406-Y428 HydrophobicContact CD1-CE2 3.6Å; Y406-Y428 AromaticContact CD1-CG 3.98Å; Y406-Y428 HydrophobicContact CD1-CG 3.98Å; Y406-Y428 AromaticContact CD1-CZ 3.92Å; Y406-Y428 HydrophobicContact CD2-CD1 4.31Å; Y406-Y428 AromaticContact CD2-CD2 3.85Å; Y406-Y428 HydrophobicContact CD2-CD2 3.85Å; Y406-Y428 AromaticContact CD2-CG 3.67Å; Y406-Y428 HydrophobicContact CD2-CG 3.67Å; Y406-Y428 AromaticContact CE1-CD1 3.64Å; Y406-Y428 HydrophobicContact CE1-CD1 3.64Å; Y406-Y428 AromaticContact CE1-CD2 3.88Å; Y406-Y428 HydrophobicContact CE1-CD2 3.88Å; Y406-Y428 AromaticContact CE1-CE1 3.55Å; Y406-Y428 HydrophobicContact CE1-CE1 3.55Å; Y406-Y428 AromaticContact CE1-CE2 3.81Å; Y406-Y428 HydrophobicContact CE1-CE2 3.81Å; Y406-Y428 AromaticContact CE1-CG 3.82Å; Y406-Y428 HydrophobicContact CE1-CG 3.82Å; Y406-Y428 AromaticContact CE1-CZ 3.64Å; Y406-Y428 AromaticContact CE2-CD1 3.72Å; Y406-Y428 HydrophobicContact CE2-CD1 3.72Å; Y406-Y428 HydrophobicContact CE2-CD2 4.11Å; Y406-Y428 HydrophobicContact CE2-CE1 4.47Å; Y406-Y428 AromaticContact CE2-CG 3.51Å; Y406-Y428 HydrophobicContact CE2-CG 3.51Å; Y406-Y428 AromaticContact CG-CD2 3.59Å; Y406-Y428 HydrophobicContact CG-CD2 3.59Å; Y406-Y428 HydrophobicContact CG-CE2 4.05Å; Y406-Y428 AromaticContact CG-CG 3.9Å; Y406-Y428 HydrophobicContact CG-CG 3.9Å; Y406-Y428 AromaticContact CZ-CD1 3.33Å; Y406-Y428 AromaticContact CZ-CE1 3.69Å; Y406-Y428 AromaticContact CZ-CG 3.58Å; Y406-Y428 WeakPolarHBondContact OH-CD1 3.32Å; Y406-L430 HydrophobicContact CD2-CD1 4.28Å; Y406-L430 HydrophobicContact CE2-CD1 4.1Å; Y406-L430 HydrophobicContact CE2-CD2 4.2Å
407	K	94.1	Very high	95.8	Very high	102 Å²	102	40.8 Å²	40.8	44%	0.443	22%	0.221	S	C	.	.	S	Bend	trans	59.4	27	169.9	-59.4	-170.5	160.7	-163.2	0	115.4	T377 R378 V380 D425	T377-K407 CarbonylContact O-C 3.48Å; T377-K407 VanDerWaalsContact O-C 3.24Å; R378-K407 WeakPolarHBondContact O-CB 3.3Å; R378-K407 WeakPolarHBondContact O-CD 3.38Å; R378-K407 WeakPolarHBondContact O-CG 3.39Å; V380-K407 HydrophobicContact CG2-CD 4.24Å; V380-K407 VanDerWaalsContact CG2-CE 3.42Å; V380-K407 HydrophobicContact CG2-CG 3.81Å; K407-D425 PolarHBondContact N-OD1 3.41Å
408	N	91.3	Very high	95.8	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.021	19%	0.192	C	C	.	.			trans	-152.6	47.9	174.5	-157.4	82.8	0	0	0	111.2	K23 Y205 T377 Y406 N410 D425 Y426	K23-N408 VanDerWaalsContact CE-OD1 3.27Å; K23-N408 WeakPolarHBondContact CE-OD1 3.49Å; K23-N408 PolarHBondContact NZ-OD1 3.38Å; Y205-N408 WeakPolarHBondContact CE1-ND2 3.42Å; Y205-N408 PolarHBondContact OH-ND2 3.37Å; T377-N408 PolarHBondContact O-N 3.37Å; Y406-N408 VanDerWaalsContact C-N 3.27Å; Y406-N408 PolarHBondContact O-N 2.93Å; N408-N410 PolarHBondContact O-N 2.94Å; N408-N410 PolarHBondContact O-ND2 3.16Å; N408-D425 WeakPolarHBondContact CA-OD1 3.32Å; N408-D425 PolarHBondContact N-OD1 3.23Å; N408-Y426 HydrophobicContact CB-CD2 3.69Å; N408-Y426 HydrophobicContact CB-CG 4.06Å; N408-Y426 PolarHBondContact O-N 3.2Å
409	T	95.4	Very high	95.9	Very high	1 Å²	1	36 Å²	36	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	120	171.9	-61.1	0	0	0	0	109.1	T377 N404 V412 V423 F424 D425	T377-T409 VanDerWaalsContact CB-O 3.29Å; T377-T409 WeakPolarHBondContact CB-O 3.31Å; T377-T409 HydrophobicContact CG2-CG2 4.16Å; T377-T409 WeakPolarHBondContact CG2-O 3.37Å; T377-T409 PolarHBondContact O-N 3.19Å; N404-T409 WeakPolarHBondContact OD1-CB 3.5Å; N404-T409 PolarHBondContact OD1-OG1 2.74Å; T409-V412 HydrophobicContact CG2-CG2 3.35Å; T409-V423 HydrophobicContact CG2-CG1 3.94Å; T409-F424 WeakPolarHBondContact CA-O 3.32Å; T409-D425 PolarHBondContact N-OD1 3.07Å; T409-D425 VanDerWaalsContact N-OD1 3.12Å
410	N	93.5	Very high	95.9	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.011	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	1.1	-178.3	57.5	99	0	0	0	113.8	Y204 Y205 G206 T261 F311 N408 F424	Y204-N410 PolarHBondContact O-ND2 2.73Å; Y204-N410 VanDerWaalsContact O-ND2 3.17Å; Y205-N410 WeakPolarHBondContact CA-OD1 3.26Å; Y205-N410 HydrophobicContact CD1-CB 3.99Å; Y205-N410 HydrophobicContact CE1-CB 4.39Å; G206-N410 PolarHBondContact N-OD1 2.88Å; G206-N410 PolarHBondContact O-OD1 2.96Å; T261-N410 WeakPolarHBondContact CB-O 3.36Å; T261-N410 PolarHBondContact OG1-O 2.84Å; F311-N410 HydrophobicContact CD2-CB 3.91Å; F311-N410 HydrophobicContact CE2-CB 4.11Å; F311-N410 HydrophobicContact CG-CB 4.49Å; N408-N410 PolarHBondContact O-N 2.94Å; N408-N410 PolarHBondContact O-ND2 3.16Å; N410-F424 PolarHBondContact N-O 3.18Å; N410-F424 PolarHBondContact ND2-O 3.3Å
411	M	96.8	Very high	96	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	134.1	167.2	168.9	-93	-158.4	0	0	109.2	A207 W208 F209 E363 A413 V423 F424	A207-M411 HydrophobicContact CB-CB 4.15Å; A207-M411 HydrophobicContact CB-CE 4.04Å; A207-M411 HydrophobicContact CB-CG 3.73Å; A207-M411 HydrophobicContact CB-SD 4.26Å; W208-M411 VanDerWaalsContact O-CE 3.25Å; W208-M411 WeakPolarHBondContact O-CE 3.41Å; F209-M411 HydrophobicContact CD1-CE 3.96Å; F209-M411 HydrophobicContact CE1-CE 3.69Å; E363-M411 VanDerWaalsContact OE1-C 3.31Å; E363-M411 VanDerWaalsContact OE1-CA 3.22Å; E363-M411 WeakPolarHBondContact OE1-CA 3.41Å; M411-A413 HydrophobicContact CE-CB 3.49Å; M411-A413 VanDerWaalsContact CE-CB 3.49Å; M411-A413 HydrophobicContact SD-CB 4.3Å; M411-V423 VanDerWaalsContact O-CA 3.3Å; M411-V423 WeakPolarHBondContact O-CA 3.32Å; M411-F424 HydrophobicContact CB-CB 4.03Å; M411-F424 PolarHBondContact O-N 3.08Å; M411-F424 HydrophobicContact SD-CB 4.44Å
412	V	97.8	Very high	96	Very high	2 Å²	2	29 Å²	29	1%	0.012	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	91.4	172.7	-176.7	0	0	0	0	109.8	E363 F365 I374 W402 T409 L421 Y422 V423	E363-V412 HydrophobicContact CB-CG2 4.32Å; E363-V412 HydrophobicContact CG-CG2 4.14Å; E363-V412 PolarHBondContact OE1-N 2.72Å; F365-V412 HydrophobicContact CB-CG1 4.49Å; F365-V412 HydrophobicContact CD1-CG1 3.87Å; F365-V412 HydrophobicContact CG-CG1 4.47Å; I374-V412 HydrophobicContact CD1-CG1 4.22Å; I374-V412 HydrophobicContact CD1-CG2 4.17Å; W402-V412 HydrophobicContact CH2-CG1 3.96Å; W402-V412 HydrophobicContact CZ2-CG1 4.12Å; W402-V412 HydrophobicContact CZ2-CG2 3.97Å; T409-V412 HydrophobicContact CG2-CG2 3.35Å; V412-L421 HydrophobicContact CG1-CB 4.24Å; V412-L421 HydrophobicContact CG1-CD1 4.17Å; V412-L421 HydrophobicContact CG1-CD2 4.06Å; V412-L421 HydrophobicContact CG1-CG 4.39Å; V412-Y422 CarbonylContact C-O 3.54Å; V412-Y422 WeakPolarHBondContact CA-O 3.42Å; V412-V423 HydrophobicContact CG1-CG2 4.4Å; V412-V423 HydrophobicContact CG2-CG1 4.41Å; V412-V423 HydrophobicContact CG2-CG2 4.43Å
413	A	98	Very high	96.1	Very high	20 Å²	20	28.9 Å²	28.9	17%	0.165	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	134.7	-179.4	0	0	0	0	0	112.9	M411 L421 Y422	M411-A413 HydrophobicContact CE-CB 3.49Å; M411-A413 VanDerWaalsContact CE-CB 3.49Å; M411-A413 HydrophobicContact SD-CB 4.3Å; A413-L421 CarbonylContact O-C 3.51Å; A413-L421 WeakPolarHBondContact O-CA 3.35Å; A413-Y422 PolarHBondContact N-O 3.02Å; A413-Y422 PolarHBondContact O-N 2.81Å
414	Y	98.2	Very high	96.1	Very high	7 Å²	7	26.2 Å²	26.2	3%	0.027	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	139.2	175.2	-178.9	-122.1	0	0	0	112.5	L318 D319 E320 I366 V367 P416 K419 R420 L421 A434 I436	L318-Y414 VanDerWaalsContact O-CD1 3.32Å; L318-Y414 WeakPolarHBondContact O-CD1 3.22Å; D319-Y414 HydrophobicContact CB-CD1 4.21Å; D319-Y414 HydrophobicContact CB-CE1 4.42Å; E320-Y414 WeakPolarHBondContact OE1-CE1 3.29Å; E320-Y414 PolarHBondContact OE1-OH 2.67Å; E320-Y414 WeakPolarHBondContact OE2-CE1 3.33Å; I366-Y414 WeakPolarHBondContact O-CB 3.41Å; I366-Y414 VanDerWaalsContact O-CD1 3.24Å; I366-Y414 WeakPolarHBondContact O-CD1 3.47Å; V367-Y414 HydrophobicContact CB-CD1 4.44Å; V367-Y414 HydrophobicContact CB-CE1 4.28Å; V367-Y414 HydrophobicContact CG1-CE1 3.89Å; V367-Y414 HydrophobicContact CG1-CE2 4.4Å; V367-Y414 HydrophobicContact CG2-CD1 3.94Å; V367-Y414 HydrophobicContact CG2-CD2 3.98Å; V367-Y414 HydrophobicContact CG2-CE1 4.1Å; V367-Y414 HydrophobicContact CG2-CE2 4.13Å; V367-Y414 HydrophobicContact CG2-CG 3.9Å; Y414-P416 HydrophobicContact CE1-CB 4.01Å; Y414-K419 WeakPolarHBondContact OH-CD 3.44Å; Y414-R420 WeakPolarHBondContact CD2-O 3.4Å; Y414-L421 HydrophobicContact CD2-CD2 4.15Å; Y414-L421 HydrophobicContact CG-CD2 4.4Å; Y414-A434 HydrophobicContact CE2-CB 4.3Å; Y414-I436 HydrophobicContact CE2-CD1 4.23Å; Y414-I436 WeakPolarHBondContact OH-CD1 3.49Å
415	N	97.7	Very high	96.1	Very high	7 Å²	7	26.3 Å²	26.3	4%	0.037	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	106.6	172.5	-171.2	-66.7	0	0	0	110.1	K210 A417 D418 K419 R420 Y422	K210-N415 PolarHBondContact O-ND2 3.39Å; N415-A417 PolarHBondContact O-N 3.39Å; N415-A417 WeakPolarHBondContact OD1-CB 3.43Å; N415-A417 PolarHBondContact OD1-N 2.96Å; N415-D418 PolarHBondContact OD1-N 2.74Å; N415-D418 VanDerWaalsContact OD1-N 3.11Å; N415-K419 WeakPolarHBondContact O-CA 3.29Å; N415-K419 PolarHBondContact O-N 2.7Å; N415-R420 PolarHBondContact N-O 2.9Å; N415-Y422 HydrophobicContact CB-CD2 3.76Å; N415-Y422 HydrophobicContact CB-CE2 3.49Å; N415-Y422 VanDerWaalsContact CB-CE2 3.49Å
416	P	95.5	Very high	96.1	Very high	7 Å²	7	24.7 Å²	24.7	5%	0.045	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-9.9	-176.5	27.3	-35.1	0	0	0	114.2	P212 F213 E320 Y414 K419	P212-P416 HydrophobicContact CB-CG 4.29Å; F213-P416 HydrophobicContact CE2-CG 4.4Å; E320-P416 HydrophobicContact CG-CB 4.21Å; Y414-P416 HydrophobicContact CE1-CB 4.01Å; P416-K419 VanDerWaalsContact O-CE 3.23Å; P416-K419 WeakPolarHBondContact O-CE 3.3Å; P416-K419 PolarHBondContact O-NZ 3.48Å
417	A	94.1	Very high	96.1	Very high	45 Å²	45	20.9 Å²	20.9	37%	0.372	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-35.7	179.3	0	0	0	0	0	113.6	P212 F213 N415	P212-A417 HydrophobicContact CB-CB 3.55Å; P212-A417 WeakPolarHBondContact O-CB 3.37Å; F213-A417 HydrophobicContact CE1-CB 4.47Å; F213-A417 HydrophobicContact CE2-CB 4.5Å; F213-A417 HydrophobicContact CZ-CB 4.24Å; N415-A417 PolarHBondContact O-N 3.39Å; N415-A417 WeakPolarHBondContact OD1-CB 3.43Å; N415-A417 PolarHBondContact OD1-N 2.96Å
418	D	95.1	Very high	96.2	Very high	40 Å²	40	18.3 Å²	18.3	21%	0.214	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	2.2	176.5	67.2	32.4	0	0	0	115.5	K210 N415 R420 Y422	K210-D418 WeakPolarHBondContact CD-OD2 3.41Å; K210-D418 IonicContact NZ-OD2 3.69Å; K210-D418 PolarHBondContact NZ-OD2 2.83Å; N415-D418 PolarHBondContact OD1-N 2.74Å; N415-D418 VanDerWaalsContact OD1-N 3.11Å; D418-R420 WeakPolarHBondContact OD1-CB 3.46Å; D418-R420 WeakPolarHBondContact OD1-CG 3.42Å; D418-R420 PolarHBondContact OD1-N 2.59Å; D418-Y422 PolarHBondContact OD2-OH 3.06Å
419	K	95.6	Very high	96.5	Very high	65 Å²	65	18.1 Å²	18.1	28%	0.283	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	44.2	173.9	-48	-58.5	-178.6	-170.9	0	112.5	E320 Y414 N415 P416 A434 I436	E320-K419 IonicContact OE1-NZ 2.65Å; E320-K419 PolarHBondContact OE1-NZ 2.7Å; Y414-K419 WeakPolarHBondContact OH-CD 3.44Å; N415-K419 WeakPolarHBondContact O-CA 3.29Å; N415-K419 PolarHBondContact O-N 2.7Å; P416-K419 VanDerWaalsContact O-CE 3.23Å; P416-K419 WeakPolarHBondContact O-CE 3.3Å; P416-K419 PolarHBondContact O-NZ 3.48Å; K419-A434 WeakPolarHBondContact O-CB 3.15Å; K419-A434 PolarHBondContact O-N 3.31Å; K419-I436 HydrophobicContact CB-CD1 4.4Å; K419-I436 HydrophobicContact CD-CD1 4.24Å
420	R	97.5	Very high	96.7	Very high	76 Å²	76	18.3 Å²	18.3	29%	0.287	9%	0.091	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	150.8	178.6	-58.8	174.2	-178.9	-145.3	1.3	111.3	Y414 N415 D418 Y422 T431 V432	Y414-R420 WeakPolarHBondContact CD2-O 3.4Å; N415-R420 PolarHBondContact N-O 2.9Å; D418-R420 WeakPolarHBondContact OD1-CB 3.46Å; D418-R420 WeakPolarHBondContact OD1-CG 3.42Å; D418-R420 PolarHBondContact OD1-N 2.59Å; R420-Y422 HydrophobicContact CB-CD2 4.48Å; R420-Y422 HydrophobicContact CB-CE2 4.17Å; R420-T431 PolarHBondContact NH1-OG1 3.23Å; R420-V432 WeakPolarHBondContact CA-O 3.45Å
421	L	98.3	Very high	96.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	129	159.2	-63.6	167.1	0	0	0	108.6	F192 F365 W402 V412 A413 Y414 V423 T431 V432	F192-L421 HydrophobicContact CD1-CD1 4.02Å; F192-L421 HydrophobicContact CE1-CD1 3.49Å; F192-L421 VanDerWaalsContact CE1-CD1 3.49Å; F192-L421 HydrophobicContact CZ-CD1 4.48Å; F365-L421 HydrophobicContact CB-CD2 3.83Å; F365-L421 HydrophobicContact CD1-CD1 4.04Å; F365-L421 HydrophobicContact CD1-CD2 4Å; F365-L421 HydrophobicContact CD2-CD1 4.32Å; F365-L421 HydrophobicContact CD2-CD2 3.6Å; F365-L421 HydrophobicContact CE1-CD1 3.8Å; F365-L421 HydrophobicContact CE1-CD2 4.49Å; F365-L421 HydrophobicContact CE2-CD1 4.09Å; F365-L421 HydrophobicContact CE2-CD2 4.13Å; F365-L421 HydrophobicContact CG-CD1 4.3Å; F365-L421 HydrophobicContact CG-CD2 3.52Å; F365-L421 HydrophobicContact CZ-CD1 3.83Å; W402-L421 HydrophobicContact CH2-CB 4.45Å; W402-L421 HydrophobicContact CH2-CD1 3.88Å; W402-L421 HydrophobicContact CZ3-CD1 3.6Å; V412-L421 HydrophobicContact CG1-CB 4.24Å; V412-L421 HydrophobicContact CG1-CD1 4.17Å; V412-L421 HydrophobicContact CG1-CD2 4.06Å; V412-L421 HydrophobicContact CG1-CG 4.39Å; A413-L421 CarbonylContact O-C 3.51Å; A413-L421 WeakPolarHBondContact O-CA 3.35Å; Y414-L421 HydrophobicContact CD2-CD2 4.15Å; Y414-L421 HydrophobicContact CG-CD2 4.4Å; L421-V423 HydrophobicContact CB-CG2 4.39Å; L421-T431 CarbonylContact O-C 3.48Å; L421-T431 VanDerWaalsContact O-CA 3.23Å; L421-T431 WeakPolarHBondContact O-CA 3.44Å; L421-V432 HydrophobicContact CB-CB 4.39Å; L421-V432 PolarHBondContact N-O 3.25Å; L421-V432 PolarHBondContact O-N 3.32Å
422	Y	98.3	Very high	97	Very high	7 Å²	7	18.4 Å²	18.4	3%	0.027	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	128.6	168.8	-76.3	-113.2	0	0	0	106.9	W208 K210 V412 A413 N415 D418 R420 T431	W208-Y422 HydrophobicContact CD2-CD1 4Å; W208-Y422 AromaticContact CE2-CD1 3.75Å; W208-Y422 AromaticContact CE3-CD1 4Å; W208-Y422 HydrophobicContact CE3-CD1 4Å; W208-Y422 HydrophobicContact CE3-CE1 4.25Å; W208-Y422 AromaticContact CH2-CD1 3.57Å; W208-Y422 HydrophobicContact CH2-CD1 3.57Å; W208-Y422 AromaticContact CH2-CE1 3.6Å; W208-Y422 HydrophobicContact CH2-CE1 3.6Å; W208-Y422 AromaticContact CZ2-CD1 3.55Å; W208-Y422 HydrophobicContact CZ2-CD1 3.55Å; W208-Y422 HydrophobicContact CZ2-CE1 4.08Å; W208-Y422 HydrophobicContact CZ2-CG 4.35Å; W208-Y422 AromaticContact CZ3-CD1 3.79Å; W208-Y422 HydrophobicContact CZ3-CD1 3.79Å; W208-Y422 AromaticContact CZ3-CE1 3.69Å; W208-Y422 HydrophobicContact CZ3-CE1 3.69Å; K210-Y422 HydrophobicContact CB-CE1 3.89Å; K210-Y422 WeakPolarHBondContact CD-OH 3.21Å; V412-Y422 CarbonylContact C-O 3.54Å; V412-Y422 WeakPolarHBondContact CA-O 3.42Å; A413-Y422 PolarHBondContact N-O 3.02Å; A413-Y422 PolarHBondContact O-N 2.81Å; N415-Y422 HydrophobicContact CB-CD2 3.76Å; N415-Y422 HydrophobicContact CB-CE2 3.49Å; N415-Y422 VanDerWaalsContact CB-CE2 3.49Å; D418-Y422 PolarHBondContact OD2-OH 3.06Å; R420-Y422 HydrophobicContact CB-CD2 4.48Å; R420-Y422 HydrophobicContact CB-CE2 4.17Å; Y422-T431 HydrophobicContact CD1-CG2 3.86Å; Y422-T431 HydrophobicContact CD2-CG2 4.07Å; Y422-T431 HydrophobicContact CE1-CG2 3.77Å; Y422-T431 HydrophobicContact CE2-CG2 3.97Å; Y422-T431 HydrophobicContact CG-CG2 3.99Å
423	V	98.2	Very high	96.9	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.018	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.3	-170.6	-177.8	0	0	0	0	109.9	W208 W402 T409 M411 V412 L421 D425 L430 V432	W208-V423 PolarHBondContact NE1-O 2.84Å; W402-V423 HydrophobicContact CH2-CG2 3.73Å; W402-V423 HydrophobicContact CZ2-CG2 3.93Å; T409-V423 HydrophobicContact CG2-CG1 3.94Å; M411-V423 VanDerWaalsContact O-CA 3.3Å; M411-V423 WeakPolarHBondContact O-CA 3.32Å; V412-V423 HydrophobicContact CG1-CG2 4.4Å; V412-V423 HydrophobicContact CG2-CG1 4.41Å; V412-V423 HydrophobicContact CG2-CG2 4.43Å; L421-V423 HydrophobicContact CB-CG2 4.39Å; V423-D425 HydrophobicContact CG1-CB 4.25Å; V423-L430 HydrophobicContact CB-CB 4.26Å; V423-L430 PolarHBondContact N-O 2.95Å; V423-L430 PolarHBondContact O-N 2.7Å; V423-V432 HydrophobicContact CG2-CG2 4.09Å
424	F	97.4	Very high	96.9	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	107.7	170.1	-158.8	-66.7	0	0	0	108.6	A201 T203 Y204 G206 M225 T409 N410 M411 G427 L429	A201-F424 HydrophobicContact CB-CE2 4.33Å; A201-F424 HydrophobicContact CB-CZ 3.94Å; T203-F424 HydrophobicContact CG2-CZ 4.31Å; Y204-F424 WeakPolarHBondContact O-CE1 3.46Å; G206-F424 WeakPolarHBondContact O-CB 3.34Å; G206-F424 VanDerWaalsContact O-CD2 3.31Å; G206-F424 WeakPolarHBondContact O-CD2 3.48Å; G206-F424 VanDerWaalsContact O-CG 3.24Å; G206-F424 WeakPolarHBondContact O-CG 3.39Å; M225-F424 HydrophobicContact SD-CE2 4.37Å; T409-F424 WeakPolarHBondContact CA-O 3.32Å; N410-F424 PolarHBondContact N-O 3.18Å; N410-F424 PolarHBondContact ND2-O 3.3Å; M411-F424 HydrophobicContact CB-CB 4.03Å; M411-F424 PolarHBondContact O-N 3.08Å; M411-F424 HydrophobicContact SD-CB 4.44Å; F424-G427 VanDerWaalsContact CE1-CA 3.47Å; F424-L429 HydrophobicContact CD2-CD2 3.29Å; F424-L429 HydrophobicContact CE2-CD2 3.34Å; F424-L429 HydrophobicContact CG-CD2 4Å; F424-L429 HydrophobicContact CZ-CD2 4.06Å
425	D	96.4	Very high	96.7	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	105.3	-174.6	-175.4	5.1	0	0	0	110	L405 Y406 K407 N408 T409 V423 G427 Y428 L430	L405-D425 PolarHBondContact N-OD2 3.35Å; Y406-D425 VanDerWaalsContact C-OD1 3.24Å; Y406-D425 WeakPolarHBondContact CB-OD1 3.43Å; Y406-D425 HydrophobicContact CD2-CB 4.33Å; Y406-D425 PolarHBondContact N-OD2 3.04Å; K407-D425 PolarHBondContact N-OD1 3.41Å; N408-D425 WeakPolarHBondContact CA-OD1 3.32Å; N408-D425 PolarHBondContact N-OD1 3.23Å; T409-D425 PolarHBondContact N-OD1 3.07Å; T409-D425 VanDerWaalsContact N-OD1 3.12Å; V423-D425 HydrophobicContact CG1-CB 4.25Å; D425-G427 PolarHBondContact O-N 3.44Å; D425-G427 VanDerWaalsContact O-N 3.13Å; D425-Y428 PolarHBondContact N-O 2.58Å; D425-Y428 WeakPolarHBondContact O-CB 3.46Å; D425-Y428 PolarHBondContact O-N 2.99Å; D425-L430 HydrophobicContact CB-CD1 4.35Å
426	Y	93.9	Very high	96.5	Very high	46 Å²	46	25 Å²	25	18%	0.18	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	36.3	-177.4	-154.9	-127	0	0	0	115.8	K23 Y204 N408	K23-Y426 HydrophobicContact CD-CE2 4.5Å; Y204-Y426 HydrophobicContact CD1-CD1 4.16Å; Y204-Y426 AromaticContact CD1-CD2 3.66Å; Y204-Y426 HydrophobicContact CD1-CD2 3.66Å; Y204-Y426 AromaticContact CD1-CE1 3.87Å; Y204-Y426 HydrophobicContact CD1-CE1 3.87Å; Y204-Y426 AromaticContact CD1-CE2 3.31Å; Y204-Y426 HydrophobicContact CD1-CE2 3.31Å; Y204-Y426 HydrophobicContact CD1-CG 4.06Å; Y204-Y426 AromaticContact CD1-CZ 3.42Å; Y204-Y426 VanDerWaalsContact CD1-CZ 3.42Å; Y204-Y426 HydrophobicContact CE1-CD1 4.43Å; Y204-Y426 HydrophobicContact CE1-CD2 4.5Å; Y204-Y426 AromaticContact CE1-CE1 3.78Å; Y204-Y426 HydrophobicContact CE1-CE1 3.78Å; Y204-Y426 AromaticContact CE1-CE2 3.85Å; Y204-Y426 HydrophobicContact CE1-CE2 3.85Å; Y204-Y426 AromaticContact CE1-CZ 3.43Å; Y204-Y426 VanDerWaalsContact CE1-CZ 3.43Å; Y204-Y426 WeakPolarHBondContact CE1-OH 3.21Å; Y204-Y426 HydrophobicContact CG-CD2 4.11Å; Y204-Y426 AromaticContact CG-CE2 3.72Å; Y204-Y426 HydrophobicContact CG-CE2 3.72Å; N408-Y426 HydrophobicContact CB-CD2 3.69Å; N408-Y426 HydrophobicContact CB-CG 4.06Å; N408-Y426 PolarHBondContact O-N 3.2Å
427	G	94.9	Very high	96.3	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.01	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	1.4	-176.1	0	0	0	0	0	114.9	R200 A201 T203 Y204 F424 D425	R200-G427 CarbonylContact C-O 3.59Å; R200-G427 VanDerWaalsContact CA-O 3.3Å; R200-G427 WeakPolarHBondContact CA-O 3.35Å; R200-G427 WeakPolarHBondContact CG-O 3.38Å; A201-G427 PolarHBondContact N-O 3.38Å; T203-G427 WeakPolarHBondContact O-CA 3.47Å; Y204-G427 PolarHBondContact O-N 3.3Å; F424-G427 VanDerWaalsContact CE1-CA 3.47Å; D425-G427 PolarHBondContact O-N 3.44Å; D425-G427 VanDerWaalsContact O-N 3.13Å
428	Y	97.4	Very high	95.8	Very high	48 Å²	48	32.6 Å²	32.6	19%	0.188	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126.2	171.7	-64.7	-104.3	0	0	0	109.5	F197 Y406 D425	F197-Y428 HydrophobicContact CD2-CD1 4.07Å; F197-Y428 AromaticContact CE2-CD1 3.67Å; F197-Y428 HydrophobicContact CE2-CD1 3.67Å; F197-Y428 HydrophobicContact CE2-CE1 4.43Å; Y406-Y428 HydrophobicContact CD1-CD1 4.25Å; Y406-Y428 AromaticContact CD1-CD2 3.62Å; Y406-Y428 HydrophobicContact CD1-CD2 3.62Å; Y406-Y428 HydrophobicContact CD1-CE1 4.23Å; Y406-Y428 AromaticContact CD1-CE2 3.6Å; Y406-Y428 HydrophobicContact CD1-CE2 3.6Å; Y406-Y428 AromaticContact CD1-CG 3.98Å; Y406-Y428 HydrophobicContact CD1-CG 3.98Å; Y406-Y428 AromaticContact CD1-CZ 3.92Å; Y406-Y428 HydrophobicContact CD2-CD1 4.31Å; Y406-Y428 AromaticContact CD2-CD2 3.85Å; Y406-Y428 HydrophobicContact CD2-CD2 3.85Å; Y406-Y428 AromaticContact CD2-CG 3.67Å; Y406-Y428 HydrophobicContact CD2-CG 3.67Å; Y406-Y428 AromaticContact CE1-CD1 3.64Å; Y406-Y428 HydrophobicContact CE1-CD1 3.64Å; Y406-Y428 AromaticContact CE1-CD2 3.88Å; Y406-Y428 HydrophobicContact CE1-CD2 3.88Å; Y406-Y428 AromaticContact CE1-CE1 3.55Å; Y406-Y428 HydrophobicContact CE1-CE1 3.55Å; Y406-Y428 AromaticContact CE1-CE2 3.81Å; Y406-Y428 HydrophobicContact CE1-CE2 3.81Å; Y406-Y428 AromaticContact CE1-CG 3.82Å; Y406-Y428 HydrophobicContact CE1-CG 3.82Å; Y406-Y428 AromaticContact CE1-CZ 3.64Å; Y406-Y428 AromaticContact CE2-CD1 3.72Å; Y406-Y428 HydrophobicContact CE2-CD1 3.72Å; Y406-Y428 HydrophobicContact CE2-CD2 4.11Å; Y406-Y428 HydrophobicContact CE2-CE1 4.47Å; Y406-Y428 AromaticContact CE2-CG 3.51Å; Y406-Y428 HydrophobicContact CE2-CG 3.51Å; Y406-Y428 AromaticContact CG-CD2 3.59Å; Y406-Y428 HydrophobicContact CG-CD2 3.59Å; Y406-Y428 HydrophobicContact CG-CE2 4.05Å; Y406-Y428 AromaticContact CG-CG 3.9Å; Y406-Y428 HydrophobicContact CG-CG 3.9Å; Y406-Y428 AromaticContact CZ-CD1 3.33Å; Y406-Y428 AromaticContact CZ-CE1 3.69Å; Y406-Y428 AromaticContact CZ-CG 3.58Å; Y406-Y428 WeakPolarHBondContact OH-CD1 3.32Å; D425-Y428 PolarHBondContact N-O 2.58Å; D425-Y428 WeakPolarHBondContact O-CB 3.46Å; D425-Y428 PolarHBondContact O-N 2.99Å
429	L	97.6	Very high	94.7	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	112	-178.5	-49.6	-169.7	0	0	0	108.7	H198 A199 W208 M225 M243 F424	H198-L429 WeakPolarHBondContact CB-O 2.91Å; H198-L429 PolarHBondContact N-O 3.31Å; A199-L429 HydrophobicContact CB-CD1 4.24Å; A199-L429 WeakPolarHBondContact O-CB 3.33Å; A199-L429 PolarHBondContact O-N 3.04Å; W208-L429 HydrophobicContact CB-CD1 4.14Å; W208-L429 HydrophobicContact CB-CD2 4.29Å; W208-L429 HydrophobicContact CD2-CB 3.96Å; W208-L429 HydrophobicContact CD2-CD1 4.17Å; W208-L429 HydrophobicContact CD2-CG 4.47Å; W208-L429 HydrophobicContact CE3-CD1 4.46Å; W208-L429 HydrophobicContact CG-CB 4.18Å; W208-L429 HydrophobicContact CG-CD1 4.03Å; W208-L429 HydrophobicContact CG-CD2 3.97Å; W208-L429 HydrophobicContact CG-CG 4.28Å; W208-L429 HydrophobicContact CZ2-CB 4.13Å; M225-L429 HydrophobicContact SD-CD1 3.85Å; M225-L429 HydrophobicContact SD-CD2 4.48Å; M243-L429 HydrophobicContact CE-CD1 3.93Å; M243-L429 HydrophobicContact CG-CD1 4.24Å; M243-L429 HydrophobicContact SD-CD1 3.74Å; F424-L429 HydrophobicContact CD2-CD2 3.29Å; F424-L429 HydrophobicContact CE2-CD2 3.34Å; F424-L429 HydrophobicContact CG-CD2 4Å; F424-L429 HydrophobicContact CZ-CD2 4.06Å
430	L	97.9	Very high	92.9	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.1	-171.5	-48	175.8	0	0	0	111.3	I196 F197 W208 L405 Y406 V423 D425	I196-L430 CarbonylContact O-C 3.54Å; I196-L430 VanDerWaalsContact O-CA 3.23Å; I196-L430 WeakPolarHBondContact O-CA 3.41Å; F197-L430 HydrophobicContact CB-CD2 4.06Å; F197-L430 HydrophobicContact CD2-CD2 3.94Å; W208-L430 WeakPolarHBondContact CZ2-O 3.34Å; L405-L430 HydrophobicContact CB-CD1 4.44Å; L405-L430 HydrophobicContact CD1-CD1 4.13Å; Y406-L430 HydrophobicContact CD2-CD1 4.28Å; Y406-L430 HydrophobicContact CE2-CD1 4.1Å; Y406-L430 HydrophobicContact CE2-CD2 4.2Å; V423-L430 HydrophobicContact CB-CB 4.26Å; V423-L430 PolarHBondContact N-O 2.95Å; V423-L430 PolarHBondContact O-N 2.7Å; D425-L430 HydrophobicContact CB-CD1 4.35Å
431	T	98.1	Very high	92.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.2	160.5	64.5	0	0	0	0	112	P195 I196 H198 W208 R420 L421 Y422	P195-T431 CarbonylContact C-O 3.56Å; P195-T431 WeakPolarHBondContact CA-O 3.12Å; I196-T431 PolarHBondContact N-O 3.32Å; I196-T431 PolarHBondContact O-N 3.22Å; H198-T431 PolarHBondContact CD2-N 3.01Å; H198-T431 WeakPolarHBondContact NE2-CG2 3.36Å; H198-T431 PolarHBondContact NE2-OG1 3.29Å; W208-T431 HydrophobicContact CH2-CG2 3.7Å; W208-T431 HydrophobicContact CZ2-CG2 3.7Å; R420-T431 PolarHBondContact NH1-OG1 3.23Å; L421-T431 CarbonylContact O-C 3.48Å; L421-T431 VanDerWaalsContact O-CA 3.23Å; L421-T431 WeakPolarHBondContact O-CA 3.44Å; Y422-T431 HydrophobicContact CD1-CG2 3.86Å; Y422-T431 HydrophobicContact CD2-CG2 4.07Å; Y422-T431 HydrophobicContact CE1-CG2 3.77Å; Y422-T431 HydrophobicContact CE2-CG2 3.97Å; Y422-T431 HydrophobicContact CG-CG2 3.99Å
432	V	98.2	Very high	92.3	Very high	6 Å²	6	37.5 Å²	37.5	4%	0.036	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	115.2	177.4	-175.1	0	0	0	0	108.1	F192 P195 W402 R420 L421 V423 A434	F192-V432 HydrophobicContact CB-CG1 3.72Å; F192-V432 HydrophobicContact CD1-CG1 4.06Å; F192-V432 HydrophobicContact CG-CG1 4.2Å; P195-V432 HydrophobicContact CB-CG2 4.12Å; P195-V432 HydrophobicContact CG-CG2 4.13Å; W402-V432 HydrophobicContact CH2-CB 4.38Å; W402-V432 HydrophobicContact CH2-CG2 4Å; W402-V432 HydrophobicContact CZ3-CB 4.27Å; W402-V432 HydrophobicContact CZ3-CG1 4.1Å; W402-V432 HydrophobicContact CZ3-CG2 4.22Å; R420-V432 WeakPolarHBondContact CA-O 3.45Å; L421-V432 HydrophobicContact CB-CB 4.39Å; L421-V432 PolarHBondContact N-O 3.25Å; L421-V432 PolarHBondContact O-N 3.32Å; V423-V432 HydrophobicContact CG2-CG2 4.09Å; V432-A434 PolarHBondContact O-N 3.46Å
433	P	97.8	Very high	92	Very high	41 Å²	41	39.2 Å²	39.2	27%	0.266	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	134.4	176	-22.8	33.9	0	0	0	111.7	G193 K194 I196	G193-P433 PolarHBondContact N-O 3.32Å; K194-P433 WeakPolarHBondContact O-CD 3.27Å; I196-P433 HydrophobicContact CD1-CG 4.2Å
434	A	96.2	Very high	91.6	Very high	13 Å²	13	41.3 Å²	41.3	11%	0.107	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117	174.2	0	0	0	0	0	109.8	L189 Y414 K419 V432 I436	L189-A434 HydrophobicContact CD1-CB 3.79Å; Y414-A434 HydrophobicContact CE2-CB 4.3Å; K419-A434 WeakPolarHBondContact O-CB 3.15Å; K419-A434 PolarHBondContact O-N 3.31Å; V432-A434 PolarHBondContact O-N 3.46Å; A434-I436 HydrophobicContact CB-CD1 4.04Å; A434-I436 HydrophobicContact CB-CG1 4.08Å; A434-I436 PolarHBondContact O-N 3.24Å
435	E	95	Very high	91.3	Very high	90 Å²	90	43.9 Å²	43.9	42%	0.421	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	101.9	173.2	-166.9	170.4	133	0	0	109.4	K190 R191	K190-E435 PolarHBondContact N-O 3.38Å; R191-E435 HydrophobicContact CG-CB 3.83Å; R191-E435 HydrophobicContact CG-CG 4.44Å; R191-E435 IonicContact CZ-OE1 3.6Å; R191-E435 IonicContact CZ-OE2 3.46Å; R191-E435 VanDerWaalsContact NE-CD 3.29Å; R191-E435 IonicContact NE-OE1 3.78Å; R191-E435 PolarHBondContact NE-OE1 3.05Å; R191-E435 IonicContact NE-OE2 3.35Å; R191-E435 PolarHBondContact NE-OE2 3.03Å; R191-E435 IonicContact NH2-OE1 3.21Å; R191-E435 PolarHBondContact NH2-OE1 3.16Å; R191-E435 IonicContact NH2-OE2 2.74Å; R191-E435 PolarHBondContact NH2-OE2 2.73Å; R191-E435 WeakPolarHBondContact O-CB 3.4Å; R191-E435 PolarHBondContact O-N 3.34Å
436	I	92.3	Very high	90.9	Very high	29 Å²	29	46.7 Å²	46.7	15%	0.149	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.8	-170.9	-70.9	168.2	0	0	0	110.8	C187 V367 Y414 K419 A434 W438	C187-I436 HydrophobicContact CB-CG2 3.68Å; C187-I436 WeakPolarHBondContact SG-CG2 3.41Å; V367-I436 HydrophobicContact CG1-CD1 3.67Å; V367-I436 HydrophobicContact CG1-CG1 4.2Å; Y414-I436 HydrophobicContact CE2-CD1 4.23Å; Y414-I436 WeakPolarHBondContact OH-CD1 3.49Å; K419-I436 HydrophobicContact CB-CD1 4.4Å; K419-I436 HydrophobicContact CD-CD1 4.24Å; A434-I436 HydrophobicContact CB-CD1 4.04Å; A434-I436 HydrophobicContact CB-CG1 4.08Å; A434-I436 PolarHBondContact O-N 3.24Å; I436-W438 HydrophobicContact CG2-CD2 4.29Å; I436-W438 HydrophobicContact CG2-CZ2 4.04Å
437	H	91.2	Very high	90.7	Very high	83 Å²	83	46.8 Å²	46.8	38%	0.384	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109.8	169.3	178	78	0	0	0	109.9	C187 S188 K190	C187-H437 CarbonylContact C-O 3.33Å; C187-H437 WeakPolarHBondContact CA-O 3.43Å; C187-H437 WeakPolarHBondContact CB-O 3.07Å; S188-H437 PolarHBondContact N-O 3.4Å; S188-H437 PolarHBondContact O-N 3.23Å; S188-H437 PolarHBondContact OG-O 3Å; K190-H437 HydrophobicContact CD-CB 4.12Å; K190-H437 HydrophobicContact CG-CB 3.61Å
438	W	83.8	Confident	90.4	Very high	130 Å²	130	50.3 Å²	50.3	49%	0.492	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	132.9	173.4	-60.9	95.4	0	0	0	110.4	A185 C187 E320 I436	A185-W438 HydrophobicContact CB-CZ3 4.17Å; C187-W438 HydrophobicContact CB-CD2 4.11Å; C187-W438 HydrophobicContact CB-CE3 3.69Å; C187-W438 HydrophobicContact CB-CZ3 3.99Å; E320-W438 HydrophobicContact CG-CH2 4.12Å; I436-W438 HydrophobicContact CG2-CD2 4.29Å; I436-W438 HydrophobicContact CG2-CZ2 4.04Å
439	R	73.2	Confident	89.8	Confident	66 Å²	66	50.5 Å²	50.5	25%	0.249	28%	0.276	C	S	.	.			trans	-98.8	132.6	173.7	-66.8	173.2	177.2	158.4	-0.4	108.1	T177 H186	T177-R439 HydrophobicContact CG2-CB 4.48Å; H186-R439 WeakPolarHBondContact CE1-CD 3.32Å; H186-R439 WeakPolarHBondContact NE2-CD 3.32Å; H186-R439 PolarHBondContact NE2-NH1 3.49Å; H186-R439 PolarHBondContact O-N 3.39Å
440	A	56.3	Low	89.1	Confident	143 Å²	143	55 Å²	55	100%	1.182	30%	0.301	S	S	*	.			trans	-80.4	0	177	0	0	0	0	0	112	T177	T177-A440 VanDerWaalsContact CB-O 3.29Å; T177-A440 WeakPolarHBondContact CB-O 3.37Å; T177-A440 WeakPolarHBondContact CG2-O 3.44Å; T177-A440 PolarHBondContact OG1-O 2.87Å

Retrieved 440 of 440 residues in 94.2 ms (Link to these results)

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