A0A077ZIL0_TRITR Loading...

WD repeat-containing protein 37

AlphaFold DB , UniProt , Accession A0A077ZIL0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 461 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	34.6	Very low	55.9	Low	235 Å²	235	131.5 Å²	131.5	100%	1.158	72%	0.716	S	S	*	*				0	151.8	0	-74.1	174.1	175.3	0	0	108.5	Y3	M1-Y3 PolarHBondContact O-N 3.44Å
2	N	37.6	Very low	57.6	Low	167 Å²	167	124.8 Å²	124.8	89%	0.893	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-49.6	121.8	-158.4	-57.3	-11.7	0	0	0	116.1
3	Y	39.1	Very low	58.4	Low	235 Å²	235	119.7 Å²	119.7	92%	0.922	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-76.9	116.9	155	-75.8	-81	0	0	0	108.4	M1	M1-Y3 PolarHBondContact O-N 3.44Å
4	S	46	Very low	59.7	Low	115 Å²	115	117.9 Å²	117.9	80%	0.804	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-65.9	136.1	172.1	-177.6	0	0	0	0	109.7
5	S	57.5	Low	60.8	Low	94 Å²	94	117.1 Å²	117.1	66%	0.657	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-61.4	148.8	173.1	57.3	0	0	0	0	110.9	G7	S5-G7 PolarHBondContact O-N 3.06Å
6	P	52.8	Low	61.9	Low	69 Å²	69	115.6 Å²	115.6	45%	0.448	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-57.2	129.2	170.8	-21.7	32.5	0	0	0	110.4	F10	P6-F10 HydrophobicContact CB-CB 3.74Å; P6-F10 HydrophobicContact CB-CD1 3.31Å; P6-F10 HydrophobicContact CB-CD2 4.49Å; P6-F10 HydrophobicContact CB-CE1 4Å; P6-F10 HydrophobicContact CB-CG 3.6Å; P6-F10 HydrophobicContact CG-CD1 3.99Å; P6-F10 HydrophobicContact CG-CE1 4.2Å
7	G	68.1	Low	62.6	Low	46 Å²	46	113.4 Å²	113.4	47%	0.474	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-63.6	163.1	-176.6	0	0	0	0	0	112.8	S5 A9 F10 N11	S5-G7 PolarHBondContact O-N 3.06Å; G7-A9 PolarHBondContact O-N 2.87Å; G7-F10 WeakPolarHBondContact O-CB 3.46Å; G7-F10 PolarHBondContact O-N 3.13Å; G7-N11 PolarHBondContact O-N 3.35Å
8	K	68.6	Low	63.5	Low	195 Å²	195	111.2 Å²	111.2	85%	0.848	62%	0.62	S	S	*	*	H	α-helix	trans	-48.9	-33.3	-178.4	-70.1	-176.5	177	-179.2	0	114.2	N11 A12	K8-N11 PolarHBondContact O-N 2.96Å; K8-A12 WeakPolarHBondContact O-CB 3.41Å; K8-A12 PolarHBondContact O-N 2.85Å
9	A	63.7	Low	64.4	Low	82 Å²	82	111.3 Å²	111.3	68%	0.678	61%	0.613	S	S	*	*	H	α-helix	trans	-65	-36.2	175.8	0	0	0	0	0	113.7	G7 A13	G7-A9 PolarHBondContact O-N 2.87Å; A9-A13 WeakPolarHBondContact O-CB 3.48Å; A9-A13 PolarHBondContact O-N 3.23Å
10	F	73.1	Confident	65	Low	121 Å²	121	109.9 Å²	109.9	53%	0.531	61%	0.607	S	S	.	*	H	α-helix	trans	-68.4	-45	175	-177	-88.5	0	0	0	111	P6 G7 A12 A13 L14	P6-F10 HydrophobicContact CB-CB 3.74Å; P6-F10 HydrophobicContact CB-CD1 3.31Å; P6-F10 HydrophobicContact CB-CD2 4.49Å; P6-F10 HydrophobicContact CB-CE1 4Å; P6-F10 HydrophobicContact CB-CG 3.6Å; P6-F10 HydrophobicContact CG-CD1 3.99Å; P6-F10 HydrophobicContact CG-CE1 4.2Å; G7-F10 WeakPolarHBondContact O-CB 3.46Å; G7-F10 PolarHBondContact O-N 3.13Å; F10-A12 VanDerWaalsContact C-N 3.35Å; F10-A12 PolarHBondContact O-N 3Å; F10-A13 PolarHBondContact O-N 2.72Å; F10-L14 WeakPolarHBondContact O-CB 3.35Å; F10-L14 PolarHBondContact O-N 2.81Å
11	N	74.1	Confident	65.4	Low	87 Å²	87	109 Å²	109	47%	0.465	60%	0.599	S	S	.	*	H	α-helix	trans	-63.9	-40.5	177.4	-66.2	-10.9	0	0	0	111.6	G7 K8 L14 E15	G7-N11 PolarHBondContact O-N 3.35Å; K8-N11 PolarHBondContact O-N 2.96Å; N11-L14 PolarHBondContact O-N 2.74Å; N11-E15 WeakPolarHBondContact O-CB 3.47Å; N11-E15 PolarHBondContact O-N 3.48Å
12	A	75.6	Confident	67.4	Low	51 Å²	51	100.2 Å²	100.2	42%	0.421	56%	0.564	S	S	.	*	H	α-helix	trans	-63.8	-40.3	173.5	0	0	0	0	0	112.4	K8 F10 E15 V16	K8-A12 WeakPolarHBondContact O-CB 3.41Å; K8-A12 PolarHBondContact O-N 2.85Å; F10-A12 VanDerWaalsContact C-N 3.35Å; F10-A12 PolarHBondContact O-N 3Å; A12-E15 PolarHBondContact O-N 3Å; A12-V16 WeakPolarHBondContact O-CG2 3.37Å; A12-V16 PolarHBondContact O-N 3.06Å
13	A	68.3	Low	69.1	Low	59 Å²	59	97.4 Å²	97.4	49%	0.488	55%	0.548	S	S	.	.	H	α-helix	trans	-65	-38.3	175.1	0	0	0	0	0	112.4	A9 F10 V16 H17	A9-A13 WeakPolarHBondContact O-CB 3.48Å; A9-A13 PolarHBondContact O-N 3.23Å; F10-A13 PolarHBondContact O-N 2.72Å; A13-V16 PolarHBondContact O-N 2.9Å; A13-H17 WeakPolarHBondContact O-CB 3.4Å; A13-H17 PolarHBondContact O-N 2.72Å
14	L	76.8	Confident	70.6	Confident	95 Å²	95	89.7 Å²	89.7	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-67.7	-39	175.8	-172.3	67.3	0	0	0	112.2	F10 N11 H17 T18	F10-L14 WeakPolarHBondContact O-CB 3.35Å; F10-L14 PolarHBondContact O-N 2.81Å; N11-L14 PolarHBondContact O-N 2.74Å; L14-H17 WeakPolarHBondContact O-CB 3.36Å; L14-H17 PolarHBondContact O-N 3.23Å; L14-T18 PolarHBondContact O-N 3.44Å; L14-T18 PolarHBondContact O-OG1 2.75Å
15	E	76.3	Confident	71.9	Confident	106 Å²	106	88.9 Å²	88.9	50%	0.495	51%	0.512	S	S	.	.	H	α-helix	trans	-68.5	-34.1	175.3	-159.9	-167.2	152	0	0	112	N11 A12 T18 K19	N11-E15 WeakPolarHBondContact O-CB 3.47Å; N11-E15 PolarHBondContact O-N 3.48Å; A12-E15 PolarHBondContact O-N 3Å; E15-T18 WeakPolarHBondContact CA-OG1 3.05Å; E15-T18 PolarHBondContact O-OG1 2.9Å; E15-K19 WeakPolarHBondContact O-CB 3.31Å; E15-K19 WeakPolarHBondContact O-CD 3.39Å; E15-K19 VanDerWaalsContact O-CG 3.27Å; E15-K19 WeakPolarHBondContact O-CG 3.4Å; E15-K19 PolarHBondContact O-N 2.83Å; E15-K19 WeakPolarHBondContact OE1-CE 3.44Å; E15-K19 IonicContact OE1-NZ 3.87Å; E15-K19 PolarHBondContact OE1-NZ 3.32Å
16	V	78.7	Confident	72.6	Confident	92 Å²	92	93.1 Å²	93.1	56%	0.558	51%	0.514	S	S	*	.	H	α-helix	trans	-68.8	-40.8	170.1	170.8	0	0	0	0	110.8	A12 A13 K19 V20	A12-V16 WeakPolarHBondContact O-CG2 3.37Å; A12-V16 PolarHBondContact O-N 3.06Å; A13-V16 PolarHBondContact O-N 2.9Å; V16-K19 PolarHBondContact O-N 2.94Å; V16-V20 HydrophobicContact CG1-CG2 4.43Å; V16-V20 WeakPolarHBondContact O-CG2 3.43Å; V16-V20 PolarHBondContact O-N 2.73Å
17	H	72.5	Confident	73.3	Confident	78 Å²	78	94.4 Å²	94.4	36%	0.361	52%	0.516	S	S	.	.	H	α-helix	trans	-60	-51.8	178.2	-159.1	-78.8	0	0	0	111.9	A13 L14 K19 V20 E21	A13-H17 WeakPolarHBondContact O-CB 3.4Å; A13-H17 PolarHBondContact O-N 2.72Å; L14-H17 WeakPolarHBondContact O-CB 3.36Å; L14-H17 PolarHBondContact O-N 3.23Å; H17-K19 VanDerWaalsContact C-N 3.29Å; H17-K19 PolarHBondContact O-N 2.79Å; H17-V20 PolarHBondContact O-N 2.86Å; H17-E21 IonicContact CE1-OE1 3.34Å; H17-E21 PolarHBondContact CE1-OE1 2.74Å; H17-E21 IonicContact CE1-OE2 2.77Å; H17-E21 IonicContact CG-OE2 2.97Å; H17-E21 IonicContact ND1-OE1 3.55Å; H17-E21 PolarHBondContact ND1-OE1 2.91Å; H17-E21 IonicContact ND1-OE2 2.89Å; H17-E21 PolarHBondContact ND1-OE2 3.32Å; H17-E21 PolarHBondContact O-N 3.12Å
18	T	79.1	Confident	73.1	Confident	75 Å²	75	97.2 Å²	97.2	46%	0.46	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-33.6	178.2	36.1	0	0	0	0	112.9	L14 E15 A22	L14-T18 PolarHBondContact O-N 3.44Å; L14-T18 PolarHBondContact O-OG1 2.75Å; E15-T18 WeakPolarHBondContact CA-OG1 3.05Å; E15-T18 PolarHBondContact O-OG1 2.9Å; T18-A22 WeakPolarHBondContact O-CB 3.4Å; T18-A22 PolarHBondContact O-N 2.83Å
19	K	81.2	Confident	73	Confident	113 Å²	113	95.9 Å²	95.9	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-69.8	-34.2	172.4	-74.5	171.6	-170.9	169.1	0	113	E15 V16 H17 L23	E15-K19 WeakPolarHBondContact O-CB 3.31Å; E15-K19 WeakPolarHBondContact O-CD 3.39Å; E15-K19 VanDerWaalsContact O-CG 3.27Å; E15-K19 WeakPolarHBondContact O-CG 3.4Å; E15-K19 PolarHBondContact O-N 2.83Å; E15-K19 WeakPolarHBondContact OE1-CE 3.44Å; E15-K19 IonicContact OE1-NZ 3.87Å; E15-K19 PolarHBondContact OE1-NZ 3.32Å; V16-K19 PolarHBondContact O-N 2.94Å; H17-K19 VanDerWaalsContact C-N 3.29Å; H17-K19 PolarHBondContact O-N 2.79Å; K19-L23 WeakPolarHBondContact O-CB 3.42Å; K19-L23 WeakPolarHBondContact O-CD1 3.48Å; K19-L23 WeakPolarHBondContact O-CG 3.17Å; K19-L23 PolarHBondContact O-N 3.33Å; K19-L23 VanDerWaalsContact O-N 3.14Å
20	V	76	Confident	72.5	Confident	82 Å²	82	93.5 Å²	93.5	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-70.1	-44.8	175.1	170.1	0	0	0	0	110.6	V16 H17 L23 T24	V16-V20 HydrophobicContact CG1-CG2 4.43Å; V16-V20 WeakPolarHBondContact O-CG2 3.43Å; V16-V20 PolarHBondContact O-N 2.73Å; H17-V20 PolarHBondContact O-N 2.86Å; V20-L23 PolarHBondContact O-N 3Å; V20-L23 VanDerWaalsContact O-N 3.14Å; V20-T24 PolarHBondContact O-N 3.43Å; V20-T24 PolarHBondContact O-OG1 3.01Å; V20-T24 VanDerWaalsContact O-OG1 3.08Å
21	E	74.7	Confident	71.1	Confident	92 Å²	92	91.6 Å²	91.6	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-58.5	-50.8	175.2	-72.9	166.8	137	0	0	111.3	H17 L23 T24 D25	H17-E21 IonicContact CE1-OE1 3.34Å; H17-E21 PolarHBondContact CE1-OE1 2.74Å; H17-E21 IonicContact CE1-OE2 2.77Å; H17-E21 IonicContact CG-OE2 2.97Å; H17-E21 IonicContact ND1-OE1 3.55Å; H17-E21 PolarHBondContact ND1-OE1 2.91Å; H17-E21 IonicContact ND1-OE2 2.89Å; H17-E21 PolarHBondContact ND1-OE2 3.32Å; H17-E21 PolarHBondContact O-N 3.12Å; E21-L23 PolarHBondContact O-N 2.96Å; E21-L23 VanDerWaalsContact O-N 3.15Å; E21-T24 WeakPolarHBondContact O-CA 3.21Å; E21-T24 WeakPolarHBondContact O-CB 3.45Å; E21-T24 PolarHBondContact O-N 2.82Å; E21-D25 PolarHBondContact O-N 3.2Å
22	A	74.8	Confident	69.9	Low	51 Å²	51	92.5 Å²	92.5	42%	0.421	52%	0.524	S	S	.	.	H	α-helix	trans	-62.9	-22.1	176.8	0	0	0	0	0	114.3	T18 R26	T18-A22 WeakPolarHBondContact O-CB 3.4Å; T18-A22 PolarHBondContact O-N 2.83Å; A22-R26 WeakPolarHBondContact O-CD 3.29Å; A22-R26 VanDerWaalsContact O-CG 3.25Å; A22-R26 WeakPolarHBondContact O-CG 3.25Å
23	L	73.9	Confident	68.6	Low	107 Å²	107	94.3 Å²	94.3	56%	0.56	53%	0.531	S	S	*	.	H	α-helix	trans	-83.1	-34	171.2	-76.4	169.9	0	0	0	112.1	K19 V20 E21 L27	K19-L23 WeakPolarHBondContact O-CB 3.42Å; K19-L23 WeakPolarHBondContact O-CD1 3.48Å; K19-L23 WeakPolarHBondContact O-CG 3.17Å; K19-L23 PolarHBondContact O-N 3.33Å; K19-L23 VanDerWaalsContact O-N 3.14Å; V20-L23 PolarHBondContact O-N 3Å; V20-L23 VanDerWaalsContact O-N 3.14Å; E21-L23 PolarHBondContact O-N 2.96Å; E21-L23 VanDerWaalsContact O-N 3.15Å; L23-L27 PolarHBondContact O-N 3.31Å; L23-L27 VanDerWaalsContact O-N 3.13Å
24	T	70.9	Confident	67.9	Low	74 Å²	74	98.7 Å²	98.7	45%	0.454	55%	0.546	S	S	.	.	H	α-helix	trans	-66.3	-45.3	174.3	-60.5	0	0	0	0	111.2	V20 E21 R26 L27 T28	V20-T24 PolarHBondContact O-N 3.43Å; V20-T24 PolarHBondContact O-OG1 3.01Å; V20-T24 VanDerWaalsContact O-OG1 3.08Å; E21-T24 WeakPolarHBondContact O-CA 3.21Å; E21-T24 WeakPolarHBondContact O-CB 3.45Å; E21-T24 PolarHBondContact O-N 2.82Å; T24-R26 VanDerWaalsContact C-N 3.32Å; T24-R26 PolarHBondContact O-N 3.18Å; T24-L27 WeakPolarHBondContact O-CA 3.25Å; T24-L27 WeakPolarHBondContact O-CB 3.25Å; T24-L27 PolarHBondContact O-N 3.42Å; T24-T28 PolarHBondContact O-N 3.21Å; T24-T28 PolarHBondContact O-OG1 2.91Å
25	D	73.2	Confident	66.9	Low	97 Å²	97	102.5 Å²	102.5	52%	0.519	56%	0.561	S	S	.	*	H	α-helix	trans	-62.1	-39.6	177	-65.3	-24.3	0	0	0	111.6	E21 L27 T28 E29	E21-D25 PolarHBondContact O-N 3.2Å; D25-L27 PolarHBondContact O-N 3.12Å; D25-T28 WeakPolarHBondContact CA-OG1 3.16Å; D25-T28 PolarHBondContact O-N 3.05Å; D25-T28 PolarHBondContact O-OG1 3.32Å; D25-E29 WeakPolarHBondContact O-CG 3.09Å; D25-E29 PolarHBondContact O-N 2.85Å
26	R	71.9	Confident	65.6	Low	183 Å²	183	103.2 Å²	103.2	69%	0.691	56%	0.562	S	S	*	*	H	α-helix	trans	-68	-22	173.4	-73	-179.3	66.8	-162.9	-1.7	113.7	A22 T24 G30	A22-R26 WeakPolarHBondContact O-CD 3.29Å; A22-R26 VanDerWaalsContact O-CG 3.25Å; A22-R26 WeakPolarHBondContact O-CG 3.25Å; T24-R26 VanDerWaalsContact C-N 3.32Å; T24-R26 PolarHBondContact O-N 3.18Å; R26-G30 PolarHBondContact O-N 3.26Å
27	L	67.6	Low	64.2	Low	96 Å²	96	100.4 Å²	100.4	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-84.5	-26.2	175.7	-147.9	82.6	0	0	0	112.2	L23 T24 D25	L23-L27 PolarHBondContact O-N 3.31Å; L23-L27 VanDerWaalsContact O-N 3.13Å; T24-L27 WeakPolarHBondContact O-CA 3.25Å; T24-L27 WeakPolarHBondContact O-CB 3.25Å; T24-L27 PolarHBondContact O-N 3.42Å; D25-L27 PolarHBondContact O-N 3.12Å
28	T	64.1	Low	63.1	Low	105 Å²	105	100.1 Å²	100.1	64%	0.644	56%	0.56	S	S	*	*	H	α-helix	trans	-82.6	-34.6	174.6	53.8	0	0	0	0	112.2	T24 D25	T24-T28 PolarHBondContact O-N 3.21Å; T24-T28 PolarHBondContact O-OG1 2.91Å; D25-T28 WeakPolarHBondContact CA-OG1 3.16Å; D25-T28 PolarHBondContact O-N 3.05Å; D25-T28 PolarHBondContact O-OG1 3.32Å
29	E	66.7	Low	61.6	Low	167 Å²	167	102.7 Å²	102.7	78%	0.78	57%	0.567	S	S	*	*	H	α-helix	trans	-71.8	-36.4	171.8	-70.4	-175.4	162.1	0	0	112.8	D25 G31	D25-E29 WeakPolarHBondContact O-CG 3.09Å; D25-E29 PolarHBondContact O-N 2.85Å; E29-G31 PolarHBondContact O-N 2.93Å
30	G	53.6	Low	60	Low	32 Å²	32	102.2 Å²	102.2	33%	0.33	57%	0.569	S	S	.	*	S	Bend	trans	-94.9	88.8	178.7	0	0	0	0	0	112.1	R26 L32	R26-G30 PolarHBondContact O-N 3.26Å; G30-L32 PolarHBondContact O-N 2.99Å
31	G	44	Very low	58.4	Low	82 Å²	82	105.9 Å²	105.9	85%	0.845	58%	0.578	S	S	*	*			trans	-60.3	63.8	-177	0	0	0	0	0	116.6	E29	E29-G31 PolarHBondContact O-N 2.93Å
32	L	47.4	Very low	57.1	Low	106 Å²	106	104.8 Å²	104.8	56%	0.555	58%	0.584	S	S	*	*			trans	-87.6	130.3	175.5	-83.8	155.1	0	0	0	109.8	G30 K36	G30-L32 PolarHBondContact O-N 2.99Å; L32-K36 HydrophobicContact CD2-CD 4.21Å
33	P	49.5	Very low	55.7	Low	89 Å²	89	108.6 Å²	108.6	58%	0.578	60%	0.597	S	S	*	*			trans	-62.4	140.6	175.9	25.2	-33.1	0	0	0	111	E35 K36	P33-E35 PolarHBondContact O-N 3.3Å; P33-K36 PolarHBondContact O-N 3.22Å
34	L	52.1	Low	54.2	Low	151 Å²	151	108.5 Å²	108.5	79%	0.791	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	-25.6	-168.5	-141.8	81.2	0	0	0	114.4	K36 A37	L34-K36 VanDerWaalsContact C-N 3.29Å; L34-K36 PolarHBondContact O-N 2.58Å; L34-A37 WeakPolarHBondContact O-CB 3.29Å; L34-A37 PolarHBondContact O-N 3.12Å
35	E	55.9	Low	52.8	Low	174 Å²	174	109.7 Å²	109.7	81%	0.813	61%	0.612	S	S	*	*	H	α-helix	trans	-62.7	-30.9	179.3	-61.5	-177.2	151.2	0	0	113.1	P33	P33-E35 PolarHBondContact O-N 3.3Å
36	K	50.6	Low	51.1	Low	121 Å²	121	114 Å²	114	53%	0.526	63%	0.629	S	S	.	*	H	α-helix	trans	-79.3	-19.8	175.8	-85	-172.4	172.3	-178.2	0	114.3	L32 P33 L34 A38 E39	L32-K36 HydrophobicContact CD2-CD 4.21Å; P33-K36 PolarHBondContact O-N 3.22Å; L34-K36 VanDerWaalsContact C-N 3.29Å; L34-K36 PolarHBondContact O-N 2.58Å; K36-A38 PolarHBondContact O-N 3.27Å; K36-E39 PolarHBondContact O-N 3.06Å
37	A	47.6	Very low	49.3	Very low	34 Å²	34	109.1 Å²	109.1	28%	0.281	63%	0.627	S	S	.	*	H	α-helix	trans	-67.5	-28.4	177.3	0	0	0	0	0	112	L34 F41	L34-A37 WeakPolarHBondContact O-CB 3.29Å; L34-A37 PolarHBondContact O-N 3.12Å; A37-F41 PolarHBondContact O-N 2.8Å
38	A	49.9	Very low	47.8	Very low	71 Å²	71	111.3 Å²	111.3	59%	0.587	65%	0.645	S	S	*	*	H	α-helix	trans	-68.1	-35.4	178.1	0	0	0	0	0	113.4	K36 A42	K36-A38 PolarHBondContact O-N 3.27Å; A38-A42 PolarHBondContact O-N 2.78Å
39	E	49	Very low	46.4	Very low	129 Å²	129	112.5 Å²	112.5	60%	0.603	66%	0.657	S	S	*	*	H	α-helix	trans	-70.8	-36	177.8	-66.4	-172.2	139.2	0	0	112.1	K36 F41 A42 I43	K36-E39 PolarHBondContact O-N 3.06Å; E39-F41 VanDerWaalsContact C-N 3.31Å; E39-F41 PolarHBondContact O-N 2.93Å; E39-A42 PolarHBondContact O-N 2.85Å; E39-A42 VanDerWaalsContact O-N 3.16Å; E39-I43 WeakPolarHBondContact O-CG1 3.34Å; E39-I43 PolarHBondContact O-N 2.79Å
40	I	47.2	Very low	45	Very low	104 Å²	104	109.3 Å²	109.3	53%	0.533	65%	0.654	S	S	.	*	H	α-helix	trans	-67	-33.3	-179.6	-62.8	172.6	0	0	0	111.5	T44	I40-T44 PolarHBondContact O-OG1 2.89Å; I40-T44 VanDerWaalsContact O-OG1 3.12Å
41	F	41.2	Very low	44	Very low	159 Å²	159	117 Å²	117	70%	0.697	68%	0.678	S	S	*	*	H	α-helix	trans	-75.4	-20.6	174.6	-103.5	-85	0	0	0	114.1	A37 E39	A37-F41 PolarHBondContact O-N 2.8Å; E39-F41 VanDerWaalsContact C-N 3.31Å; E39-F41 PolarHBondContact O-N 2.93Å
42	A	48.4	Very low	43.6	Very low	68 Å²	68	118.8 Å²	118.8	56%	0.562	68%	0.677	S	S	*	*	H	α-helix	trans	-77.3	-29.4	175.8	0	0	0	0	0	112.7	A38 E39	A38-A42 PolarHBondContact O-N 2.78Å; E39-A42 PolarHBondContact O-N 2.85Å; E39-A42 VanDerWaalsContact O-N 3.16Å
43	I	45.3	Very low	43.1	Very low	132 Å²	132	118.7 Å²	118.7	68%	0.677	69%	0.692	S	S	*	*	H	α-helix	trans	-85.4	-17.6	-172.3	-65.6	167.3	0	0	0	112.9	E39	E39-I43 WeakPolarHBondContact O-CG1 3.34Å; E39-I43 PolarHBondContact O-N 2.79Å
44	T	41.3	Very low	42.4	Very low	104 Å²	104	118.6 Å²	118.6	64%	0.638	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	2.7	-170.8	34.5	0	0	0	0	115.4	I40	I40-T44 PolarHBondContact O-OG1 2.89Å; I40-T44 VanDerWaalsContact O-OG1 3.12Å
45	S	42.7	Very low	41.6	Very low	100 Å²	100	115 Å²	115	70%	0.699	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-14.5	-179.9	63.6	0	0	0	0	115.5
46	E	37.6	Very low	40.7	Very low	188 Å²	188	116.8 Å²	116.8	88%	0.879	71%	0.712	S	S	*	*	S	Bend	trans	-95.1	3	-173.4	-66.3	-159.5	137.6	0	0	115.4
47	A	33.9	Very low	39.7	Very low	79 Å²	79	120.6 Å²	120.6	65%	0.653	73%	0.728	S	S	*	*			trans	-118.1	52.7	-166.1	0	0	0	0	0	115.7
48	T	35.9	Very low	39.3	Very low	142 Å²	142	124.9 Å²	124.9	87%	0.871	75%	0.753	S	S	*	*			trans	-162.2	78.9	160.8	31.1	0	0	0	0	114.8
49	S	35.3	Very low	38.6	Very low	130 Å²	130	126.2 Å²	126.2	91%	0.909	76%	0.758	S	S	*	*			trans	-165.8	149.7	140.1	54.9	0	0	0	0	109.9
50	S	35.9	Very low	37.9	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	77%	0.773	S	S	*	*			trans	-140.8	149.3	-164.7	74.3	0	0	0	0	113.6
51	K	34.4	Very low	37.4	Very low	195 Å²	195	133.2 Å²	133.2	85%	0.848	79%	0.791	S	S	*	*			trans	63	114.9	164	-58.4	169.5	-179.8	176.2	0	115.2
52	S	35.6	Very low	36.9	Very low	118 Å²	118	135 Å²	135	83%	0.825	80%	0.804	S	S	*	*				-175.1	148.4	73.8	40.7	0	0	0	0	114.7
53	A	36.7	Very low	36.3	Very low	105 Å²	105	134.6 Å²	134.6	87%	0.868	81%	0.806	S	S	*	*			trans	41.7	114.3	151.8	0	0	0	0	0	123.3
54	G	34.5	Very low	35.9	Very low	86 Å²	86	137.1 Å²	137.1	89%	0.887	82%	0.815	S	S	*	*				114.2	113.1	114.8	0	0	0	0	0	120.3
55	G	34	Very low	35.6	Very low	76 Å²	76	143.5 Å²	143.5	78%	0.784	83%	0.828	S	S	*	*			trans	115.1	85.7	142.8	0	0	0	0	0	120.4
56	K	37.9	Very low	35.2	Very low	212 Å²	212	147.4 Å²	147.4	92%	0.922	84%	0.84	S	S	*	*			trans	45.6	110.4	145.6	-62.9	-177.4	177.7	179.9	0	121.2
57	K	30.7	Very low	35.1	Very low	201 Å²	201	147.8 Å²	147.8	87%	0.874	84%	0.838	S	S	*	*			trans	-71.5	177	150.7	-76.9	-178.3	176.8	178.4	0	111.3
58	P	38.5	Very low	35.3	Very low	123 Å²	123	150.8 Å²	150.8	80%	0.799	85%	0.849	S	S	*	*			cis	-122.3	-151.8	4.2	46	-30.4	0	0	0	111.7
59	S	34.8	Very low	35.1	Very low	100 Å²	100	148.4 Å²	148.4	70%	0.699	84%	0.843	S	S	*	*			cis	-157.7	150.6	3.8	43.8	0	0	0	0	113.2
60	M	35.4	Very low	35.1	Very low	184 Å²	184	151.9 Å²	151.9	91%	0.906	84%	0.842	S	S	*	*			trans	30	104.4	152.8	-62.5	-176.4	74.1	0	0	121.3
61	Q	36.2	Very low	35	Very low	195 Å²	195	157 Å²	157	91%	0.911	85%	0.852	S	S	*	*				-178.4	107.9	119.1	-101.3	-177.6	10.5	0	0	108.9	G63	Q61-G63 PolarHBondContact O-N 3.09Å
62	M	30.4	Very low	35.3	Very low	197 Å²	197	153.2 Å²	153.2	97%	0.97	85%	0.845	S	S	*	*			trans	-93.5	84.1	-173.9	-155.6	71.4	-151.5	0	0	112.1
63	G	36.2	Very low	35.4	Very low	59 Å²	59	152.4 Å²	152.4	61%	0.608	84%	0.837	S	S	*	*			trans	-123.2	131	169.5	0	0	0	0	0	111.1	Q61	Q61-G63 PolarHBondContact O-N 3.09Å
64	Q	36.3	Very low	35.5	Very low	186 Å²	186	154 Å²	154	87%	0.869	84%	0.838	S	S	*	*			trans	50.3	106.8	163.4	-57.1	179.2	-4.8	0	0	118.2
65	R	35.8	Very low	36.1	Very low	238 Å²	238	153.5 Å²	153.5	90%	0.898	83%	0.834	S	S	*	*				169.3	115.9	126.2	-93	156.1	-177.2	-155.2	0.1	112.1
66	L	33.3	Very low	36.4	Very low	182 Å²	182	161 Å²	161	95%	0.953	84%	0.838	S	S	*	*			trans	-151.3	78.4	150.3	-112	164.6	0	0	0	108.6
67	K	36.5	Very low	36.3	Very low	195 Å²	195	158 Å²	158	85%	0.848	83%	0.832	S	S	*	*			trans	-128.6	107.5	167.1	-98	-170.7	176.8	-179.8	0	107.1
68	T	37.2	Very low	36.6	Very low	143 Å²	143	156.9 Å²	156.9	88%	0.877	84%	0.835	S	S	*	*			trans	156.8	116.8	142.1	43.4	0	0	0	0	108.9
69	A	32.3	Very low	36.5	Very low	91 Å²	91	157.1 Å²	157.1	75%	0.752	83%	0.834	S	S	*	*			trans	157.5	44.4	143.9	0	0	0	0	0	114.4
70	F	34.4	Very low	36.4	Very low	204 Å²	204	155.5 Å²	155.5	90%	0.895	82%	0.823	S	S	*	*			trans	-128.7	90.7	150.9	-86.7	-75.5	0	0	0	109	V72	F70-V72 VanDerWaalsContact C-N 3.33Å; F70-V72 PolarHBondContact O-N 3.39Å
71	K	35	Very low	36.5	Very low	208 Å²	208	152.1 Å²	152.1	90%	0.904	82%	0.817	S	S	*	*			trans	-79.2	82.5	178.7	-169.8	178	-177.3	-179.3	0	108.5
72	V	40.2	Very low	36.4	Very low	115 Å²	115	151 Å²	151	70%	0.697	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-65.7	129	174	-178.3	0	0	0	0	108.7	F70	F70-V72 VanDerWaalsContact C-N 3.33Å; F70-V72 PolarHBondContact O-N 3.39Å
73	P	37.4	Very low	36.7	Very low	101 Å²	101	150.6 Å²	150.6	66%	0.656	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-61.5	139.1	177.9	-24.2	34.3	0	0	0	112.3	G75	P73-G75 PolarHBondContact O-N 3.27Å
74	P	39.1	Very low	36.7	Very low	137 Å²	137	153.7 Å²	153.7	89%	0.89	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	129.1	170.7	29.9	-32.9	0	0	0	109.2
75	G	45.6	Very low	36.6	Very low	77 Å²	77	147.2 Å²	147.2	79%	0.794	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	141	-11.3	178.6	0	0	0	0	0	115.7	P73	P73-G75 PolarHBondContact O-N 3.27Å
76	R	41.8	Very low	37.2	Very low	233 Å²	233	139.1 Å²	139.1	88%	0.879	77%	0.772	S	S	*	*			trans	-90.5	107.3	171.6	-130.6	174.3	-172.6	163.1	2.4	110.2	L78	R76-L78 PolarHBondContact O-N 2.83Å; R76-L78 VanDerWaalsContact O-N 3.13Å
77	N	34.5	Very low	38	Very low	148 Å²	148	134.9 Å²	134.9	79%	0.791	75%	0.75	S	S	*	*			trans	-52	118.5	173.4	-72	-25	0	0	0	109.8	V79	N77-V79 PolarHBondContact O-N 3.42Å
78	L	37.2	Very low	38.9	Very low	178 Å²	178	132 Å²	132	93%	0.932	74%	0.74	S	S	*	*			trans	-67.7	85.1	161.5	-77.9	165.3	0	0	0	107	R76 S80	R76-L78 PolarHBondContact O-N 2.83Å; R76-L78 VanDerWaalsContact O-N 3.13Å; L78-S80 VanDerWaalsContact C-N 3.26Å; L78-S80 PolarHBondContact O-N 3.12Å
79	V	36	Very low	40.1	Very low	128 Å²	128	131.9 Å²	131.9	78%	0.776	73%	0.734	S	S	*	*			trans	-62.3	101.2	163.6	179.5	0	0	0	0	105.2	N77 S81	N77-V79 PolarHBondContact O-N 3.42Å; V79-S81 PolarHBondContact O-N 3.15Å
80	S	32.8	Very low	42.4	Very low	67 Å²	67	130.7 Å²	130.7	47%	0.469	71%	0.71	S	S	.	*			trans	-42.1	113.2	162.7	170.4	0	0	0	0	106.7	L78 F82	L78-S80 VanDerWaalsContact C-N 3.26Å; L78-S80 PolarHBondContact O-N 3.12Å; S80-F82 WeakPolarHBondContact O-CD2 3.26Å; S80-F82 PolarHBondContact O-N 2.79Å; S80-F82 WeakPolarHBondContact OG-CD2 3.26Å; S80-F82 WeakPolarHBondContact OG-CE2 3.46Å
81	S	39	Very low	44.9	Very low	112 Å²	112	121.4 Å²	121.4	78%	0.783	67%	0.671	S	S	*	*			trans	-70	77.4	164.9	60.7	0	0	0	0	106	V79 K83	V79-S81 PolarHBondContact O-N 3.15Å; S81-K83 PolarHBondContact O-N 2.9Å
82	F	34.1	Very low	47.4	Very low	171 Å²	171	117.2 Å²	117.2	75%	0.75	65%	0.65	S	S	*	*			trans	-49.6	112.8	162.2	-77.4	-79	0	0	0	105.2	S80 V84	S80-F82 WeakPolarHBondContact O-CD2 3.26Å; S80-F82 PolarHBondContact O-N 2.79Å; S80-F82 WeakPolarHBondContact OG-CD2 3.26Å; S80-F82 WeakPolarHBondContact OG-CE2 3.46Å; F82-V84 PolarHBondContact O-N 3.29Å
83	K	35.8	Very low	49.9	Very low	189 Å²	189	114.7 Å²	114.7	82%	0.822	63%	0.629	S	S	*	*			trans	-63.9	85	176.9	-176.8	178.8	-178.4	-179.8	0	105.4	S81 G85	S81-K83 PolarHBondContact O-N 2.9Å; K83-G85 PolarHBondContact O-N 2.92Å
84	V	37.1	Very low	52.5	Low	124 Å²	124	112.2 Å²	112.2	75%	0.752	61%	0.612	S	S	*	*			trans	-49.6	112.2	172.6	174.8	0	0	0	0	104.2	F82 S86	F82-V84 PolarHBondContact O-N 3.29Å; V84-S86 PolarHBondContact O-N 2.89Å
85	G	33	Very low	55	Low	50 Å²	50	110.5 Å²	110.5	52%	0.515	59%	0.588	S	S	.	*			trans	-58.1	106.3	-164.2	0	0	0	0	0	108.8	K83 D87	K83-G85 PolarHBondContact O-N 2.92Å; G85-D87 PolarHBondContact O-N 3.08Å
86	S	48.3	Very low	57.4	Low	68 Å²	68	108.3 Å²	108.3	48%	0.476	56%	0.563	S	S	.	*			trans	-67.2	82.6	157.8	59.4	0	0	0	0	105.2	V84 Q88	V84-S86 PolarHBondContact O-N 2.89Å; S86-Q88 PolarHBondContact O-N 3.37Å
87	D	51.5	Low	59.9	Low	94 Å²	94	97.4 Å²	97.4	50%	0.503	52%	0.521	S	S	.	.			trans	-52.9	110.5	173.4	-111.6	-37	0	0	0	106.2	G85 N89 R90	G85-D87 PolarHBondContact O-N 3.08Å; D87-N89 PolarHBondContact O-N 2.85Å; D87-R90 HydrophobicContact CB-CB 4.31Å; D87-R90 HydrophobicContact CB-CG 3.68Å; D87-R90 WeakPolarHBondContact O-CB 3.11Å; D87-R90 PolarHBondContact O-N 2.86Å
88	Q	54.5	Low	62.8	Low	134 Å²	134	97.5 Å²	97.5	63%	0.626	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.4	-175.9	-67.7	-177.1	-17.2	0	0	111	S86	S86-Q88 PolarHBondContact O-N 3.37Å
89	N	62.6	Low	65.5	Low	140 Å²	140	90.3 Å²	90.3	75%	0.749	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-5.9	175.5	-67.1	-12.6	0	0	0	114.8	D87 A91	D87-N89 PolarHBondContact O-N 2.85Å; N89-A91 PolarHBondContact O-N 2.91Å; N89-A91 VanDerWaalsContact O-N 3.16Å
90	R	80.8	Confident	68.4	Low	66 Å²	66	84.8 Å²	84.8	25%	0.249	45%	0.45	C	S	.	.	S	Bend	trans	-63.4	-20.6	-179.8	-90.7	176.3	-175.4	-152.6	-7.6	114.4	D87 I409 T410 V452 S453	D87-R90 HydrophobicContact CB-CB 4.31Å; D87-R90 HydrophobicContact CB-CG 3.68Å; D87-R90 WeakPolarHBondContact O-CB 3.11Å; D87-R90 PolarHBondContact O-N 2.86Å; R90-I409 PolarHBondContact NH1-O 2.76Å; R90-T410 HydrophobicContact CB-CG2 4.3Å; R90-V452 CarbonylContact O-C 3.53Å; R90-V452 WeakPolarHBondContact O-CA 3.08Å; R90-S453 WeakPolarHBondContact CA-OG 3.48Å; R90-S453 PolarHBondContact O-N 3.12Å; R90-S453 PolarHBondContact O-OG 3.06Å
91	A	86.5	Confident	71.5	Confident	10 Å²	10	89.7 Å²	89.7	8%	0.083	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	124.5	172.3	0	0	0	0	0	111.2	N89 T410 L412 N451 V452	N89-A91 PolarHBondContact O-N 2.91Å; N89-A91 VanDerWaalsContact O-N 3.16Å; A91-T410 HydrophobicContact CB-CG2 4.23Å; A91-L412 HydrophobicContact CB-CD2 3.26Å; A91-N451 CarbonylContact C-O 3.44Å; A91-N451 VanDerWaalsContact CA-O 3.28Å; A91-N451 WeakPolarHBondContact CA-O 3.14Å; A91-V452 HydrophobicContact CB-CG2 4.19Å
92	R	88.6	Confident	74.3	Confident	120 Å²	120	86.9 Å²	86.9	45%	0.453	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140.6	174.6	63	-178.1	-179.8	106.4	1.8	110.4	N435 W450 N451	R92-N435 PolarHBondContact NH2-O 3.43Å; R92-W450 WeakPolarHBondContact O-CA 3.45Å; R92-N451 HydrophobicContact CG-CB 3.66Å; R92-N451 PolarHBondContact N-O 2.91Å; R92-N451 VanDerWaalsContact NE-CG 3.33Å; R92-N451 PolarHBondContact NE-OD1 2.81Å; R92-N451 VanDerWaalsContact NH2-CG 3.33Å; R92-N451 PolarHBondContact NH2-ND2 3.31Å; R92-N451 PolarHBondContact O-N 3.18Å
93	F	91.6	Very high	77.3	Confident	61 Å²	61	78.8 Å²	78.8	27%	0.268	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	134.6	164.5	169.7	-97.4	0	0	0	109.4	R95 A96 R418 L448 W450	F93-R95 VanDerWaalsContact CE2-C 3.4Å; F93-R95 WeakPolarHBondContact CE2-O 3.33Å; F93-A96 HydrophobicContact CE2-CB 4.26Å; F93-A96 HydrophobicContact CZ-CB 4.04Å; F93-R418 HydrophobicContact CB-CB 4.46Å; F93-L448 HydrophobicContact CE2-CB 4.37Å; F93-L448 HydrophobicContact CE2-CD2 3.98Å; F93-W450 HydrophobicContact CB-CE3 4.16Å; F93-W450 HydrophobicContact CB-CZ3 4.02Å
94	V	92.2	Very high	80.3	Confident	50 Å²	50	69.8 Å²	69.8	30%	0.303	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-58.9	179.7	-178.1	0	0	0	0	110.5	C436 G449 N451	V94-C436 HydrophobicContact CB-CB 4.5Å; V94-C436 HydrophobicContact CG1-CB 4.27Å; V94-C436 HydrophobicContact CG2-CB 4.36Å; V94-G449 PolarHBondContact N-O 3.42Å; V94-N451 HydrophobicContact CG2-CB 3.6Å
95	R	92.4	Very high	83.2	Confident	101 Å²	101	67.9 Å²	67.9	38%	0.381	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	156	-172.8	-167.7	177.2	-65.7	-81	7.2	111.2	F93 E130 T131 G449	F93-R95 VanDerWaalsContact CE2-C 3.4Å; F93-R95 WeakPolarHBondContact CE2-O 3.33Å; R95-E130 VanDerWaalsContact CZ-O 3.3Å; R95-E130 PolarHBondContact NE-O 2.66Å; R95-E130 VanDerWaalsContact NE-O 3.11Å; R95-E130 PolarHBondContact NH2-O 3.12Å; R95-T131 PolarHBondContact NE-O 3.09Å; R95-T131 PolarHBondContact NH1-O 3.29Å; R95-G449 PolarHBondContact N-O 3.49Å; R95-G449 PolarHBondContact O-N 3.47Å
96	A	94.5	Very high	86.3	Confident	31 Å²	31	65.5 Å²	65.5	26%	0.256	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	136.2	164.6	0	0	0	0	0	109.2	F93 V447 L448	F93-A96 HydrophobicContact CE2-CB 4.26Å; F93-A96 HydrophobicContact CZ-CB 4.04Å; A96-V447 CarbonylContact C-O 3.51Å; A96-V447 WeakPolarHBondContact CA-O 3.24Å; A96-L448 HydrophobicContact CB-CD2 3.66Å
97	F	95.5	Very high	88.7	Confident	3 Å²	3	62.2 Å²	62.2	1%	0.013	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.8	171.6	-46.9	-108.4	0	0	0	107	I115 W127 F439 V447	F97-I115 HydrophobicContact CD1-CD1 3.96Å; F97-I115 HydrophobicContact CD2-CD1 3.96Å; F97-I115 HydrophobicContact CE1-CD1 3.77Å; F97-I115 HydrophobicContact CE1-CG1 4.32Å; F97-I115 HydrophobicContact CE2-CD1 3.81Å; F97-I115 HydrophobicContact CG-CD1 4.06Å; F97-I115 HydrophobicContact CZ-CD1 3.72Å; F97-I115 HydrophobicContact CZ-CG1 4.49Å; F97-W127 HydrophobicContact CB-CD2 4.03Å; F97-W127 HydrophobicContact CB-CE3 3.85Å; F97-W127 HydrophobicContact CB-CZ3 4.12Å; F97-W127 HydrophobicContact CD1-CB 3.69Å; F97-W127 HydrophobicContact CD1-CD2 4.19Å; F97-W127 HydrophobicContact CD1-CE3 4.17Å; F97-W127 HydrophobicContact CD1-CG 4.02Å; F97-W127 HydrophobicContact CE1-CB 4.02Å; F97-F439 AromaticContact CE2-CD1 3.91Å; F97-F439 HydrophobicContact CE2-CD1 3.91Å; F97-F439 AromaticContact CE2-CE1 3.84Å; F97-F439 HydrophobicContact CE2-CE1 3.84Å; F97-F439 HydrophobicContact CZ-CD1 4.31Å; F97-F439 AromaticContact CZ-CE1 3.81Å; F97-F439 HydrophobicContact CZ-CE1 3.81Å; F97-V447 HydrophobicContact CB-CB 4.11Å; F97-V447 HydrophobicContact CD2-CB 4Å; F97-V447 HydrophobicContact CD2-CG1 3.65Å; F97-V447 HydrophobicContact CE2-CG1 4.23Å; F97-V447 HydrophobicContact CG-CB 4.41Å; F97-V447 HydrophobicContact CG-CG1 4.38Å; F97-V447 PolarHBondContact N-O 2.95Å; F97-V447 PolarHBondContact O-N 2.74Å
98	K	95.1	Very high	90.8	Very high	150 Å²	150	59 Å²	59	65%	0.652	27%	0.274	S	S	*	.			trans	-130.9	149.1	-170.6	-65	-174.7	177.2	-176.4	0	109.7	W127 L446	K98-W127 VanDerWaalsContact O-CH2 3.27Å; K98-W127 WeakPolarHBondContact O-CH2 3.35Å; K98-W127 WeakPolarHBondContact O-CZ3 3.33Å; K98-L446 HydrophobicContact CD-CD2 4.48Å; K98-L446 HydrophobicContact CG-CD2 3.8Å
99	G	93.8	Very high	92.7	Very high	28 Å²	28	53.5 Å²	53.5	29%	0.289	25%	0.252	S	S	.	.			trans	138.5	-14	173.6	0	0	0	0	0	114.3	R125	G99-R125 VanDerWaalsContact O-CZ 3.25Å; G99-R125 PolarHBondContact O-NH1 3.05Å; G99-R125 PolarHBondContact O-NH2 2.87Å
100	H	97.3	Very high	93.8	Very high	11 Å²	11	47.6 Å²	47.6	5%	0.051	22%	0.222	C	C	.	.			trans	-65.3	139.9	164.8	-82.7	-62.4	0	0	0	110.5	V104 S117 S119 D121 T123 W127	H100-V104 HydrophobicContact CB-CG2 4.05Å; H100-S117 PolarHBondContact NE2-OG 3.21Å; H100-S119 VanDerWaalsContact CE1-CB 3.43Å; H100-S119 WeakPolarHBondContact CE1-CB 3.36Å; H100-S119 WeakPolarHBondContact ND1-CB 3.35Å; H100-D121 WeakPolarHBondContact CA-OD2 3.48Å; H100-D121 WeakPolarHBondContact CB-OD2 3.28Å; H100-D121 IonicContact CE1-OD1 3.8Å; H100-D121 IonicContact CG-OD2 3.52Å; H100-D121 IonicContact ND1-OD1 3.23Å; H100-D121 PolarHBondContact ND1-OD1 2.85Å; H100-D121 IonicContact ND1-OD2 2.86Å; H100-D121 PolarHBondContact ND1-OD2 3.3Å; H100-T123 PolarHBondContact CE1-OG1 2.9Å; H100-T123 VanDerWaalsContact CE1-OG1 3.31Å; H100-T123 PolarHBondContact ND1-OG1 3.23Å; H100-W127 AromaticContact CD2-CZ2 3.9Å
101	R	97.1	Very high	93.3	Very high	170 Å²	170	47.6 Å²	47.6	64%	0.642	24%	0.236	S	C	*	.	S	Bend	trans	-90	-15	-177.2	-64	-175.9	-65.3	-153.2	2.1	112.9	D121 R445	R101-D121 HydrophobicContact CB-CB 4.02Å; R101-D121 PolarHBondContact N-OD2 3.41Å; R101-R445 WeakPolarHBondContact O-CD 3.45Å; R101-R445 PolarHBondContact O-NE 3.37Å; R101-R445 PolarHBondContact O-NH2 3.12Å
102	D	97.3	Very high	92.6	Very high	54 Å²	54	49.8 Å²	49.8	29%	0.289	25%	0.251	S	S	.	.	S	Bend	trans	-142.1	-177.6	174	-156.4	5	0	0	0	112.1	S119 A120 D121	D102-S119 PolarHBondContact O-OG 2.96Å; D102-S119 VanDerWaalsContact O-OG 3.06Å; D102-A120 HydrophobicContact CB-CB 3.95Å; D102-A120 WeakPolarHBondContact OD2-CB 3.23Å; D102-D121 HydrophobicContact CB-CB 4.17Å
103	G	97.4	Very high	92.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.			trans	-55.5	141	-173.4	0	0	0	0	0	113.9	S119 A120	G103-S119 VanDerWaalsContact O-CA 3.31Å; G103-S119 WeakPolarHBondContact O-CA 3.37Å; G103-S119 WeakPolarHBondContact O-CB 3.2Å; G103-S119 PolarHBondContact O-OG 2.93Å; G103-A120 PolarHBondContact O-N 3.37Å
104	V	98.5	Very high	92.5	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116	179.8	-171.7	0	0	0	0	108.8	H100 A118 C425 C441 G442 V447	H100-V104 HydrophobicContact CB-CG2 4.05Å; V104-A118 CarbonylContact C-O 3.31Å; V104-A118 WeakPolarHBondContact CG1-O 3.37Å; V104-C425 VanDerWaalsContact O-CB 3.31Å; V104-C425 WeakPolarHBondContact O-CB 3.38Å; V104-C425 PolarHBondContact O-SG 3.02Å; V104-C441 HydrophobicContact CB-CB 3.91Å; V104-C441 HydrophobicContact CG1-CB 3.6Å; V104-C441 PolarHBondContact O-SG 3.5Å; V104-C441 VanDerWaalsContact O-SG 3.36Å; V104-G442 PolarHBondContact N-O 2.57Å; V104-V447 HydrophobicContact CG1-CG2 4.19Å
105	W	98.2	Very high	92.7	Very high	84 Å²	84	40.6 Å²	40.6	32%	0.318	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-37	-175.8	-68.7	123	0	0	0	113.4	A118 S144 C425 C426 F443	W105-A118 PolarHBondContact N-O 3.45Å; W105-S144 PolarHBondContact NE1-OG 3.37Å; W105-C425 WeakPolarHBondContact O-CB 3.23Å; W105-C426 WeakPolarHBondContact O-CB 3.33Å; W105-F443 HydrophobicContact CE3-CD2 4.46Å; W105-F443 AromaticContact CH2-CD2 3.88Å; W105-F443 HydrophobicContact CH2-CD2 3.88Å; W105-F443 AromaticContact CH2-CE2 3.5Å; W105-F443 HydrophobicContact CH2-CE2 3.5Å; W105-F443 HydrophobicContact CH2-CZ 4.38Å; W105-F443 HydrophobicContact CZ2-CD2 4.23Å; W105-F443 AromaticContact CZ2-CE2 3.52Å; W105-F443 HydrophobicContact CZ2-CE2 3.52Å; W105-F443 HydrophobicContact CZ2-CZ 4.38Å; W105-F443 HydrophobicContact CZ3-CD2 4Å; W105-F443 HydrophobicContact CZ3-CE2 4.1Å
106	H	98.6	Very high	92.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	149.6	-168.2	-170	-71.2	0	0	0	111.2	S117 A118 N146 C147 A148 R149 R380	H106-S117 WeakPolarHBondContact O-CA 3.39Å; H106-A118 HydrophobicContact CB-CB 4.22Å; H106-A118 PolarHBondContact N-O 2.96Å; H106-A118 PolarHBondContact O-N 2.95Å; H106-N146 WeakPolarHBondContact CB-O 3.41Å; H106-C147 PolarHBondContact CD2-SG 2.82Å; H106-C147 PolarHBondContact NE2-SG 2.9Å; H106-A148 PolarHBondContact CE1-O 3.24Å; H106-A148 PolarHBondContact ND1-O 2.96Å; H106-A148 VanDerWaalsContact ND1-O 3.07Å; H106-R149 PolarHBondContact NE2-NH2 2.98Å; H106-R380 VanDerWaalsContact CD2-CD 3.45Å; H106-R380 WeakPolarHBondContact CD2-CD 3.47Å; H106-R380 PolarHBondContact CD2-NE 2.96Å
107	I	98.1	Very high	93.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	144	172.1	179.5	152.1	0	0	0	110	I115 C116 C426 A428 F439 C441 V447	I107-I115 HydrophobicContact CD1-CB 4.4Å; I107-I115 HydrophobicContact CD1-CD1 3.91Å; I107-C116 WeakPolarHBondContact CA-O 3.41Å; I107-C116 WeakPolarHBondContact CG1-O 3.45Å; I107-C426 HydrophobicContact CG2-CB 4.17Å; I107-A428 HydrophobicContact CG1-CB 4.15Å; I107-A428 HydrophobicContact CG2-CB 4.08Å; I107-F439 HydrophobicContact CD1-CB 3.49Å; I107-F439 VanDerWaalsContact CD1-CB 3.49Å; I107-F439 HydrophobicContact CD1-CG 4.22Å; I107-F439 HydrophobicContact CG1-CB 4.22Å; I107-C441 HydrophobicContact CB-CB 4.19Å; I107-C441 HydrophobicContact CG2-CB 4.02Å; I107-V447 HydrophobicContact CD1-CB 4.25Å; I107-V447 HydrophobicContact CD1-CG1 3.24Å; I107-V447 HydrophobicContact CD1-CG2 3.97Å
108	D	97	Very high	93.2	Very high	25 Å²	25	34.2 Å²	34.2	13%	0.134	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.1	171.4	-158.5	43.2	0	0	0	110.2	I115 C116 A148 R149 F150	D108-I115 VanDerWaalsContact O-CA 3.28Å; D108-I115 WeakPolarHBondContact O-CA 3.39Å; D108-I115 WeakPolarHBondContact O-CB 3.39Å; D108-C116 PolarHBondContact N-O 3.33Å; D108-C116 PolarHBondContact O-N 3.28Å; D108-A148 WeakPolarHBondContact CB-O 3.4Å; D108-R149 VanDerWaalsContact CG-CD 3.47Å; D108-R149 IonicContact OD1-CZ 2.81Å; D108-R149 IonicContact OD1-NH1 3.56Å; D108-R149 PolarHBondContact OD1-NH1 3.12Å; D108-R149 WeakPolarHBondContact OD2-CA 3.35Å; D108-R149 WeakPolarHBondContact OD2-CD 3.38Å; D108-F150 HydrophobicContact CB-CD2 4.31Å; D108-F150 PolarHBondContact OD2-N 2.77Å
109	A	93.8	Very high	93.4	Very high	19 Å²	19	27 Å²	27	16%	0.157	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134.8	-177.4	0	0	0	0	0	110.8	I115 A428 A430 F439	A109-I115 HydrophobicContact CB-CG2 3.79Å; A109-A428 HydrophobicContact CB-CB 4.13Å; A109-A430 HydrophobicContact CB-CB 4.03Å; A109-F439 HydrophobicContact CB-CD2 4.2Å; A109-F439 HydrophobicContact CB-CE2 4.33Å
110	A	85.8	Confident	93.6	Very high	16 Å²	16	26.4 Å²	26.4	13%	0.132	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	158.3	174.1	0	0	0	0	0	111.4	S112 V114 F150 I155	A110-S112 PolarHBondContact O-N 3.42Å; A110-V114 HydrophobicContact CB-CG2 3.9Å; A110-V114 PolarHBondContact N-O 3.5Å; A110-F150 HydrophobicContact CB-CB 4.35Å; A110-F150 HydrophobicContact CB-CD2 3.63Å; A110-F150 HydrophobicContact CB-CE2 3.95Å; A110-F150 HydrophobicContact CB-CG 3.94Å; A110-I155 HydrophobicContact CB-CD1 3.75Å
111	A	70.5	Confident	93.6	Very high	66 Å²	66	26.8 Å²	26.8	55%	0.545	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-38	176.2	0	0	0	0	0	113.9	G113 E432	A111-G113 PolarHBondContact O-N 2.89Å; A111-E432 VanDerWaalsContact CB-OE2 3.23Å; A111-E432 WeakPolarHBondContact CB-OE2 3.26Å
112	S	71.3	Confident	93.7	Very high	56 Å²	56	22.9 Å²	22.9	39%	0.392	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	29.3	-170.9	76.3	0	0	0	0	115.4	A110 V114 I155	A110-S112 PolarHBondContact O-N 3.42Å; S112-V114 VanDerWaalsContact C-N 3.29Å; S112-V114 PolarHBondContact O-N 2.95Å; S112-V114 WeakPolarHBondContact OG-CG2 3.24Å; S112-I155 WeakPolarHBondContact OG-CD1 3.32Å
113	G	86.5	Confident	93.7	Very high	28 Å²	28	20.3 Å²	20.3	29%	0.289	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	26.4	178.4	0	0	0	0	0	114.6	A111 T129	A111-G113 PolarHBondContact O-N 2.89Å; G113-T129 VanDerWaalsContact C-OG1 3.24Å; G113-T129 WeakPolarHBondContact CA-OG1 3.2Å; G113-T129 WeakPolarHBondContact O-CB 3.16Å; G113-T129 VanDerWaalsContact O-CG2 3.3Å; G113-T129 WeakPolarHBondContact O-CG2 3.08Å; G113-T129 PolarHBondContact O-N 3.48Å; G113-T129 PolarHBondContact O-OG1 3.43Å
114	V	91.7	Very high	93.8	Very high	11 Å²	11	20.3 Å²	20.3	7%	0.067	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	147.7	177.7	-59.4	0	0	0	0	111.5	A110 S112 I126 W127 F135 F150 I155 I161	A110-V114 HydrophobicContact CB-CG2 3.9Å; A110-V114 PolarHBondContact N-O 3.5Å; S112-V114 VanDerWaalsContact C-N 3.29Å; S112-V114 PolarHBondContact O-N 2.95Å; S112-V114 WeakPolarHBondContact OG-CG2 3.24Å; V114-I126 HydrophobicContact CB-CG2 4.33Å; V114-W127 WeakPolarHBondContact CA-O 3.44Å; V114-F135 HydrophobicContact CB-CZ 4.47Å; V114-F135 HydrophobicContact CG1-CE1 3.93Å; V114-F135 HydrophobicContact CG1-CZ 3.89Å; V114-F150 HydrophobicContact CB-CZ 4.44Å; V114-F150 HydrophobicContact CG2-CE1 4.2Å; V114-F150 HydrophobicContact CG2-CE2 4.35Å; V114-F150 HydrophobicContact CG2-CZ 3.82Å; V114-I155 HydrophobicContact CG2-CD1 4.13Å; V114-I161 HydrophobicContact CG1-CD1 4.47Å; V114-I161 HydrophobicContact CG2-CD1 4.33Å
115	I	95.3	Very high	93.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.5	171.6	52.5	162.6	0	0	0	109.8	F97 I107 D108 A109 I126 W127 T129 F150 F439 V447	F97-I115 HydrophobicContact CD1-CD1 3.96Å; F97-I115 HydrophobicContact CD2-CD1 3.96Å; F97-I115 HydrophobicContact CE1-CD1 3.77Å; F97-I115 HydrophobicContact CE1-CG1 4.32Å; F97-I115 HydrophobicContact CE2-CD1 3.81Å; F97-I115 HydrophobicContact CG-CD1 4.06Å; F97-I115 HydrophobicContact CZ-CD1 3.72Å; F97-I115 HydrophobicContact CZ-CG1 4.49Å; I107-I115 HydrophobicContact CD1-CB 4.4Å; I107-I115 HydrophobicContact CD1-CD1 3.91Å; D108-I115 VanDerWaalsContact O-CA 3.28Å; D108-I115 WeakPolarHBondContact O-CA 3.39Å; D108-I115 WeakPolarHBondContact O-CB 3.39Å; A109-I115 HydrophobicContact CB-CG2 3.79Å; I115-I126 WeakPolarHBondContact O-CA 3.34Å; I115-I126 WeakPolarHBondContact O-CG2 3.49Å; I115-W127 HydrophobicContact CD1-CB 4.22Å; I115-W127 HydrophobicContact CD1-CG 4.3Å; I115-W127 HydrophobicContact CG1-CB 3.84Å; I115-W127 HydrophobicContact CG1-CG 4.2Å; I115-W127 PolarHBondContact N-O 2.86Å; I115-W127 VanDerWaalsContact N-O 3.11Å; I115-W127 PolarHBondContact O-N 2.85Å; I115-T129 HydrophobicContact CB-CG2 4.37Å; I115-T129 HydrophobicContact CG1-CG2 4.11Å; I115-T129 HydrophobicContact CG2-CG2 3.7Å; I115-F150 VanDerWaalsContact C-CZ 3.47Å; I115-F439 HydrophobicContact CD1-CD1 4.01Å; I115-F439 HydrophobicContact CD1-CE1 4.24Å; I115-F439 HydrophobicContact CG2-CD1 4.08Å; I115-F439 HydrophobicContact CG2-CD2 3.69Å; I115-F439 HydrophobicContact CG2-CE1 4.03Å; I115-F439 HydrophobicContact CG2-CE2 3.64Å; I115-F439 HydrophobicContact CG2-CG 3.93Å; I115-F439 HydrophobicContact CG2-CZ 3.82Å; I115-V447 HydrophobicContact CD1-CG1 3.97Å
116	C	96.8	Very high	93.6	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	150.9	167.1	69.3	0	0	0	0	110.8	I107 D108 R125 I126 A148 F150	I107-C116 WeakPolarHBondContact CA-O 3.41Å; I107-C116 WeakPolarHBondContact CG1-O 3.45Å; D108-C116 PolarHBondContact N-O 3.33Å; D108-C116 PolarHBondContact O-N 3.28Å; C116-R125 CarbonylContact C-O 3.55Å; C116-R125 WeakPolarHBondContact CA-O 3.3Å; C116-R125 WeakPolarHBondContact CB-O 3.44Å; C116-I126 HydrophobicContact CB-CG1 4.33Å; C116-A148 HydrophobicContact CB-CB 4.49Å; C116-F150 HydrophobicContact CB-CE1 3.93Å; C116-F150 HydrophobicContact CB-CE2 3.98Å; C116-F150 HydrophobicContact CB-CZ 3.51Å
117	S	98.4	Very high	93.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	149.7	-179.9	57.3	0	0	0	0	111.2	H100 H106 A124 R125 W127	H100-S117 PolarHBondContact NE2-OG 3.21Å; H106-S117 WeakPolarHBondContact O-CA 3.39Å; S117-A124 CarbonylContact O-C 3.59Å; S117-A124 WeakPolarHBondContact O-CA 3.43Å; S117-R125 PolarHBondContact N-O 2.93Å; S117-R125 PolarHBondContact O-N 2.97Å; S117-W127 PolarHBondContact OG-NE1 3.04Å
118	A	98.7	Very high	93.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.6	177.5	0	0	0	0	0	110.5	V104 W105 H106 V145 A148	V104-A118 CarbonylContact C-O 3.31Å; V104-A118 WeakPolarHBondContact CG1-O 3.37Å; W105-A118 PolarHBondContact N-O 3.45Å; H106-A118 HydrophobicContact CB-CB 4.22Å; H106-A118 PolarHBondContact N-O 2.96Å; H106-A118 PolarHBondContact O-N 2.95Å; A118-V145 CarbonylContact C-O 3.55Å; A118-V145 VanDerWaalsContact C-O 3.31Å; A118-V145 HydrophobicContact CB-CB 4.06Å; A118-V145 HydrophobicContact CB-CG1 3.78Å; A118-V145 VanDerWaalsContact CB-O 3.32Å; A118-V145 WeakPolarHBondContact CB-O 3.32Å; A118-A148 HydrophobicContact CB-CB 3.97Å
119	S	98.7	Very high	92.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	156.1	-169.8	175.7	0	0	0	0	113.8	H100 D102 G103 D121 H122 T123 V145	H100-S119 VanDerWaalsContact CE1-CB 3.43Å; H100-S119 WeakPolarHBondContact CE1-CB 3.36Å; H100-S119 WeakPolarHBondContact ND1-CB 3.35Å; D102-S119 PolarHBondContact O-OG 2.96Å; D102-S119 VanDerWaalsContact O-OG 3.06Å; G103-S119 VanDerWaalsContact O-CA 3.31Å; G103-S119 WeakPolarHBondContact O-CA 3.37Å; G103-S119 WeakPolarHBondContact O-CB 3.2Å; G103-S119 PolarHBondContact O-OG 2.93Å; S119-D121 VanDerWaalsContact CB-OD1 3.29Å; S119-D121 WeakPolarHBondContact CB-OD1 3.18Å; S119-D121 PolarHBondContact O-N 2.71Å; S119-D121 VanDerWaalsContact O-N 3.16Å; S119-D121 VanDerWaalsContact OG-CG 3.29Å; S119-D121 PolarHBondContact OG-N 2.9Å; S119-D121 VanDerWaalsContact OG-N 3.14Å; S119-D121 PolarHBondContact OG-OD1 3.2Å; S119-H122 PolarHBondContact O-N 3.12Å; S119-T123 PolarHBondContact N-O 3.38Å; S119-T123 VanDerWaalsContact N-O 3.16Å; S119-V145 CarbonylContact C-O 3.52Å; S119-V145 PolarHBondContact N-O 2.84Å; S119-V145 VanDerWaalsContact N-O 3.16Å; S119-V145 PolarHBondContact O-N 3.28Å
120	A	98.3	Very high	92.5	Very high	15 Å²	15	25.1 Å²	25.1	12%	0.124	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-15.2	166.7	0	0	0	0	0	113.6	D102 G103 H122	D102-A120 HydrophobicContact CB-CB 3.95Å; D102-A120 WeakPolarHBondContact OD2-CB 3.23Å; G103-A120 PolarHBondContact O-N 3.37Å; A120-H122 PolarHBondContact O-CD2 3.18Å; A120-H122 VanDerWaalsContact O-CD2 3.25Å; A120-H122 PolarHBondContact O-N 3.15Å; A120-H122 VanDerWaalsContact O-N 3.09Å
121	D	98	Very high	92.7	Very high	18 Å²	18	28.2 Å²	28.2	10%	0.096	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	14.5	175.9	71	11.5	0	0	0	115.5	H100 R101 D102 S119 T123	H100-D121 WeakPolarHBondContact CA-OD2 3.48Å; H100-D121 WeakPolarHBondContact CB-OD2 3.28Å; H100-D121 IonicContact CE1-OD1 3.8Å; H100-D121 IonicContact CG-OD2 3.52Å; H100-D121 IonicContact ND1-OD1 3.23Å; H100-D121 PolarHBondContact ND1-OD1 2.85Å; H100-D121 IonicContact ND1-OD2 2.86Å; H100-D121 PolarHBondContact ND1-OD2 3.3Å; R101-D121 HydrophobicContact CB-CB 4.02Å; R101-D121 PolarHBondContact N-OD2 3.41Å; D102-D121 HydrophobicContact CB-CB 4.17Å; S119-D121 VanDerWaalsContact CB-OD1 3.29Å; S119-D121 WeakPolarHBondContact CB-OD1 3.18Å; S119-D121 PolarHBondContact O-N 2.71Å; S119-D121 VanDerWaalsContact O-N 3.16Å; S119-D121 VanDerWaalsContact OG-CG 3.29Å; S119-D121 PolarHBondContact OG-N 2.9Å; S119-D121 VanDerWaalsContact OG-N 3.14Å; S119-D121 PolarHBondContact OG-OD1 3.2Å; D121-T123 VanDerWaalsContact O-CG2 3.24Å; D121-T123 WeakPolarHBondContact O-CG2 3.48Å; D121-T123 PolarHBondContact O-N 2.89Å; D121-T123 WeakPolarHBondContact OD1-CA 3.38Å; D121-T123 VanDerWaalsContact OD1-CB 3.26Å; D121-T123 WeakPolarHBondContact OD1-CB 3.49Å; D121-T123 WeakPolarHBondContact OD1-CG2 3.48Å; D121-T123 PolarHBondContact OD1-N 2.59Å; D121-T123 PolarHBondContact OD1-OG1 3.4Å
122	H	98.3	Very high	93.7	Very high	88 Å²	88	25.7 Å²	25.7	41%	0.407	15%	0.15	S	C	.	.	S	Bend	trans	65.8	14.6	-176.5	-53.8	-175	0	0	0	114.1	S119 A120 E142 G143 S144 V145	S119-H122 PolarHBondContact O-N 3.12Å; A120-H122 PolarHBondContact O-CD2 3.18Å; A120-H122 VanDerWaalsContact O-CD2 3.25Å; A120-H122 PolarHBondContact O-N 3.15Å; A120-H122 VanDerWaalsContact O-N 3.09Å; H122-E142 PolarHBondContact CE1-O 2.9Å; H122-G143 WeakPolarHBondContact CA-O 3.34Å; H122-S144 PolarHBondContact CD2-N 3.31Å; H122-S144 VanDerWaalsContact CD2-N 3.29Å; H122-V145 VanDerWaalsContact C-CG2 3.48Å; H122-V145 WeakPolarHBondContact O-CG2 3.11Å
123	T	98.3	Very high	94.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.141	C	C	.	.			trans	-119.9	146.3	-176	85.6	0	0	0	0	113	H100 S119 D121 Q137 Y138 L139	H100-T123 PolarHBondContact CE1-OG1 2.9Å; H100-T123 VanDerWaalsContact CE1-OG1 3.31Å; H100-T123 PolarHBondContact ND1-OG1 3.23Å; S119-T123 PolarHBondContact N-O 3.38Å; S119-T123 VanDerWaalsContact N-O 3.16Å; D121-T123 VanDerWaalsContact O-CG2 3.24Å; D121-T123 WeakPolarHBondContact O-CG2 3.48Å; D121-T123 PolarHBondContact O-N 2.89Å; D121-T123 WeakPolarHBondContact OD1-CA 3.38Å; D121-T123 VanDerWaalsContact OD1-CB 3.26Å; D121-T123 WeakPolarHBondContact OD1-CB 3.49Å; D121-T123 WeakPolarHBondContact OD1-CG2 3.48Å; D121-T123 PolarHBondContact OD1-N 2.59Å; D121-T123 PolarHBondContact OD1-OG1 3.4Å; T123-Q137 VanDerWaalsContact CG2-NE2 3.34Å; T123-Q137 PolarHBondContact OG1-NE2 2.74Å; T123-Y138 WeakPolarHBondContact CA-O 3.41Å; T123-L139 HydrophobicContact CG2-CD2 3.32Å
124	A	98.3	Very high	95	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	145.6	159.2	0	0	0	0	0	109.3	S117 Q137 Y138 V145 W175	S117-A124 CarbonylContact O-C 3.59Å; S117-A124 WeakPolarHBondContact O-CA 3.43Å; A124-Q137 CarbonylContact O-C 3.6Å; A124-Q137 WeakPolarHBondContact O-CA 3.2Å; A124-Y138 PolarHBondContact N-O 3.16Å; A124-Y138 PolarHBondContact O-N 2.9Å; A124-V145 HydrophobicContact CB-CG1 4.44Å; A124-W175 HydrophobicContact CB-CH2 4.33Å; A124-W175 HydrophobicContact CB-CZ2 3.68Å
125	R	97.2	Very high	95	Very high	20 Å²	20	22.8 Å²	22.8	8%	0.075	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	150.9	-178.9	-73.6	-179.1	176	-141.4	2.6	111.4	G99 C116 S117 W127 A136 Q137	G99-R125 VanDerWaalsContact O-CZ 3.25Å; G99-R125 PolarHBondContact O-NH1 3.05Å; G99-R125 PolarHBondContact O-NH2 2.87Å; C116-R125 CarbonylContact C-O 3.55Å; C116-R125 WeakPolarHBondContact CA-O 3.3Å; C116-R125 WeakPolarHBondContact CB-O 3.44Å; S117-R125 PolarHBondContact N-O 2.93Å; S117-R125 PolarHBondContact O-N 2.97Å; R125-W127 HydrophobicContact CB-CZ2 3.76Å; R125-W127 HydrophobicContact CG-CZ2 4.21Å; R125-A136 CarbonylContact C-O 3.38Å; R125-A136 WeakPolarHBondContact CA-O 3.38Å; R125-Q137 HydrophobicContact CG-CB 4.2Å; R125-Q137 HydrophobicContact CG-CG 3.89Å; R125-Q137 VanDerWaalsContact NH2-NE2 3.18Å
126	I	95.6	Very high	95	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.7	170.6	-42.1	-176.9	0	0	0	109.4	V114 I115 C116 F135 A136 F150 I161 V163 W175 A177	V114-I126 HydrophobicContact CB-CG2 4.33Å; I115-I126 WeakPolarHBondContact O-CA 3.34Å; I115-I126 WeakPolarHBondContact O-CG2 3.49Å; C116-I126 HydrophobicContact CB-CG1 4.33Å; I126-F135 HydrophobicContact CB-CE1 4.32Å; I126-F135 HydrophobicContact CB-CE2 4.05Å; I126-F135 HydrophobicContact CB-CZ 3.92Å; I126-F135 HydrophobicContact CG2-CE1 3.75Å; I126-F135 HydrophobicContact CG2-CE2 3.86Å; I126-F135 HydrophobicContact CG2-CZ 3.28Å; I126-F135 PolarHBondContact O-N 2.92Å; I126-A136 HydrophobicContact CB-CB 4.27Å; I126-A136 HydrophobicContact CD1-CB 4.24Å; I126-A136 HydrophobicContact CG1-CB 4.19Å; I126-A136 PolarHBondContact N-O 2.8Å; I126-F150 HydrophobicContact CG2-CE1 4.21Å; I126-F150 HydrophobicContact CG2-CZ 4.13Å; I126-I161 HydrophobicContact CD1-CG2 4.43Å; I126-V163 HydrophobicContact CD1-CG2 3.77Å; I126-W175 HydrophobicContact CD1-CH2 3.91Å; I126-W175 HydrophobicContact CD1-CZ3 3.77Å; I126-W175 HydrophobicContact CG1-CH2 3.81Å; I126-W175 HydrophobicContact CG1-CZ3 4.1Å; I126-A177 HydrophobicContact CD1-CB 3.44Å; I126-A177 VanDerWaalsContact CD1-CB 3.44Å
127	W	94.1	Very high	95	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.011	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.2	-173.2	-37.8	74.6	0	0	0	111.5	F97 K98 H100 V114 I115 S117 R125 A133 C134 F135	F97-W127 HydrophobicContact CB-CD2 4.03Å; F97-W127 HydrophobicContact CB-CE3 3.85Å; F97-W127 HydrophobicContact CB-CZ3 4.12Å; F97-W127 HydrophobicContact CD1-CB 3.69Å; F97-W127 HydrophobicContact CD1-CD2 4.19Å; F97-W127 HydrophobicContact CD1-CE3 4.17Å; F97-W127 HydrophobicContact CD1-CG 4.02Å; F97-W127 HydrophobicContact CE1-CB 4.02Å; K98-W127 VanDerWaalsContact O-CH2 3.27Å; K98-W127 WeakPolarHBondContact O-CH2 3.35Å; K98-W127 WeakPolarHBondContact O-CZ3 3.33Å; H100-W127 AromaticContact CD2-CZ2 3.9Å; V114-W127 WeakPolarHBondContact CA-O 3.44Å; I115-W127 HydrophobicContact CD1-CB 4.22Å; I115-W127 HydrophobicContact CD1-CG 4.3Å; I115-W127 HydrophobicContact CG1-CB 3.84Å; I115-W127 HydrophobicContact CG1-CG 4.2Å; I115-W127 PolarHBondContact N-O 2.86Å; I115-W127 VanDerWaalsContact N-O 3.11Å; I115-W127 PolarHBondContact O-N 2.85Å; S117-W127 PolarHBondContact OG-NE1 3.04Å; R125-W127 HydrophobicContact CB-CZ2 3.76Å; R125-W127 HydrophobicContact CG-CZ2 4.21Å; W127-A133 VanDerWaalsContact CA-O 3.29Å; W127-A133 WeakPolarHBondContact CA-O 3.35Å; W127-C134 HydrophobicContact CD2-CB 4.28Å; W127-C134 HydrophobicContact CE3-CB 3.61Å; W127-C134 HydrophobicContact CH2-CB 4.3Å; W127-C134 HydrophobicContact CZ3-CB 3.62Å; W127-F135 VanDerWaalsContact C-CE1 3.49Å
128	C	91.6	Very high	94.9	Very high	36 Å²	36	23.5 Å²	23.5	24%	0.243	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122	168.2	174.9	0	0	0	0	109.2	E130 T131 G132 A133 F135	C128-E130 VanDerWaalsContact C-N 3.3Å; C128-E130 PolarHBondContact O-N 2.89Å; C128-T131 WeakPolarHBondContact CB-OG1 3.44Å; C128-G132 VanDerWaalsContact O-CA 3.32Å; C128-G132 WeakPolarHBondContact O-CA 3.41Å; C128-G132 PolarHBondContact O-N 3.5Å; C128-A133 PolarHBondContact N-O 2.91Å; C128-F135 HydrophobicContact CB-CD1 4.33Å; C128-F135 HydrophobicContact CB-CE1 4.46Å
129	T	91.2	Very high	94.9	Very high	17 Å²	17	25.7 Å²	25.7	10%	0.104	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-29	-174.8	58.7	0	0	0	0	113.9	G113 I115 F439	G113-T129 VanDerWaalsContact C-OG1 3.24Å; G113-T129 WeakPolarHBondContact CA-OG1 3.2Å; G113-T129 WeakPolarHBondContact O-CB 3.16Å; G113-T129 VanDerWaalsContact O-CG2 3.3Å; G113-T129 WeakPolarHBondContact O-CG2 3.08Å; G113-T129 PolarHBondContact O-N 3.48Å; G113-T129 PolarHBondContact O-OG1 3.43Å; I115-T129 HydrophobicContact CB-CG2 4.37Å; I115-T129 HydrophobicContact CG1-CG2 4.11Å; I115-T129 HydrophobicContact CG2-CG2 3.7Å; T129-F439 HydrophobicContact CG2-CE1 3.95Å; T129-F439 HydrophobicContact CG2-CE2 4.27Å; T129-F439 HydrophobicContact CG2-CZ 3.46Å; T129-F439 VanDerWaalsContact CG2-CZ 3.46Å
130	E	88.3	Confident	94.8	Very high	154 Å²	154	26.1 Å²	26.1	72%	0.72	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-54.7	-179.6	-178.3	171.8	-161.6	0	0	111.6	R95 C128	R95-E130 VanDerWaalsContact CZ-O 3.3Å; R95-E130 PolarHBondContact NE-O 2.66Å; R95-E130 VanDerWaalsContact NE-O 3.11Å; R95-E130 PolarHBondContact NH2-O 3.12Å; C128-E130 VanDerWaalsContact C-N 3.3Å; C128-E130 PolarHBondContact O-N 2.89Å
131	T	89.3	Confident	94.8	Very high	80 Å²	80	25.9 Å²	25.9	49%	0.491	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-34.8	-177.1	64.9	0	0	0	0	112.6	R95 C128 A133	R95-T131 PolarHBondContact NE-O 3.09Å; R95-T131 PolarHBondContact NH1-O 3.29Å; C128-T131 WeakPolarHBondContact CB-OG1 3.44Å; T131-A133 VanDerWaalsContact C-N 3.34Å; T131-A133 WeakPolarHBondContact OG1-CB 3.49Å; T131-A133 PolarHBondContact OG1-N 3.25Å; T131-A133 VanDerWaalsContact OG1-N 3.12Å
132	G	90.9	Very high	94.8	Very high	13 Å²	13	32.2 Å²	32.2	13%	0.134	17%	0.171	C	C	.	.			trans	88.1	-5.3	-168	0	0	0	0	0	115.1	C128	C128-G132 VanDerWaalsContact O-CA 3.32Å; C128-G132 WeakPolarHBondContact O-CA 3.41Å; C128-G132 PolarHBondContact O-N 3.5Å
133	A	92.1	Very high	94.7	Very high	25 Å²	25	28.5 Å²	28.5	21%	0.207	16%	0.157	C	C	.	.			trans	-69.7	137.3	-175.6	0	0	0	0	0	111.4	W127 C128 T131	W127-A133 VanDerWaalsContact CA-O 3.29Å; W127-A133 WeakPolarHBondContact CA-O 3.35Å; C128-A133 PolarHBondContact N-O 2.91Å; T131-A133 VanDerWaalsContact C-N 3.34Å; T131-A133 WeakPolarHBondContact OG1-CB 3.49Å; T131-A133 PolarHBondContact OG1-N 3.25Å; T131-A133 VanDerWaalsContact OG1-N 3.12Å
134	C	93.9	Very high	94.7	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.007	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	136.4	162.7	-171.6	0	0	0	0	108.1	W127 F219	W127-C134 HydrophobicContact CD2-CB 4.28Å; W127-C134 HydrophobicContact CE3-CB 3.61Å; W127-C134 HydrophobicContact CH2-CB 4.3Å; W127-C134 HydrophobicContact CZ3-CB 3.62Å; C134-F219 HydrophobicContact CB-CD1 4.5Å
135	F	92.4	Very high	94.8	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.039	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	-15.2	177.9	68	-103.3	0	0	0	114.3	V114 I126 W127 C128 I161 P178 F181 V220	V114-F135 HydrophobicContact CB-CZ 4.47Å; V114-F135 HydrophobicContact CG1-CE1 3.93Å; V114-F135 HydrophobicContact CG1-CZ 3.89Å; I126-F135 HydrophobicContact CB-CE1 4.32Å; I126-F135 HydrophobicContact CB-CE2 4.05Å; I126-F135 HydrophobicContact CB-CZ 3.92Å; I126-F135 HydrophobicContact CG2-CE1 3.75Å; I126-F135 HydrophobicContact CG2-CE2 3.86Å; I126-F135 HydrophobicContact CG2-CZ 3.28Å; I126-F135 PolarHBondContact O-N 2.92Å; W127-F135 VanDerWaalsContact C-CE1 3.49Å; C128-F135 HydrophobicContact CB-CD1 4.33Å; C128-F135 HydrophobicContact CB-CE1 4.46Å; F135-I161 HydrophobicContact CE2-CD1 4.04Å; F135-I161 HydrophobicContact CZ-CD1 3.85Å; F135-P178 VanDerWaalsContact CE2-O 3.31Å; F135-P178 WeakPolarHBondContact CE2-O 3.35Å; F135-F181 HydrophobicContact CB-CB 4.48Å; F135-F181 HydrophobicContact CB-CD2 3.67Å; F135-F181 HydrophobicContact CB-CE2 4.47Å; F135-V220 PolarHBondContact O-N 2.79Å
136	A	94.1	Very high	94.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	138.8	168.1	0	0	0	0	0	110.7	R125 I126 A177 V220 L222	R125-A136 CarbonylContact C-O 3.38Å; R125-A136 WeakPolarHBondContact CA-O 3.38Å; I126-A136 HydrophobicContact CB-CB 4.27Å; I126-A136 HydrophobicContact CD1-CB 4.24Å; I126-A136 HydrophobicContact CG1-CB 4.19Å; I126-A136 PolarHBondContact N-O 2.8Å; A136-A177 HydrophobicContact CB-CB 3.8Å; A136-V220 CarbonylContact C-O 3.56Å; A136-V220 VanDerWaalsContact CA-O 3.3Å; A136-V220 WeakPolarHBondContact CA-O 3.35Å; A136-L222 HydrophobicContact CB-CD1 4.48Å
137	Q	96.6	Very high	95	Very high	15 Å²	15	29.9 Å²	29.9	7%	0.07	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.5	169.7	-173.6	178.9	35.4	0	0	109.7	T123 A124 R125 L139 F219 V220 L222	T123-Q137 VanDerWaalsContact CG2-NE2 3.34Å; T123-Q137 PolarHBondContact OG1-NE2 2.74Å; A124-Q137 CarbonylContact O-C 3.6Å; A124-Q137 WeakPolarHBondContact O-CA 3.2Å; R125-Q137 HydrophobicContact CG-CB 4.2Å; R125-Q137 HydrophobicContact CG-CG 3.89Å; R125-Q137 VanDerWaalsContact NH2-NE2 3.18Å; Q137-L139 HydrophobicContact CG-CD2 4.48Å; Q137-L139 HydrophobicContact CG-CG 4.4Å; Q137-F219 HydrophobicContact CB-CD2 3.77Å; Q137-F219 HydrophobicContact CB-CE2 3.48Å; Q137-F219 VanDerWaalsContact CB-CE2 3.48Å; Q137-F219 HydrophobicContact CB-CZ 4.44Å; Q137-F219 HydrophobicContact CG-CE2 4.37Å; Q137-F219 VanDerWaalsContact OE1-CE2 3.3Å; Q137-V220 PolarHBondContact N-O 2.97Å; Q137-L222 PolarHBondContact O-N 2.83Å
138	Y	98	Very high	95.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.8	175.7	-173.1	-105.5	0	0	0	110.6	T123 A124 H141 H173 W175 L222 P225	T123-Y138 WeakPolarHBondContact CA-O 3.41Å; A124-Y138 PolarHBondContact N-O 3.16Å; A124-Y138 PolarHBondContact O-N 2.9Å; Y138-H141 AromaticContact CE1-CD2 3.82Å; Y138-H173 HydrophobicContact CE1-CB 4.18Å; Y138-H173 AromaticContact CE1-ND1 3.51Å; Y138-H173 AromaticContact CZ-ND1 3.55Å; Y138-H173 PolarHBondContact OH-ND1 3.31Å; Y138-W175 HydrophobicContact CD1-CD2 4.37Å; Y138-W175 HydrophobicContact CD1-CG 4.36Å; Y138-W175 AromaticContact CD1-NE1 3.77Å; Y138-W175 HydrophobicContact CD2-CB 3.95Å; Y138-W175 AromaticContact CD2-CD2 3.63Å; Y138-W175 HydrophobicContact CD2-CD2 3.63Å; Y138-W175 AromaticContact CD2-CE3 3.98Å; Y138-W175 HydrophobicContact CD2-CE3 3.98Å; Y138-W175 AromaticContact CD2-CG 3.62Å; Y138-W175 HydrophobicContact CD2-CG 3.62Å; Y138-W175 AromaticContact CE1-CD1 3.91Å; Y138-W175 HydrophobicContact CE1-CG 4.39Å; Y138-W175 HydrophobicContact CE2-CB 3.64Å; Y138-W175 AromaticContact CE2-CD1 3.98Å; Y138-W175 HydrophobicContact CE2-CD2 4.2Å; Y138-W175 AromaticContact CE2-CG 3.67Å; Y138-W175 HydrophobicContact CE2-CG 3.67Å; Y138-W175 AromaticContact CG-CD2 3.74Å; Y138-W175 HydrophobicContact CG-CD2 3.74Å; Y138-W175 AromaticContact CG-CE2 3.7Å; Y138-W175 HydrophobicContact CG-CE3 4.2Å; Y138-W175 AromaticContact CG-CG 3.99Å; Y138-W175 HydrophobicContact CG-CG 3.99Å; Y138-W175 HydrophobicContact CG-CZ2 4.15Å; Y138-W175 AromaticContact CG-NE1 3.9Å; Y138-W175 AromaticContact CZ-CD1 3.9Å; Y138-L222 WeakPolarHBondContact CA-O 3.32Å; Y138-L222 HydrophobicContact CD2-CB 3.83Å; Y138-P225 WeakPolarHBondContact OH-CA 3.45Å; Y138-P225 VanDerWaalsContact OH-CB 3.31Å; Y138-P225 WeakPolarHBondContact OH-CB 3.47Å; Y138-P225 WeakPolarHBondContact OH-CD 3.22Å
139	L	97.6	Very high	95.4	Very high	45 Å²	45	29.6 Å²	29.6	24%	0.236	16%	0.162	C	C	.	.			trans	-124.3	27.2	-175.8	-69.8	178.8	0	0	0	111.8	T123 Q137 V221 L222 R223	T123-L139 HydrophobicContact CG2-CD2 3.32Å; Q137-L139 HydrophobicContact CG-CD2 4.48Å; Q137-L139 HydrophobicContact CG-CG 4.4Å; L139-V221 HydrophobicContact CD1-CG1 3.64Å; L139-V221 HydrophobicContact CG-CG1 4.36Å; L139-L222 PolarHBondContact N-O 2.92Å; L139-R223 HydrophobicContact CB-CG 4.13Å
140	G	97.1	Very high	95.6	Very high	10 Å²	10	29.3 Å²	29.3	10%	0.103	16%	0.159	C	C	.	.			trans	-88.2	-9.8	-178.1	0	0	0	0	0	115.5	H173 R223 R228	G140-H173 PolarHBondContact O-CE1 3.35Å; G140-R223 WeakPolarHBondContact CA-O 3.25Å; G140-R228 PolarHBondContact O-NH2 3.46Å
141	H	98.3	Very high	95.7	Very high	10 Å²	10	22.7 Å²	22.7	5%	0.046	13%	0.13	C	C	.	.			trans	-91.6	146.4	179.1	-79.3	-60	0	0	0	111.9	Y138 V145 S165 S167 D169 H173	Y138-H141 AromaticContact CE1-CD2 3.82Å; H141-V145 HydrophobicContact CB-CG2 3.9Å; H141-S165 PolarHBondContact CD2-OG 2.91Å; H141-S165 PolarHBondContact NE2-OG 2.54Å; H141-S167 VanDerWaalsContact CE1-CB 3.4Å; H141-S167 WeakPolarHBondContact CE1-CB 3.35Å; H141-S167 WeakPolarHBondContact ND1-CB 3.46Å; H141-D169 VanDerWaalsContact CA-OD2 3.25Å; H141-D169 WeakPolarHBondContact CA-OD2 3.25Å; H141-D169 VanDerWaalsContact CB-OD2 3.25Å; H141-D169 WeakPolarHBondContact CB-OD2 3.32Å; H141-D169 IonicContact CE1-OD2 3.41Å; H141-D169 IonicContact CG-OD2 3.36Å; H141-D169 IonicContact ND1-OD1 3.5Å; H141-D169 PolarHBondContact ND1-OD1 3.23Å; H141-D169 IonicContact ND1-OD2 2.77Å; H141-D169 PolarHBondContact ND1-OD2 3.13Å; H141-H173 VanDerWaalsContact CA-CE1 3.41Å; H141-H173 WeakPolarHBondContact CA-CE1 3.42Å; H141-H173 AromaticContact CE1-CD2 3.58Å; H141-H173 AromaticContact CE1-CE1 3.85Å; H141-H173 AromaticContact CE1-CG 3.42Å; H141-H173 VanDerWaalsContact CE1-CG 3.42Å; H141-H173 AromaticContact CE1-ND1 3.39Å; H141-H173 PolarHBondContact CE1-ND1 2.71Å; H141-H173 AromaticContact CE1-NE2 3.86Å; H141-H173 AromaticContact CG-CE1 3.73Å; H141-H173 AromaticContact CG-ND1 3.93Å; H141-H173 PolarHBondContact N-CE1 3.22Å; H141-H173 AromaticContact ND1-CE1 3.26Å; H141-H173 PolarHBondContact ND1-CE1 3.02Å; H141-H173 VanDerWaalsContact ND1-CE1 3.26Å; H141-H173 AromaticContact ND1-ND1 3.54Å; H141-H173 AromaticContact ND1-NE2 3.75Å; H141-H173 AromaticContact NE2-CG 3.77Å; H141-H173 AromaticContact NE2-ND1 3.7Å
142	E	97.3	Very high	95.2	Very high	151 Å²	151	21 Å²	21	71%	0.706	12%	0.121	S	C	*	.	S	Bend	trans	-101.7	4	-178.4	-71.2	168.8	-155.1	0	0	112.5	H122 D169	H122-E142 PolarHBondContact CE1-O 2.9Å; E142-D169 HydrophobicContact CB-CB 4.13Å; E142-D169 PolarHBondContact N-OD2 3.31Å
143	G	97.5	Very high	94	Very high	10 Å²	10	24.8 Å²	24.8	10%	0.103	14%	0.141	C	C	.	.	S	Bend	trans	-148.9	179.6	178.7	0	0	0	0	0	112.7	H122 V145 S167	H122-G143 WeakPolarHBondContact CA-O 3.34Å; G143-V145 PolarHBondContact O-N 2.96Å; G143-S167 PolarHBondContact O-OG 3.31Å
144	S	98.4	Very high	92.2	Very high	27 Å²	27	28.6 Å²	28.6	19%	0.189	16%	0.164	C	C	.	.			trans	-48.5	122.9	177	170.9	0	0	0	0	111.9	W105 H122 N146 S167 G168	W105-S144 PolarHBondContact NE1-OG 3.37Å; H122-S144 PolarHBondContact CD2-N 3.31Å; H122-S144 VanDerWaalsContact CD2-N 3.29Å; S144-N146 PolarHBondContact O-N 3.07Å; S144-N146 PolarHBondContact O-ND2 3.37Å; S144-N146 PolarHBondContact O-OD1 3.06Å; S144-N146 PolarHBondContact OG-OD1 3.21Å; S144-S167 CarbonylContact O-C 3.55Å; S144-S167 VanDerWaalsContact O-CA 3.3Å; S144-S167 WeakPolarHBondContact O-CA 3.42Å; S144-S167 PolarHBondContact O-OG 3.5Å; S144-G168 PolarHBondContact O-N 2.9Å
145	V	98.7	Very high	90.2	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	111.6	175.9	-164.3	0	0	0	0	108.3	A118 S119 H122 A124 H141 G143 A166	A118-V145 CarbonylContact C-O 3.55Å; A118-V145 VanDerWaalsContact C-O 3.31Å; A118-V145 HydrophobicContact CB-CB 4.06Å; A118-V145 HydrophobicContact CB-CG1 3.78Å; A118-V145 VanDerWaalsContact CB-O 3.32Å; A118-V145 WeakPolarHBondContact CB-O 3.32Å; S119-V145 CarbonylContact C-O 3.52Å; S119-V145 PolarHBondContact N-O 2.84Å; S119-V145 VanDerWaalsContact N-O 3.16Å; S119-V145 PolarHBondContact O-N 3.28Å; H122-V145 VanDerWaalsContact C-CG2 3.48Å; H122-V145 WeakPolarHBondContact O-CG2 3.11Å; A124-V145 HydrophobicContact CB-CG1 4.44Å; H141-V145 HydrophobicContact CB-CG2 3.9Å; G143-V145 PolarHBondContact O-N 2.96Å; V145-A166 CarbonylContact C-O 3.58Å; V145-A166 WeakPolarHBondContact CG1-O 3.47Å
146	N	98.6	Very high	87.5	Confident	19 Å²	19	32.4 Å²	32.4	10%	0.102	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-16.2	-167.3	-55.7	-41	0	0	0	113	H106 S144 A166 G168 V236	H106-N146 WeakPolarHBondContact CB-O 3.41Å; S144-N146 PolarHBondContact O-N 3.07Å; S144-N146 PolarHBondContact O-ND2 3.37Å; S144-N146 PolarHBondContact O-OD1 3.06Å; S144-N146 PolarHBondContact OG-OD1 3.21Å; N146-A166 PolarHBondContact N-O 2.78Å; N146-G168 PolarHBondContact ND2-N 3.2Å; N146-V236 PolarHBondContact ND2-O 3.33Å
147	C	98.7	Very high	85.2	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	144.2	-178.6	-166.3	0	0	0	0	111	H106 S165 A166 A239	H106-C147 PolarHBondContact CD2-SG 2.82Å; H106-C147 PolarHBondContact NE2-SG 2.9Å; C147-S165 VanDerWaalsContact O-CA 3.24Å; C147-S165 WeakPolarHBondContact O-CA 3.29Å; C147-A166 HydrophobicContact CB-CB 4.07Å; C147-A166 PolarHBondContact N-O 3.11Å; C147-A166 PolarHBondContact O-N 3.18Å; C147-A239 PolarHBondContact SG-O 2.66Å
148	A	98.2	Very high	83.1	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	140.4	164.2	0	0	0	0	0	109.7	H106 D108 C116 A118 V163 L164	H106-A148 PolarHBondContact CE1-O 3.24Å; H106-A148 PolarHBondContact ND1-O 2.96Å; H106-A148 VanDerWaalsContact ND1-O 3.07Å; D108-A148 WeakPolarHBondContact CB-O 3.4Å; C116-A148 HydrophobicContact CB-CB 4.49Å; A118-A148 HydrophobicContact CB-CB 3.97Å; A148-V163 HydrophobicContact CB-CG1 4.44Å; A148-L164 CarbonylContact C-O 3.54Å; A148-L164 VanDerWaalsContact CA-O 3.24Å; A148-L164 WeakPolarHBondContact CA-O 3.47Å
149	R	97.1	Very high	81.7	Confident	33 Å²	33	53.1 Å²	53.1	13%	0.125	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	136.8	179.8	-71.9	-63.1	-168.5	-166.8	-3.1	111.4	H106 D108 V163 L164 A239 W241	H106-R149 PolarHBondContact NE2-NH2 2.98Å; D108-R149 VanDerWaalsContact CG-CD 3.47Å; D108-R149 IonicContact OD1-CZ 2.81Å; D108-R149 IonicContact OD1-NH1 3.56Å; D108-R149 PolarHBondContact OD1-NH1 3.12Å; D108-R149 WeakPolarHBondContact OD2-CA 3.35Å; D108-R149 WeakPolarHBondContact OD2-CD 3.38Å; R149-V163 WeakPolarHBondContact O-CA 3.34Å; R149-L164 PolarHBondContact N-O 3.43Å; R149-L164 PolarHBondContact O-N 2.9Å; R149-A239 WeakPolarHBondContact CG-O 3.28Å; R149-W241 PolarHBondContact O-NE1 3.14Å
150	F	94.2	Very high	81	Confident	12 Å²	12	56.1 Å²	56.1	5%	0.053	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	147.4	168.5	-65.5	-66.7	0	0	0	111.2	D108 A110 V114 I115 C116 I126 I161 V163 W241	D108-F150 HydrophobicContact CB-CD2 4.31Å; D108-F150 PolarHBondContact OD2-N 2.77Å; A110-F150 HydrophobicContact CB-CB 4.35Å; A110-F150 HydrophobicContact CB-CD2 3.63Å; A110-F150 HydrophobicContact CB-CE2 3.95Å; A110-F150 HydrophobicContact CB-CG 3.94Å; V114-F150 HydrophobicContact CB-CZ 4.44Å; V114-F150 HydrophobicContact CG2-CE1 4.2Å; V114-F150 HydrophobicContact CG2-CE2 4.35Å; V114-F150 HydrophobicContact CG2-CZ 3.82Å; I115-F150 VanDerWaalsContact C-CZ 3.47Å; C116-F150 HydrophobicContact CB-CE1 3.93Å; C116-F150 HydrophobicContact CB-CE2 3.98Å; C116-F150 HydrophobicContact CB-CZ 3.51Å; I126-F150 HydrophobicContact CG2-CE1 4.21Å; I126-F150 HydrophobicContact CG2-CZ 4.13Å; F150-I161 HydrophobicContact CD1-CG2 3.53Å; F150-I161 HydrophobicContact CE1-CG2 3.58Å; F150-V163 HydrophobicContact CD1-CG2 3.88Å; F150-V163 HydrophobicContact CE1-CG2 3.96Å; F150-W241 PolarHBondContact O-NE1 3.42Å
151	A	91.1	Very high	80.6	Confident	14 Å²	14	55.7 Å²	55.7	12%	0.116	31%	0.31	C	S	.	.			trans	-68.4	155.3	171.9	0	0	0	0	0	112	T153 L162 W241	A151-T153 PolarHBondContact O-N 3.46Å; A151-T153 VanDerWaalsContact O-N 3.17Å; A151-L162 HydrophobicContact CB-CB 3.79Å; A151-L162 HydrophobicContact CB-CD2 3.86Å; A151-L162 HydrophobicContact CB-CG 4.11Å; A151-L162 PolarHBondContact N-O 2.88Å; A151-W241 HydrophobicContact CB-CD2 4.21Å; A151-W241 HydrophobicContact CB-CH2 4.25Å; A151-W241 HydrophobicContact CB-CZ2 3.84Å
152	P	78.2	Confident	80.3	Confident	46 Å²	46	57.3 Å²	57.3	30%	0.299	32%	0.318	S	S	.	.	S	Bend	trans	-58.1	-23	177.2	-32.3	39	0	0	0	117	W241 W243	P152-W241 HydrophobicContact CG-CB 3.9Å; P152-W241 HydrophobicContact CG-CG 4.49Å; P152-W243 VanDerWaalsContact CA-CZ3 3.44Å; P152-W243 HydrophobicContact CB-CD2 3.95Å; P152-W243 HydrophobicContact CB-CE3 3.4Å; P152-W243 HydrophobicContact CB-CH2 4.17Å; P152-W243 HydrophobicContact CB-CZ3 3.53Å; P152-W243 HydrophobicContact CG-CB 4.45Å; P152-W243 HydrophobicContact CG-CD2 3.68Å; P152-W243 HydrophobicContact CG-CE3 3.69Å; P152-W243 HydrophobicContact CG-CG 4.1Å; P152-W243 HydrophobicContact CG-CH2 4.26Å; P152-W243 HydrophobicContact CG-CZ2 4.31Å; P152-W243 HydrophobicContact CG-CZ3 3.99Å
153	T	66.8	Low	80.3	Confident	91 Å²	91	50.1 Å²	50.1	56%	0.558	29%	0.285	S	S	*	.	S	Bend	trans	-68.2	138.6	-168.9	26.7	0	0	0	0	111.5	A151 I155	A151-T153 PolarHBondContact O-N 3.46Å; A151-T153 VanDerWaalsContact O-N 3.17Å; T153-I155 PolarHBondContact O-N 2.93Å
154	P	53.4	Low	80.3	Confident	106 Å²	106	49.7 Å²	49.7	69%	0.688	28%	0.28	S	S	*	.			trans	-52.9	133.1	170.7	-24.8	34	0	0	0	110.3	G156	P154-G156 CarbonylContact O-C 3.59Å; P154-G156 PolarHBondContact O-N 3.33Å
155	I	51.4	Low	80.3	Confident	52 Å²	52	48.4 Å²	48.4	27%	0.267	27%	0.271	S	S	.	.	S	Bend	trans	-74.8	80.2	175.6	-63.8	168.8	0	0	0	107	A110 S112 V114 T153 I161 T179	A110-I155 HydrophobicContact CB-CD1 3.75Å; S112-I155 WeakPolarHBondContact OG-CD1 3.32Å; V114-I155 HydrophobicContact CG2-CD1 4.13Å; T153-I155 PolarHBondContact O-N 2.93Å; I155-I161 HydrophobicContact CD1-CG1 4.37Å; I155-I161 HydrophobicContact CD1-CG2 4.37Å; I155-I161 HydrophobicContact CG2-CG1 4.07Å; I155-T179 HydrophobicContact CG2-CG2 3.46Å; I155-T179 VanDerWaalsContact CG2-CG2 3.46Å
156	G	36.8	Very low	80.3	Confident	38 Å²	38	48.4 Å²	48.4	39%	0.392	27%	0.271	S	S	.	.			trans	150.9	87.1	-161.2	0	0	0	0	0	107.8	P154	P154-G156 CarbonylContact O-C 3.59Å; P154-G156 PolarHBondContact O-N 3.33Å
157	N	45.5	Very low	80.3	Confident	184 Å²	184	47.5 Å²	47.5	98%	0.984	27%	0.266	S	S	*	.	S	Bend		-107.6	25.4	80.6	-65.1	-29.3	0	0	0	116.4
158	G	53.3	Low	80.3	Confident	54 Å²	54	48.6 Å²	48.6	56%	0.557	28%	0.278	S	S	*	.	S	Bend	trans	94.3	59.9	143.3	0	0	0	0	0	118.6
159	R	66.8	Low	80.3	Confident	212 Å²	212	50.2 Å²	50.2	80%	0.8	29%	0.287	S	S	*	.	S	Bend	trans	-170.5	-24.2	150.2	-108.4	156.9	-158	-162.9	4.9	115.6	P178 T179	R159-P178 CarbonylContact O-C 3.49Å; R159-P178 WeakPolarHBondContact O-CA 3.43Å; R159-T179 PolarHBondContact O-N 3.25Å; R159-T179 PolarHBondContact O-OG1 3.07Å
160	E	83.8	Confident	80.3	Confident	107 Å²	107	52.8 Å²	52.8	50%	0.5	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	144.1	-171	-59.1	178.7	137.3	0	0	112.6	K176 A177 T179	E160-K176 IonicContact OE1-NZ 2.75Å; E160-K176 WeakPolarHBondContact OE2-CD 3.35Å; E160-K176 VanDerWaalsContact OE2-CE 3.23Å; E160-K176 WeakPolarHBondContact OE2-CE 3.22Å; E160-K176 IonicContact OE2-NZ 3.91Å; E160-K176 PolarHBondContact OE2-NZ 3.44Å; E160-A177 CarbonylContact C-O 3.5Å; E160-A177 VanDerWaalsContact CA-O 3.27Å; E160-A177 WeakPolarHBondContact CA-O 3.32Å; E160-T179 PolarHBondContact N-OG1 2.81Å
161	I	89.2	Confident	80.6	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.8	169.1	-58.7	169.4	0	0	0	107	V114 I126 F135 F150 I155 V163 K176 A177	V114-I161 HydrophobicContact CG1-CD1 4.47Å; V114-I161 HydrophobicContact CG2-CD1 4.33Å; I126-I161 HydrophobicContact CD1-CG2 4.43Å; F135-I161 HydrophobicContact CE2-CD1 4.04Å; F135-I161 HydrophobicContact CZ-CD1 3.85Å; F150-I161 HydrophobicContact CD1-CG2 3.53Å; F150-I161 HydrophobicContact CE1-CG2 3.58Å; I155-I161 HydrophobicContact CD1-CG1 4.37Å; I155-I161 HydrophobicContact CD1-CG2 4.37Å; I155-I161 HydrophobicContact CG2-CG1 4.07Å; I161-V163 HydrophobicContact CG2-CG2 4.04Å; I161-K176 WeakPolarHBondContact O-CA 3.28Å; I161-A177 PolarHBondContact N-O 2.96Å; I161-A177 PolarHBondContact O-N 3.41Å
162	L	92.4	Very high	80.9	Confident	43 Å²	43	51.8 Å²	51.8	23%	0.225	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.6	176.7	-166.4	70.1	0	0	0	109.8	A151 V174 K176 W241	A151-L162 HydrophobicContact CB-CB 3.79Å; A151-L162 HydrophobicContact CB-CD2 3.86Å; A151-L162 HydrophobicContact CB-CG 4.11Å; A151-L162 PolarHBondContact N-O 2.88Å; L162-V174 HydrophobicContact CD1-CG1 3.56Å; L162-V174 HydrophobicContact CD2-CG1 4.27Å; L162-V174 HydrophobicContact CG-CG1 3.89Å; L162-K176 HydrophobicContact CD1-CG 3.59Å; L162-W241 HydrophobicContact CD2-CH2 3.61Å; L162-W241 HydrophobicContact CD2-CZ2 4.14Å; L162-W241 HydrophobicContact CD2-CZ3 4.34Å; L162-W241 HydrophobicContact CG-CH2 4.08Å; L162-W241 HydrophobicContact CG-CZ2 4.19Å
163	V	95.3	Very high	81.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	140.3	-177.8	-173.3	0	0	0	0	109.9	I126 A148 R149 F150 I161 V174 W175	I126-V163 HydrophobicContact CD1-CG2 3.77Å; A148-V163 HydrophobicContact CB-CG1 4.44Å; R149-V163 WeakPolarHBondContact O-CA 3.34Å; F150-V163 HydrophobicContact CD1-CG2 3.88Å; F150-V163 HydrophobicContact CE1-CG2 3.96Å; I161-V163 HydrophobicContact CG2-CG2 4.04Å; V163-V174 WeakPolarHBondContact O-CA 3.45Å; V163-W175 HydrophobicContact CB-CD2 3.98Å; V163-W175 HydrophobicContact CB-CE3 4.26Å; V163-W175 HydrophobicContact CB-CH2 3.98Å; V163-W175 HydrophobicContact CB-CZ2 3.65Å; V163-W175 HydrophobicContact CB-CZ3 4.28Å; V163-W175 HydrophobicContact CG1-CH2 4.01Å; V163-W175 HydrophobicContact CG1-CZ2 3.4Å; V163-W175 VanDerWaalsContact CG1-CZ2 3.4Å; V163-W175 HydrophobicContact CG2-CH2 4.03Å; V163-W175 HydrophobicContact CG2-CZ2 4.21Å; V163-W175 HydrophobicContact CG2-CZ3 4.19Å; V163-W175 PolarHBondContact N-O 2.87Å; V163-W175 PolarHBondContact O-N 2.62Å
164	L	97.9	Very high	83.3	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.2	169.5	168	62	0	0	0	108.6	A148 R149 A172 H173 V174 L229 A239 W241 I248	A148-L164 CarbonylContact C-O 3.54Å; A148-L164 VanDerWaalsContact CA-O 3.24Å; A148-L164 WeakPolarHBondContact CA-O 3.47Å; R149-L164 PolarHBondContact N-O 3.43Å; R149-L164 PolarHBondContact O-N 2.9Å; L164-A172 HydrophobicContact CD1-CB 4.2Å; L164-H173 CarbonylContact C-O 3.53Å; L164-H173 WeakPolarHBondContact CA-O 3.44Å; L164-V174 HydrophobicContact CD1-CG2 4.33Å; L164-L229 HydrophobicContact CD1-CD1 4.47Å; L164-A239 HydrophobicContact CD1-CB 4.2Å; L164-A239 HydrophobicContact CD2-CB 3.74Å; L164-A239 HydrophobicContact CG-CB 3.94Å; L164-W241 HydrophobicContact CB-CZ2 3.71Å; L164-W241 VanDerWaalsContact CB-NE1 3.33Å; L164-W241 HydrophobicContact CD2-CD2 4.44Å; L164-W241 HydrophobicContact CD2-CG 4.41Å; L164-I248 HydrophobicContact CD1-CD1 4.26Å; L164-I248 HydrophobicContact CD1-CG2 4.02Å; L164-I248 HydrophobicContact CD2-CB 4.48Å; L164-I248 HydrophobicContact CD2-CD1 4.46Å; L164-I248 HydrophobicContact CD2-CG1 4.18Å; L164-I248 HydrophobicContact CD2-CG2 3.58Å; L164-I248 HydrophobicContact CG-CG2 4.46Å
165	S	98.6	Very high	85.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	152.6	170.8	52.1	0	0	0	0	112	H141 C147 A172 H173 W175	H141-S165 PolarHBondContact CD2-OG 2.91Å; H141-S165 PolarHBondContact NE2-OG 2.54Å; C147-S165 VanDerWaalsContact O-CA 3.24Å; C147-S165 WeakPolarHBondContact O-CA 3.29Å; S165-A172 CarbonylContact O-C 3.58Å; S165-A172 WeakPolarHBondContact O-CA 3.3Å; S165-A172 VanDerWaalsContact O-CB 3.32Å; S165-A172 WeakPolarHBondContact O-CB 3.31Å; S165-H173 PolarHBondContact N-O 3.21Å; S165-H173 PolarHBondContact O-N 3.04Å; S165-W175 PolarHBondContact OG-NE1 2.95Å
166	A	98.7	Very high	87.3	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.3	177.6	0	0	0	0	0	110.8	V145 N146 C147 A172 V236 A239	V145-A166 CarbonylContact C-O 3.58Å; V145-A166 WeakPolarHBondContact CG1-O 3.47Å; N146-A166 PolarHBondContact N-O 2.78Å; C147-A166 HydrophobicContact CB-CB 4.07Å; C147-A166 PolarHBondContact N-O 3.11Å; C147-A166 PolarHBondContact O-N 3.18Å; A166-A172 HydrophobicContact CB-CB 4.22Å; A166-V236 HydrophobicContact CB-CB 4.1Å; A166-V236 HydrophobicContact CB-CG1 3.77Å; A166-A239 HydrophobicContact CB-CB 3.89Å
167	S	98.8	Very high	89.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	159.6	-162.8	173.8	0	0	0	0	114.9	H141 G143 S144 D169 Q170 S171 V236	H141-S167 VanDerWaalsContact CE1-CB 3.4Å; H141-S167 WeakPolarHBondContact CE1-CB 3.35Å; H141-S167 WeakPolarHBondContact ND1-CB 3.46Å; G143-S167 PolarHBondContact O-OG 3.31Å; S144-S167 CarbonylContact O-C 3.55Å; S144-S167 VanDerWaalsContact O-CA 3.3Å; S144-S167 WeakPolarHBondContact O-CA 3.42Å; S144-S167 PolarHBondContact O-OG 3.5Å; S167-D169 VanDerWaalsContact CB-CG 3.49Å; S167-D169 WeakPolarHBondContact CB-OD1 3.33Å; S167-D169 WeakPolarHBondContact CB-OD2 3.44Å; S167-D169 PolarHBondContact O-N 3.35Å; S167-D169 PolarHBondContact OG-N 3.21Å; S167-D169 VanDerWaalsContact OG-N 3.12Å; S167-D169 PolarHBondContact OG-OD1 2.68Å; S167-D169 PolarHBondContact OG-OD2 3.4Å; S167-Q170 PolarHBondContact O-N 2.97Å; S167-S171 PolarHBondContact N-O 2.81Å; S167-S171 VanDerWaalsContact N-O 3.07Å; S167-V236 CarbonylContact C-O 3.59Å; S167-V236 PolarHBondContact N-O 3.37Å; S167-V236 PolarHBondContact O-N 3.39Å
168	G	98.3	Very high	91.9	Very high	25 Å²	25	33 Å²	33	26%	0.258	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.2	167.7	0	0	0	0	0	114.3	S144 N146 Q170	S144-G168 PolarHBondContact O-N 2.9Å; N146-G168 PolarHBondContact ND2-N 3.2Å; G168-Q170 PolarHBondContact O-N 3.12Å; G168-Q170 VanDerWaalsContact O-N 3.09Å
169	D	98.3	Very high	93.1	Very high	34 Å²	34	32.9 Å²	32.9	18%	0.182	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	15.3	172.5	65.5	34.9	0	0	0	114.7	H141 E142 S167 S171 H173	H141-D169 VanDerWaalsContact CA-OD2 3.25Å; H141-D169 WeakPolarHBondContact CA-OD2 3.25Å; H141-D169 VanDerWaalsContact CB-OD2 3.25Å; H141-D169 WeakPolarHBondContact CB-OD2 3.32Å; H141-D169 IonicContact CE1-OD2 3.41Å; H141-D169 IonicContact CG-OD2 3.36Å; H141-D169 IonicContact ND1-OD1 3.5Å; H141-D169 PolarHBondContact ND1-OD1 3.23Å; H141-D169 IonicContact ND1-OD2 2.77Å; H141-D169 PolarHBondContact ND1-OD2 3.13Å; E142-D169 HydrophobicContact CB-CB 4.13Å; E142-D169 PolarHBondContact N-OD2 3.31Å; S167-D169 VanDerWaalsContact CB-CG 3.49Å; S167-D169 WeakPolarHBondContact CB-OD1 3.33Å; S167-D169 WeakPolarHBondContact CB-OD2 3.44Å; S167-D169 PolarHBondContact O-N 3.35Å; S167-D169 PolarHBondContact OG-N 3.21Å; S167-D169 VanDerWaalsContact OG-N 3.12Å; S167-D169 PolarHBondContact OG-OD1 2.68Å; S167-D169 PolarHBondContact OG-OD2 3.4Å; D169-S171 PolarHBondContact O-N 2.73Å; D169-S171 WeakPolarHBondContact OD1-CB 3.27Å; D169-S171 PolarHBondContact OD1-N 3.38Å; D169-S171 PolarHBondContact OD1-OG 3.12Å; D169-H173 IonicContact OD1-NE2 3.97Å
170	Q	98.6	Very high	93	Very high	87 Å²	87	25.8 Å²	25.8	41%	0.407	15%	0.147	S	C	.	.	S	Bend	trans	66	12.6	177.2	-39	-178.3	11.4	0	0	114.1	S167 G168 T233 A234	S167-Q170 PolarHBondContact O-N 2.97Å; G168-Q170 PolarHBondContact O-N 3.12Å; G168-Q170 VanDerWaalsContact O-N 3.09Å; Q170-T233 PolarHBondContact OE1-O 2.76Å; Q170-A234 WeakPolarHBondContact CA-O 3.44Å
171	S	98.5	Very high	91.7	Very high	5 Å²	5	25.9 Å²	25.9	4%	0.035	15%	0.146	C	C	.	.			trans	-124.7	163.2	178.3	77.1	0	0	0	0	113.7	S167 D169 H173 L229	S167-S171 PolarHBondContact N-O 2.81Å; S167-S171 VanDerWaalsContact N-O 3.07Å; D169-S171 PolarHBondContact O-N 2.73Å; D169-S171 WeakPolarHBondContact OD1-CB 3.27Å; D169-S171 PolarHBondContact OD1-N 3.38Å; D169-S171 PolarHBondContact OD1-OG 3.12Å; S171-H173 WeakPolarHBondContact CB-NE2 3.11Å; S171-H173 PolarHBondContact OG-CD2 3.27Å; S171-H173 PolarHBondContact OG-NE2 3.06Å; S171-L229 WeakPolarHBondContact CA-O 3.03Å; S171-L229 WeakPolarHBondContact CB-O 3.46Å
172	A	98.7	Very high	89.6	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.008	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.1	166.9	0	0	0	0	0	109.9	L164 S165 A166 L229 T250	L164-A172 HydrophobicContact CD1-CB 4.2Å; S165-A172 CarbonylContact O-C 3.58Å; S165-A172 WeakPolarHBondContact O-CA 3.3Å; S165-A172 VanDerWaalsContact O-CB 3.32Å; S165-A172 WeakPolarHBondContact O-CB 3.31Å; A166-A172 HydrophobicContact CB-CB 4.22Å; A172-L229 HydrophobicContact CB-CB 4.27Å; A172-L229 HydrophobicContact CB-CD1 4.24Å; A172-L229 PolarHBondContact N-O 2.8Å; A172-L229 VanDerWaalsContact N-O 3.09Å; A172-L229 WeakPolarHBondContact O-CA 3.4Å; A172-L229 VanDerWaalsContact O-CB 3.29Å; A172-L229 WeakPolarHBondContact O-CB 3.32Å; A172-L229 PolarHBondContact O-N 2.82Å; A172-T250 HydrophobicContact CB-CG2 3.63Å
173	H	98.4	Very high	87	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.9	-174.4	-68.3	174.2	0	0	0	110.7	Y138 G140 H141 L164 S165 D169 S171 P225 L227 R228	Y138-H173 HydrophobicContact CE1-CB 4.18Å; Y138-H173 AromaticContact CE1-ND1 3.51Å; Y138-H173 AromaticContact CZ-ND1 3.55Å; Y138-H173 PolarHBondContact OH-ND1 3.31Å; G140-H173 PolarHBondContact O-CE1 3.35Å; H141-H173 VanDerWaalsContact CA-CE1 3.41Å; H141-H173 WeakPolarHBondContact CA-CE1 3.42Å; H141-H173 AromaticContact CE1-CD2 3.58Å; H141-H173 AromaticContact CE1-CE1 3.85Å; H141-H173 AromaticContact CE1-CG 3.42Å; H141-H173 VanDerWaalsContact CE1-CG 3.42Å; H141-H173 AromaticContact CE1-ND1 3.39Å; H141-H173 PolarHBondContact CE1-ND1 2.71Å; H141-H173 AromaticContact CE1-NE2 3.86Å; H141-H173 AromaticContact CG-CE1 3.73Å; H141-H173 AromaticContact CG-ND1 3.93Å; H141-H173 PolarHBondContact N-CE1 3.22Å; H141-H173 AromaticContact ND1-CE1 3.26Å; H141-H173 PolarHBondContact ND1-CE1 3.02Å; H141-H173 VanDerWaalsContact ND1-CE1 3.26Å; H141-H173 AromaticContact ND1-ND1 3.54Å; H141-H173 AromaticContact ND1-NE2 3.75Å; H141-H173 AromaticContact NE2-CG 3.77Å; H141-H173 AromaticContact NE2-ND1 3.7Å; L164-H173 CarbonylContact C-O 3.53Å; L164-H173 WeakPolarHBondContact CA-O 3.44Å; S165-H173 PolarHBondContact N-O 3.21Å; S165-H173 PolarHBondContact O-N 3.04Å; D169-H173 IonicContact OD1-NE2 3.97Å; S171-H173 WeakPolarHBondContact CB-NE2 3.11Å; S171-H173 PolarHBondContact OG-CD2 3.27Å; S171-H173 PolarHBondContact OG-NE2 3.06Å; H173-P225 HydrophobicContact CB-CB 3.97Å; H173-L227 WeakPolarHBondContact CA-O 3.39Å; H173-R228 PolarHBondContact CE1-NH1 2.77Å; H173-R228 PolarHBondContact CE1-NH2 2.97Å; H173-R228 WeakPolarHBondContact NE2-CG 3.25Å; H173-R228 PolarHBondContact NE2-NE 2.96Å; H173-R228 PolarHBondContact NE2-NH1 2.92Å
174	V	97.3	Very high	83.8	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.2	161.7	-176	0	0	0	0	107.9	L162 V163 L164 Q226 L227 W241 I248	L162-V174 HydrophobicContact CD1-CG1 3.56Å; L162-V174 HydrophobicContact CD2-CG1 4.27Å; L162-V174 HydrophobicContact CG-CG1 3.89Å; V163-V174 WeakPolarHBondContact O-CA 3.45Å; L164-V174 HydrophobicContact CD1-CG2 4.33Å; V174-Q226 WeakPolarHBondContact O-CB 3.41Å; V174-Q226 PolarHBondContact O-N 3.1Å; V174-L227 HydrophobicContact CB-CB 4.08Å; V174-L227 HydrophobicContact CG2-CB 4.38Å; V174-L227 HydrophobicContact CG2-CD2 4.49Å; V174-L227 PolarHBondContact N-O 2.8Å; V174-L227 PolarHBondContact O-N 2.93Å; V174-L227 VanDerWaalsContact O-N 3.14Å; V174-W241 HydrophobicContact CG1-CH2 3.82Å; V174-W241 HydrophobicContact CG1-CZ2 4.21Å; V174-W241 HydrophobicContact CG2-CH2 4.08Å; V174-W241 HydrophobicContact CG2-CZ2 4.46Å; V174-I248 HydrophobicContact CG2-CD1 3.49Å; V174-I248 VanDerWaalsContact CG2-CD1 3.49Å
175	W	96.1	Very high	80.7	Confident	1 Å²	1	43.4 Å²	43.4	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	159.5	-179.1	52.2	-84.5	0	0	0	111.6	A124 I126 Y138 V163 S165 A177 L222	A124-W175 HydrophobicContact CB-CH2 4.33Å; A124-W175 HydrophobicContact CB-CZ2 3.68Å; I126-W175 HydrophobicContact CD1-CH2 3.91Å; I126-W175 HydrophobicContact CD1-CZ3 3.77Å; I126-W175 HydrophobicContact CG1-CH2 3.81Å; I126-W175 HydrophobicContact CG1-CZ3 4.1Å; Y138-W175 HydrophobicContact CD1-CD2 4.37Å; Y138-W175 HydrophobicContact CD1-CG 4.36Å; Y138-W175 AromaticContact CD1-NE1 3.77Å; Y138-W175 HydrophobicContact CD2-CB 3.95Å; Y138-W175 AromaticContact CD2-CD2 3.63Å; Y138-W175 HydrophobicContact CD2-CD2 3.63Å; Y138-W175 AromaticContact CD2-CE3 3.98Å; Y138-W175 HydrophobicContact CD2-CE3 3.98Å; Y138-W175 AromaticContact CD2-CG 3.62Å; Y138-W175 HydrophobicContact CD2-CG 3.62Å; Y138-W175 AromaticContact CE1-CD1 3.91Å; Y138-W175 HydrophobicContact CE1-CG 4.39Å; Y138-W175 HydrophobicContact CE2-CB 3.64Å; Y138-W175 AromaticContact CE2-CD1 3.98Å; Y138-W175 HydrophobicContact CE2-CD2 4.2Å; Y138-W175 AromaticContact CE2-CG 3.67Å; Y138-W175 HydrophobicContact CE2-CG 3.67Å; Y138-W175 AromaticContact CG-CD2 3.74Å; Y138-W175 HydrophobicContact CG-CD2 3.74Å; Y138-W175 AromaticContact CG-CE2 3.7Å; Y138-W175 HydrophobicContact CG-CE3 4.2Å; Y138-W175 AromaticContact CG-CG 3.99Å; Y138-W175 HydrophobicContact CG-CG 3.99Å; Y138-W175 HydrophobicContact CG-CZ2 4.15Å; Y138-W175 AromaticContact CG-NE1 3.9Å; Y138-W175 AromaticContact CZ-CD1 3.9Å; V163-W175 HydrophobicContact CB-CD2 3.98Å; V163-W175 HydrophobicContact CB-CE3 4.26Å; V163-W175 HydrophobicContact CB-CH2 3.98Å; V163-W175 HydrophobicContact CB-CZ2 3.65Å; V163-W175 HydrophobicContact CB-CZ3 4.28Å; V163-W175 HydrophobicContact CG1-CH2 4.01Å; V163-W175 HydrophobicContact CG1-CZ2 3.4Å; V163-W175 VanDerWaalsContact CG1-CZ2 3.4Å; V163-W175 HydrophobicContact CG2-CH2 4.03Å; V163-W175 HydrophobicContact CG2-CZ2 4.21Å; V163-W175 HydrophobicContact CG2-CZ3 4.19Å; V163-W175 PolarHBondContact N-O 2.87Å; V163-W175 PolarHBondContact O-N 2.62Å; S165-W175 PolarHBondContact OG-NE1 2.95Å; W175-A177 HydrophobicContact CE3-CB 4.44Å; W175-A177 HydrophobicContact CZ3-CB 4.06Å; W175-L222 HydrophobicContact CE3-CD1 3.74Å; W175-L222 HydrophobicContact CZ3-CD1 3.93Å
176	K	92.5	Very high	77.3	Confident	84 Å²	84	50.7 Å²	50.7	37%	0.365	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.5	-176.5	-73.7	173.3	157.5	-161.3	0	110.8	E160 I161 L162 L222	E160-K176 IonicContact OE1-NZ 2.75Å; E160-K176 WeakPolarHBondContact OE2-CD 3.35Å; E160-K176 VanDerWaalsContact OE2-CE 3.23Å; E160-K176 WeakPolarHBondContact OE2-CE 3.22Å; E160-K176 IonicContact OE2-NZ 3.91Å; E160-K176 PolarHBondContact OE2-NZ 3.44Å; I161-K176 WeakPolarHBondContact O-CA 3.28Å; L162-K176 HydrophobicContact CD1-CG 3.59Å; K176-L222 WeakPolarHBondContact O-CD1 3.34Å
177	A	91	Very high	73.9	Confident	3 Å²	3	53.2 Å²	53.2	3%	0.025	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	154.4	172.9	0	0	0	0	0	110.6	I126 A136 E160 I161 W175 L222	I126-A177 HydrophobicContact CD1-CB 3.44Å; I126-A177 VanDerWaalsContact CD1-CB 3.44Å; A136-A177 HydrophobicContact CB-CB 3.8Å; E160-A177 CarbonylContact C-O 3.5Å; E160-A177 VanDerWaalsContact CA-O 3.27Å; E160-A177 WeakPolarHBondContact CA-O 3.32Å; I161-A177 PolarHBondContact N-O 2.96Å; I161-A177 PolarHBondContact O-N 3.41Å; W175-A177 HydrophobicContact CE3-CB 4.44Å; W175-A177 HydrophobicContact CZ3-CB 4.06Å; A177-L222 HydrophobicContact CB-CD1 3.9Å
178	P	86.9	Confident	70.4	Confident	33 Å²	33	57.8 Å²	57.8	21%	0.214	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	145.4	175.3	27.9	-34.9	0	0	0	111.6	F135 R159 A180 V220	F135-P178 VanDerWaalsContact CE2-O 3.31Å; F135-P178 WeakPolarHBondContact CE2-O 3.35Å; R159-P178 CarbonylContact O-C 3.49Å; R159-P178 WeakPolarHBondContact O-CA 3.43Å; P178-A180 VanDerWaalsContact C-N 3.29Å; P178-A180 PolarHBondContact O-N 3.39Å; P178-V220 HydrophobicContact CG-CB 4.44Å; P178-V220 HydrophobicContact CG-CG2 4.04Å
179	T	78.2	Confident	67	Low	50 Å²	50	59.8 Å²	59.8	31%	0.307	40%	0.402	S	S	.	.	S	Bend	trans	-71.7	-21.1	175.8	-52.2	0	0	0	0	113.4	I155 R159 E160	I155-T179 HydrophobicContact CG2-CG2 3.46Å; I155-T179 VanDerWaalsContact CG2-CG2 3.46Å; R159-T179 PolarHBondContact O-N 3.25Å; R159-T179 PolarHBondContact O-OG1 3.07Å; E160-T179 PolarHBondContact N-OG1 2.81Å
180	A	65.4	Low	63.6	Low	64 Å²	64	67.4 Å²	67.4	53%	0.529	44%	0.436	S	S	.	.	S	Bend	trans	-119.6	143	-173.7	0	0	0	0	0	112.3	P178 V182	P178-A180 VanDerWaalsContact C-N 3.29Å; P178-A180 PolarHBondContact O-N 3.39Å; A180-V182 PolarHBondContact O-N 3.06Å
181	F	55.8	Low	60.2	Low	108 Å²	108	71.5 Å²	71.5	47%	0.474	46%	0.455	S	S	.	.			trans	-65.6	108.5	169.6	-176.6	-110.4	0	0	0	109.6	F135 G183	F135-F181 HydrophobicContact CB-CB 4.48Å; F135-F181 HydrophobicContact CB-CD2 3.67Å; F135-F181 HydrophobicContact CB-CE2 4.47Å; F181-G183 PolarHBondContact O-N 2.75Å
182	V	45.8	Very low	57.1	Low	115 Å²	115	76.5 Å²	76.5	70%	0.697	49%	0.488	S	S	*	.			trans	-82.8	68.1	174.7	-171	0	0	0	0	109	A180	A180-V182 PolarHBondContact O-N 3.06Å
183	G	36.9	Very low	53.8	Low	36 Å²	36	83.4 Å²	83.4	37%	0.371	52%	0.524	S	S	.	.			trans	-126	107.4	178	0	0	0	0	0	111.8	F181	F181-G183 PolarHBondContact O-N 2.75Å
184	G	30.1	Very low	50.9	Low	73 Å²	73	89.9 Å²	89.9	75%	0.753	56%	0.557	S	S	*	*			trans	80.1	54.3	158.8	0	0	0	0	0	118.2
185	Q	32.3	Very low	47.9	Very low	191 Å²	191	95.7 Å²	95.7	89%	0.893	59%	0.587	S	S	*	*			trans	-96.8	96	150.1	-74.8	-159.1	14.6	0	0	110.6	G187	Q185-G187 VanDerWaalsContact C-N 3.25Å; Q185-G187 PolarHBondContact O-N 2.87Å
186	T	27.3	Very low	44.8	Very low	152 Å²	152	102.7 Å²	102.7	93%	0.933	62%	0.624	S	S	*	*			trans	-76	79.9	161.5	50	0	0	0	0	109.2
187	G	26.8	Very low	41.8	Very low	54 Å²	54	106.6 Å²	106.6	56%	0.557	64%	0.643	S	S	*	*	S	Bend	trans	-156.9	125	176.1	0	0	0	0	0	109.5	Q185 G189	Q185-G187 VanDerWaalsContact C-N 3.25Å; Q185-G187 PolarHBondContact O-N 2.87Å; G187-G189 PolarHBondContact O-N 3.18Å
188	G	25.9	Very low	38.8	Very low	95 Å²	95	114.6 Å²	114.6	98%	0.979	68%	0.68	S	S	*	*			trans	-65.6	115.3	-168.6	0	0	0	0	0	113.6
189	G	25.8	Very low	36.2	Very low	68 Å²	68	118.6 Å²	118.6	70%	0.701	71%	0.709	S	S	*	*	S	Bend	trans	173.7	105.8	173.3	0	0	0	0	0	112.6	G187	G187-G189 PolarHBondContact O-N 3.18Å
190	H	26.9	Very low	33.9	Very low	193 Å²	193	120.6 Å²	120.6	89%	0.894	72%	0.724	S	S	*	*			trans	20.1	98	171.1	-71.6	-61.3	0	0	0	118.5
191	Q	28.1	Very low	32.4	Very low	174 Å²	174	125.9 Å²	125.9	81%	0.813	74%	0.738	S	S	*	*			trans	-61.2	135.5	159.2	-67.4	177.5	-13.9	0	0	110.4	N193	Q191-N193 PolarHBondContact O-N 3.33Å
192	P	33.2	Very low	31.5	Very low	110 Å²	110	128 Å²	128	71%	0.714	76%	0.755	S	S	*	*			trans	-74.6	117	163.1	30	-30.1	0	0	0	108.9	I194	P192-I194 PolarHBondContact O-N 3.23Å
193	N	28.9	Very low	31.1	Very low	145 Å²	145	129.2 Å²	129.2	78%	0.775	75%	0.753	S	S	*	*			trans	-63.6	94.1	173.8	-75.2	-24.5	0	0	0	110.4	Q191 I195	Q191-N193 PolarHBondContact O-N 3.33Å; N193-I195 PolarHBondContact O-N 3.33Å
194	I	38.1	Very low	30.8	Very low	136 Å²	136	135.1 Å²	135.1	70%	0.697	77%	0.768	S	S	*	*			trans	-78.9	107.3	163	-61.4	178.8	0	0	0	106.5	P192 L196	P192-I194 PolarHBondContact O-N 3.23Å; I194-L196 PolarHBondContact O-N 2.86Å; I194-L196 VanDerWaalsContact O-N 3.12Å
195	I	34	Very low	31	Very low	125 Å²	125	142 Å²	142	64%	0.641	78%	0.777	S	S	*	*			trans	-68.7	110.5	-172	-56.3	173.7	0	0	0	109.5	N193 H197	N193-I195 PolarHBondContact O-N 3.33Å; I195-H197 VanDerWaalsContact C-N 3.31Å; I195-H197 VanDerWaalsContact CG2-CD2 3.48Å; I195-H197 WeakPolarHBondContact CG2-CD2 3.48Å; I195-H197 PolarHBondContact O-N 2.94Å
196	L	30.9	Very low	30.8	Very low	147 Å²	147	138 Å²	138	77%	0.77	77%	0.771	S	S	*	*			trans	-69.1	87.4	167.3	-70.7	168.1	0	0	0	109.3	I194 H198	I194-L196 PolarHBondContact O-N 2.86Å; I194-L196 VanDerWaalsContact O-N 3.12Å; L196-H198 VanDerWaalsContact C-N 3.29Å; L196-H198 PolarHBondContact O-N 2.89Å
197	H	29.9	Very low	31.3	Very low	166 Å²	166	138.3 Å²	138.3	77%	0.769	77%	0.767	S	S	*	*			trans	-70.8	88	167.4	-85.1	-84.8	0	0	0	110	I195 S199	I195-H197 VanDerWaalsContact C-N 3.31Å; I195-H197 VanDerWaalsContact CG2-CD2 3.48Å; I195-H197 WeakPolarHBondContact CG2-CD2 3.48Å; I195-H197 PolarHBondContact O-N 2.94Å; H197-S199 PolarHBondContact O-N 2.92Å; H197-S199 VanDerWaalsContact O-N 3.14Å
198	H	28.2	Very low	31.6	Very low	171 Å²	171	147.1 Å²	147.1	79%	0.792	78%	0.783	S	S	*	*			trans	-69	97.2	156.1	-78.3	-80.4	0	0	0	108.4	L196	L196-H198 VanDerWaalsContact C-N 3.29Å; L196-H198 PolarHBondContact O-N 2.89Å
199	S	32.1	Very low	32.1	Very low	118 Å²	118	150.3 Å²	150.3	83%	0.825	77%	0.773	S	S	*	*			trans	-81.7	122.9	156.6	-165	0	0	0	0	107.5	H197	H197-S199 PolarHBondContact O-N 2.92Å; H197-S199 VanDerWaalsContact O-N 3.14Å
200	S	29.7	Very low	32.8	Very low	91 Å²	91	155.5 Å²	155.5	64%	0.636	78%	0.779	S	S	*	*			trans	-80.5	165	169	49.4	0	0	0	0	111.1
201	E	33.6	Very low	32.9	Very low	175 Å²	175	151.5 Å²	151.5	82%	0.818	76%	0.764	S	S	*	*			trans	90.6	139.7	162.9	-42.8	-153.4	150.6	0	0	117.4
202	D	36.2	Very low	33.4	Very low	153 Å²	153	150.2 Å²	150.2	82%	0.818	76%	0.762	S	S	*	*			trans	62.2	140.6	178.2	-56	-20.7	0	0	0	120
203	E	37.8	Very low	33.3	Very low	141 Å²	141	151.8 Å²	151.8	66%	0.659	76%	0.76	S	S	*	*			cis	-166.5	142.7	-40.6	-118.8	-109.1	128.3	0	0	106.9
204	K	30.9	Very low	33.9	Very low	159 Å²	159	151.1 Å²	151.1	69%	0.691	76%	0.756	S	S	*	*			trans	44.4	99.8	166.7	-62.4	179.8	177.7	78.1	0	119.1
205	F	34.5	Very low	34	Very low	217 Å²	217	152.2 Å²	152.2	95%	0.952	76%	0.758	S	S	*	*			trans	-135.1	118.5	133	-108	-84.5	0	0	0	110
206	S	27.9	Very low	34.7	Very low	109 Å²	109	153.3 Å²	153.3	76%	0.762	77%	0.765	S	S	*	*			trans	-99	110.1	178.9	56.9	0	0	0	0	110.2
207	D	37	Very low	35.9	Very low	157 Å²	157	150.5 Å²	150.5	84%	0.84	75%	0.751	S	S	*	*			trans	-149.6	148.9	153.1	-102.3	-39.4	0	0	0	110.3	E209	D207-E209 PolarHBondContact O-N 2.93Å
208	R	34.6	Very low	37.9	Very low	240 Å²	240	147.2 Å²	147.2	91%	0.906	74%	0.743	S	S	*	*			trans	-60.9	121.3	-160.4	-71.6	170.8	167.6	158.7	-4.8	113.6	E210	R208-E210 PolarHBondContact O-N 2.81Å; R208-E210 VanDerWaalsContact O-N 3.09Å
209	E	36.1	Very low	40.6	Very low	162 Å²	162	141.5 Å²	141.5	76%	0.757	72%	0.716	S	S	*	*			trans	-67.4	100.3	167.5	-66.1	-175.9	146.1	0	0	111.5	D207 N211	D207-E209 PolarHBondContact O-N 2.93Å; E209-N211 PolarHBondContact O-N 3.32Å
210	E	40.4	Very low	43.4	Very low	176 Å²	176	137.5 Å²	137.5	82%	0.822	69%	0.687	S	S	*	*			trans	-73.1	97.7	149.9	-77.7	-170.5	157.4	0	0	107.9	R208 L212	R208-E210 PolarHBondContact O-N 2.81Å; R208-E210 VanDerWaalsContact O-N 3.09Å; E210-L212 VanDerWaalsContact C-N 3.25Å; E210-L212 PolarHBondContact O-N 3.02Å
211	N	29.5	Very low	46.5	Very low	110 Å²	110	136.5 Å²	136.5	59%	0.588	68%	0.676	S	S	*	*			trans	-66.9	79.3	177.4	-91	-67.1	0	0	0	111.6	E209 Q213	E209-N211 PolarHBondContact O-N 3.32Å; N211-Q213 PolarHBondContact O-N 2.84Å; N211-Q213 VanDerWaalsContact O-N 3.15Å
212	L	38.4	Very low	49.5	Very low	146 Å²	146	129.8 Å²	129.8	76%	0.764	65%	0.646	S	S	*	*			trans	-79.2	78.4	157.6	-74.2	168.6	0	0	0	108.6	E210 D214	E210-L212 VanDerWaalsContact C-N 3.25Å; E210-L212 PolarHBondContact O-N 3.02Å; L212-D214 PolarHBondContact O-N 3.19Å
213	Q	31.6	Very low	52.3	Low	143 Å²	143	130.4 Å²	130.4	67%	0.668	64%	0.637	S	S	*	*			trans	-70.2	84.8	162.2	-73.5	179.1	-24.9	0	0	108.4	N211 E215	N211-Q213 PolarHBondContact O-N 2.84Å; N211-Q213 VanDerWaalsContact O-N 3.15Å; Q213-E215 HydrophobicContact CB-CG 4.26Å; Q213-E215 PolarHBondContact O-N 2.8Å
214	D	40.5	Very low	55	Low	132 Å²	132	128.3 Å²	128.3	71%	0.706	64%	0.638	S	S	*	*			trans	-70.3	80.2	160.8	-82.5	-32.7	0	0	0	107.9	L212 N216	L212-D214 PolarHBondContact O-N 3.19Å; D214-N216 PolarHBondContact O-N 3.19Å
215	E	41	Very low	58.1	Low	158 Å²	158	122.4 Å²	122.4	74%	0.738	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	90.7	176.1	-65.1	-170.2	144.4	0	0	110.5	Q213	Q213-E215 HydrophobicContact CB-CG 4.26Å; Q213-E215 PolarHBondContact O-N 2.8Å
216	N	47.8	Very low	60.9	Low	148 Å²	148	117.3 Å²	117.3	79%	0.791	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	163.7	-5.8	143.3	-91.3	-63.1	0	0	0	114.6	D214 T218	D214-N216 PolarHBondContact O-N 3.19Å; N216-T218 PolarHBondContact O-N 2.99Å; N216-T218 PolarHBondContact O-OG1 3.25Å
217	D	55.6	Low	64.2	Low	88 Å²	88	113.4 Å²	113.4	47%	0.471	57%	0.565	S	S	.	*			trans	-75.2	86.9	-172.5	-115.2	23.5	0	0	0	112.6	F219	D217-F219 HydrophobicContact CB-CD1 4.22Å; D217-F219 HydrophobicContact CB-CE1 4.43Å; D217-F219 WeakPolarHBondContact O-CD1 3.49Å; D217-F219 PolarHBondContact O-N 3.09Å; D217-F219 VanDerWaalsContact O-N 3.09Å
218	T	72.4	Confident	67.1	Low	97 Å²	97	110.9 Å²	110.9	60%	0.595	54%	0.544	S	S	*	.			trans	-77.8	89	179.1	-50	0	0	0	0	110.9	N216	N216-T218 PolarHBondContact O-N 2.99Å; N216-T218 PolarHBondContact O-OG1 3.25Å
219	F	84.7	Confident	70.1	Confident	52 Å²	52	99.6 Å²	99.6	23%	0.228	50%	0.501	C	S	.	.			trans	-114.7	159.1	174	60	-98	0	0	0	112.8	C134 Q137 D217 V221	C134-F219 HydrophobicContact CB-CD1 4.5Å; Q137-F219 HydrophobicContact CB-CD2 3.77Å; Q137-F219 HydrophobicContact CB-CE2 3.48Å; Q137-F219 VanDerWaalsContact CB-CE2 3.48Å; Q137-F219 HydrophobicContact CB-CZ 4.44Å; Q137-F219 HydrophobicContact CG-CE2 4.37Å; Q137-F219 VanDerWaalsContact OE1-CE2 3.3Å; D217-F219 HydrophobicContact CB-CD1 4.22Å; D217-F219 HydrophobicContact CB-CE1 4.43Å; D217-F219 WeakPolarHBondContact O-CD1 3.49Å; D217-F219 PolarHBondContact O-N 3.09Å; D217-F219 VanDerWaalsContact O-N 3.09Å; F219-V221 HydrophobicContact CD2-CG2 4.13Å; F219-V221 HydrophobicContact CE2-CG2 3.78Å
220	V	91.9	Very high	73	Confident	34 Å²	34	95.9 Å²	95.9	21%	0.206	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	123.9	178.9	179.5	0	0	0	0	110.4	F135 A136 Q137 P178 L222	F135-V220 PolarHBondContact O-N 2.79Å; A136-V220 CarbonylContact C-O 3.56Å; A136-V220 VanDerWaalsContact CA-O 3.3Å; A136-V220 WeakPolarHBondContact CA-O 3.35Å; Q137-V220 PolarHBondContact N-O 2.97Å; P178-V220 HydrophobicContact CG-CB 4.44Å; P178-V220 HydrophobicContact CG-CG2 4.04Å; V220-L222 HydrophobicContact CG1-CD2 4.03Å; V220-L222 HydrophobicContact CG1-CG 4.26Å
221	V	94.5	Very high	75.7	Confident	70 Å²	70	89.7 Å²	89.7	42%	0.424	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123.6	174.9	179.4	0	0	0	0	109.9	L139 F219 R223	L139-V221 HydrophobicContact CD1-CG1 3.64Å; L139-V221 HydrophobicContact CG-CG1 4.36Å; F219-V221 HydrophobicContact CD2-CG2 4.13Å; F219-V221 HydrophobicContact CE2-CG2 3.78Å; V221-R223 HydrophobicContact CG1-CG 4.45Å
222	L	95.7	Very high	79	Confident	34 Å²	34	85.1 Å²	85.1	18%	0.178	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139.8	179.8	-60.6	167.7	0	0	0	109.4	A136 Q137 Y138 L139 W175 K176 A177 V220	A136-L222 HydrophobicContact CB-CD1 4.48Å; Q137-L222 PolarHBondContact O-N 2.83Å; Y138-L222 WeakPolarHBondContact CA-O 3.32Å; Y138-L222 HydrophobicContact CD2-CB 3.83Å; L139-L222 PolarHBondContact N-O 2.92Å; W175-L222 HydrophobicContact CE3-CD1 3.74Å; W175-L222 HydrophobicContact CZ3-CD1 3.93Å; K176-L222 WeakPolarHBondContact O-CD1 3.34Å; A177-L222 HydrophobicContact CB-CD1 3.9Å; V220-L222 HydrophobicContact CG1-CD2 4.03Å; V220-L222 HydrophobicContact CG1-CG 4.26Å
223	R	95.7	Very high	81.9	Confident	165 Å²	165	83.4 Å²	83.4	62%	0.623	44%	0.444	S	S	*	.			trans	-131.7	-34.3	-178	-66	178.8	-176.6	-85.6	3.2	113.2	L139 G140 V221	L139-R223 HydrophobicContact CB-CG 4.13Å; G140-R223 WeakPolarHBondContact CA-O 3.25Å; V221-R223 HydrophobicContact CG1-CG 4.45Å
224	S	94.1	Very high	85.1	Confident	97 Å²	97	77.4 Å²	77.4	68%	0.678	42%	0.419	S	S	*	.			trans	-83.4	128.7	175.9	39.2	0	0	0	0	111.3
225	P	96.1	Very high	87.8	Confident	36 Å²	36	72.6 Å²	72.6	23%	0.234	40%	0.396	C	S	.	.			trans	-67.9	152.8	160.8	27.2	-30.5	0	0	0	110	Y138 H173 R228	Y138-P225 WeakPolarHBondContact OH-CA 3.45Å; Y138-P225 VanDerWaalsContact OH-CB 3.31Å; Y138-P225 WeakPolarHBondContact OH-CB 3.47Å; Y138-P225 WeakPolarHBondContact OH-CD 3.22Å; H173-P225 HydrophobicContact CB-CB 3.97Å; P225-R228 HydrophobicContact CG-CB 4.21Å
226	Q	94.3	Very high	90.6	Very high	110 Å²	110	65.1 Å²	65.1	51%	0.514	36%	0.36	S	S	.	.	S	Bend	trans	-72.1	-38.9	160.2	179.3	-174.5	-33.2	0	0	110.1	V174	V174-Q226 WeakPolarHBondContact O-CB 3.41Å; V174-Q226 PolarHBondContact O-N 3.1Å
227	L	96.2	Very high	93	Very high	27 Å²	27	58.6 Å²	58.6	14%	0.141	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	131.7	179.6	-174.1	64.4	0	0	0	110	H173 V174 L229 S262	H173-L227 WeakPolarHBondContact CA-O 3.39Å; V174-L227 HydrophobicContact CB-CB 4.08Å; V174-L227 HydrophobicContact CG2-CB 4.38Å; V174-L227 HydrophobicContact CG2-CD2 4.49Å; V174-L227 PolarHBondContact N-O 2.8Å; V174-L227 PolarHBondContact O-N 2.93Å; V174-L227 VanDerWaalsContact O-N 3.14Å; L227-L229 HydrophobicContact CD2-CD2 3.7Å; L227-L229 HydrophobicContact CG-CD2 3.88Å; L227-S262 WeakPolarHBondContact CD2-O 3.47Å
228	R	97.8	Very high	95	Very high	104 Å²	104	54.4 Å²	54.4	39%	0.392	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.5	174.6	-179.3	-178.9	-70.6	-108.5	7.1	108.7	G140 H173 P225 T230	G140-R228 PolarHBondContact O-NH2 3.46Å; H173-R228 PolarHBondContact CE1-NH1 2.77Å; H173-R228 PolarHBondContact CE1-NH2 2.97Å; H173-R228 WeakPolarHBondContact NE2-CG 3.25Å; H173-R228 PolarHBondContact NE2-NE 2.96Å; H173-R228 PolarHBondContact NE2-NH1 2.92Å; P225-R228 HydrophobicContact CG-CB 4.21Å; R228-T230 HydrophobicContact CG-CG2 3.89Å
229	L	98.2	Very high	96.3	Very high	2 Å²	2	50 Å²	50	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	117.5	176.7	-51.7	177.9	0	0	0	108.8	L164 S171 A172 L227 I248 F260	L164-L229 HydrophobicContact CD1-CD1 4.47Å; S171-L229 WeakPolarHBondContact CA-O 3.03Å; S171-L229 WeakPolarHBondContact CB-O 3.46Å; A172-L229 HydrophobicContact CB-CB 4.27Å; A172-L229 HydrophobicContact CB-CD1 4.24Å; A172-L229 PolarHBondContact N-O 2.8Å; A172-L229 VanDerWaalsContact N-O 3.09Å; A172-L229 WeakPolarHBondContact O-CA 3.4Å; A172-L229 VanDerWaalsContact O-CB 3.29Å; A172-L229 WeakPolarHBondContact O-CB 3.32Å; A172-L229 PolarHBondContact O-N 2.82Å; L227-L229 HydrophobicContact CD2-CD2 3.7Å; L227-L229 HydrophobicContact CG-CD2 3.88Å; L229-I248 HydrophobicContact CD1-CB 4.18Å; L229-I248 HydrophobicContact CD1-CD1 3.9Å; L229-I248 HydrophobicContact CD1-CG2 3.77Å; L229-F260 HydrophobicContact CB-CD1 4.18Å; L229-F260 HydrophobicContact CB-CD2 4.14Å; L229-F260 HydrophobicContact CB-CE1 4.01Å; L229-F260 HydrophobicContact CB-CE2 3.97Å; L229-F260 HydrophobicContact CB-CG 4.23Å; L229-F260 HydrophobicContact CB-CZ 3.91Å; L229-F260 HydrophobicContact CD1-CB 4.17Å; L229-F260 HydrophobicContact CD1-CD2 3.91Å; L229-F260 HydrophobicContact CD1-CE2 4.46Å; L229-F260 HydrophobicContact CD1-CG 4.04Å; L229-F260 HydrophobicContact CD2-CB 3.96Å; L229-F260 HydrophobicContact CD2-CD1 3.91Å; L229-F260 HydrophobicContact CD2-CG 3.9Å; L229-F260 HydrophobicContact CG-CD1 4.49Å; L229-F260 HydrophobicContact CG-CD2 4.42Å; L229-F260 HydrophobicContact CG-CG 4.28Å
230	T	97.7	Very high	96.9	Very high	84 Å²	84	48 Å²	48	52%	0.515	27%	0.269	S	S	.	.			trans	-125.3	161.3	179.5	61	0	0	0	0	110.7	R228 F260	R228-T230 HydrophobicContact CG-CG2 3.89Å; T230-F260 WeakPolarHBondContact O-CE1 3.17Å; T230-F260 WeakPolarHBondContact O-CZ 3.34Å
231	G	96.9	Very high	97	Very high	47 Å²	47	47 Å²	47	49%	0.485	26%	0.261	S	S	.	.			trans	138.3	-19.3	179.9	0	0	0	0	0	113.9
232	H	98.4	Very high	96.9	Very high	14 Å²	14	44 Å²	44	7%	0.065	24%	0.243	C	C	.	.			trans	-72.3	151.9	167.7	-76.3	-56.2	0	0	0	111.5	V236 T250 S252 D254 T256 I258	H232-V236 HydrophobicContact CB-CG2 4.11Å; H232-T250 PolarHBondContact CD2-OG1 3.27Å; H232-T250 WeakPolarHBondContact NE2-CB 3.19Å; H232-T250 PolarHBondContact NE2-OG1 2.96Å; H232-S252 WeakPolarHBondContact CE1-CB 3.5Å; H232-S252 WeakPolarHBondContact ND1-CB 3.35Å; H232-D254 WeakPolarHBondContact CA-OD2 3.39Å; H232-D254 WeakPolarHBondContact CB-OD2 3.4Å; H232-D254 IonicContact CE1-OD1 3.93Å; H232-D254 IonicContact CE1-OD2 3.89Å; H232-D254 IonicContact CG-OD2 3.38Å; H232-D254 VanDerWaalsContact CG-OD2 3.31Å; H232-D254 IonicContact ND1-OD1 3.61Å; H232-D254 PolarHBondContact ND1-OD1 2.9Å; H232-D254 IonicContact ND1-OD2 3.35Å; H232-D254 PolarHBondContact ND1-OD2 3.24Å; H232-T256 PolarHBondContact CE1-O 2.81Å; H232-T256 PolarHBondContact CE1-OG1 2.86Å; H232-T256 PolarHBondContact ND1-OG1 2.81Å; H232-I258 VanDerWaalsContact CE1-CG1 3.49Å; H232-I258 WeakPolarHBondContact CE1-CG1 3.47Å
233	T	98.3	Very high	95.9	Very high	109 Å²	109	46.5 Å²	46.5	67%	0.669	25%	0.25	S	C	*	.	S	Bend	trans	-112.5	8.8	179.6	57.3	0	0	0	0	113	Q170 D254	Q170-T233 PolarHBondContact OE1-O 2.76Å; T233-D254 PolarHBondContact N-OD2 3.44Å; T233-D254 WeakPolarHBondContact OG1-CB 3.49Å
234	A	98.5	Very high	94.9	Very high	17 Å²	17	41.4 Å²	41.4	14%	0.14	24%	0.237	C	C	.	.	S	Bend	trans	-153.2	170.9	-178.5	0	0	0	0	0	110	Q170 V236 S252 W253 D254	Q170-A234 WeakPolarHBondContact CA-O 3.44Å; A234-V236 PolarHBondContact O-N 2.79Å; A234-S252 PolarHBondContact O-OG 3.16Å; A234-W253 HydrophobicContact CB-CB 3.95Å; A234-D254 HydrophobicContact CB-CB 3.93Å
235	P	98.6	Very high	94.1	Very high	32 Å²	32	40 Å²	40	21%	0.208	22%	0.22	C	C	.	.			trans	-48.8	131.6	178.6	-35.9	41.2	0	0	0	115	S252 W253	P235-S252 WeakPolarHBondContact O-CA 3.36Å; P235-S252 PolarHBondContact O-OG 2.81Å; P235-W253 HydrophobicContact CB-CD2 4.15Å; P235-W253 HydrophobicContact CB-CE3 3.86Å; P235-W253 HydrophobicContact CB-CZ3 4.32Å; P235-W253 HydrophobicContact CG-CD2 4.48Å; P235-W253 HydrophobicContact CG-CE3 3.73Å; P235-W253 HydrophobicContact CG-CZ3 4.11Å; P235-W253 PolarHBondContact O-N 3.27Å
236	V	98.8	Very high	93.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	120.3	172.5	-163.7	0	0	0	0	108.6	N146 A166 S167 H232 A234 T250 A251	N146-V236 PolarHBondContact ND2-O 3.33Å; A166-V236 HydrophobicContact CB-CB 4.1Å; A166-V236 HydrophobicContact CB-CG1 3.77Å; S167-V236 CarbonylContact C-O 3.59Å; S167-V236 PolarHBondContact N-O 3.37Å; S167-V236 PolarHBondContact O-N 3.39Å; H232-V236 HydrophobicContact CB-CG2 4.11Å; A234-V236 PolarHBondContact O-N 2.79Å; V236-T250 HydrophobicContact CG1-CG2 4.21Å; V236-A251 WeakPolarHBondContact CG1-O 3.48Å
237	V	98.5	Very high	93.6	Very high	12 Å²	12	40.3 Å²	40.3	7%	0.073	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-10.8	-168.8	-63.8	0	0	0	0	114.9	A251 W253 L278 R380	V237-A251 PolarHBondContact N-O 3.45Å; V237-W253 HydrophobicContact CG1-CD2 4.27Å; V237-W253 HydrophobicContact CG1-CG 4.35Å; V237-W253 HydrophobicContact CG1-CZ2 4.1Å; V237-L278 VanDerWaalsContact CG2-O 3.28Å; V237-L278 WeakPolarHBondContact CG2-O 3.47Å; V237-R380 PolarHBondContact O-NH2 3.42Å
238	A	98.5	Very high	93.6	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	151	169.2	0	0	0	0	0	109.9	T250 A251	A238-T250 CarbonylContact O-C 3.59Å; A238-T250 WeakPolarHBondContact O-CA 3.36Å; A238-A251 HydrophobicContact CB-CB 4.4Å; A238-A251 PolarHBondContact N-O 2.98Å; A238-A251 PolarHBondContact O-N 2.86Å
239	A	98.4	Very high	93.7	Very high	3 Å²	3	34.1 Å²	34.1	3%	0.025	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	152.5	164.3	0	0	0	0	0	110	C147 R149 L164 A166 V249 T250	C147-A239 PolarHBondContact SG-O 2.66Å; R149-A239 WeakPolarHBondContact CG-O 3.28Å; L164-A239 HydrophobicContact CD1-CB 4.2Å; L164-A239 HydrophobicContact CD2-CB 3.74Å; L164-A239 HydrophobicContact CG-CB 3.94Å; A166-A239 HydrophobicContact CB-CB 3.89Å; A239-V249 CarbonylContact C-O 3.56Å; A239-V249 WeakPolarHBondContact CA-O 3.39Å; A239-V249 WeakPolarHBondContact CB-O 3.19Å; A239-T250 HydrophobicContact CB-CG2 4.06Å
240	D	97.5	Very high	93.7	Very high	12 Å²	12	34 Å²	34	6%	0.064	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	155.4	-178.6	-163.4	17.2	0	0	0	111.4	V249 C282 S283	D240-V249 HydrophobicContact CB-CG1 3.89Å; D240-V249 PolarHBondContact N-O 3.33Å; D240-V249 PolarHBondContact O-N 3Å; D240-C282 WeakPolarHBondContact OD2-CA 3.27Å; D240-S283 WeakPolarHBondContact OD2-CB 3.45Å; D240-S283 PolarHBondContact OD2-N 3.11Å; D240-S283 PolarHBondContact OD2-OG 3.19Å
241	W	95.3	Very high	93.7	Very high	13 Å²	13	30 Å²	30	5%	0.049	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	128	-178.7	-67.5	93.2	0	0	0	111	R149 F150 A151 P152 L162 L164 V174 W243 I248 S283	R149-W241 PolarHBondContact O-NE1 3.14Å; F150-W241 PolarHBondContact O-NE1 3.42Å; A151-W241 HydrophobicContact CB-CD2 4.21Å; A151-W241 HydrophobicContact CB-CH2 4.25Å; A151-W241 HydrophobicContact CB-CZ2 3.84Å; P152-W241 HydrophobicContact CG-CB 3.9Å; P152-W241 HydrophobicContact CG-CG 4.49Å; L162-W241 HydrophobicContact CD2-CH2 3.61Å; L162-W241 HydrophobicContact CD2-CZ2 4.14Å; L162-W241 HydrophobicContact CD2-CZ3 4.34Å; L162-W241 HydrophobicContact CG-CH2 4.08Å; L162-W241 HydrophobicContact CG-CZ2 4.19Å; L164-W241 HydrophobicContact CB-CZ2 3.71Å; L164-W241 VanDerWaalsContact CB-NE1 3.33Å; L164-W241 HydrophobicContact CD2-CD2 4.44Å; L164-W241 HydrophobicContact CD2-CG 4.41Å; V174-W241 HydrophobicContact CG1-CH2 3.82Å; V174-W241 HydrophobicContact CG1-CZ2 4.21Å; V174-W241 HydrophobicContact CG2-CH2 4.08Å; V174-W241 HydrophobicContact CG2-CZ2 4.46Å; W241-W243 PolarHBondContact O-N 3.22Å; W241-W243 VanDerWaalsContact O-N 3.14Å; W241-W243 PolarHBondContact O-NE1 3.3Å; W241-I248 HydrophobicContact CD2-CG1 4.17Å; W241-I248 HydrophobicContact CE3-CD1 4.1Å; W241-I248 HydrophobicContact CE3-CG1 3.7Å; W241-I248 HydrophobicContact CH2-CD1 3.96Å; W241-I248 HydrophobicContact CH2-CG1 4.46Å; W241-I248 HydrophobicContact CZ2-CD1 4.49Å; W241-I248 HydrophobicContact CZ3-CD1 3.76Å; W241-I248 HydrophobicContact CZ3-CG1 3.88Å; W241-S283 WeakPolarHBondContact O-CB 3.41Å; W241-S283 PolarHBondContact O-OG 2.9Å
242	L	92.6	Very high	93.8	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.037	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	98	169.8	-82.9	69.5	0	0	0	109.1	T244 Q245 R247 V249 I259 V290	L242-T244 PolarHBondContact O-N 3.3Å; L242-Q245 PolarHBondContact O-N 2.61Å; L242-R247 HydrophobicContact CB-CB 3.88Å; L242-R247 HydrophobicContact CD2-CB 4.05Å; L242-R247 HydrophobicContact CG-CB 4.42Å; L242-R247 PolarHBondContact N-O 2.89Å; L242-V249 HydrophobicContact CD1-CB 3.78Å; L242-V249 HydrophobicContact CD1-CG1 3.74Å; L242-I259 HydrophobicContact CD1-CD1 4.37Å; L242-I259 HydrophobicContact CD2-CD1 4.38Å; L242-V290 HydrophobicContact CD1-CG2 3.96Å; L242-V290 HydrophobicContact CD2-CG2 4Å; L242-V290 HydrophobicContact CG-CG2 4.09Å
243	W	73.9	Confident	93.8	Very high	86 Å²	86	32.7 Å²	32.7	33%	0.326	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-18	-175.1	-60.9	74.2	0	0	0	115.9	P152 W241 S283 P285	P152-W243 VanDerWaalsContact CA-CZ3 3.44Å; P152-W243 HydrophobicContact CB-CD2 3.95Å; P152-W243 HydrophobicContact CB-CE3 3.4Å; P152-W243 HydrophobicContact CB-CH2 4.17Å; P152-W243 HydrophobicContact CB-CZ3 3.53Å; P152-W243 HydrophobicContact CG-CB 4.45Å; P152-W243 HydrophobicContact CG-CD2 3.68Å; P152-W243 HydrophobicContact CG-CE3 3.69Å; P152-W243 HydrophobicContact CG-CG 4.1Å; P152-W243 HydrophobicContact CG-CH2 4.26Å; P152-W243 HydrophobicContact CG-CZ2 4.31Å; P152-W243 HydrophobicContact CG-CZ3 3.99Å; W241-W243 PolarHBondContact O-N 3.22Å; W241-W243 VanDerWaalsContact O-N 3.14Å; W241-W243 PolarHBondContact O-NE1 3.3Å; W243-S283 VanDerWaalsContact CD1-OG 3.29Å; W243-S283 PolarHBondContact NE1-OG 2.92Å; W243-P285 VanDerWaalsContact CB-O 3.29Å; W243-P285 WeakPolarHBondContact CB-O 3.36Å
244	T	75.6	Confident	93.8	Very high	58 Å²	58	29 Å²	29	36%	0.356	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-13.7	-170	52.9	0	0	0	0	115.6	L242 N288	L242-T244 PolarHBondContact O-N 3.3Å; T244-N288 VanDerWaalsContact CB-OD1 3.28Å; T244-N288 WeakPolarHBondContact CB-OD1 3.44Å; T244-N288 PolarHBondContact OG1-OD1 3.05Å
245	Q	75.2	Confident	93.8	Very high	67 Å²	67	34.1 Å²	34.1	31%	0.313	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.5	14.4	-164.8	-75	-165.6	-21.8	0	0	116.1	L242 R247 N288	L242-Q245 PolarHBondContact O-N 2.61Å; Q245-R247 HydrophobicContact CB-CG 4.19Å; Q245-R247 PolarHBondContact O-N 3.16Å; Q245-R247 VanDerWaalsContact OE1-CZ 3.29Å; Q245-N288 PolarHBondContact NE2-ND2 2.75Å; Q245-N288 VanDerWaalsContact NE2-ND2 3.12Å
246	N	87	Confident	93.8	Very high	95 Å²	95	33.9 Å²	33.9	51%	0.508	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	44.9	-171.8	-72.1	8.5	0	0	0	111.9	S262 E263	N246-S262 WeakPolarHBondContact O-CB 3.5Å; N246-S262 PolarHBondContact O-N 3.43Å; N246-S262 PolarHBondContact O-OG 3.12Å; N246-E263 PolarHBondContact ND2-OE1 3.45Å
247	R	94	Very high	93.8	Very high	58 Å²	58	34 Å²	34	22%	0.219	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	158.6	-179.3	-75.9	171.2	-172.3	-161.2	-0.8	111.5	L242 Q245 I259 F260	L242-R247 HydrophobicContact CB-CB 3.88Å; L242-R247 HydrophobicContact CD2-CB 4.05Å; L242-R247 HydrophobicContact CG-CB 4.42Å; L242-R247 PolarHBondContact N-O 2.89Å; Q245-R247 HydrophobicContact CB-CG 4.19Å; Q245-R247 PolarHBondContact O-N 3.16Å; Q245-R247 VanDerWaalsContact OE1-CZ 3.29Å; R247-I259 HydrophobicContact CB-CG2 4.13Å; R247-I259 HydrophobicContact CG-CG2 4.2Å; R247-F260 CarbonylContact C-O 3.44Å; R247-F260 WeakPolarHBondContact CA-O 3.48Å; R247-F260 WeakPolarHBondContact CB-O 3.36Å
248	I	97.1	Very high	93.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.9	175.2	-70.6	162.7	0	0	0	108.2	L164 V174 L229 W241 T250 I259 F260	L164-I248 HydrophobicContact CD1-CD1 4.26Å; L164-I248 HydrophobicContact CD1-CG2 4.02Å; L164-I248 HydrophobicContact CD2-CB 4.48Å; L164-I248 HydrophobicContact CD2-CD1 4.46Å; L164-I248 HydrophobicContact CD2-CG1 4.18Å; L164-I248 HydrophobicContact CD2-CG2 3.58Å; L164-I248 HydrophobicContact CG-CG2 4.46Å; V174-I248 HydrophobicContact CG2-CD1 3.49Å; V174-I248 VanDerWaalsContact CG2-CD1 3.49Å; L229-I248 HydrophobicContact CD1-CB 4.18Å; L229-I248 HydrophobicContact CD1-CD1 3.9Å; L229-I248 HydrophobicContact CD1-CG2 3.77Å; W241-I248 HydrophobicContact CD2-CG1 4.17Å; W241-I248 HydrophobicContact CE3-CD1 4.1Å; W241-I248 HydrophobicContact CE3-CG1 3.7Å; W241-I248 HydrophobicContact CH2-CD1 3.96Å; W241-I248 HydrophobicContact CH2-CG1 4.46Å; W241-I248 HydrophobicContact CZ2-CD1 4.49Å; W241-I248 HydrophobicContact CZ3-CD1 3.76Å; W241-I248 HydrophobicContact CZ3-CG1 3.88Å; I248-T250 HydrophobicContact CG2-CG2 4.35Å; I248-I259 CarbonylContact O-C 3.57Å; I248-I259 WeakPolarHBondContact O-CA 3.48Å; I248-F260 HydrophobicContact CB-CB 4.48Å; I248-F260 PolarHBondContact N-O 2.89Å; I248-F260 PolarHBondContact O-N 3.04Å
249	V	98.1	Very high	93.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	135.7	164.3	58	0	0	0	0	109.9	A239 D240 L242 A257 I258 I259 C281 V290	A239-V249 CarbonylContact C-O 3.56Å; A239-V249 WeakPolarHBondContact CA-O 3.39Å; A239-V249 WeakPolarHBondContact CB-O 3.19Å; D240-V249 HydrophobicContact CB-CG1 3.89Å; D240-V249 PolarHBondContact N-O 3.33Å; D240-V249 PolarHBondContact O-N 3Å; L242-V249 HydrophobicContact CD1-CB 3.78Å; L242-V249 HydrophobicContact CD1-CG1 3.74Å; V249-A257 HydrophobicContact CG2-CB 4.19Å; V249-I258 CarbonylContact C-O 3.57Å; V249-I258 WeakPolarHBondContact CA-O 3.27Å; V249-I259 HydrophobicContact CB-CD1 3.63Å; V249-I259 HydrophobicContact CG2-CD1 3.8Å; V249-C281 HydrophobicContact CG1-CB 4.11Å; V249-C281 HydrophobicContact CG2-CB 3.85Å; V249-V290 HydrophobicContact CB-CG1 4.38Å; V249-V290 HydrophobicContact CG1-CG1 4.3Å; V249-V290 HydrophobicContact CG2-CG1 3.92Å
250	T	98.7	Very high	93.7	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	155.4	166.1	55.5	0	0	0	0	110.1	A172 H232 V236 A238 A239 I248 A257 I258 F260	A172-T250 HydrophobicContact CB-CG2 3.63Å; H232-T250 PolarHBondContact CD2-OG1 3.27Å; H232-T250 WeakPolarHBondContact NE2-CB 3.19Å; H232-T250 PolarHBondContact NE2-OG1 2.96Å; V236-T250 HydrophobicContact CG1-CG2 4.21Å; A238-T250 CarbonylContact O-C 3.59Å; A238-T250 WeakPolarHBondContact O-CA 3.36Å; A239-T250 HydrophobicContact CB-CG2 4.06Å; I248-T250 HydrophobicContact CG2-CG2 4.35Å; T250-A257 CarbonylContact O-C 3.54Å; T250-A257 WeakPolarHBondContact O-CA 3.45Å; T250-A257 WeakPolarHBondContact O-CB 3.47Å; T250-I258 PolarHBondContact N-O 3.16Å; T250-I258 PolarHBondContact O-N 2.92Å; T250-I258 PolarHBondContact OG1-O 3.33Å; T250-F260 HydrophobicContact CG2-CD2 4.1Å; T250-F260 HydrophobicContact CG2-CE2 3.85Å; T250-F260 WeakPolarHBondContact OG1-CE2 3.37Å
251	A	98.7	Very high	93.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134.1	173.5	0	0	0	0	0	111	V236 V237 A238 A257 L278 C281	V236-A251 WeakPolarHBondContact CG1-O 3.48Å; V237-A251 PolarHBondContact N-O 3.45Å; A238-A251 HydrophobicContact CB-CB 4.4Å; A238-A251 PolarHBondContact N-O 2.98Å; A238-A251 PolarHBondContact O-N 2.86Å; A251-A257 HydrophobicContact CB-CB 4.47Å; A251-L278 HydrophobicContact CB-CB 4Å; A251-L278 HydrophobicContact CB-CD1 3.74Å; A251-C281 HydrophobicContact CB-CB 3.83Å
252	S	98.8	Very high	93.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	161.3	-166.8	173	0	0	0	0	113.9	H232 A234 P235 D254 R255 T256 L278	H232-S252 WeakPolarHBondContact CE1-CB 3.5Å; H232-S252 WeakPolarHBondContact ND1-CB 3.35Å; A234-S252 PolarHBondContact O-OG 3.16Å; P235-S252 WeakPolarHBondContact O-CA 3.36Å; P235-S252 PolarHBondContact O-OG 2.81Å; S252-D254 WeakPolarHBondContact CB-OD1 3.4Å; S252-D254 WeakPolarHBondContact CB-OD2 3.44Å; S252-D254 PolarHBondContact O-N 3.41Å; S252-D254 PolarHBondContact OG-N 2.8Å; S252-D254 VanDerWaalsContact OG-N 3.08Å; S252-D254 PolarHBondContact OG-OD1 3.31Å; S252-D254 PolarHBondContact OG-OD2 2.83Å; S252-R255 PolarHBondContact O-N 3.26Å; S252-T256 PolarHBondContact N-O 3.47Å; S252-T256 VanDerWaalsContact N-O 3.08Å; S252-L278 WeakPolarHBondContact O-CB 3.35Å; S252-L278 PolarHBondContact O-N 3.44Å; S252-L278 VanDerWaalsContact O-N 3.16Å
253	W	98.5	Very high	93.3	Very high	116 Å²	116	40.9 Å²	40.9	44%	0.439	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-7.5	168.8	-72.6	-2.6	0	0	0	114.3	A234 P235 V237 R255 E277 L278	A234-W253 HydrophobicContact CB-CB 3.95Å; P235-W253 HydrophobicContact CB-CD2 4.15Å; P235-W253 HydrophobicContact CB-CE3 3.86Å; P235-W253 HydrophobicContact CB-CZ3 4.32Å; P235-W253 HydrophobicContact CG-CD2 4.48Å; P235-W253 HydrophobicContact CG-CE3 3.73Å; P235-W253 HydrophobicContact CG-CZ3 4.11Å; P235-W253 PolarHBondContact O-N 3.27Å; V237-W253 HydrophobicContact CG1-CD2 4.27Å; V237-W253 HydrophobicContact CG1-CG 4.35Å; V237-W253 HydrophobicContact CG1-CZ2 4.1Å; W253-R255 PolarHBondContact O-N 3.39Å; W253-E277 HydrophobicContact CB-CB 4.14Å; W253-E277 HydrophobicContact CB-CG 3.93Å; W253-E277 HydrophobicContact CG-CB 4.04Å; W253-E277 HydrophobicContact CG-CG 4.13Å; W253-E277 VanDerWaalsContact O-CG 3.31Å; W253-E277 WeakPolarHBondContact O-CG 3.29Å; W253-L278 VanDerWaalsContact CD1-O 3.26Å
254	D	98.3	Very high	94.2	Very high	31 Å²	31	45 Å²	45	17%	0.166	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	7.4	168.2	62.6	36.3	0	0	0	113.3	H232 T233 A234 S252 T256	H232-D254 WeakPolarHBondContact CA-OD2 3.39Å; H232-D254 WeakPolarHBondContact CB-OD2 3.4Å; H232-D254 IonicContact CE1-OD1 3.93Å; H232-D254 IonicContact CE1-OD2 3.89Å; H232-D254 IonicContact CG-OD2 3.38Å; H232-D254 VanDerWaalsContact CG-OD2 3.31Å; H232-D254 IonicContact ND1-OD1 3.61Å; H232-D254 PolarHBondContact ND1-OD1 2.9Å; H232-D254 IonicContact ND1-OD2 3.35Å; H232-D254 PolarHBondContact ND1-OD2 3.24Å; T233-D254 PolarHBondContact N-OD2 3.44Å; T233-D254 WeakPolarHBondContact OG1-CB 3.49Å; A234-D254 HydrophobicContact CB-CB 3.93Å; S252-D254 WeakPolarHBondContact CB-OD1 3.4Å; S252-D254 WeakPolarHBondContact CB-OD2 3.44Å; S252-D254 PolarHBondContact O-N 3.41Å; S252-D254 PolarHBondContact OG-N 2.8Å; S252-D254 VanDerWaalsContact OG-N 3.08Å; S252-D254 PolarHBondContact OG-OD1 3.31Å; S252-D254 PolarHBondContact OG-OD2 2.83Å; D254-T256 PolarHBondContact O-N 2.86Å; D254-T256 WeakPolarHBondContact OD1-CB 3.41Å; D254-T256 PolarHBondContact OD1-N 2.82Å; D254-T256 PolarHBondContact OD1-OG1 2.82Å
255	R	98.3	Very high	95.1	Very high	125 Å²	125	43 Å²	43	47%	0.472	20%	0.195	S	C	.	.	S	Bend	trans	71.4	8.6	177.3	-37.9	177.9	-170.8	175.5	11.2	113.8	S252 W253 D275	S252-R255 PolarHBondContact O-N 3.26Å; W253-R255 PolarHBondContact O-N 3.39Å; R255-D275 WeakPolarHBondContact CD-O 3.49Å; R255-D275 PolarHBondContact NH1-O 2.77Å
256	T	98.5	Very high	96.1	Very high	28 Å²	28	44.9 Å²	44.9	17%	0.172	20%	0.204	C	C	.	.			trans	-108.8	153.7	173.9	75.1	0	0	0	0	111.9	H232 S252 D254 I270 L271 L278	H232-T256 PolarHBondContact CE1-O 2.81Å; H232-T256 PolarHBondContact CE1-OG1 2.86Å; H232-T256 PolarHBondContact ND1-OG1 2.81Å; S252-T256 PolarHBondContact N-O 3.47Å; S252-T256 VanDerWaalsContact N-O 3.08Å; D254-T256 PolarHBondContact O-N 2.86Å; D254-T256 WeakPolarHBondContact OD1-CB 3.41Å; D254-T256 PolarHBondContact OD1-N 2.82Å; D254-T256 PolarHBondContact OD1-OG1 2.82Å; T256-I270 HydrophobicContact CG2-CG2 4.05Å; T256-L271 WeakPolarHBondContact CA-O 3.23Å; T256-L278 VanDerWaalsContact C-CD1 3.47Å; T256-L278 VanDerWaalsContact O-CD1 3.27Å; T256-L278 WeakPolarHBondContact O-CD1 3.39Å
257	A	98.6	Very high	96.6	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.008	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	144.7	156.1	0	0	0	0	0	108.5	V249 T250 A251 L271 L278 T292	V249-A257 HydrophobicContact CG2-CB 4.19Å; T250-A257 CarbonylContact O-C 3.54Å; T250-A257 WeakPolarHBondContact O-CA 3.45Å; T250-A257 WeakPolarHBondContact O-CB 3.47Å; A251-A257 HydrophobicContact CB-CB 4.47Å; A257-L271 HydrophobicContact CB-CB 4.13Å; A257-L271 HydrophobicContact CB-CD1 4.18Å; A257-L271 HydrophobicContact CB-CG 4.44Å; A257-L271 PolarHBondContact N-O 3.45Å; A257-L271 WeakPolarHBondContact O-CA 3.28Å; A257-L271 WeakPolarHBondContact O-CB 3.24Å; A257-L271 PolarHBondContact O-N 3.08Å; A257-L278 HydrophobicContact CB-CD1 3.8Å; A257-T292 HydrophobicContact CB-CG2 3.68Å
258	I	98.4	Very high	96.6	Very high	2 Å²	2	44 Å²	44	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	135.1	179.5	-61.5	174.2	0	0	0	108.9	H232 V249 T250 F260 I267 I270	H232-I258 VanDerWaalsContact CE1-CG1 3.49Å; H232-I258 WeakPolarHBondContact CE1-CG1 3.47Å; V249-I258 CarbonylContact C-O 3.57Å; V249-I258 WeakPolarHBondContact CA-O 3.27Å; T250-I258 PolarHBondContact N-O 3.16Å; T250-I258 PolarHBondContact O-N 2.92Å; T250-I258 PolarHBondContact OG1-O 3.33Å; I258-F260 HydrophobicContact CB-CD2 4.27Å; I258-F260 HydrophobicContact CB-CE2 3.68Å; I258-F260 HydrophobicContact CB-CZ 4.07Å; I258-F260 HydrophobicContact CD1-CZ 4.38Å; I258-F260 HydrophobicContact CG2-CD1 4.32Å; I258-F260 HydrophobicContact CG2-CD2 3.8Å; I258-F260 HydrophobicContact CG2-CE1 3.99Å; I258-F260 HydrophobicContact CG2-CE2 3.42Å; I258-F260 VanDerWaalsContact CG2-CE2 3.42Å; I258-F260 HydrophobicContact CG2-CG 4.25Å; I258-F260 HydrophobicContact CG2-CZ 3.52Å; I258-I267 HydrophobicContact CG2-CB 4.4Å; I258-I267 HydrophobicContact CG2-CD1 4.44Å; I258-I267 HydrophobicContact CG2-CG1 3.99Å; I258-I267 HydrophobicContact CG2-CG2 3.86Å; I258-I270 HydrophobicContact CG1-CG1 4.39Å; I258-I270 HydrophobicContact CG1-CG2 4.45Å
259	I	97.4	Very high	96.6	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119.8	169.3	-54.8	-59.4	0	0	0	108.1	L242 R247 I248 V249 V268 N269 L271 V290 F304	L242-I259 HydrophobicContact CD1-CD1 4.37Å; L242-I259 HydrophobicContact CD2-CD1 4.38Å; R247-I259 HydrophobicContact CB-CG2 4.13Å; R247-I259 HydrophobicContact CG-CG2 4.2Å; I248-I259 CarbonylContact O-C 3.57Å; I248-I259 WeakPolarHBondContact O-CA 3.48Å; V249-I259 HydrophobicContact CB-CD1 3.63Å; V249-I259 HydrophobicContact CG2-CD1 3.8Å; I259-V268 HydrophobicContact CG2-CB 4.31Å; I259-V268 PolarHBondContact O-N 3.18Å; I259-N269 HydrophobicContact CB-CB 4.08Å; I259-N269 HydrophobicContact CG1-CB 4.12Å; I259-N269 PolarHBondContact N-O 3.49Å; I259-N269 PolarHBondContact O-N 3.34Å; I259-L271 HydrophobicContact CD1-CD1 4Å; I259-L271 HydrophobicContact CG1-CD1 4.03Å; I259-L271 HydrophobicContact CG1-CD2 4.28Å; I259-L271 HydrophobicContact CG1-CG 4.23Å; I259-V290 HydrophobicContact CD1-CG2 4.24Å; I259-F304 HydrophobicContact CG1-CZ 4.23Å
260	F	97.2	Very high	96.5	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	149.1	176.4	-67.4	-85.9	0	0	0	111.5	L229 T230 R247 I248 T250 I258 G265 E266 I267	L229-F260 HydrophobicContact CB-CD1 4.18Å; L229-F260 HydrophobicContact CB-CD2 4.14Å; L229-F260 HydrophobicContact CB-CE1 4.01Å; L229-F260 HydrophobicContact CB-CE2 3.97Å; L229-F260 HydrophobicContact CB-CG 4.23Å; L229-F260 HydrophobicContact CB-CZ 3.91Å; L229-F260 HydrophobicContact CD1-CB 4.17Å; L229-F260 HydrophobicContact CD1-CD2 3.91Å; L229-F260 HydrophobicContact CD1-CE2 4.46Å; L229-F260 HydrophobicContact CD1-CG 4.04Å; L229-F260 HydrophobicContact CD2-CB 3.96Å; L229-F260 HydrophobicContact CD2-CD1 3.91Å; L229-F260 HydrophobicContact CD2-CG 3.9Å; L229-F260 HydrophobicContact CG-CD1 4.49Å; L229-F260 HydrophobicContact CG-CD2 4.42Å; L229-F260 HydrophobicContact CG-CG 4.28Å; T230-F260 WeakPolarHBondContact O-CE1 3.17Å; T230-F260 WeakPolarHBondContact O-CZ 3.34Å; R247-F260 CarbonylContact C-O 3.44Å; R247-F260 WeakPolarHBondContact CA-O 3.48Å; R247-F260 WeakPolarHBondContact CB-O 3.36Å; I248-F260 HydrophobicContact CB-CB 4.48Å; I248-F260 PolarHBondContact N-O 2.89Å; I248-F260 PolarHBondContact O-N 3.04Å; T250-F260 HydrophobicContact CG2-CD2 4.1Å; T250-F260 HydrophobicContact CG2-CE2 3.85Å; T250-F260 WeakPolarHBondContact OG1-CE2 3.37Å; I258-F260 HydrophobicContact CB-CD2 4.27Å; I258-F260 HydrophobicContact CB-CE2 3.68Å; I258-F260 HydrophobicContact CB-CZ 4.07Å; I258-F260 HydrophobicContact CD1-CZ 4.38Å; I258-F260 HydrophobicContact CG2-CD1 4.32Å; I258-F260 HydrophobicContact CG2-CD2 3.8Å; I258-F260 HydrophobicContact CG2-CE1 3.99Å; I258-F260 HydrophobicContact CG2-CE2 3.42Å; I258-F260 VanDerWaalsContact CG2-CE2 3.42Å; I258-F260 HydrophobicContact CG2-CG 4.25Å; I258-F260 HydrophobicContact CG2-CZ 3.52Å; F260-G265 WeakPolarHBondContact CD1-O 3.48Å; F260-E266 CarbonylContact C-O 3.56Å; F260-E266 WeakPolarHBondContact CA-O 3.36Å; F260-I267 HydrophobicContact CD1-CG1 3.94Å; F260-I267 HydrophobicContact CE1-CD1 4.27Å; F260-I267 HydrophobicContact CE1-CG1 3.48Å; F260-I267 VanDerWaalsContact CE1-CG1 3.48Å; F260-I267 HydrophobicContact CZ-CG1 4.22Å
261	D	94.1	Very high	96.5	Very high	38 Å²	38	50.5 Å²	50.5	20%	0.203	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	127.7	158.3	-176.7	-82	0	0	0	109.4	E263 R264 G265 E266 V268	D261-E263 VanDerWaalsContact C-N 3.34Å; D261-E263 PolarHBondContact O-N 3.32Å; D261-E263 WeakPolarHBondContact OD1-CA 3.41Å; D261-E263 PolarHBondContact OD1-N 3.05Å; D261-R264 PolarHBondContact OD1-N 2.94Å; D261-G265 VanDerWaalsContact O-CA 3.24Å; D261-G265 WeakPolarHBondContact O-CA 3.36Å; D261-G265 PolarHBondContact O-N 2.84Å; D261-E266 HydrophobicContact CB-CB 4.43Å; D261-E266 PolarHBondContact N-O 2.87Å; D261-V268 HydrophobicContact CB-CG2 4.17Å
262	S	92.4	Very high	96.4	Very high	18 Å²	18	54 Å²	54	13%	0.126	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-10.5	-172.9	72.3	0	0	0	0	114.8	L227 N246	L227-S262 WeakPolarHBondContact CD2-O 3.47Å; N246-S262 WeakPolarHBondContact O-CB 3.5Å; N246-S262 PolarHBondContact O-N 3.43Å; N246-S262 PolarHBondContact O-OG 3.12Å
263	E	90.4	Very high	96.3	Very high	134 Å²	134	56.1 Å²	56.1	63%	0.626	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-39.6	178.3	-64.2	179.1	-160.8	0	0	111.1	N246 D261	N246-E263 PolarHBondContact ND2-OE1 3.45Å; D261-E263 VanDerWaalsContact C-N 3.34Å; D261-E263 PolarHBondContact O-N 3.32Å; D261-E263 WeakPolarHBondContact OD1-CA 3.41Å; D261-E263 PolarHBondContact OD1-N 3.05Å
264	R	92.9	Very high	96.2	Very high	171 Å²	171	51 Å²	51	65%	0.645	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-25	-175.4	-59.2	-178.4	174.9	-162.2	-1.6	114.7	D261 E266	D261-R264 PolarHBondContact OD1-N 2.94Å; R264-E266 VanDerWaalsContact C-N 3.27Å; R264-E266 HydrophobicContact CB-CB 4.44Å; R264-E266 HydrophobicContact CB-CG 3.89Å; R264-E266 WeakPolarHBondContact CD-OE2 3.34Å; R264-E266 IonicContact NH1-OE1 3.99Å; R264-E266 IonicContact NH1-OE2 2.68Å; R264-E266 PolarHBondContact NH1-OE2 3.09Å
265	G	94.2	Very high	96	Very high	18 Å²	18	54.9 Å²	54.9	19%	0.186	29%	0.287	C	S	.	.			trans	73.8	15.7	-171.8	0	0	0	0	0	114.4	F260 D261	F260-G265 WeakPolarHBondContact CD1-O 3.48Å; D261-G265 VanDerWaalsContact O-CA 3.24Å; D261-G265 WeakPolarHBondContact O-CA 3.36Å; D261-G265 PolarHBondContact O-N 2.84Å
266	E	96.4	Very high	95.9	Very high	106 Å²	106	51.7 Å²	51.7	50%	0.495	28%	0.279	S	S	.	.			trans	-71	138.8	175.6	-69.9	172.5	164.9	0	0	110.4	F260 D261 R264 V268	F260-E266 CarbonylContact C-O 3.56Å; F260-E266 WeakPolarHBondContact CA-O 3.36Å; D261-E266 HydrophobicContact CB-CB 4.43Å; D261-E266 PolarHBondContact N-O 2.87Å; R264-E266 VanDerWaalsContact C-N 3.27Å; R264-E266 HydrophobicContact CB-CB 4.44Å; R264-E266 HydrophobicContact CB-CG 3.89Å; R264-E266 WeakPolarHBondContact CD-OE2 3.34Å; R264-E266 IonicContact NH1-OE1 3.99Å; R264-E266 IonicContact NH1-OE2 2.68Å; R264-E266 PolarHBondContact NH1-OE2 3.09Å; E266-V268 PolarHBondContact O-N 2.87Å
267	I	97.4	Very high	95.8	Very high	80 Å²	80	52.6 Å²	52.6	41%	0.41	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	119.5	173.7	-65	175.4	0	0	0	108.9	I258 F260 I270	I258-I267 HydrophobicContact CG2-CB 4.4Å; I258-I267 HydrophobicContact CG2-CD1 4.44Å; I258-I267 HydrophobicContact CG2-CG1 3.99Å; I258-I267 HydrophobicContact CG2-CG2 3.86Å; F260-I267 HydrophobicContact CD1-CG1 3.94Å; F260-I267 HydrophobicContact CE1-CD1 4.27Å; F260-I267 HydrophobicContact CE1-CG1 3.48Å; F260-I267 VanDerWaalsContact CE1-CG1 3.48Å; F260-I267 HydrophobicContact CZ-CG1 4.22Å; I267-I270 HydrophobicContact CG2-CD1 4.39Å; I267-I270 HydrophobicContact CG2-CG1 3.84Å
268	V	95.2	Very high	95.8	Very high	55 Å²	55	52.6 Å²	52.6	33%	0.333	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-43.6	178.5	-168.4	0	0	0	0	111.3	I259 D261 E266	I259-V268 HydrophobicContact CG2-CB 4.31Å; I259-V268 PolarHBondContact O-N 3.18Å; D261-V268 HydrophobicContact CB-CG2 4.17Å; E266-V268 PolarHBondContact O-N 2.87Å
269	N	95.6	Very high	95.7	Very high	41 Å²	41	53.8 Å²	53.8	22%	0.219	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	143.8	177.8	-61.7	104	0	0	0	110.9	I259 L271	I259-N269 HydrophobicContact CB-CB 4.08Å; I259-N269 HydrophobicContact CG1-CB 4.12Å; I259-N269 PolarHBondContact N-O 3.49Å; I259-N269 PolarHBondContact O-N 3.34Å; N269-L271 HydrophobicContact CB-CD2 3.94Å
270	I	97.4	Very high	95.8	Very high	93 Å²	93	53.8 Å²	53.8	48%	0.477	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118.8	166.7	-56.2	177.1	0	0	0	107.1	T256 I258 I267	T256-I270 HydrophobicContact CG2-CG2 4.05Å; I258-I270 HydrophobicContact CG1-CG1 4.39Å; I258-I270 HydrophobicContact CG1-CG2 4.45Å; I267-I270 HydrophobicContact CG2-CD1 4.39Å; I267-I270 HydrophobicContact CG2-CG1 3.84Å
271	L	97.7	Very high	95.8	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	103.8	-176.9	-45.9	-175	0	0	0	108.1	T256 A257 I259 N269 W302 F304	T256-L271 WeakPolarHBondContact CA-O 3.23Å; A257-L271 HydrophobicContact CB-CB 4.13Å; A257-L271 HydrophobicContact CB-CD1 4.18Å; A257-L271 HydrophobicContact CB-CG 4.44Å; A257-L271 PolarHBondContact N-O 3.45Å; A257-L271 WeakPolarHBondContact O-CA 3.28Å; A257-L271 WeakPolarHBondContact O-CB 3.24Å; A257-L271 PolarHBondContact O-N 3.08Å; I259-L271 HydrophobicContact CD1-CD1 4Å; I259-L271 HydrophobicContact CG1-CD1 4.03Å; I259-L271 HydrophobicContact CG1-CD2 4.28Å; I259-L271 HydrophobicContact CG1-CG 4.23Å; N269-L271 HydrophobicContact CB-CD2 3.94Å; L271-W302 HydrophobicContact CB-CD2 4.09Å; L271-W302 HydrophobicContact CB-CE3 4.09Å; L271-W302 HydrophobicContact CB-CH2 3.83Å; L271-W302 HydrophobicContact CB-CZ2 3.82Å; L271-W302 HydrophobicContact CB-CZ3 3.96Å; L271-W302 HydrophobicContact CD1-CB 4.43Å; L271-W302 HydrophobicContact CD1-CD2 3.97Å; L271-W302 HydrophobicContact CD1-CE3 4.42Å; L271-W302 HydrophobicContact CD1-CG 3.96Å; L271-W302 HydrophobicContact CD2-CD2 4.44Å; L271-W302 HydrophobicContact CD2-CE3 4.06Å; L271-W302 HydrophobicContact CD2-CZ3 4.39Å; L271-W302 HydrophobicContact CG-CD2 4.39Å; L271-W302 HydrophobicContact CG-CE3 4.41Å; L271-F304 HydrophobicContact CD1-CE2 4.5Å; L271-F304 HydrophobicContact CD1-CZ 3.86Å; L271-F304 HydrophobicContact CD2-CE1 3.87Å; L271-F304 HydrophobicContact CD2-CZ 3.55Å; L271-F304 HydrophobicContact CG-CZ 4.36Å
272	S	96.9	Very high	96	Very high	75 Å²	75	52.7 Å²	52.7	52%	0.524	28%	0.282	S	S	.	.			trans	-122.2	164.6	-167.3	64.3	0	0	0	0	113.3	W302	S272-W302 WeakPolarHBondContact O-CH2 3.26Å
273	G	95.6	Very high	96.1	Very high	44 Å²	44	52 Å²	52	45%	0.454	28%	0.277	S	S	.	.			trans	105.9	4.2	172.5	0	0	0	0	0	115.5	R300	G273-R300 PolarHBondContact O-NH1 2.96Å; G273-R300 PolarHBondContact O-NH2 3.14Å
274	H	96.5	Very high	96.3	Very high	9 Å²	9	45.7 Å²	45.7	4%	0.042	25%	0.248	C	C	.	.			trans	-65	138.1	158.9	-89.7	-72.5	0	0	0	109.3	L278 T292 S294 D296 T298 R300	H274-L278 HydrophobicContact CB-CD2 3.76Å; H274-L278 WeakPolarHBondContact CD2-CD2 3.44Å; H274-T292 PolarHBondContact NE2-OG1 3Å; H274-S294 WeakPolarHBondContact ND1-CB 3.03Å; H274-D296 WeakPolarHBondContact CA-OD2 3.36Å; H274-D296 IonicContact CE1-OD1 2.67Å; H274-D296 IonicContact CE1-OD2 3.42Å; H274-D296 IonicContact CG-OD2 3.38Å; H274-D296 IonicContact ND1-OD1 4Å; H274-D296 PolarHBondContact ND1-OD1 2.8Å; H274-D296 IonicContact ND1-OD2 3.87Å; H274-D296 PolarHBondContact ND1-OD2 2.85Å; H274-T298 PolarHBondContact CE1-OG1 2.71Å; H274-T298 VanDerWaalsContact CE1-OG1 3.3Å; H274-T298 PolarHBondContact ND1-OG1 3.27Å; H274-R300 PolarHBondContact CE1-NE 3.47Å; H274-R300 PolarHBondContact ND1-NE 3.45Å; H274-R300 WeakPolarHBondContact NE2-CD 3.34Å; H274-R300 WeakPolarHBondContact NE2-CG 3.39Å
275	D	95.4	Very high	96.1	Very high	112 Å²	112	40.1 Å²	40.1	60%	0.599	23%	0.234	S	C	*	.	S	Bend	trans	-80.7	-23.9	-172.3	-67.1	-51.5	0	0	0	112.4	R255 D296	R255-D275 WeakPolarHBondContact CD-O 3.49Å; R255-D275 PolarHBondContact NH1-O 2.77Å; D275-D296 HydrophobicContact CB-CB 4.08Å; D275-D296 PolarHBondContact N-OD2 3.39Å
276	L	95.8	Very high	95.8	Very high	58 Å²	58	43.1 Å²	43.1	30%	0.304	25%	0.252	S	S	.	.	S	Bend	trans	-134.5	173.2	179.5	-63.1	178.1	0	0	0	111.6	S294 K295 D296	L276-S294 PolarHBondContact O-OG 2.93Å; L276-K295 HydrophobicContact CB-CB 3.86Å; L276-K295 HydrophobicContact CD1-CB 4.13Å; L276-D296 HydrophobicContact CB-CB 4.11Å; L276-D296 HydrophobicContact CG-CB 4.34Å
277	E	96.9	Very high	95.5	Very high	47 Å²	47	40 Å²	40	22%	0.22	24%	0.237	C	C	.	.			trans	-53.5	144	-174.4	-55.4	100	101.4	0	0	113.5	W253 S294 K295	W253-E277 HydrophobicContact CB-CB 4.14Å; W253-E277 HydrophobicContact CB-CG 3.93Å; W253-E277 HydrophobicContact CG-CB 4.04Å; W253-E277 HydrophobicContact CG-CG 4.13Å; W253-E277 VanDerWaalsContact O-CG 3.31Å; W253-E277 WeakPolarHBondContact O-CG 3.29Å; E277-S294 WeakPolarHBondContact O-CA 3.07Å; E277-S294 PolarHBondContact O-OG 2.84Å; E277-S294 VanDerWaalsContact O-OG 3.07Å; E277-K295 HydrophobicContact CB-CD 4.06Å; E277-K295 HydrophobicContact CB-CG 4.46Å; E277-K295 PolarHBondContact O-N 2.84Å; E277-K295 IonicContact OE1-NZ 3.94Å; E277-K295 PolarHBondContact OE1-NZ 3.3Å
278	L	98.2	Very high	95.3	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	153.6	173.3	-51.9	-166.3	0	0	0	111.2	V237 A251 S252 W253 T256 A257 H274 T292 A293	V237-L278 VanDerWaalsContact CG2-O 3.28Å; V237-L278 WeakPolarHBondContact CG2-O 3.47Å; A251-L278 HydrophobicContact CB-CB 4Å; A251-L278 HydrophobicContact CB-CD1 3.74Å; S252-L278 WeakPolarHBondContact O-CB 3.35Å; S252-L278 PolarHBondContact O-N 3.44Å; S252-L278 VanDerWaalsContact O-N 3.16Å; W253-L278 VanDerWaalsContact CD1-O 3.26Å; T256-L278 VanDerWaalsContact C-CD1 3.47Å; T256-L278 VanDerWaalsContact O-CD1 3.27Å; T256-L278 WeakPolarHBondContact O-CD1 3.39Å; A257-L278 HydrophobicContact CB-CD1 3.8Å; H274-L278 HydrophobicContact CB-CD2 3.76Å; H274-L278 WeakPolarHBondContact CD2-CD2 3.44Å; L278-T292 HydrophobicContact CD1-CG2 4.21Å; L278-A293 CarbonylContact C-O 3.59Å; L278-A293 WeakPolarHBondContact CA-O 3.28Å
279	N	97.1	Very high	95.3	Very high	26 Å²	26	35.2 Å²	35.2	14%	0.139	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	-25.3	175.1	-50.5	-66.2	0	0	0	112.6	A293 K295 S336 V337 R380	N279-A293 PolarHBondContact N-O 2.8Å; N279-K295 PolarHBondContact ND2-N 2.81Å; N279-S336 PolarHBondContact ND2-OG 3.43Å; N279-V337 PolarHBondContact ND2-O 3.41Å; N279-R380 PolarHBondContact O-NH1 2.8Å
280	H	98.1	Very high	95.4	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	150.2	-179.1	-161.6	-138.1	0	0	0	112.3	T292 A293 V340 R380	H280-T292 WeakPolarHBondContact O-CA 3.45Å; H280-A293 HydrophobicContact CB-CB 4.29Å; H280-A293 PolarHBondContact O-N 2.88Å; H280-V340 PolarHBondContact CE1-O 2.87Å; H280-V340 PolarHBondContact ND1-N 2.85Å; H280-V340 PolarHBondContact ND1-O 2.86Å; H280-R380 PolarHBondContact CD2-NH1 3.2Å
281	C	98.1	Very high	95.4	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	153.2	156.1	53.6	0	0	0	0	109.6	V249 A251 V291 T292	V249-C281 HydrophobicContact CG1-CB 4.11Å; V249-C281 HydrophobicContact CG2-CB 3.85Å; A251-C281 HydrophobicContact CB-CB 3.83Å; C281-V291 CarbonylContact C-O 3.57Å; C281-V291 WeakPolarHBondContact CA-O 3.21Å; C281-T292 HydrophobicContact CB-CG2 4.41Å
282	C	97	Very high	95.4	Very high	14 Å²	14	28.8 Å²	28.8	10%	0.095	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	142.1	171.1	-179.5	0	0	0	0	109.7	D240 V290 V291 V340	D240-C282 WeakPolarHBondContact OD2-CA 3.27Å; C282-V290 CarbonylContact O-C 3.56Å; C282-V290 WeakPolarHBondContact O-CA 3.35Å; C282-V291 HydrophobicContact CB-CG2 3.8Å; C282-V291 PolarHBondContact N-O 2.92Å; C282-V291 WeakPolarHBondContact O-CG2 3.1Å; C282-V291 PolarHBondContact O-N 2.73Å; C282-V340 WeakPolarHBondContact CB-O 3.34Å
283	S	95.6	Very high	95.4	Very high	4 Å²	4	25.2 Å²	25.2	3%	0.028	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	152.1	176.7	65	0	0	0	0	111.6	D240 W241 W243 F342	D240-S283 WeakPolarHBondContact OD2-CB 3.45Å; D240-S283 PolarHBondContact OD2-N 3.11Å; D240-S283 PolarHBondContact OD2-OG 3.19Å; W241-S283 WeakPolarHBondContact O-CB 3.41Å; W241-S283 PolarHBondContact O-OG 2.9Å; W243-S283 VanDerWaalsContact CD1-OG 3.29Å; W243-S283 PolarHBondContact NE1-OG 2.92Å; S283-F342 VanDerWaalsContact C-CD2 3.41Å; S283-F342 WeakPolarHBondContact O-CD2 3.34Å
284	H	94.3	Very high	95.5	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.131	C	C	.	.			trans	-81.5	135.2	170.4	-175.2	-75.5	0	0	0	109.9	S286 Q287 L289 F342 G344	H284-S286 PolarHBondContact CE1-OG 3.47Å; H284-S286 VanDerWaalsContact CE1-OG 3.29Å; H284-S286 PolarHBondContact ND1-N 3.39Å; H284-S286 PolarHBondContact O-N 2.97Å; H284-S286 VanDerWaalsContact O-N 3.11Å; H284-Q287 HydrophobicContact CB-CB 4.29Å; H284-Q287 PolarHBondContact CE1-NE2 3.06Å; H284-Q287 WeakPolarHBondContact ND1-CB 3.37Å; H284-Q287 PolarHBondContact ND1-N 3.48Å; H284-Q287 PolarHBondContact NE2-NE2 3.04Å; H284-Q287 VanDerWaalsContact NE2-NE2 3.12Å; H284-L289 HydrophobicContact CB-CB 3.79Å; H284-L289 HydrophobicContact CB-CD1 4.48Å; H284-L289 HydrophobicContact CB-CG 4.48Å; H284-L289 PolarHBondContact N-O 2.82Å; H284-F342 HydrophobicContact CB-CD1 4.24Å; H284-F342 HydrophobicContact CB-CD2 3.82Å; H284-F342 HydrophobicContact CB-CE1 4.21Å; H284-F342 HydrophobicContact CB-CE2 3.76Å; H284-F342 HydrophobicContact CB-CG 4.03Å; H284-F342 HydrophobicContact CB-CZ 3.96Å; H284-F342 AromaticContact CD2-CD1 3.64Å; H284-F342 AromaticContact CD2-CG 3.91Å; H284-G344 PolarHBondContact NE2-O 3.42Å
285	P	88.4	Confident	95.3	Very high	54 Å²	54	24.8 Å²	24.8	35%	0.351	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.8	-170.4	25.6	-36.2	0	0	0	115.5	W243	W243-P285 VanDerWaalsContact CB-O 3.29Å; W243-P285 WeakPolarHBondContact CB-O 3.36Å
286	S	87.8	Confident	95.2	Very high	82 Å²	82	20.3 Å²	20.3	57%	0.573	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-144.4	9.6	-177.2	63.3	0	0	0	0	115.7	H284	H284-S286 PolarHBondContact CE1-OG 3.47Å; H284-S286 VanDerWaalsContact CE1-OG 3.29Å; H284-S286 PolarHBondContact ND1-N 3.39Å; H284-S286 PolarHBondContact O-N 2.97Å; H284-S286 VanDerWaalsContact O-N 3.11Å
287	Q	91.2	Very high	95.1	Very high	40 Å²	40	18.9 Å²	18.9	19%	0.187	11%	0.108	C	C	.	.	S	Bend	trans	-135.7	151.8	179.5	-64.1	-177.3	72.7	0	0	107.8	H284 L289 S345	H284-Q287 HydrophobicContact CB-CB 4.29Å; H284-Q287 PolarHBondContact CE1-NE2 3.06Å; H284-Q287 WeakPolarHBondContact ND1-CB 3.37Å; H284-Q287 PolarHBondContact ND1-N 3.48Å; H284-Q287 PolarHBondContact NE2-NE2 3.04Å; H284-Q287 VanDerWaalsContact NE2-NE2 3.12Å; Q287-L289 HydrophobicContact CB-CD1 4.01Å; Q287-L289 HydrophobicContact CB-CG 3.87Å; Q287-L289 PolarHBondContact O-N 2.87Å; Q287-S345 PolarHBondContact NE2-O 3.37Å
288	N	92.3	Very high	95	Very high	32 Å²	32	17.2 Å²	17.2	17%	0.171	10%	0.101	C	C	.	.	S	Bend	trans	-76.9	57	178.6	-54.1	-14.6	0	0	0	110.9	T244 Q245 F304 R305	T244-N288 VanDerWaalsContact CB-OD1 3.28Å; T244-N288 WeakPolarHBondContact CB-OD1 3.44Å; T244-N288 PolarHBondContact OG1-OD1 3.05Å; Q245-N288 PolarHBondContact NE2-ND2 2.75Å; Q245-N288 VanDerWaalsContact NE2-ND2 3.12Å; N288-F304 HydrophobicContact CB-CB 4.04Å; N288-F304 VanDerWaalsContact CB-O 3.32Å; N288-F304 WeakPolarHBondContact CB-O 3.5Å; N288-F304 PolarHBondContact ND2-O 2.87Å; N288-F304 PolarHBondContact O-N 3.08Å; N288-R305 HydrophobicContact CB-CG 4.11Å
289	L	95.2	Very high	94.9	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.01	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	141.1	-178.3	-55.5	176.7	0	0	0	109.8	H284 Q287 L301 W302 D303 F342 F362	H284-L289 HydrophobicContact CB-CB 3.79Å; H284-L289 HydrophobicContact CB-CD1 4.48Å; H284-L289 HydrophobicContact CB-CG 4.48Å; H284-L289 PolarHBondContact N-O 2.82Å; Q287-L289 HydrophobicContact CB-CD1 4.01Å; Q287-L289 HydrophobicContact CB-CG 3.87Å; Q287-L289 PolarHBondContact O-N 2.87Å; L289-L301 HydrophobicContact CB-CD1 4.1Å; L289-W302 WeakPolarHBondContact CA-O 3.33Å; L289-D303 HydrophobicContact CD2-CB 3.71Å; L289-D303 VanDerWaalsContact CD2-CG 3.44Å; L289-D303 WeakPolarHBondContact CD2-OD1 3.45Å; L289-F342 HydrophobicContact CB-CE1 4.28Å; L289-F342 HydrophobicContact CB-CE2 4.4Å; L289-F342 HydrophobicContact CB-CZ 3.69Å; L289-F342 HydrophobicContact CD1-CE1 4.37Å; L289-F362 HydrophobicContact CD1-CD2 4.47Å; L289-F362 HydrophobicContact CD1-CE2 3.66Å; L289-F362 HydrophobicContact CD1-CZ 3.76Å
290	V	97	Very high	94.9	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	141.8	174.2	172.3	0	0	0	0	108.4	L242 V249 I259 C282 W302 F304	L242-V290 HydrophobicContact CD1-CG2 3.96Å; L242-V290 HydrophobicContact CD2-CG2 4Å; L242-V290 HydrophobicContact CG-CG2 4.09Å; V249-V290 HydrophobicContact CB-CG1 4.38Å; V249-V290 HydrophobicContact CG1-CG1 4.3Å; V249-V290 HydrophobicContact CG2-CG1 3.92Å; I259-V290 HydrophobicContact CD1-CG2 4.24Å; C282-V290 CarbonylContact O-C 3.56Å; C282-V290 WeakPolarHBondContact O-CA 3.35Å; V290-W302 HydrophobicContact CB-CB 4.3Å; V290-W302 PolarHBondContact N-O 3.14Å; V290-W302 PolarHBondContact O-N 3.15Å; V290-F304 HydrophobicContact CB-CE2 4.11Å; V290-F304 HydrophobicContact CG2-CE2 4Å
291	V	97.7	Very high	94.9	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	141.5	167.6	-75.9	0	0	0	0	110.8	C281 C282 R300 L301 V340 F342 I348	C281-V291 CarbonylContact C-O 3.57Å; C281-V291 WeakPolarHBondContact CA-O 3.21Å; C282-V291 HydrophobicContact CB-CG2 3.8Å; C282-V291 PolarHBondContact N-O 2.92Å; C282-V291 WeakPolarHBondContact O-CG2 3.1Å; C282-V291 PolarHBondContact O-N 2.73Å; V291-R300 CarbonylContact C-O 3.57Å; V291-R300 WeakPolarHBondContact CA-O 3.33Å; V291-L301 HydrophobicContact CG1-CB 4.41Å; V291-L301 HydrophobicContact CG1-CD1 3.86Å; V291-V340 HydrophobicContact CB-CG1 3.84Å; V291-V340 HydrophobicContact CB-CG2 3.95Å; V291-V340 HydrophobicContact CG1-CG2 4.33Å; V291-V340 HydrophobicContact CG2-CB 4.36Å; V291-V340 HydrophobicContact CG2-CG1 3.7Å; V291-V340 HydrophobicContact CG2-CG2 3.95Å; V291-F342 HydrophobicContact CB-CE2 4.29Å; V291-F342 HydrophobicContact CB-CZ 4.39Å; V291-F342 HydrophobicContact CG1-CE1 4.08Å; V291-F342 HydrophobicContact CG1-CE2 3.96Å; V291-F342 HydrophobicContact CG1-CZ 3.59Å; V291-F342 HydrophobicContact CG2-CD2 4.01Å; V291-F342 HydrophobicContact CG2-CE2 3.67Å; V291-F342 HydrophobicContact CG2-CZ 4.2Å; V291-I348 HydrophobicContact CG1-CD1 3.66Å; V291-I348 HydrophobicContact CG1-CG1 4.28Å
292	T	98.3	Very high	94.8	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.006	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.3	171.8	54.7	0	0	0	0	110.1	A257 H274 L278 H280 C281 F299 R300 W302	A257-T292 HydrophobicContact CB-CG2 3.68Å; H274-T292 PolarHBondContact NE2-OG1 3Å; L278-T292 HydrophobicContact CD1-CG2 4.21Å; H280-T292 WeakPolarHBondContact O-CA 3.45Å; C281-T292 HydrophobicContact CB-CG2 4.41Å; T292-F299 CarbonylContact O-C 3.54Å; T292-F299 WeakPolarHBondContact O-CA 3.48Å; T292-F299 WeakPolarHBondContact O-CB 3.44Å; T292-R300 PolarHBondContact N-O 3.41Å; T292-R300 PolarHBondContact O-N 2.8Å; T292-W302 PolarHBondContact OG1-NE1 2.89Å
293	A	97.6	Very high	94.7	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.5	177.2	0	0	0	0	0	110.7	L278 N279 H280 F299 V337 V340	L278-A293 CarbonylContact C-O 3.59Å; L278-A293 WeakPolarHBondContact CA-O 3.28Å; N279-A293 PolarHBondContact N-O 2.8Å; H280-A293 HydrophobicContact CB-CB 4.29Å; H280-A293 PolarHBondContact O-N 2.88Å; A293-F299 HydrophobicContact CB-CB 4.33Å; A293-V337 HydrophobicContact CB-CB 3.87Å; A293-V337 HydrophobicContact CB-CG1 3.67Å; A293-V337 WeakPolarHBondContact CB-O 3.21Å; A293-V340 HydrophobicContact CB-CB 4.06Å; A293-V340 HydrophobicContact CB-CG1 3.58Å
294	S	96.4	Very high	94.6	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	161.7	-171.2	172.2	0	0	0	0	113.3	H274 L276 E277 D296 T298 V337	H274-S294 WeakPolarHBondContact ND1-CB 3.03Å; L276-S294 PolarHBondContact O-OG 2.93Å; E277-S294 WeakPolarHBondContact O-CA 3.07Å; E277-S294 PolarHBondContact O-OG 2.84Å; E277-S294 VanDerWaalsContact O-OG 3.07Å; S294-D296 WeakPolarHBondContact CB-OD1 3.47Å; S294-D296 PolarHBondContact O-N 3.18Å; S294-D296 VanDerWaalsContact OG-CG 3.26Å; S294-D296 PolarHBondContact OG-N 3.01Å; S294-D296 PolarHBondContact OG-OD1 2.94Å; S294-T298 PolarHBondContact N-O 3.17Å; S294-T298 VanDerWaalsContact N-O 3.15Å; S294-V337 PolarHBondContact O-N 3.36Å
295	K	94.1	Very high	94.4	Very high	45 Å²	45	25.2 Å²	25.2	20%	0.196	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-14.5	166.2	-61.5	-176.2	-168.8	174.2	0	113.2	L276 E277 N279 T297 S336	L276-K295 HydrophobicContact CB-CB 3.86Å; L276-K295 HydrophobicContact CD1-CB 4.13Å; E277-K295 HydrophobicContact CB-CD 4.06Å; E277-K295 HydrophobicContact CB-CG 4.46Å; E277-K295 PolarHBondContact O-N 2.84Å; E277-K295 IonicContact OE1-NZ 3.94Å; E277-K295 PolarHBondContact OE1-NZ 3.3Å; N279-K295 PolarHBondContact ND2-N 2.81Å; K295-T297 PolarHBondContact O-N 2.91Å; K295-S336 WeakPolarHBondContact CA-OG 3.31Å
296	D	92.7	Very high	94.5	Very high	18 Å²	18	29.6 Å²	29.6	10%	0.096	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	11.2	177.8	74	9.9	0	0	0	114.9	H274 D275 L276 S294 T298 R300	H274-D296 WeakPolarHBondContact CA-OD2 3.36Å; H274-D296 IonicContact CE1-OD1 2.67Å; H274-D296 IonicContact CE1-OD2 3.42Å; H274-D296 IonicContact CG-OD2 3.38Å; H274-D296 IonicContact ND1-OD1 4Å; H274-D296 PolarHBondContact ND1-OD1 2.8Å; H274-D296 IonicContact ND1-OD2 3.87Å; H274-D296 PolarHBondContact ND1-OD2 2.85Å; D275-D296 HydrophobicContact CB-CB 4.08Å; D275-D296 PolarHBondContact N-OD2 3.39Å; L276-D296 HydrophobicContact CB-CB 4.11Å; L276-D296 HydrophobicContact CG-CB 4.34Å; S294-D296 WeakPolarHBondContact CB-OD1 3.47Å; S294-D296 PolarHBondContact O-N 3.18Å; S294-D296 VanDerWaalsContact OG-CG 3.26Å; S294-D296 PolarHBondContact OG-N 3.01Å; S294-D296 PolarHBondContact OG-OD1 2.94Å; D296-T298 PolarHBondContact O-N 3.39Å; D296-T298 WeakPolarHBondContact OD1-CA 3.21Å; D296-T298 VanDerWaalsContact OD1-CB 3.28Å; D296-T298 WeakPolarHBondContact OD1-CB 3.39Å; D296-T298 PolarHBondContact OD1-N 3.3Å; D296-T298 PolarHBondContact OD1-OG1 2.88Å; D296-T298 PolarHBondContact OD2-OG1 2.8Å; D296-R300 IonicContact OD2-NH2 2.9Å
297	T	92.8	Very high	94.3	Very high	27 Å²	27	31.7 Å²	31.7	17%	0.166	16%	0.16	C	C	.	.	S	Bend	trans	69.6	4.1	-176.9	79.5	0	0	0	0	115	K295 Q315 R335	K295-T297 PolarHBondContact O-N 2.91Å; T297-Q315 PolarHBondContact OG1-NE2 2.81Å; T297-R335 WeakPolarHBondContact CA-O 3.33Å; T297-R335 HydrophobicContact CG2-CB 3.8Å; T297-R335 WeakPolarHBondContact CG2-O 3.31Å
298	T	94.7	Very high	94	Very high	13 Å²	13	36.5 Å²	36.5	8%	0.08	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	157.7	178.4	80	0	0	0	0	113	H274 S294 D296 V313 F314 Q315 V337	H274-T298 PolarHBondContact CE1-OG1 2.71Å; H274-T298 VanDerWaalsContact CE1-OG1 3.3Å; H274-T298 PolarHBondContact ND1-OG1 3.27Å; S294-T298 PolarHBondContact N-O 3.17Å; S294-T298 VanDerWaalsContact N-O 3.15Å; D296-T298 PolarHBondContact O-N 3.39Å; D296-T298 WeakPolarHBondContact OD1-CA 3.21Å; D296-T298 VanDerWaalsContact OD1-CB 3.28Å; D296-T298 WeakPolarHBondContact OD1-CB 3.39Å; D296-T298 PolarHBondContact OD1-N 3.3Å; D296-T298 PolarHBondContact OD1-OG1 2.88Å; D296-T298 PolarHBondContact OD2-OG1 2.8Å; T298-V313 HydrophobicContact CG2-CG1 4Å; T298-F314 VanDerWaalsContact CA-O 3.26Å; T298-F314 WeakPolarHBondContact CA-O 3.42Å; T298-F314 WeakPolarHBondContact CB-O 3.34Å; T298-Q315 HydrophobicContact CG2-CB 4.26Å; T298-V337 WeakPolarHBondContact O-CG2 3.45Å
299	F	96.7	Very high	93.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	155	152.9	62.8	-84.5	0	0	0	109.4	T292 A293 F314 V337 V340 I348 W360 M365	T292-F299 CarbonylContact O-C 3.54Å; T292-F299 WeakPolarHBondContact O-CA 3.48Å; T292-F299 WeakPolarHBondContact O-CB 3.44Å; A293-F299 HydrophobicContact CB-CB 4.33Å; F299-F314 HydrophobicContact CD1-CB 4.29Å; F299-F314 HydrophobicContact CD2-CB 4.24Å; F299-F314 AromaticContact CD2-CD2 3.83Å; F299-F314 HydrophobicContact CD2-CD2 3.83Å; F299-F314 HydrophobicContact CE1-CB 3.93Å; F299-F314 HydrophobicContact CE2-CB 3.88Å; F299-F314 AromaticContact CE2-CD2 3.52Å; F299-F314 HydrophobicContact CE2-CD2 3.52Å; F299-F314 HydrophobicContact CE2-CE2 4.42Å; F299-F314 HydrophobicContact CE2-CG 4.03Å; F299-F314 HydrophobicContact CG-CB 4.44Å; F299-F314 HydrophobicContact CZ-CB 3.71Å; F299-F314 HydrophobicContact CZ-CD2 4.17Å; F299-F314 HydrophobicContact CZ-CG 4.22Å; F299-F314 PolarHBondContact N-O 3.42Å; F299-F314 VanDerWaalsContact N-O 3.09Å; F299-F314 PolarHBondContact O-N 2.77Å; F299-V337 HydrophobicContact CB-CG1 4.31Å; F299-V337 HydrophobicContact CD1-CG1 4.32Å; F299-V340 HydrophobicContact CB-CB 4.47Å; F299-V340 HydrophobicContact CB-CG2 4.25Å; F299-V340 HydrophobicContact CD2-CG2 3.89Å; F299-V340 HydrophobicContact CE2-CG2 4.44Å; F299-V340 HydrophobicContact CG-CG2 4.11Å; F299-I348 HydrophobicContact CE2-CD1 4.43Å; F299-I348 HydrophobicContact CE2-CG2 3.98Å; F299-I348 HydrophobicContact CZ-CG2 4.49Å; F299-W360 AromaticContact CE1-CE2 3.92Å; F299-W360 HydrophobicContact CE1-CZ2 4.08Å; F299-W360 AromaticContact CE1-NE1 3.77Å; F299-W360 AromaticContact CZ-CD1 3.83Å; F299-W360 HydrophobicContact CZ-CD2 4.11Å; F299-W360 AromaticContact CZ-CE2 3.78Å; F299-W360 HydrophobicContact CZ-CG 4.17Å; F299-W360 HydrophobicContact CZ-CZ2 4.33Å; F299-W360 AromaticContact CZ-NE1 3.57Å; F299-M365 HydrophobicContact CE2-CE 3.45Å; F299-M365 VanDerWaalsContact CE2-CE 3.45Å; F299-M365 HydrophobicContact CZ-CE 3.42Å; F299-M365 VanDerWaalsContact CZ-CE 3.42Å
300	R	97.4	Very high	93.7	Very high	26 Å²	26	41.6 Å²	41.6	10%	0.098	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	140.2	-179.3	-61.7	-179.4	-171.5	-151.3	-1.4	110.2	G273 H274 V291 T292 D296 W302 V311 A312 V313	G273-R300 PolarHBondContact O-NH1 2.96Å; G273-R300 PolarHBondContact O-NH2 3.14Å; H274-R300 PolarHBondContact CE1-NE 3.47Å; H274-R300 PolarHBondContact ND1-NE 3.45Å; H274-R300 WeakPolarHBondContact NE2-CD 3.34Å; H274-R300 WeakPolarHBondContact NE2-CG 3.39Å; V291-R300 CarbonylContact C-O 3.57Å; V291-R300 WeakPolarHBondContact CA-O 3.33Å; T292-R300 PolarHBondContact N-O 3.41Å; T292-R300 PolarHBondContact O-N 2.8Å; D296-R300 IonicContact OD2-NH2 2.9Å; R300-W302 HydrophobicContact CB-CZ2 4.24Å; R300-V311 HydrophobicContact CB-CG2 4.01Å; R300-V311 HydrophobicContact CG-CG2 4.44Å; R300-A312 CarbonylContact C-O 3.52Å; R300-A312 VanDerWaalsContact CA-O 3.24Å; R300-A312 WeakPolarHBondContact CA-O 3.22Å; R300-V313 HydrophobicContact CG-CB 4.36Å; R300-V313 HydrophobicContact CG-CG1 4.19Å; R300-V313 HydrophobicContact CG-CG2 4.05Å
301	L	97.2	Very high	93.6	Very high	17 Å²	17	44.8 Å²	44.8	9%	0.089	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.3	168	175.1	64.4	0	0	0	108.1	L289 V291 V311 A312 F314 F342 I348 F362	L289-L301 HydrophobicContact CB-CD1 4.1Å; V291-L301 HydrophobicContact CG1-CB 4.41Å; V291-L301 HydrophobicContact CG1-CD1 3.86Å; L301-V311 CarbonylContact O-C 3.56Å; L301-V311 VanDerWaalsContact O-CA 3.32Å; L301-V311 WeakPolarHBondContact O-CA 3.45Å; L301-A312 PolarHBondContact N-O 3.38Å; L301-A312 PolarHBondContact O-N 3.48Å; L301-F314 HydrophobicContact CB-CE2 3.71Å; L301-F314 HydrophobicContact CB-CZ 4.49Å; L301-F342 HydrophobicContact CD1-CE1 3.92Å; L301-F342 HydrophobicContact CD1-CZ 3.66Å; L301-I348 HydrophobicContact CD1-CD1 4.45Å; L301-F362 HydrophobicContact CD2-CB 4.15Å; L301-F362 HydrophobicContact CD2-CD2 4.23Å; L301-F362 HydrophobicContact CD2-CG 4.44Å
302	W	96.9	Very high	93.5	Very high	7 Å²	7	46.6 Å²	46.6	3%	0.027	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.7	177.1	-52.5	87	0	0	0	108.4	L271 S272 L289 V290 T292 R300 F304 S310 V311	L271-W302 HydrophobicContact CB-CD2 4.09Å; L271-W302 HydrophobicContact CB-CE3 4.09Å; L271-W302 HydrophobicContact CB-CH2 3.83Å; L271-W302 HydrophobicContact CB-CZ2 3.82Å; L271-W302 HydrophobicContact CB-CZ3 3.96Å; L271-W302 HydrophobicContact CD1-CB 4.43Å; L271-W302 HydrophobicContact CD1-CD2 3.97Å; L271-W302 HydrophobicContact CD1-CE3 4.42Å; L271-W302 HydrophobicContact CD1-CG 3.96Å; L271-W302 HydrophobicContact CD2-CD2 4.44Å; L271-W302 HydrophobicContact CD2-CE3 4.06Å; L271-W302 HydrophobicContact CD2-CZ3 4.39Å; L271-W302 HydrophobicContact CG-CD2 4.39Å; L271-W302 HydrophobicContact CG-CE3 4.41Å; S272-W302 WeakPolarHBondContact O-CH2 3.26Å; L289-W302 WeakPolarHBondContact CA-O 3.33Å; V290-W302 HydrophobicContact CB-CB 4.3Å; V290-W302 PolarHBondContact N-O 3.14Å; V290-W302 PolarHBondContact O-N 3.15Å; T292-W302 PolarHBondContact OG1-NE1 2.89Å; R300-W302 HydrophobicContact CB-CZ2 4.24Å; W302-F304 HydrophobicContact CB-CE2 3.55Å; W302-F304 HydrophobicContact CB-CZ 3.76Å; W302-S310 WeakPolarHBondContact CA-O 3.48Å; W302-V311 HydrophobicContact CD2-CB 4.33Å; W302-V311 HydrophobicContact CD2-CG2 3.83Å; W302-V311 HydrophobicContact CE3-CB 3.75Å; W302-V311 HydrophobicContact CE3-CG2 3.68Å; W302-V311 HydrophobicContact CH2-CB 4.44Å; W302-V311 HydrophobicContact CH2-CG2 3.87Å; W302-V311 HydrophobicContact CZ2-CG2 4.01Å; W302-V311 HydrophobicContact CZ3-CB 3.82Å; W302-V311 HydrophobicContact CZ3-CG1 4.35Å; W302-V311 HydrophobicContact CZ3-CG2 3.71Å
303	D	94.7	Very high	93.3	Very high	22 Å²	22	50.1 Å²	50.1	12%	0.118	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	116.7	-176.4	-173.1	-6.7	0	0	0	110.8	L289 R305 H309 S310	L289-D303 HydrophobicContact CD2-CB 3.71Å; L289-D303 VanDerWaalsContact CD2-CG 3.44Å; L289-D303 WeakPolarHBondContact CD2-OD1 3.45Å; D303-R305 VanDerWaalsContact CG-NE 3.35Å; D303-R305 VanDerWaalsContact OD1-CB 3.24Å; D303-R305 WeakPolarHBondContact OD1-CB 3.21Å; D303-R305 WeakPolarHBondContact OD1-CG 3.2Å; D303-R305 IonicContact OD1-CZ 3.96Å; D303-R305 PolarHBondContact OD1-N 3.44Å; D303-R305 IonicContact OD1-NE 2.66Å; D303-R305 PolarHBondContact OD1-NE 3.18Å; D303-R305 IonicContact OD1-NH2 3.32Å; D303-R305 IonicContact OD2-CZ 2.61Å; D303-R305 VanDerWaalsContact OD2-CZ 3.27Å; D303-R305 IonicContact OD2-NE 3.56Å; D303-R305 PolarHBondContact OD2-NE 3.39Å; D303-R305 VanDerWaalsContact OD2-NE 3.09Å; D303-R305 IonicContact OD2-NH2 2.99Å; D303-R305 PolarHBondContact OD2-NH2 3.19Å; D303-H309 CarbonylContact O-C 3.58Å; D303-H309 WeakPolarHBondContact O-CA 3.43Å; D303-H309 WeakPolarHBondContact O-CB 3.4Å; D303-S310 PolarHBondContact N-O 2.67Å; D303-S310 PolarHBondContact O-N 3.03Å
304	F	93.1	Very high	93.1	Very high	15 Å²	15	51.6 Å²	51.6	7%	0.066	28%	0.277	C	S	.	.			trans	-114.4	27.9	179.4	-48.5	-90.8	0	0	0	111.6	I259 L271 N288 V290 W302 H309	I259-F304 HydrophobicContact CG1-CZ 4.23Å; L271-F304 HydrophobicContact CD1-CE2 4.5Å; L271-F304 HydrophobicContact CD1-CZ 3.86Å; L271-F304 HydrophobicContact CD2-CE1 3.87Å; L271-F304 HydrophobicContact CD2-CZ 3.55Å; L271-F304 HydrophobicContact CG-CZ 4.36Å; N288-F304 HydrophobicContact CB-CB 4.04Å; N288-F304 VanDerWaalsContact CB-O 3.32Å; N288-F304 WeakPolarHBondContact CB-O 3.5Å; N288-F304 PolarHBondContact ND2-O 2.87Å; N288-F304 PolarHBondContact O-N 3.08Å; V290-F304 HydrophobicContact CB-CE2 4.11Å; V290-F304 HydrophobicContact CG2-CE2 4Å; W302-F304 HydrophobicContact CB-CE2 3.55Å; W302-F304 HydrophobicContact CB-CZ 3.76Å; F304-H309 HydrophobicContact CD1-CB 3.54Å; F304-H309 HydrophobicContact CE1-CB 3.7Å; F304-H309 AromaticContact CE1-CG 3.96Å; F304-H309 HydrophobicContact CG-CB 4.34Å
305	R	90.7	Very high	92.7	Very high	129 Å²	129	58 Å²	58	49%	0.487	31%	0.307	S	S	.	.	S	Bend	trans	-74.9	-30.8	171.4	-64.9	175.8	-64.4	174.4	13.5	111.5	N288 D303	N288-R305 HydrophobicContact CB-CG 4.11Å; D303-R305 VanDerWaalsContact CG-NE 3.35Å; D303-R305 VanDerWaalsContact OD1-CB 3.24Å; D303-R305 WeakPolarHBondContact OD1-CB 3.21Å; D303-R305 WeakPolarHBondContact OD1-CG 3.2Å; D303-R305 IonicContact OD1-CZ 3.96Å; D303-R305 PolarHBondContact OD1-N 3.44Å; D303-R305 IonicContact OD1-NE 2.66Å; D303-R305 PolarHBondContact OD1-NE 3.18Å; D303-R305 IonicContact OD1-NH2 3.32Å; D303-R305 IonicContact OD2-CZ 2.61Å; D303-R305 VanDerWaalsContact OD2-CZ 3.27Å; D303-R305 IonicContact OD2-NE 3.56Å; D303-R305 PolarHBondContact OD2-NE 3.39Å; D303-R305 VanDerWaalsContact OD2-NE 3.09Å; D303-R305 IonicContact OD2-NH2 2.99Å; D303-R305 PolarHBondContact OD2-NH2 3.19Å
306	E	90.4	Very high	91.8	Very high	145 Å²	145	56.2 Å²	56.2	68%	0.678	30%	0.302	S	S	*	.	S	Bend	trans	-98.2	165.3	174	-59.9	-58.4	156.1	0	0	112
307	S	83.7	Confident	91.4	Very high	126 Å²	126	55.3 Å²	55.3	88%	0.881	30%	0.297	S	S	*	.	S	Bend	trans	-67.4	-34.1	178.6	58.5	0	0	0	0	113.6
308	I	85	Confident	90.4	Very high	141 Å²	141	57.5 Å²	57.5	72%	0.723	31%	0.31	S	S	*	.	S	Bend	trans	-96.9	114.4	168.8	-59.5	175.6	0	0	0	106.6
309	H	87.7	Confident	88.9	Confident	74 Å²	74	59.2 Å²	59.2	34%	0.343	32%	0.318	S	S	.	.			trans	-67.6	141.5	177.9	65.1	-91.8	0	0	0	110.6	D303 F304	D303-H309 CarbonylContact O-C 3.58Å; D303-H309 WeakPolarHBondContact O-CA 3.43Å; D303-H309 WeakPolarHBondContact O-CB 3.4Å; F304-H309 HydrophobicContact CD1-CB 3.54Å; F304-H309 HydrophobicContact CE1-CB 3.7Å; F304-H309 AromaticContact CE1-CG 3.96Å; F304-H309 HydrophobicContact CG-CB 4.34Å
310	S	92.9	Very high	87.1	Confident	67 Å²	67	66.3 Å²	66.3	47%	0.469	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	153.1	173.3	76.3	0	0	0	0	110.9	W302 D303	W302-S310 WeakPolarHBondContact CA-O 3.48Å; D303-S310 PolarHBondContact N-O 2.67Å; D303-S310 PolarHBondContact O-N 3.03Å
311	V	95.3	Very high	85.2	Confident	68 Å²	68	66.7 Å²	66.7	41%	0.412	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.3	176.4	64.2	0	0	0	0	110.3	R300 L301 W302	R300-V311 HydrophobicContact CB-CG2 4.01Å; R300-V311 HydrophobicContact CG-CG2 4.44Å; L301-V311 CarbonylContact O-C 3.56Å; L301-V311 VanDerWaalsContact O-CA 3.32Å; L301-V311 WeakPolarHBondContact O-CA 3.45Å; W302-V311 HydrophobicContact CD2-CB 4.33Å; W302-V311 HydrophobicContact CD2-CG2 3.83Å; W302-V311 HydrophobicContact CE3-CB 3.75Å; W302-V311 HydrophobicContact CE3-CG2 3.68Å; W302-V311 HydrophobicContact CH2-CB 4.44Å; W302-V311 HydrophobicContact CH2-CG2 3.87Å; W302-V311 HydrophobicContact CZ2-CG2 4.01Å; W302-V311 HydrophobicContact CZ3-CB 3.82Å; W302-V311 HydrophobicContact CZ3-CG1 4.35Å; W302-V311 HydrophobicContact CZ3-CG2 3.71Å
312	A	94.7	Very high	83.4	Confident	38 Å²	38	73.2 Å²	73.2	31%	0.314	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.4	171.5	0	0	0	0	0	109.4	R300 L301 F314	R300-A312 CarbonylContact C-O 3.52Å; R300-A312 VanDerWaalsContact CA-O 3.24Å; R300-A312 WeakPolarHBondContact CA-O 3.22Å; L301-A312 PolarHBondContact N-O 3.38Å; L301-A312 PolarHBondContact O-N 3.48Å; A312-F314 HydrophobicContact CB-CE1 3.95Å; A312-F314 HydrophobicContact CB-CE2 3.83Å; A312-F314 HydrophobicContact CB-CZ 3.28Å
313	V	95.1	Very high	81.1	Confident	75 Å²	75	79.4 Å²	79.4	46%	0.455	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.9	-175.2	-173.2	0	0	0	0	109.6	T298 R300	T298-V313 HydrophobicContact CG2-CG1 4Å; R300-V313 HydrophobicContact CG-CB 4.36Å; R300-V313 HydrophobicContact CG-CG1 4.19Å; R300-V313 HydrophobicContact CG-CG2 4.05Å
314	F	93.1	Very high	79	Confident	30 Å²	30	82.2 Å²	82.2	13%	0.132	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	115.1	-174.9	-52.9	-61.7	0	0	0	111.6	T298 F299 L301 A312 M365	T298-F314 VanDerWaalsContact CA-O 3.26Å; T298-F314 WeakPolarHBondContact CA-O 3.42Å; T298-F314 WeakPolarHBondContact CB-O 3.34Å; F299-F314 HydrophobicContact CD1-CB 4.29Å; F299-F314 HydrophobicContact CD2-CB 4.24Å; F299-F314 AromaticContact CD2-CD2 3.83Å; F299-F314 HydrophobicContact CD2-CD2 3.83Å; F299-F314 HydrophobicContact CE1-CB 3.93Å; F299-F314 HydrophobicContact CE2-CB 3.88Å; F299-F314 AromaticContact CE2-CD2 3.52Å; F299-F314 HydrophobicContact CE2-CD2 3.52Å; F299-F314 HydrophobicContact CE2-CE2 4.42Å; F299-F314 HydrophobicContact CE2-CG 4.03Å; F299-F314 HydrophobicContact CG-CB 4.44Å; F299-F314 HydrophobicContact CZ-CB 3.71Å; F299-F314 HydrophobicContact CZ-CD2 4.17Å; F299-F314 HydrophobicContact CZ-CG 4.22Å; F299-F314 PolarHBondContact N-O 3.42Å; F299-F314 VanDerWaalsContact N-O 3.09Å; F299-F314 PolarHBondContact O-N 2.77Å; L301-F314 HydrophobicContact CB-CE2 3.71Å; L301-F314 HydrophobicContact CB-CZ 4.49Å; A312-F314 HydrophobicContact CB-CE1 3.95Å; A312-F314 HydrophobicContact CB-CE2 3.83Å; A312-F314 HydrophobicContact CB-CZ 3.28Å; F314-M365 HydrophobicContact CB-CE 4.14Å; F314-M365 HydrophobicContact CD1-CB 3.54Å; F314-M365 HydrophobicContact CD1-CE 3.87Å; F314-M365 HydrophobicContact CD1-CG 4.02Å; F314-M365 HydrophobicContact CD2-CE 3.55Å; F314-M365 HydrophobicContact CE1-CB 3.21Å; F314-M365 HydrophobicContact CE1-CE 4.16Å; F314-M365 HydrophobicContact CE1-CG 3.47Å; F314-M365 VanDerWaalsContact CE1-CG 3.47Å; F314-M365 HydrophobicContact CE2-CE 3.81Å; F314-M365 HydrophobicContact CE2-CG 4.11Å; F314-M365 HydrophobicContact CG-CB 4.42Å; F314-M365 HydrophobicContact CG-CE 3.55Å; F314-M365 HydrophobicContact CZ-CB 3.83Å; F314-M365 HydrophobicContact CZ-CE 4.11Å; F314-M365 HydrophobicContact CZ-CG 3.5Å; F314-M365 VanDerWaalsContact CZ-CG 3.5Å
315	Q	88.8	Confident	76.5	Confident	134 Å²	134	85.8 Å²	85.8	63%	0.626	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	92.7	173.5	-169.4	175	35.9	0	0	109.7	T297 T298 T318	T297-Q315 PolarHBondContact OG1-NE2 2.81Å; T298-Q315 HydrophobicContact CG2-CB 4.26Å; Q315-T318 HydrophobicContact CG-CG2 3.94Å
316	G	74.5	Confident	74.3	Confident	8 Å²	8	89.9 Å²	89.9	8%	0.082	48%	0.475	C	S	.	.			trans	-106.8	-21.6	-177.3	0	0	0	0	0	115.5	K358 W360	G316-K358 WeakPolarHBondContact O-CD 3.46Å; G316-K358 WeakPolarHBondContact O-CE 3.39Å; G316-W360 VanDerWaalsContact CA-CH2 3.48Å
317	H	83.7	Confident	72.3	Confident	0 Å²	0	90.1 Å²	90.1	0%	0	48%	0.476	C	S	.	.			trans	-108	83.9	-169.2	-73.9	-74.3	0	0	0	110.7	V337 S350 S352 D354 S356	H317-V337 HydrophobicContact CB-CG2 4.36Å; H317-S350 PolarHBondContact NE2-OG 2.59Å; H317-S352 VanDerWaalsContact CG-CB 3.46Å; H317-S352 WeakPolarHBondContact ND1-CB 3.18Å; H317-D354 VanDerWaalsContact CA-OD2 3.29Å; H317-D354 WeakPolarHBondContact CA-OD2 3.22Å; H317-D354 WeakPolarHBondContact CB-OD2 3.37Å; H317-D354 IonicContact CE1-OD1 3.77Å; H317-D354 IonicContact CG-OD2 3.94Å; H317-D354 IonicContact ND1-OD1 2.73Å; H317-D354 PolarHBondContact ND1-OD1 2.79Å; H317-D354 IonicContact ND1-OD2 3.31Å; H317-D354 PolarHBondContact ND1-OD2 3.3Å; H317-S356 PolarHBondContact CE1-OG 3.36Å; H317-S356 VanDerWaalsContact CE1-OG 3.27Å; H317-S356 PolarHBondContact ND1-OG 2.8Å; H317-S356 VanDerWaalsContact ND1-OG 3.12Å
318	T	72.3	Confident	70.3	Confident	72 Å²	72	91.6 Å²	91.6	44%	0.442	47%	0.473	S	S	.	.			trans	-122.6	2	-174.3	56.8	0	0	0	0	113.2	Q315 R335	Q315-T318 HydrophobicContact CG-CG2 3.94Å; T318-R335 PolarHBondContact O-NH1 3.08Å
319	E	63.5	Low	68.1	Low	50 Å²	50	94.1 Å²	94.1	23%	0.234	47%	0.473	C	S	.	.			trans	-69.3	138.1	-174	-64.7	-172.3	-152.9	0	0	111.4	R335 K358 R373	E319-R335 PolarHBondContact O-NE 3.27Å; E319-K358 IonicContact OE1-NZ 3.05Å; E319-K358 PolarHBondContact OE1-NZ 3.45Å; E319-R373 VanDerWaalsContact CD-NH2 3.26Å; E319-R373 IonicContact OE1-CZ 3.65Å; E319-R373 IonicContact OE1-NE 3.71Å; E319-R373 IonicContact OE1-NH2 2.81Å; E319-R373 PolarHBondContact OE1-NH2 2.91Å; E319-R373 IonicContact OE2-CZ 3.86Å; E319-R373 VanDerWaalsContact OE2-CZ 3.32Å; E319-R373 IonicContact OE2-NE 2.72Å; E319-R373 PolarHBondContact OE2-NE 2.98Å; E319-R373 IonicContact OE2-NH2 3.51Å; E319-R373 PolarHBondContact OE2-NH2 3.07Å
320	Y	59.2	Low	65.7	Low	149 Å²	149	97.9 Å²	97.9	58%	0.584	50%	0.495	S	S	*	.			trans	-86.9	123.3	179.9	-148.6	-67.2	0	0	0	109.3	E322 N333	Y320-E322 PolarHBondContact O-N 3.04Å; Y320-E322 VanDerWaalsContact O-N 3.12Å; Y320-N333 PolarHBondContact OH-ND2 3.21Å
321	V	57.7	Low	63	Low	33 Å²	33	101.1 Å²	101.1	20%	0.2	51%	0.507	C	S	.	.			trans	-82.9	86.8	171.6	-178.1	0	0	0	0	108.5	N323 V324 R355	V321-N323 PolarHBondContact O-N 3.32Å; V321-V324 HydrophobicContact CB-CG2 4.35Å; V321-V324 HydrophobicContact CG1-CG2 3.89Å; V321-R355 VanDerWaalsContact CG1-NH2 3.35Å; V321-R355 HydrophobicContact CG2-CG 4.19Å
322	E	57.6	Low	60.6	Low	154 Å²	154	102.3 Å²	102.3	72%	0.72	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-5.4	-172.4	-62.2	-175.2	149.5	0	0	115.7	Y320	Y320-E322 PolarHBondContact O-N 3.04Å; Y320-E322 VanDerWaalsContact O-N 3.12Å
323	N	50	Low	58.3	Low	137 Å²	137	105.1 Å²	105.1	73%	0.733	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.6	25.6	-171.3	-68.8	-74.2	0	0	0	114.2	V321	V321-N323 PolarHBondContact O-N 3.32Å
324	V	49.4	Very low	56.4	Low	82 Å²	82	107 Å²	107	50%	0.497	52%	0.523	S	S	.	.	S	Bend	trans	-82.3	125.6	164.4	-177.5	0	0	0	0	108.3	V321 Y326	V321-V324 HydrophobicContact CB-CG2 4.35Å; V321-V324 HydrophobicContact CG1-CG2 3.89Å; V324-Y326 PolarHBondContact O-N 3.08Å
325	C	41.3	Very low	55.4	Low	89 Å²	89	109 Å²	109	60%	0.601	53%	0.53	S	S	*	.			trans	-54.2	126.9	-167.6	-169.9	0	0	0	0	113	H327 L328	C325-H327 PolarHBondContact O-N 3.39Å; C325-L328 PolarHBondContact O-N 2.81Å
326	Y	43.9	Very low	55.4	Low	216 Å²	216	102.9 Å²	102.9	85%	0.847	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	0.2	178	-81.6	-84.1	0	0	0	115.5	V324	V324-Y326 PolarHBondContact O-N 3.08Å
327	H	50	Low	56.4	Low	150 Å²	150	102.5 Å²	102.5	69%	0.694	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-10.9	-173.7	-158.9	56	0	0	0	114.9	C325	C325-H327 PolarHBondContact O-N 3.39Å
328	L	40.5	Very low	56.9	Low	156 Å²	156	103.6 Å²	103.6	82%	0.817	51%	0.505	S	S	*	.			trans	-105.4	80.5	172.2	-86.7	150.6	0	0	0	109.5	C325 L330	C325-L328 PolarHBondContact O-N 2.81Å; L328-L330 VanDerWaalsContact C-N 3.27Å; L328-L330 PolarHBondContact O-N 3.31Å
329	R	38.5	Very low	58.1	Low	195 Å²	195	100.2 Å²	100.2	74%	0.736	48%	0.484	S	S	*	.			trans	-88.6	24.3	-168.8	-142.3	-178.7	-160.7	171.6	7.2	114.7
330	L	37.7	Very low	59.7	Low	152 Å²	152	97.8 Å²	97.8	80%	0.796	47%	0.473	S	S	*	.	S	Bend	trans	-128.4	131.1	178.3	-72.5	172	0	0	0	110.8	L328	L328-L330 VanDerWaalsContact C-N 3.27Å; L328-L330 PolarHBondContact O-N 3.31Å
331	N	35.7	Very low	61.5	Low	136 Å²	136	91.4 Å²	91.4	73%	0.727	45%	0.449	S	S	*	.	S	Bend	trans	74.2	80.7	170.1	-56	-23	0	0	0	117.6
332	V	44.8	Very low	63.3	Low	93 Å²	93	90.7 Å²	90.7	56%	0.564	44%	0.444	S	S	*	.			trans	54.9	116.5	144	-167.4	0	0	0	0	116.9	Y334	V332-Y334 HydrophobicContact CB-CD1 4.31Å; V332-Y334 HydrophobicContact CB-CD2 4.08Å; V332-Y334 HydrophobicContact CB-CE1 3.9Å; V332-Y334 HydrophobicContact CB-CE2 3.65Å; V332-Y334 HydrophobicContact CB-CG 4.4Å; V332-Y334 HydrophobicContact CG1-CD1 3.72Å; V332-Y334 HydrophobicContact CG1-CD2 4.25Å; V332-Y334 HydrophobicContact CG1-CE1 3.59Å; V332-Y334 HydrophobicContact CG1-CE2 4.14Å; V332-Y334 HydrophobicContact CG1-CG 4.05Å; V332-Y334 HydrophobicContact CG2-CE1 4.45Å; V332-Y334 HydrophobicContact CG2-CE2 4.48Å; V332-Y334 WeakPolarHBondContact O-CD2 3.22Å; V332-Y334 PolarHBondContact O-N 3.41Å
333	N	47.8	Very low	65	Low	97 Å²	97	84.2 Å²	84.2	52%	0.519	42%	0.415	S	S	.	.			trans	-68.8	78.3	163.5	-71.6	-32.6	0	0	0	110	Y320 R335	Y320-N333 PolarHBondContact OH-ND2 3.21Å; N333-R335 PolarHBondContact O-N 3.14Å
334	Y	53.5	Low	66.8	Low	113 Å²	113	80.4 Å²	80.4	44%	0.443	41%	0.408	S	S	.	.			trans	-59.9	130.4	172	-61	-74.9	0	0	0	108.9	V332	V332-Y334 HydrophobicContact CB-CD1 4.31Å; V332-Y334 HydrophobicContact CB-CD2 4.08Å; V332-Y334 HydrophobicContact CB-CE1 3.9Å; V332-Y334 HydrophobicContact CB-CE2 3.65Å; V332-Y334 HydrophobicContact CB-CG 4.4Å; V332-Y334 HydrophobicContact CG1-CD1 3.72Å; V332-Y334 HydrophobicContact CG1-CD2 4.25Å; V332-Y334 HydrophobicContact CG1-CE1 3.59Å; V332-Y334 HydrophobicContact CG1-CE2 4.14Å; V332-Y334 HydrophobicContact CG1-CG 4.05Å; V332-Y334 HydrophobicContact CG2-CE1 4.45Å; V332-Y334 HydrophobicContact CG2-CE2 4.48Å; V332-Y334 WeakPolarHBondContact O-CD2 3.22Å; V332-Y334 PolarHBondContact O-N 3.41Å
335	R	73.6	Confident	68.6	Low	73 Å²	73	79.5 Å²	79.5	28%	0.275	41%	0.405	S	S	.	.			trans	-112.8	49.1	168.9	-58.8	179.9	-170.7	144	1.8	108	T297 T318 E319 N333 D353	T297-R335 WeakPolarHBondContact CA-O 3.33Å; T297-R335 HydrophobicContact CG2-CB 3.8Å; T297-R335 WeakPolarHBondContact CG2-O 3.31Å; T318-R335 PolarHBondContact O-NH1 3.08Å; E319-R335 PolarHBondContact O-NE 3.27Å; N333-R335 PolarHBondContact O-N 3.14Å; R335-D353 WeakPolarHBondContact CA-OD1 3.32Å
336	S	88.7	Confident	71	Confident	6 Å²	6	77 Å²	77	4%	0.042	39%	0.385	C	S	.	.			trans	-59.9	135.1	-173	-168.4	0	0	0	0	110.7	N279 K295 T338 S352 D353	N279-S336 PolarHBondContact ND2-OG 3.43Å; K295-S336 WeakPolarHBondContact CA-OG 3.31Å; S336-T338 PolarHBondContact O-N 3.39Å; S336-S352 VanDerWaalsContact O-CA 3.23Å; S336-S352 WeakPolarHBondContact O-CA 3.42Å; S336-S352 WeakPolarHBondContact O-CB 3.18Å; S336-S352 PolarHBondContact O-OG 3.07Å; S336-D353 WeakPolarHBondContact CB-OD2 3.48Å; S336-D353 VanDerWaalsContact N-CG 3.28Å; S336-D353 PolarHBondContact N-OD1 3.02Å; S336-D353 PolarHBondContact N-OD2 3.39Å; S336-D353 VanDerWaalsContact N-OD2 3.12Å; S336-D353 PolarHBondContact O-N 3.02Å
337	V	94.6	Very high	73.4	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	106.2	164.7	-168.8	0	0	0	0	106.4	N279 A293 S294 T298 F299 H317 G351	N279-V337 PolarHBondContact ND2-O 3.41Å; A293-V337 HydrophobicContact CB-CB 3.87Å; A293-V337 HydrophobicContact CB-CG1 3.67Å; A293-V337 WeakPolarHBondContact CB-O 3.21Å; S294-V337 PolarHBondContact O-N 3.36Å; T298-V337 WeakPolarHBondContact O-CG2 3.45Å; F299-V337 HydrophobicContact CB-CG1 4.31Å; F299-V337 HydrophobicContact CD1-CG1 4.32Å; H317-V337 HydrophobicContact CB-CG2 4.36Å; V337-G351 CarbonylContact C-O 3.58Å; V337-G351 WeakPolarHBondContact CG1-O 3.35Å
338	T	95.2	Very high	75.6	Confident	23 Å²	23	62.1 Å²	62.1	14%	0.141	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-31.7	-171	57.3	0	0	0	0	112	S336 G351 D353 V378	S336-T338 PolarHBondContact O-N 3.39Å; T338-G351 PolarHBondContact N-O 2.97Å; T338-G351 PolarHBondContact OG1-O 2.76Å; T338-D353 HydrophobicContact CG2-CB 4.37Å; T338-V378 VanDerWaalsContact CB-O 3.25Å; T338-V378 WeakPolarHBondContact CB-O 3.19Å; T338-V378 WeakPolarHBondContact CG2-O 3.49Å; T338-V378 PolarHBondContact OG1-O 3.36Å
339	S	96.5	Very high	78.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	153.3	173.2	58.9	0	0	0	0	112.6	S350 G351 N379 I381	S339-S350 CarbonylContact O-C 3.56Å; S339-S350 WeakPolarHBondContact O-CA 3.36Å; S339-G351 PolarHBondContact N-O 3.35Å; S339-G351 PolarHBondContact O-N 3.39Å; S339-N379 PolarHBondContact OG-O 3.14Å; S339-I381 WeakPolarHBondContact OG-CG1 3.38Å; S339-I381 PolarHBondContact OG-N 2.78Å
340	V	97.5	Very high	81.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	130.1	176.7	65.2	0	0	0	0	108.5	H280 C282 V291 A293 F299 I348 V349	H280-V340 PolarHBondContact CE1-O 2.87Å; H280-V340 PolarHBondContact ND1-N 2.85Å; H280-V340 PolarHBondContact ND1-O 2.86Å; C282-V340 WeakPolarHBondContact CB-O 3.34Å; V291-V340 HydrophobicContact CB-CG1 3.84Å; V291-V340 HydrophobicContact CB-CG2 3.95Å; V291-V340 HydrophobicContact CG1-CG2 4.33Å; V291-V340 HydrophobicContact CG2-CB 4.36Å; V291-V340 HydrophobicContact CG2-CG1 3.7Å; V291-V340 HydrophobicContact CG2-CG2 3.95Å; A293-V340 HydrophobicContact CB-CB 4.06Å; A293-V340 HydrophobicContact CB-CG1 3.58Å; F299-V340 HydrophobicContact CB-CB 4.47Å; F299-V340 HydrophobicContact CB-CG2 4.25Å; F299-V340 HydrophobicContact CD2-CG2 3.89Å; F299-V340 HydrophobicContact CE2-CG2 4.44Å; F299-V340 HydrophobicContact CG-CG2 4.11Å; V340-I348 HydrophobicContact CG2-CG2 3.44Å; V340-I348 VanDerWaalsContact CG2-CG2 3.44Å; V340-V349 CarbonylContact C-O 3.59Å; V340-V349 WeakPolarHBondContact CA-O 3.42Å
341	V	96.9	Very high	83.9	Confident	14 Å²	14	38.1 Å²	38.1	9%	0.085	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	145.8	-174.5	-72	0	0	0	0	110.9	I348 V349 I381 I383	V341-I348 CarbonylContact O-C 3.59Å; V341-I348 WeakPolarHBondContact O-CA 3.12Å; V341-V349 HydrophobicContact CG2-CB 4.09Å; V341-V349 PolarHBondContact N-O 3.47Å; V341-V349 PolarHBondContact O-N 3.32Å; V341-I381 HydrophobicContact CG2-CG2 4.17Å; V341-I383 HydrophobicContact CG2-CD1 3.56Å; V341-I383 HydrophobicContact CG2-CG1 4.05Å
342	F	95.4	Very high	86.8	Confident	19 Å²	19	31.7 Å²	31.7	8%	0.083	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	152.1	173.2	-72.2	-77.5	0	0	0	112.3	S283 H284 L289 V291 L301 I348 F362	S283-F342 VanDerWaalsContact C-CD2 3.41Å; S283-F342 WeakPolarHBondContact O-CD2 3.34Å; H284-F342 HydrophobicContact CB-CD1 4.24Å; H284-F342 HydrophobicContact CB-CD2 3.82Å; H284-F342 HydrophobicContact CB-CE1 4.21Å; H284-F342 HydrophobicContact CB-CE2 3.76Å; H284-F342 HydrophobicContact CB-CG 4.03Å; H284-F342 HydrophobicContact CB-CZ 3.96Å; H284-F342 AromaticContact CD2-CD1 3.64Å; H284-F342 AromaticContact CD2-CG 3.91Å; L289-F342 HydrophobicContact CB-CE1 4.28Å; L289-F342 HydrophobicContact CB-CE2 4.4Å; L289-F342 HydrophobicContact CB-CZ 3.69Å; L289-F342 HydrophobicContact CD1-CE1 4.37Å; V291-F342 HydrophobicContact CB-CE2 4.29Å; V291-F342 HydrophobicContact CB-CZ 4.39Å; V291-F342 HydrophobicContact CG1-CE1 4.08Å; V291-F342 HydrophobicContact CG1-CE2 3.96Å; V291-F342 HydrophobicContact CG1-CZ 3.59Å; V291-F342 HydrophobicContact CG2-CD2 4.01Å; V291-F342 HydrophobicContact CG2-CE2 3.67Å; V291-F342 HydrophobicContact CG2-CZ 4.2Å; L301-F342 HydrophobicContact CD1-CE1 3.92Å; L301-F342 HydrophobicContact CD1-CZ 3.66Å; F342-I348 HydrophobicContact CD1-CD1 4.44Å; F342-I348 HydrophobicContact CD1-CG1 3.75Å; F342-I348 HydrophobicContact CE1-CD1 4.03Å; F342-I348 HydrophobicContact CE1-CG1 3.85Å; F342-F362 HydrophobicContact CD1-CD1 4.21Å; F342-F362 AromaticContact CD1-CE1 3.94Å; F342-F362 HydrophobicContact CD1-CE1 3.94Å; F342-F362 HydrophobicContact CE1-CD1 4.2Å; F342-F362 HydrophobicContact CE1-CE1 4.07Å
343	V	93	Very high	89	Confident	18 Å²	18	29 Å²	29	11%	0.109	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128.6	173.7	-172.1	0	0	0	0	110.1	S345 K347 V349 I383 L404	V343-S345 PolarHBondContact O-N 3.03Å; V343-K347 HydrophobicContact CB-CB 4.16Å; V343-K347 PolarHBondContact N-O 2.79Å; V343-K347 PolarHBondContact O-N 3.21Å; V343-V349 HydrophobicContact CG2-CG2 3.73Å; V343-I383 HydrophobicContact CG1-CG2 4.21Å; V343-I383 HydrophobicContact CG2-CB 4.35Å; V343-I383 HydrophobicContact CG2-CD1 3.26Å; V343-I383 HydrophobicContact CG2-CG1 4.34Å; V343-I383 HydrophobicContact CG2-CG2 3.97Å; V343-L404 HydrophobicContact CG1-CD1 3.93Å; V343-L404 HydrophobicContact CG1-CD2 4.18Å; V343-L404 HydrophobicContact CG2-CD2 4.47Å
344	G	87.6	Confident	91	Very high	57 Å²	57	24.8 Å²	24.8	59%	0.588	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	-132.4	-178.9	0	0	0	0	0	111.6	H284	H284-G344 PolarHBondContact NE2-O 3.42Å
345	S	87.6	Confident	92.9	Very high	63 Å²	63	23 Å²	23	44%	0.441	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-1	-175.4	58.3	0	0	0	0	114.4	Q287 V343 F362	Q287-S345 PolarHBondContact NE2-O 3.37Å; V343-S345 PolarHBondContact O-N 3.03Å; S345-F362 VanDerWaalsContact O-CZ 3.25Å; S345-F362 WeakPolarHBondContact O-CZ 3.45Å
346	D	92.1	Very high	93.9	Very high	35 Å²	35	19.5 Å²	19.5	19%	0.187	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-149.2	-4.5	-166.9	69.1	-27.6	0	0	0	114.9	F362	D346-F362 WeakPolarHBondContact O-CD1 3.29Å; D346-F362 PolarHBondContact O-N 2.9Å
347	K	95	Very high	94.3	Very high	54 Å²	54	19.2 Å²	19.2	24%	0.235	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	150.3	-174.9	-69	165.3	-164.9	65.6	0	114.1	V343 W360 L369 L404	V343-K347 HydrophobicContact CB-CB 4.16Å; V343-K347 PolarHBondContact N-O 2.79Å; V343-K347 PolarHBondContact O-N 3.21Å; K347-W360 WeakPolarHBondContact CA-O 3.44Å; K347-W360 WeakPolarHBondContact CB-O 3.28Å; K347-L369 HydrophobicContact CG-CD1 4.43Å; K347-L404 HydrophobicContact CD-CD1 4.3Å
348	I	96.4	Very high	94.3	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.5	169.4	-70.4	164.9	0	0	0	108.1	V291 F299 L301 V340 V341 F342 W360 F362	V291-I348 HydrophobicContact CG1-CD1 3.66Å; V291-I348 HydrophobicContact CG1-CG1 4.28Å; F299-I348 HydrophobicContact CE2-CD1 4.43Å; F299-I348 HydrophobicContact CE2-CG2 3.98Å; F299-I348 HydrophobicContact CZ-CG2 4.49Å; L301-I348 HydrophobicContact CD1-CD1 4.45Å; V340-I348 HydrophobicContact CG2-CG2 3.44Å; V340-I348 VanDerWaalsContact CG2-CG2 3.44Å; V341-I348 CarbonylContact O-C 3.59Å; V341-I348 WeakPolarHBondContact O-CA 3.12Å; F342-I348 HydrophobicContact CD1-CD1 4.44Å; F342-I348 HydrophobicContact CD1-CG1 3.75Å; F342-I348 HydrophobicContact CE1-CD1 4.03Å; F342-I348 HydrophobicContact CE1-CG1 3.85Å; I348-W360 PolarHBondContact N-O 3.48Å; I348-W360 PolarHBondContact O-N 3.02Å; I348-F362 HydrophobicContact CD1-CB 3.65Å; I348-F362 HydrophobicContact CD1-CD1 4.24Å; I348-F362 HydrophobicContact CD1-CG 4.27Å; I348-F362 HydrophobicContact CG1-CB 4.15Å; I348-F362 HydrophobicContact CG1-CD1 3.97Å; I348-F362 HydrophobicContact CG1-CG 4.48Å
349	V	97.1	Very high	94.4	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.1	166.9	179.7	0	0	0	0	109	V340 V341 V343 V357 K358 V359 I381 I383 I390 L404	V340-V349 CarbonylContact C-O 3.59Å; V340-V349 WeakPolarHBondContact CA-O 3.42Å; V341-V349 HydrophobicContact CG2-CB 4.09Å; V341-V349 PolarHBondContact N-O 3.47Å; V341-V349 PolarHBondContact O-N 3.32Å; V343-V349 HydrophobicContact CG2-CG2 3.73Å; V349-V357 HydrophobicContact CG1-CG1 3.39Å; V349-K358 CarbonylContact C-O 3.6Å; V349-K358 WeakPolarHBondContact CA-O 3.13Å; V349-V359 HydrophobicContact CG2-CB 4.41Å; V349-V359 HydrophobicContact CG2-CG1 4.15Å; V349-V359 HydrophobicContact CG2-CG2 4.03Å; V349-I381 HydrophobicContact CG1-CD1 4.26Å; V349-I383 HydrophobicContact CB-CD1 3.64Å; V349-I383 HydrophobicContact CG1-CD1 4.12Å; V349-I383 HydrophobicContact CG2-CD1 3.5Å; V349-I390 HydrophobicContact CG1-CD1 4.17Å; V349-I390 HydrophobicContact CG1-CG2 4.45Å; V349-I390 HydrophobicContact CG2-CD1 4.38Å; V349-L404 HydrophobicContact CG2-CD2 4.37Å
350	S	97.1	Very high	94.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.1	175.6	64.3	0	0	0	0	111.2	H317 S339 V357 K358 W360	H317-S350 PolarHBondContact NE2-OG 2.59Å; S339-S350 CarbonylContact O-C 3.56Å; S339-S350 WeakPolarHBondContact O-CA 3.36Å; S350-V357 CarbonylContact O-C 3.47Å; S350-V357 VanDerWaalsContact O-CA 3.26Å; S350-V357 WeakPolarHBondContact O-CA 3.49Å; S350-K358 PolarHBondContact N-O 3.33Å; S350-K358 PolarHBondContact O-N 3.11Å; S350-W360 PolarHBondContact OG-NE1 3.37Å
351	G	96.5	Very high	94.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	152.3	173.1	0	0	0	0	0	111.4	V337 T338 S339	V337-G351 CarbonylContact C-O 3.58Å; V337-G351 WeakPolarHBondContact CG1-O 3.35Å; T338-G351 PolarHBondContact N-O 2.97Å; T338-G351 PolarHBondContact OG1-O 2.76Å; S339-G351 PolarHBondContact N-O 3.35Å; S339-G351 PolarHBondContact O-N 3.39Å
352	S	95.3	Very high	93.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	159.6	-177.6	174.8	0	0	0	0	113.2	H317 S336 D354 R355 S356 V378	H317-S352 VanDerWaalsContact CG-CB 3.46Å; H317-S352 WeakPolarHBondContact ND1-CB 3.18Å; S336-S352 VanDerWaalsContact O-CA 3.23Å; S336-S352 WeakPolarHBondContact O-CA 3.42Å; S336-S352 WeakPolarHBondContact O-CB 3.18Å; S336-S352 PolarHBondContact O-OG 3.07Å; S352-D354 WeakPolarHBondContact CB-OD1 3.33Å; S352-D354 PolarHBondContact O-N 2.73Å; S352-D354 PolarHBondContact OG-N 3.47Å; S352-R355 PolarHBondContact O-N 3.11Å; S352-S356 PolarHBondContact N-O 2.91Å; S352-V378 WeakPolarHBondContact O-CB 3.34Å; S352-V378 PolarHBondContact O-N 2.85Å; S352-V378 VanDerWaalsContact O-N 3.12Å
353	D	91.8	Very high	93.7	Very high	36 Å²	36	29.7 Å²	29.7	19%	0.193	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.6	165.4	56.1	9.9	0	0	0	113.3	R335 S336 T338 R355	R335-D353 WeakPolarHBondContact CA-OD1 3.32Å; S336-D353 WeakPolarHBondContact CB-OD2 3.48Å; S336-D353 VanDerWaalsContact N-CG 3.28Å; S336-D353 PolarHBondContact N-OD1 3.02Å; S336-D353 PolarHBondContact N-OD2 3.39Å; S336-D353 VanDerWaalsContact N-OD2 3.12Å; S336-D353 PolarHBondContact O-N 3.02Å; T338-D353 HydrophobicContact CG2-CB 4.37Å; D353-R355 WeakPolarHBondContact O-CG 3.24Å; D353-R355 PolarHBondContact O-N 3.43Å
354	D	90.9	Very high	93.5	Very high	9 Å²	9	32.8 Å²	32.8	5%	0.048	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-0.7	166.7	86.1	-6	0	0	0	113.9	H317 S352 S356	H317-D354 VanDerWaalsContact CA-OD2 3.29Å; H317-D354 WeakPolarHBondContact CA-OD2 3.22Å; H317-D354 WeakPolarHBondContact CB-OD2 3.37Å; H317-D354 IonicContact CE1-OD1 3.77Å; H317-D354 IonicContact CG-OD2 3.94Å; H317-D354 IonicContact ND1-OD1 2.73Å; H317-D354 PolarHBondContact ND1-OD1 2.79Å; H317-D354 IonicContact ND1-OD2 3.31Å; H317-D354 PolarHBondContact ND1-OD2 3.3Å; S352-D354 WeakPolarHBondContact CB-OD1 3.33Å; S352-D354 PolarHBondContact O-N 2.73Å; S352-D354 PolarHBondContact OG-N 3.47Å; D354-S356 VanDerWaalsContact C-N 3.3Å; D354-S356 VanDerWaalsContact CG-OG 3.28Å; D354-S356 PolarHBondContact O-N 3.34Å; D354-S356 WeakPolarHBondContact OD1-CA 3.43Å; D354-S356 VanDerWaalsContact OD1-CB 3.25Å; D354-S356 WeakPolarHBondContact OD1-CB 3.43Å; D354-S356 PolarHBondContact OD1-N 2.97Å; D354-S356 PolarHBondContact OD1-OG 2.71Å; D354-S356 PolarHBondContact OD2-OG 2.9Å
355	R	92.7	Very high	93.4	Very high	75 Å²	75	31.3 Å²	31.3	28%	0.283	15%	0.147	S	C	.	.	S	Bend	trans	67.8	26.3	179.2	-42.2	-179.2	178.9	173.3	1.1	113.1	V321 S352 D353 L374	V321-R355 VanDerWaalsContact CG1-NH2 3.35Å; V321-R355 HydrophobicContact CG2-CG 4.19Å; S352-R355 PolarHBondContact O-N 3.11Å; D353-R355 WeakPolarHBondContact O-CG 3.24Å; D353-R355 PolarHBondContact O-N 3.43Å; R355-L374 HydrophobicContact CB-CB 4.49Å; R355-L374 VanDerWaalsContact O-CB 3.3Å; R355-L374 WeakPolarHBondContact O-CB 3.24Å; R355-L374 PolarHBondContact O-N 2.93Å
356	S	94.2	Very high	93.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	151.6	172.4	78.3	0	0	0	0	113.3	H317 S352 D354 K358 I372	H317-S356 PolarHBondContact CE1-OG 3.36Å; H317-S356 VanDerWaalsContact CE1-OG 3.27Å; H317-S356 PolarHBondContact ND1-OG 2.8Å; H317-S356 VanDerWaalsContact ND1-OG 3.12Å; S352-S356 PolarHBondContact N-O 2.91Å; D354-S356 VanDerWaalsContact C-N 3.3Å; D354-S356 VanDerWaalsContact CG-OG 3.28Å; D354-S356 PolarHBondContact O-N 3.34Å; D354-S356 WeakPolarHBondContact OD1-CA 3.43Å; D354-S356 VanDerWaalsContact OD1-CB 3.25Å; D354-S356 WeakPolarHBondContact OD1-CB 3.43Å; D354-S356 PolarHBondContact OD1-N 2.97Å; D354-S356 PolarHBondContact OD1-OG 2.71Å; D354-S356 PolarHBondContact OD2-OG 2.9Å; S356-K358 VanDerWaalsContact OG-CE 3.25Å; S356-K358 WeakPolarHBondContact OG-CE 3.38Å; S356-I372 CarbonylContact C-O 3.12Å; S356-I372 VanDerWaalsContact CA-O 3.29Å; S356-I372 WeakPolarHBondContact CA-O 3.44Å
357	V	96.1	Very high	93.4	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.5	164	176.8	0	0	0	0	107.9	V349 S350 I372 L374 V378 I381 I392	V349-V357 HydrophobicContact CG1-CG1 3.39Å; S350-V357 CarbonylContact O-C 3.47Å; S350-V357 VanDerWaalsContact O-CA 3.26Å; S350-V357 WeakPolarHBondContact O-CA 3.49Å; V357-I372 HydrophobicContact CB-CB 4.26Å; V357-I372 PolarHBondContact N-O 3.47Å; V357-I372 PolarHBondContact O-N 3.01Å; V357-L374 HydrophobicContact CG2-CD1 4.06Å; V357-V378 HydrophobicContact CG2-CB 4.48Å; V357-V378 HydrophobicContact CG2-CG1 4Å; V357-V378 HydrophobicContact CG2-CG2 3.78Å; V357-I381 HydrophobicContact CB-CD1 4.41Å; V357-I381 HydrophobicContact CG1-CD1 3.79Å; V357-I381 HydrophobicContact CG2-CD1 3.74Å; V357-I392 HydrophobicContact CB-CD1 4.18Å; V357-I392 HydrophobicContact CG1-CD1 4.43Å; V357-I392 HydrophobicContact CG2-CD1 3.77Å; V357-I392 HydrophobicContact CG2-CG1 4.13Å; V357-I392 HydrophobicContact CG2-CG2 3.82Å
358	K	96.2	Very high	93.3	Very high	14 Å²	14	40.6 Å²	40.6	6%	0.061	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.6	-175.9	-65.9	175.3	-172.1	-85.8	0	109.7	G316 E319 V349 S350 S356 W360 A368 T370 T371	G316-K358 WeakPolarHBondContact O-CD 3.46Å; G316-K358 WeakPolarHBondContact O-CE 3.39Å; E319-K358 IonicContact OE1-NZ 3.05Å; E319-K358 PolarHBondContact OE1-NZ 3.45Å; V349-K358 CarbonylContact C-O 3.6Å; V349-K358 WeakPolarHBondContact CA-O 3.13Å; S350-K358 PolarHBondContact N-O 3.33Å; S350-K358 PolarHBondContact O-N 3.11Å; S356-K358 VanDerWaalsContact OG-CE 3.25Å; S356-K358 WeakPolarHBondContact OG-CE 3.38Å; K358-W360 HydrophobicContact CB-CZ2 3.54Å; K358-W360 HydrophobicContact CD-CH2 4.14Å; K358-W360 HydrophobicContact CD-CZ2 3.64Å; K358-W360 HydrophobicContact CG-CZ2 4.18Å; K358-W360 PolarHBondContact O-NE1 2.91Å; K358-A368 HydrophobicContact CB-CB 4.02Å; K358-A368 HydrophobicContact CG-CB 4.37Å; K358-T370 WeakPolarHBondContact CA-O 3.39Å; K358-T371 HydrophobicContact CG-CG2 4.18Å; K358-T371 PolarHBondContact NZ-OG1 2.87Å
359	V	96.3	Very high	93.2	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	134.2	176.7	-173.2	0	0	0	0	108	V349 A368 L369 T370 I390	V349-V359 HydrophobicContact CG2-CB 4.41Å; V349-V359 HydrophobicContact CG2-CG1 4.15Å; V349-V359 HydrophobicContact CG2-CG2 4.03Å; V359-A368 CarbonylContact O-C 3.57Å; V359-A368 WeakPolarHBondContact O-CA 3.34Å; V359-L369 PolarHBondContact O-N 3.36Å; V359-T370 PolarHBondContact N-O 3.32Å; V359-T370 PolarHBondContact O-N 3.13Å; V359-I390 HydrophobicContact CG2-CD1 4.11Å
360	W	96.3	Very high	93.1	Very high	15 Å²	15	46.5 Å²	46.5	6%	0.057	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	147.8	-171.8	-45.5	85.4	0	0	0	111.4	F299 G316 K347 I348 S350 K358 M365 A368	F299-W360 AromaticContact CE1-CE2 3.92Å; F299-W360 HydrophobicContact CE1-CZ2 4.08Å; F299-W360 AromaticContact CE1-NE1 3.77Å; F299-W360 AromaticContact CZ-CD1 3.83Å; F299-W360 HydrophobicContact CZ-CD2 4.11Å; F299-W360 AromaticContact CZ-CE2 3.78Å; F299-W360 HydrophobicContact CZ-CG 4.17Å; F299-W360 HydrophobicContact CZ-CZ2 4.33Å; F299-W360 AromaticContact CZ-NE1 3.57Å; G316-W360 VanDerWaalsContact CA-CH2 3.48Å; K347-W360 WeakPolarHBondContact CA-O 3.44Å; K347-W360 WeakPolarHBondContact CB-O 3.28Å; I348-W360 PolarHBondContact N-O 3.48Å; I348-W360 PolarHBondContact O-N 3.02Å; S350-W360 PolarHBondContact OG-NE1 3.37Å; K358-W360 HydrophobicContact CB-CZ2 3.54Å; K358-W360 HydrophobicContact CD-CH2 4.14Å; K358-W360 HydrophobicContact CD-CZ2 3.64Å; K358-W360 HydrophobicContact CG-CZ2 4.18Å; K358-W360 PolarHBondContact O-NE1 2.91Å; W360-M365 HydrophobicContact CB-CE 3.7Å; W360-M365 HydrophobicContact CB-SD 3.39Å; W360-M365 WeakPolarHBondContact CB-SD 3.32Å; W360-M365 HydrophobicContact CD2-CE 3.96Å; W360-M365 HydrophobicContact CE3-CE 4.1Å; W360-M365 HydrophobicContact CG-CE 3.8Å; W360-M365 HydrophobicContact CG-SD 4.14Å; W360-A368 HydrophobicContact CD2-CB 4.06Å; W360-A368 HydrophobicContact CE3-CB 3.87Å; W360-A368 HydrophobicContact CH2-CB 3.94Å; W360-A368 HydrophobicContact CZ2-CB 4.15Å; W360-A368 HydrophobicContact CZ3-CB 3.82Å; W360-A368 VanDerWaalsContact CZ3-N 3.34Å
361	D	94.4	Very high	93	Very high	39 Å²	39	48.9 Å²	48.9	21%	0.209	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	114.4	162.8	173	-0.7	0	0	0	108.3	R363 N364 M365 L369	D361-R363 PolarHBondContact O-N 2.83Å; D361-R363 WeakPolarHBondContact OD1-CA 3.42Å; D361-R363 WeakPolarHBondContact OD1-CB 3.24Å; D361-R363 WeakPolarHBondContact OD1-CG 3.33Å; D361-R363 PolarHBondContact OD1-N 2.94Å; D361-N364 CarbonylContact O-C 3.49Å; D361-N364 PolarHBondContact O-N 3.38Å; D361-M365 WeakPolarHBondContact O-CG 3.43Å; D361-M365 PolarHBondContact O-N 3.2Å; D361-L369 HydrophobicContact CB-CD1 4.14Å; D361-L369 HydrophobicContact CB-CD2 4.32Å; D361-L369 HydrophobicContact CB-CG 4.43Å
362	F	90.9	Very high	92.9	Very high	23 Å²	23	49.4 Å²	49.4	10%	0.101	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-4.5	-176.8	72.2	-112	0	0	0	114.7	L289 L301 F342 S345 D346 I348 M365	L289-F362 HydrophobicContact CD1-CD2 4.47Å; L289-F362 HydrophobicContact CD1-CE2 3.66Å; L289-F362 HydrophobicContact CD1-CZ 3.76Å; L301-F362 HydrophobicContact CD2-CB 4.15Å; L301-F362 HydrophobicContact CD2-CD2 4.23Å; L301-F362 HydrophobicContact CD2-CG 4.44Å; F342-F362 HydrophobicContact CD1-CD1 4.21Å; F342-F362 AromaticContact CD1-CE1 3.94Å; F342-F362 HydrophobicContact CD1-CE1 3.94Å; F342-F362 HydrophobicContact CE1-CD1 4.2Å; F342-F362 HydrophobicContact CE1-CE1 4.07Å; S345-F362 VanDerWaalsContact O-CZ 3.25Å; S345-F362 WeakPolarHBondContact O-CZ 3.45Å; D346-F362 WeakPolarHBondContact O-CD1 3.29Å; D346-F362 PolarHBondContact O-N 2.9Å; I348-F362 HydrophobicContact CD1-CB 3.65Å; I348-F362 HydrophobicContact CD1-CD1 4.24Å; I348-F362 HydrophobicContact CD1-CG 4.27Å; I348-F362 HydrophobicContact CG1-CB 4.15Å; I348-F362 HydrophobicContact CG1-CD1 3.97Å; I348-F362 HydrophobicContact CG1-CG 4.48Å; F362-M365 VanDerWaalsContact CA-SD 3.54Å; F362-M365 HydrophobicContact CB-SD 4.13Å
363	R	89.8	Confident	92.9	Very high	184 Å²	184	56.4 Å²	56.4	69%	0.694	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-21.2	166.5	-50.9	175.8	179.6	-170.9	-0.1	111.8	D361	D361-R363 PolarHBondContact O-N 2.83Å; D361-R363 WeakPolarHBondContact OD1-CA 3.42Å; D361-R363 WeakPolarHBondContact OD1-CB 3.24Å; D361-R363 WeakPolarHBondContact OD1-CG 3.33Å; D361-R363 PolarHBondContact OD1-N 2.94Å
364	N	88.6	Confident	92.9	Very high	82 Å²	82	55.9 Å²	55.9	44%	0.439	26%	0.258	S	S	.	.			trans	-147.6	73.4	-178	-175.7	17	0	0	0	112.6	D361 R366	D361-N364 CarbonylContact O-C 3.49Å; D361-N364 PolarHBondContact O-N 3.38Å; N364-R366 PolarHBondContact O-N 3.41Å; N364-R366 WeakPolarHBondContact OD1-CD 3.3Å; N364-R366 WeakPolarHBondContact OD1-CG 3.44Å
365	M	87.4	Confident	92.8	Very high	27 Å²	27	59 Å²	59	13%	0.133	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	22.8	-173.2	-65.9	-70.1	-72.1	0	0	115.3	F299 F314 W360 D361 F362 T367	F299-M365 HydrophobicContact CE2-CE 3.45Å; F299-M365 VanDerWaalsContact CE2-CE 3.45Å; F299-M365 HydrophobicContact CZ-CE 3.42Å; F299-M365 VanDerWaalsContact CZ-CE 3.42Å; F314-M365 HydrophobicContact CB-CE 4.14Å; F314-M365 HydrophobicContact CD1-CB 3.54Å; F314-M365 HydrophobicContact CD1-CE 3.87Å; F314-M365 HydrophobicContact CD1-CG 4.02Å; F314-M365 HydrophobicContact CD2-CE 3.55Å; F314-M365 HydrophobicContact CE1-CB 3.21Å; F314-M365 HydrophobicContact CE1-CE 4.16Å; F314-M365 HydrophobicContact CE1-CG 3.47Å; F314-M365 VanDerWaalsContact CE1-CG 3.47Å; F314-M365 HydrophobicContact CE2-CE 3.81Å; F314-M365 HydrophobicContact CE2-CG 4.11Å; F314-M365 HydrophobicContact CG-CB 4.42Å; F314-M365 HydrophobicContact CG-CE 3.55Å; F314-M365 HydrophobicContact CZ-CB 3.83Å; F314-M365 HydrophobicContact CZ-CE 4.11Å; F314-M365 HydrophobicContact CZ-CG 3.5Å; F314-M365 VanDerWaalsContact CZ-CG 3.5Å; W360-M365 HydrophobicContact CB-CE 3.7Å; W360-M365 HydrophobicContact CB-SD 3.39Å; W360-M365 WeakPolarHBondContact CB-SD 3.32Å; W360-M365 HydrophobicContact CD2-CE 3.96Å; W360-M365 HydrophobicContact CE3-CE 4.1Å; W360-M365 HydrophobicContact CG-CE 3.8Å; W360-M365 HydrophobicContact CG-SD 4.14Å; D361-M365 WeakPolarHBondContact O-CG 3.43Å; D361-M365 PolarHBondContact O-N 3.2Å; F362-M365 VanDerWaalsContact CA-SD 3.54Å; F362-M365 HydrophobicContact CB-SD 4.13Å; M365-T367 PolarHBondContact O-N 3.04Å
366	R	87.8	Confident	92.8	Very high	220 Å²	220	56 Å²	56	83%	0.83	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-33.8	-177.2	-69.5	178.5	-179	-176.3	1.4	113.2	N364	N364-R366 PolarHBondContact O-N 3.41Å; N364-R366 WeakPolarHBondContact OD1-CD 3.3Å; N364-R366 WeakPolarHBondContact OD1-CG 3.44Å
367	T	90.5	Very high	92.7	Very high	101 Å²	101	57.2 Å²	57.2	62%	0.62	27%	0.274	S	S	*	.	S	Bend	trans	-149.6	143.7	-178.3	50.7	0	0	0	0	109.4	M365 L369	M365-T367 PolarHBondContact O-N 3.04Å; T367-L369 PolarHBondContact O-N 2.98Å
368	A	93.5	Very high	92.7	Very high	25 Å²	25	57.2 Å²	57.2	21%	0.207	27%	0.274	C	S	.	.			trans	-62.2	133.5	169.4	0	0	0	0	0	110.1	K358 V359 W360 T370	K358-A368 HydrophobicContact CB-CB 4.02Å; K358-A368 HydrophobicContact CG-CB 4.37Å; V359-A368 CarbonylContact O-C 3.57Å; V359-A368 WeakPolarHBondContact O-CA 3.34Å; W360-A368 HydrophobicContact CD2-CB 4.06Å; W360-A368 HydrophobicContact CE3-CB 3.87Å; W360-A368 HydrophobicContact CH2-CB 3.94Å; W360-A368 HydrophobicContact CZ2-CB 4.15Å; W360-A368 HydrophobicContact CZ3-CB 3.82Å; W360-A368 VanDerWaalsContact CZ3-N 3.34Å; A368-T370 VanDerWaalsContact C-N 3.28Å
369	L	94.5	Very high	92.7	Very high	100 Å²	100	58 Å²	58	52%	0.524	28%	0.279	S	S	.	.	S	Bend	trans	-61.3	-40.9	172.3	-58.7	176.6	0	0	0	110.8	K347 V359 D361 T367	K347-L369 HydrophobicContact CG-CD1 4.43Å; V359-L369 PolarHBondContact O-N 3.36Å; D361-L369 HydrophobicContact CB-CD1 4.14Å; D361-L369 HydrophobicContact CB-CD2 4.32Å; D361-L369 HydrophobicContact CB-CG 4.43Å; T367-L369 PolarHBondContact O-N 2.98Å
370	T	95	Very high	92.7	Very high	24 Å²	24	59.2 Å²	59.2	15%	0.147	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	137.3	-178.6	-53.1	0	0	0	0	109	K358 V359 A368 I372 L404 A405	K358-T370 WeakPolarHBondContact CA-O 3.39Å; V359-T370 PolarHBondContact N-O 3.32Å; V359-T370 PolarHBondContact O-N 3.13Å; A368-T370 VanDerWaalsContact C-N 3.28Å; T370-I372 HydrophobicContact CG2-CD1 4.39Å; T370-I372 HydrophobicContact CG2-CG1 3.79Å; T370-L404 WeakPolarHBondContact CB-O 3.32Å; T370-L404 PolarHBondContact OG1-O 3Å; T370-A405 VanDerWaalsContact CG2-C 3.47Å; T370-A405 WeakPolarHBondContact CG2-O 3.48Å
371	T	95.2	Very high	92.8	Very high	50 Å²	50	58.7 Å²	58.7	31%	0.307	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.1	164.6	-66.8	0	0	0	0	109.4	K358 R373	K358-T371 HydrophobicContact CG-CG2 4.18Å; K358-T371 PolarHBondContact NZ-OG1 2.87Å; T371-R373 HydrophobicContact CG2-CG 4.29Å
372	I	94.7	Very high	92.9	Very high	11 Å²	11	57.5 Å²	57.5	6%	0.056	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	111.7	-178.4	-49.9	178.3	0	0	0	107.9	S356 V357 T370 L374 I390 C402	S356-I372 CarbonylContact C-O 3.12Å; S356-I372 VanDerWaalsContact CA-O 3.29Å; S356-I372 WeakPolarHBondContact CA-O 3.44Å; V357-I372 HydrophobicContact CB-CB 4.26Å; V357-I372 PolarHBondContact N-O 3.47Å; V357-I372 PolarHBondContact O-N 3.01Å; T370-I372 HydrophobicContact CG2-CD1 4.39Å; T370-I372 HydrophobicContact CG2-CG1 3.79Å; I372-L374 HydrophobicContact CG2-CD2 4.26Å; I372-I390 HydrophobicContact CD1-CD1 3.98Å; I372-C402 VanDerWaalsContact CD1-SG 3.56Å
373	R	93.6	Very high	93.1	Very high	147 Å²	147	57.6 Å²	57.6	56%	0.555	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	140	179.2	-66.7	-173.2	177.1	92.2	9.4	112.7	E319 T371	E319-R373 VanDerWaalsContact CD-NH2 3.26Å; E319-R373 IonicContact OE1-CZ 3.65Å; E319-R373 IonicContact OE1-NE 3.71Å; E319-R373 IonicContact OE1-NH2 2.81Å; E319-R373 PolarHBondContact OE1-NH2 2.91Å; E319-R373 IonicContact OE2-CZ 3.86Å; E319-R373 VanDerWaalsContact OE2-CZ 3.32Å; E319-R373 IonicContact OE2-NE 2.72Å; E319-R373 PolarHBondContact OE2-NE 2.98Å; E319-R373 IonicContact OE2-NH2 3.51Å; E319-R373 PolarHBondContact OE2-NH2 3.07Å; T371-R373 HydrophobicContact CG2-CG 4.29Å
374	L	92.3	Very high	93.3	Very high	25 Å²	25	48.8 Å²	48.8	13%	0.131	25%	0.245	C	C	.	.			trans	-128.5	170.7	-170.6	-55.8	172.1	0	0	0	111.2	R355 V357 I372 V378 I392	R355-L374 HydrophobicContact CB-CB 4.49Å; R355-L374 VanDerWaalsContact O-CB 3.3Å; R355-L374 WeakPolarHBondContact O-CB 3.24Å; R355-L374 PolarHBondContact O-N 2.93Å; V357-L374 HydrophobicContact CG2-CD1 4.06Å; I372-L374 HydrophobicContact CG2-CD2 4.26Å; L374-V378 HydrophobicContact CD1-CG2 3.43Å; L374-V378 VanDerWaalsContact CD1-CG2 3.43Å; L374-I392 HydrophobicContact CD1-CD1 4.41Å; L374-I392 HydrophobicContact CD1-CG2 3.74Å
375	D	89.6	Confident	93.1	Very high	74 Å²	74	53.7 Å²	53.7	40%	0.396	26%	0.257	S	S	.	.	S	Bend	trans	-95.2	-5.9	-179.1	53.3	-6.8	0	0	0	113.5	N396 R400	D375-N396 PolarHBondContact OD1-ND2 3.25Å; D375-N396 PolarHBondContact OD2-ND2 3.27Å; D375-R400 IonicContact OD1-CZ 3.27Å; D375-R400 IonicContact OD1-NE 3.84Å; D375-R400 IonicContact OD1-NH2 3.09Å; D375-R400 PolarHBondContact OD1-NH2 2.95Å; D375-R400 IonicContact OD2-CZ 3.16Å; D375-R400 IonicContact OD2-NH2 2.81Å; D375-R400 PolarHBondContact OD2-NH2 2.9Å
376	S	91.9	Very high	93	Very high	13 Å²	13	56 Å²	56	9%	0.091	28%	0.277	C	S	.	.	S	Bend	trans	-152.8	157	-172.9	-172.7	0	0	0	0	110.5	N396	S376-N396 VanDerWaalsContact CB-CG 3.42Å; S376-N396 WeakPolarHBondContact CB-ND2 3.3Å; S376-N396 PolarHBondContact OG-N 3.06Å; S376-N396 VanDerWaalsContact OG-N 3.13Å
377	S	92.7	Very high	92.9	Very high	26 Å²	26	49 Å²	49	18%	0.182	26%	0.256	C	S	.	.			trans	-52.9	144.6	175.3	-40.7	0	0	0	0	112	T394 D395	S377-T394 VanDerWaalsContact O-CA 3.27Å; S377-T394 WeakPolarHBondContact O-CA 3.18Å; S377-T394 WeakPolarHBondContact O-CB 3.32Å; S377-T394 WeakPolarHBondContact O-CG2 3.5Å; S377-D395 VanDerWaalsContact CB-OD2 3.25Å; S377-D395 WeakPolarHBondContact CB-OD2 3.33Å; S377-D395 PolarHBondContact O-N 2.96Å; S377-D395 PolarHBondContact OG-OD2 2.9Å
378	V	95.1	Very high	92.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-95.6	133.7	-179.9	179.3	0	0	0	0	110.4	T338 S352 V357 L374 I381 I392	T338-V378 VanDerWaalsContact CB-O 3.25Å; T338-V378 WeakPolarHBondContact CB-O 3.19Å; T338-V378 WeakPolarHBondContact CG2-O 3.49Å; T338-V378 PolarHBondContact OG1-O 3.36Å; S352-V378 WeakPolarHBondContact O-CB 3.34Å; S352-V378 PolarHBondContact O-N 2.85Å; S352-V378 VanDerWaalsContact O-N 3.12Å; V357-V378 HydrophobicContact CG2-CB 4.48Å; V357-V378 HydrophobicContact CG2-CG1 4Å; V357-V378 HydrophobicContact CG2-CG2 3.78Å; L374-V378 HydrophobicContact CD1-CG2 3.43Å; L374-V378 VanDerWaalsContact CD1-CG2 3.43Å; V378-I381 HydrophobicContact CG1-CD1 3.85Å; V378-I381 HydrophobicContact CG1-CG1 3.71Å; V378-I392 HydrophobicContact CB-CG2 4.35Å; V378-I392 HydrophobicContact CG1-CG2 3.61Å; V378-I392 HydrophobicContact CG2-CG2 3.94Å
379	N	96.2	Very high	92.9	Very high	30 Å²	30	44.5 Å²	44.5	16%	0.16	23%	0.228	C	C	.	.			trans	-101.5	-146.7	174.5	-64.1	-35.2	0	0	0	110.6	S339 I381 P393 D395 V424 C425	S339-N379 PolarHBondContact OG-O 3.14Å; N379-I381 PolarHBondContact O-N 3.4Å; N379-I381 VanDerWaalsContact O-N 3.1Å; N379-P393 HydrophobicContact CB-CG 4.21Å; N379-P393 PolarHBondContact N-O 3.09Å; N379-D395 PolarHBondContact ND2-OD1 2.84Å; N379-V424 WeakPolarHBondContact CB-O 3.27Å; N379-V424 PolarHBondContact ND2-O 2.86Å; N379-C425 VanDerWaalsContact CB-O 3.29Å; N379-C425 WeakPolarHBondContact CB-O 3.25Å
380	R	97.5	Very high	93	Very high	27 Å²	27	39.7 Å²	39.7	10%	0.102	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-80.2	98.7	-169.8	-152.2	-178	-56.3	-86.6	27.2	112.6	H106 V237 N279 H280 P393 C425 C426 C427	H106-R380 VanDerWaalsContact CD2-CD 3.45Å; H106-R380 WeakPolarHBondContact CD2-CD 3.47Å; H106-R380 PolarHBondContact CD2-NE 2.96Å; V237-R380 PolarHBondContact O-NH2 3.42Å; N279-R380 PolarHBondContact O-NH1 2.8Å; H280-R380 PolarHBondContact CD2-NH1 3.2Å; R380-P393 VanDerWaalsContact O-CG 3.25Å; R380-P393 WeakPolarHBondContact O-CG 3.43Å; R380-C425 WeakPolarHBondContact CB-O 3.49Å; R380-C425 PolarHBondContact N-O 2.64Å; R380-C426 HydrophobicContact CB-CB 4Å; R380-C427 PolarHBondContact O-N 3.16Å
381	I	97.6	Very high	93.1	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	20%	0.196	C	C	.	.			trans	-60.6	146.3	179.2	-65.4	169.6	0	0	0	111.5	S339 V341 V349 V357 V378 N379 I383 I390 A391 I392	S339-I381 WeakPolarHBondContact OG-CG1 3.38Å; S339-I381 PolarHBondContact OG-N 2.78Å; V341-I381 HydrophobicContact CG2-CG2 4.17Å; V349-I381 HydrophobicContact CG1-CD1 4.26Å; V357-I381 HydrophobicContact CB-CD1 4.41Å; V357-I381 HydrophobicContact CG1-CD1 3.79Å; V357-I381 HydrophobicContact CG2-CD1 3.74Å; V378-I381 HydrophobicContact CG1-CD1 3.85Å; V378-I381 HydrophobicContact CG1-CG1 3.71Å; N379-I381 PolarHBondContact O-N 3.4Å; N379-I381 VanDerWaalsContact O-N 3.1Å; I381-I383 HydrophobicContact CG2-CD1 4.32Å; I381-I383 HydrophobicContact CG2-CG1 4Å; I381-I390 HydrophobicContact CG2-CG2 3.48Å; I381-I390 VanDerWaalsContact CG2-CG2 3.48Å; I381-A391 WeakPolarHBondContact CA-O 3.21Å; I381-I392 HydrophobicContact CG1-CG2 4.44Å
382	A	97.1	Very high	93.2	Very high	15 Å²	15	36.2 Å²	36.2	12%	0.124	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	153.7	163	0	0	0	0	0	111.8	A391 C427 W429	A382-A391 PolarHBondContact N-O 3.42Å; A382-A391 PolarHBondContact O-N 3.38Å; A382-C427 HydrophobicContact CB-CB 3.95Å; A382-C427 WeakPolarHBondContact CB-O 3.45Å; A382-W429 PolarHBondContact O-NE1 3.34Å
383	I	95.3	Very high	93.3	Very high	24 Å²	24	35.7 Å²	35.7	12%	0.123	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130.5	-172.8	-57.4	-175.4	0	0	0	110.3	V341 V343 V349 I381 R385 I389 I390	V341-I383 HydrophobicContact CG2-CD1 3.56Å; V341-I383 HydrophobicContact CG2-CG1 4.05Å; V343-I383 HydrophobicContact CG1-CG2 4.21Å; V343-I383 HydrophobicContact CG2-CB 4.35Å; V343-I383 HydrophobicContact CG2-CD1 3.26Å; V343-I383 HydrophobicContact CG2-CG1 4.34Å; V343-I383 HydrophobicContact CG2-CG2 3.97Å; V349-I383 HydrophobicContact CB-CD1 3.64Å; V349-I383 HydrophobicContact CG1-CD1 4.12Å; V349-I383 HydrophobicContact CG2-CD1 3.5Å; I381-I383 HydrophobicContact CG2-CD1 4.32Å; I381-I383 HydrophobicContact CG2-CG1 4Å; I383-R385 PolarHBondContact O-N 3.47Å; I383-I389 WeakPolarHBondContact CA-O 3.47Å; I383-I390 HydrophobicContact CD1-CG1 4.21Å; I383-I390 HydrophobicContact CD1-CG2 4.34Å; I383-I390 HydrophobicContact CG1-CB 4.47Å; I383-I390 HydrophobicContact CG1-CG1 4.4Å; I383-I390 HydrophobicContact CG1-CG2 4.18Å
384	S	93.2	Very high	93.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.			trans	-66.6	116.3	172.4	172.3	0	0	0	0	108.7	S386 N387 G388 I389 D431	S384-S386 VanDerWaalsContact C-N 3.29Å; S384-S386 PolarHBondContact O-N 3.16Å; S384-S386 PolarHBondContact OG-OG 3.26Å; S384-N387 WeakPolarHBondContact OG-CB 3.46Å; S384-N387 PolarHBondContact OG-N 2.83Å; S384-N387 PolarHBondContact OG-ND2 3.39Å; S384-G388 WeakPolarHBondContact O-CA 2.98Å; S384-G388 PolarHBondContact O-N 3.26Å; S384-I389 PolarHBondContact N-O 2.93Å; S384-D431 WeakPolarHBondContact CA-OD1 3.44Å; S384-D431 WeakPolarHBondContact CB-OD1 3.19Å; S384-D431 PolarHBondContact OG-OD1 3.29Å
385	R	84.6	Confident	93.4	Very high	184 Å²	184	30.2 Å²	30.2	69%	0.694	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.8	-180	-62.8	179.1	178.3	178.3	-1.8	111.2	I383 D431	I383-R385 PolarHBondContact O-N 3.47Å; R385-D431 WeakPolarHBondContact CB-OD2 3.32Å; R385-D431 PolarHBondContact N-OD2 3.12Å
386	S	85.8	Confident	93.4	Very high	77 Å²	77	28.9 Å²	28.9	54%	0.538	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-35.7	179.7	56.2	0	0	0	0	113.7	S384 D431	S384-S386 VanDerWaalsContact C-N 3.29Å; S384-S386 PolarHBondContact O-N 3.16Å; S384-S386 PolarHBondContact OG-OG 3.26Å; S386-D431 WeakPolarHBondContact OG-CB 3.49Å; S386-D431 VanDerWaalsContact OG-CG 3.31Å; S386-D431 PolarHBondContact OG-OD1 3.28Å
387	N	86	Confident	93.5	Very high	73 Å²	73	35 Å²	35	39%	0.39	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-9.9	-172.5	-55.9	-77.3	0	0	0	114.8	S384 I389	S384-N387 WeakPolarHBondContact OG-CB 3.46Å; S384-N387 PolarHBondContact OG-N 2.83Å; S384-N387 PolarHBondContact OG-ND2 3.39Å; N387-I389 HydrophobicContact CB-CB 4.49Å; N387-I389 HydrophobicContact CB-CD1 3.71Å; N387-I389 HydrophobicContact CB-CG1 3.91Å; N387-I389 PolarHBondContact O-N 3.3Å
388	G	90.4	Very high	93.5	Very high	17 Å²	17	34.5 Å²	34.5	18%	0.175	17%	0.169	C	C	.	.			trans	66.2	25.8	-174.8	0	0	0	0	0	113.7	S384 L404	S384-G388 WeakPolarHBondContact O-CA 2.98Å; S384-G388 PolarHBondContact O-N 3.26Å; G388-L404 WeakPolarHBondContact O-CG 3.49Å
389	I	93.7	Very high	93.4	Very high	13 Å²	13	34.6 Å²	34.6	7%	0.067	17%	0.17	C	C	.	.			trans	-95.8	125.3	-176.1	-67	170.8	0	0	0	110.2	I383 S384 N387 L401 C402 I409 W429 M454	I383-I389 WeakPolarHBondContact CA-O 3.47Å; S384-I389 PolarHBondContact N-O 2.93Å; N387-I389 HydrophobicContact CB-CB 4.49Å; N387-I389 HydrophobicContact CB-CD1 3.71Å; N387-I389 HydrophobicContact CB-CG1 3.91Å; N387-I389 PolarHBondContact O-N 3.3Å; I389-L401 HydrophobicContact CG2-CB 4.34Å; I389-C402 CarbonylContact C-O 3.43Å; I389-C402 WeakPolarHBondContact CA-O 3.36Å; I389-I409 HydrophobicContact CB-CD1 4.37Å; I389-I409 HydrophobicContact CD1-CD1 3.59Å; I389-I409 HydrophobicContact CG1-CD1 3.58Å; I389-I409 HydrophobicContact CG2-CD1 3.93Å; I389-W429 HydrophobicContact CB-CZ2 4.32Å; I389-W429 HydrophobicContact CG2-CH2 4.01Å; I389-W429 HydrophobicContact CG2-CZ2 3.72Å; I389-W429 PolarHBondContact O-NE1 3.25Å; I389-M454 HydrophobicContact CD1-CE 3.54Å; I389-M454 HydrophobicContact CD1-SD 3.37Å; I389-M454 WeakPolarHBondContact CD1-SD 3.29Å
390	I	96.5	Very high	93.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	123.3	177	-43.7	174.6	0	0	0	108.8	V349 V359 I372 I381 I383 I392 L401 C402 L404	V349-I390 HydrophobicContact CG1-CD1 4.17Å; V349-I390 HydrophobicContact CG1-CG2 4.45Å; V349-I390 HydrophobicContact CG2-CD1 4.38Å; V359-I390 HydrophobicContact CG2-CD1 4.11Å; I372-I390 HydrophobicContact CD1-CD1 3.98Å; I381-I390 HydrophobicContact CG2-CG2 3.48Å; I381-I390 VanDerWaalsContact CG2-CG2 3.48Å; I383-I390 HydrophobicContact CD1-CG1 4.21Å; I383-I390 HydrophobicContact CD1-CG2 4.34Å; I383-I390 HydrophobicContact CG1-CB 4.47Å; I383-I390 HydrophobicContact CG1-CG1 4.4Å; I383-I390 HydrophobicContact CG1-CG2 4.18Å; I390-I392 HydrophobicContact CB-CG1 4.32Å; I390-I392 HydrophobicContact CG2-CD1 4.16Å; I390-I392 HydrophobicContact CG2-CG1 3.56Å; I390-L401 WeakPolarHBondContact O-CA 3.11Å; I390-C402 PolarHBondContact N-O 2.92Å; I390-C402 PolarHBondContact O-N 2.89Å; I390-C402 VanDerWaalsContact O-N 3.15Å; I390-L404 HydrophobicContact CD1-CD2 4.07Å; I390-L404 HydrophobicContact CG1-CD2 3.93Å
391	A	97.1	Very high	93.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	115.3	165.2	0	0	0	0	0	109.2	I381 A382 P393 T399 L401 C427 W429 L438	I381-A391 WeakPolarHBondContact CA-O 3.21Å; A382-A391 PolarHBondContact N-O 3.42Å; A382-A391 PolarHBondContact O-N 3.38Å; A391-P393 WeakPolarHBondContact O-CD 3.31Å; A391-T399 HydrophobicContact CB-CG2 4.14Å; A391-L401 HydrophobicContact CB-CD2 3.69Å; A391-C427 HydrophobicContact CB-CB 3.91Å; A391-W429 HydrophobicContact CB-CZ2 3.88Å; A391-L438 HydrophobicContact CB-CD1 3.9Å; A391-L438 HydrophobicContact CB-CD2 4.49Å
392	I	97.3	Very high	93	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	98	-174	-51	169	0	0	0	109.1	V357 L374 V378 I381 I390 T394 T399 R400 C402	V357-I392 HydrophobicContact CB-CD1 4.18Å; V357-I392 HydrophobicContact CG1-CD1 4.43Å; V357-I392 HydrophobicContact CG2-CD1 3.77Å; V357-I392 HydrophobicContact CG2-CG1 4.13Å; V357-I392 HydrophobicContact CG2-CG2 3.82Å; L374-I392 HydrophobicContact CD1-CD1 4.41Å; L374-I392 HydrophobicContact CD1-CG2 3.74Å; V378-I392 HydrophobicContact CB-CG2 4.35Å; V378-I392 HydrophobicContact CG1-CG2 3.61Å; V378-I392 HydrophobicContact CG2-CG2 3.94Å; I381-I392 HydrophobicContact CG1-CG2 4.44Å; I390-I392 HydrophobicContact CB-CG1 4.32Å; I390-I392 HydrophobicContact CG2-CD1 4.16Å; I390-I392 HydrophobicContact CG2-CG1 3.56Å; I392-T394 HydrophobicContact CG2-CG2 4.33Å; I392-T399 CarbonylContact O-C 3.51Å; I392-T399 VanDerWaalsContact O-CA 3.31Å; I392-T399 WeakPolarHBondContact O-CA 3.4Å; I392-R400 PolarHBondContact N-O 3Å; I392-R400 PolarHBondContact O-N 2.87Å; I392-C402 VanDerWaalsContact CD1-SG 3.53Å
393	P	96.9	Very high	92.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	145.7	172.1	30.9	-31.8	0	0	0	111.1	N379 R380 A391 V424	N379-P393 HydrophobicContact CB-CG 4.21Å; N379-P393 PolarHBondContact N-O 3.09Å; R380-P393 VanDerWaalsContact O-CG 3.25Å; R380-P393 WeakPolarHBondContact O-CG 3.43Å; A391-P393 WeakPolarHBondContact O-CD 3.31Å; P393-V424 HydrophobicContact CB-CB 3.74Å; P393-V424 HydrophobicContact CB-CG1 3.58Å
394	T	95	Very high	92.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	157.2	-174.9	54.3	0	0	0	0	113.3	S377 I392 N396 R397 Q398 V424	S377-T394 VanDerWaalsContact O-CA 3.27Å; S377-T394 WeakPolarHBondContact O-CA 3.18Å; S377-T394 WeakPolarHBondContact O-CB 3.32Å; S377-T394 WeakPolarHBondContact O-CG2 3.5Å; I392-T394 HydrophobicContact CG2-CG2 4.33Å; T394-N396 PolarHBondContact O-N 3.31Å; T394-N396 PolarHBondContact OG1-OD1 2.93Å; T394-R397 PolarHBondContact O-N 3.07Å; T394-Q398 PolarHBondContact N-O 3.17Å; T394-Q398 PolarHBondContact OG1-O 2.81Å; T394-Q398 VanDerWaalsContact OG1-O 3.12Å; T394-V424 PolarHBondContact O-N 3.41Å
395	D	92	Very high	92.8	Very high	56 Å²	56	39.8 Å²	39.8	30%	0.299	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.5	-179.7	-69.3	-19.7	0	0	0	113.8	S377 N379 R397	S377-D395 VanDerWaalsContact CB-OD2 3.25Å; S377-D395 WeakPolarHBondContact CB-OD2 3.33Å; S377-D395 PolarHBondContact O-N 2.96Å; S377-D395 PolarHBondContact OG-OD2 2.9Å; N379-D395 PolarHBondContact ND2-OD1 2.84Å; D395-R397 PolarHBondContact O-N 2.85Å
396	N	90.7	Very high	93.2	Very high	47 Å²	47	32 Å²	32	25%	0.251	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	25.6	175.8	73.4	3.8	0	0	0	114.7	D375 S376 T394 Q398	D375-N396 PolarHBondContact OD1-ND2 3.25Å; D375-N396 PolarHBondContact OD2-ND2 3.27Å; S376-N396 VanDerWaalsContact CB-CG 3.42Å; S376-N396 WeakPolarHBondContact CB-ND2 3.3Å; S376-N396 PolarHBondContact OG-N 3.06Å; S376-N396 VanDerWaalsContact OG-N 3.13Å; T394-N396 PolarHBondContact O-N 3.31Å; T394-N396 PolarHBondContact OG1-OD1 2.93Å; N396-Q398 VanDerWaalsContact C-N 3.32Å; N396-Q398 PolarHBondContact ND2-NE2 3.18Å; N396-Q398 WeakPolarHBondContact O-CG 3.47Å; N396-Q398 PolarHBondContact O-N 3.16Å; N396-Q398 PolarHBondContact O-NE2 3.04Å; N396-Q398 WeakPolarHBondContact OD1-CB 3.18Å; N396-Q398 VanDerWaalsContact OD1-CD 3.25Å; N396-Q398 PolarHBondContact OD1-NE2 3.12Å
397	R	92.7	Very high	93.5	Very high	141 Å²	141	32.2 Å²	32.2	53%	0.532	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	27.6	170.7	-37.5	-179.8	-175.1	174	1.9	114.1	T394 D395 H421 R422	T394-R397 PolarHBondContact O-N 3.07Å; D395-R397 PolarHBondContact O-N 2.85Å; R397-H421 WeakPolarHBondContact CD-O 3.27Å; R397-H421 PolarHBondContact NE-O 2.91Å; R397-H421 PolarHBondContact NH1-O 3.39Å; R397-R422 WeakPolarHBondContact CB-O 3.5Å; R397-R422 WeakPolarHBondContact CG-O 3.16Å
398	Q	92.2	Very high	93.8	Very high	16 Å²	16	36.9 Å²	36.9	8%	0.075	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	157.6	-174.1	-64.5	162.2	50.9	0	0	111.4	T394 N396 R411 L412	T394-Q398 PolarHBondContact N-O 3.17Å; T394-Q398 PolarHBondContact OG1-O 2.81Å; T394-Q398 VanDerWaalsContact OG1-O 3.12Å; N396-Q398 VanDerWaalsContact C-N 3.32Å; N396-Q398 PolarHBondContact ND2-NE2 3.18Å; N396-Q398 WeakPolarHBondContact O-CG 3.47Å; N396-Q398 PolarHBondContact O-N 3.16Å; N396-Q398 PolarHBondContact O-NE2 3.04Å; N396-Q398 WeakPolarHBondContact OD1-CB 3.18Å; N396-Q398 VanDerWaalsContact OD1-CD 3.25Å; N396-Q398 PolarHBondContact OD1-NE2 3.12Å; Q398-R411 HydrophobicContact CG-CG 4.49Å; Q398-R411 VanDerWaalsContact OE1-CD 3.28Å; Q398-L412 VanDerWaalsContact CA-O 3.3Å; Q398-L412 WeakPolarHBondContact CA-O 3.46Å
399	T	94.2	Very high	93.7	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	121.6	161	-52.9	0	0	0	0	108.2	A391 I392 L401 R411 L412 C427 T440	A391-T399 HydrophobicContact CB-CG2 4.14Å; I392-T399 CarbonylContact O-C 3.51Å; I392-T399 VanDerWaalsContact O-CA 3.31Å; I392-T399 WeakPolarHBondContact O-CA 3.4Å; T399-L401 HydrophobicContact CG2-CD2 4.11Å; T399-R411 CarbonylContact O-C 3.56Å; T399-R411 WeakPolarHBondContact O-CA 3.48Å; T399-L412 HydrophobicContact CG2-CD1 4.43Å; T399-L412 PolarHBondContact N-O 2.68Å; T399-L412 PolarHBondContact O-N 3.2Å; T399-C427 WeakPolarHBondContact CG2-SG 3.37Å; T399-T440 HydrophobicContact CG2-CG2 4.27Å; T399-T440 WeakPolarHBondContact OG1-CG2 3.33Å
400	R	94	Very high	93.5	Very high	40 Å²	40	37.8 Å²	37.8	15%	0.151	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	136.5	177.5	-71	168.1	170.7	-131.4	0.4	109.4	D375 I392	D375-R400 IonicContact OD1-CZ 3.27Å; D375-R400 IonicContact OD1-NE 3.84Å; D375-R400 IonicContact OD1-NH2 3.09Å; D375-R400 PolarHBondContact OD1-NH2 2.95Å; D375-R400 IonicContact OD2-CZ 3.16Å; D375-R400 IonicContact OD2-NH2 2.81Å; D375-R400 PolarHBondContact OD2-NH2 2.9Å; I392-R400 PolarHBondContact N-O 3Å; I392-R400 PolarHBondContact O-N 2.87Å
401	L	95.1	Very high	93.1	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130	177.8	-53.2	-170	0	0	0	109.9	I389 I390 A391 T399 I409 T410 W429 L438 V452	I389-L401 HydrophobicContact CG2-CB 4.34Å; I390-L401 WeakPolarHBondContact O-CA 3.11Å; A391-L401 HydrophobicContact CB-CD2 3.69Å; T399-L401 HydrophobicContact CG2-CD2 4.11Å; L401-I409 HydrophobicContact CB-CB 4.32Å; L401-I409 PolarHBondContact O-N 3.46Å; L401-T410 HydrophobicContact CB-CG2 4.16Å; L401-T410 HydrophobicContact CD1-CG2 3.75Å; L401-T410 HydrophobicContact CG-CG2 4.11Å; L401-T410 PolarHBondContact N-O 3.17Å; L401-T410 PolarHBondContact O-N 2.94Å; L401-W429 HydrophobicContact CD1-CH2 4.19Å; L401-W429 HydrophobicContact CD2-CH2 4.47Å; L401-W429 HydrophobicContact CD2-CZ2 4.1Å; L401-L438 HydrophobicContact CD1-CD2 4.05Å; L401-L438 HydrophobicContact CD2-CD2 3.79Å; L401-V452 HydrophobicContact CD1-CB 4.37Å; L401-V452 HydrophobicContact CD1-CG1 3.71Å; L401-V452 HydrophobicContact CD1-CG2 3.68Å
402	C	94	Very high	92.6	Very high	4 Å²	4	43 Å²	43	3%	0.027	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	160.6	178	55.8	0	0	0	0	111.8	I372 I389 I390 I392 T407	I372-C402 VanDerWaalsContact CD1-SG 3.56Å; I389-C402 CarbonylContact C-O 3.43Å; I389-C402 WeakPolarHBondContact CA-O 3.36Å; I390-C402 PolarHBondContact N-O 2.92Å; I390-C402 PolarHBondContact O-N 2.89Å; I390-C402 VanDerWaalsContact O-N 3.15Å; I392-C402 VanDerWaalsContact CD1-SG 3.53Å; C402-T407 WeakPolarHBondContact CA-O 3.11Å; C402-T407 WeakPolarHBondContact CB-O 3.29Å
403	D	93.5	Very high	91.8	Very high	48 Å²	48	43.7 Å²	43.7	26%	0.257	22%	0.218	S	C	.	.			trans	-79.5	177.3	170	67	19.9	0	0	0	112.1	A405 G406 T407	D403-A405 PolarHBondContact O-N 2.85Å; D403-A405 VanDerWaalsContact OD1-C 3.29Å; D403-A405 VanDerWaalsContact OD1-CA 3.31Å; D403-A405 WeakPolarHBondContact OD1-CA 3.29Å; D403-A405 WeakPolarHBondContact OD1-CB 3.35Å; D403-A405 PolarHBondContact OD1-N 2.8Å; D403-G406 PolarHBondContact O-N 3.09Å; D403-G406 VanDerWaalsContact O-N 3.12Å; D403-G406 PolarHBondContact OD1-N 2.78Å; D403-T407 VanDerWaalsContact CG-CB 3.48Å; D403-T407 PolarHBondContact N-O 2.91Å; D403-T407 VanDerWaalsContact N-O 3.12Å; D403-T407 WeakPolarHBondContact OD1-CB 3.38Å; D403-T407 PolarHBondContact OD1-N 2.9Å; D403-T407 PolarHBondContact OD1-OG1 2.88Å; D403-T407 WeakPolarHBondContact OD2-CB 3.32Å; D403-T407 PolarHBondContact OD2-OG1 3.14Å
404	L	93.8	Very high	90.3	Very high	43 Å²	43	46 Å²	46	23%	0.225	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-17.8	175.5	-56.5	-179.3	0	0	0	113.9	V343 K347 V349 T370 G388 I390 G406	V343-L404 HydrophobicContact CG1-CD1 3.93Å; V343-L404 HydrophobicContact CG1-CD2 4.18Å; V343-L404 HydrophobicContact CG2-CD2 4.47Å; K347-L404 HydrophobicContact CD-CD1 4.3Å; V349-L404 HydrophobicContact CG2-CD2 4.37Å; T370-L404 WeakPolarHBondContact CB-O 3.32Å; T370-L404 PolarHBondContact OG1-O 3Å; G388-L404 WeakPolarHBondContact O-CG 3.49Å; I390-L404 HydrophobicContact CD1-CD2 4.07Å; I390-L404 HydrophobicContact CG1-CD2 3.93Å; L404-G406 VanDerWaalsContact C-N 3.31Å
405	A	94.2	Very high	89	Confident	71 Å²	71	50 Å²	50	59%	0.587	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-5.1	174.5	0	0	0	0	0	112.5	T370 D403	T370-A405 VanDerWaalsContact CG2-C 3.47Å; T370-A405 WeakPolarHBondContact CG2-O 3.48Å; D403-A405 PolarHBondContact O-N 2.85Å; D403-A405 VanDerWaalsContact OD1-C 3.29Å; D403-A405 VanDerWaalsContact OD1-CA 3.31Å; D403-A405 WeakPolarHBondContact OD1-CA 3.29Å; D403-A405 WeakPolarHBondContact OD1-CB 3.35Å; D403-A405 PolarHBondContact OD1-N 2.8Å
406	G	91.9	Very high	87.6	Confident	21 Å²	21	52.9 Å²	52.9	22%	0.216	28%	0.283	C	S	.	.			trans	86.2	6.7	-179.1	0	0	0	0	0	114.5	D403 L404 R408	D403-G406 PolarHBondContact O-N 3.09Å; D403-G406 VanDerWaalsContact O-N 3.12Å; D403-G406 PolarHBondContact OD1-N 2.78Å; L404-G406 VanDerWaalsContact C-N 3.31Å; G406-R408 PolarHBondContact O-N 2.8Å
407	T	93.3	Very high	86.7	Confident	82 Å²	82	61.8 Å²	61.8	50%	0.503	31%	0.313	S	S	.	.			trans	-64.3	123.8	174.2	-41	0	0	0	0	109.3	C402 D403 I409	C402-T407 WeakPolarHBondContact CA-O 3.11Å; C402-T407 WeakPolarHBondContact CB-O 3.29Å; D403-T407 VanDerWaalsContact CG-CB 3.48Å; D403-T407 PolarHBondContact N-O 2.91Å; D403-T407 VanDerWaalsContact N-O 3.12Å; D403-T407 WeakPolarHBondContact OD1-CB 3.38Å; D403-T407 PolarHBondContact OD1-N 2.9Å; D403-T407 PolarHBondContact OD1-OG1 2.88Å; D403-T407 WeakPolarHBondContact OD2-CB 3.32Å; D403-T407 PolarHBondContact OD2-OG1 3.14Å; T407-I409 PolarHBondContact O-N 2.87Å
408	R	91.1	Very high	85.9	Confident	171 Å²	171	62.9 Å²	62.9	65%	0.645	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	122.3	179.7	-63.3	177.5	178.9	176.6	-0.9	110	G406	G406-R408 PolarHBondContact O-N 2.8Å
409	I	88.5	Confident	85.7	Confident	32 Å²	32	62.6 Å²	62.6	16%	0.164	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-52.5	-179.1	-63.7	172.4	0	0	0	110.7	R90 I389 L401 T407	R90-I409 PolarHBondContact NH1-O 2.76Å; I389-I409 HydrophobicContact CB-CD1 4.37Å; I389-I409 HydrophobicContact CD1-CD1 3.59Å; I389-I409 HydrophobicContact CG1-CD1 3.58Å; I389-I409 HydrophobicContact CG2-CD1 3.93Å; L401-I409 HydrophobicContact CB-CB 4.32Å; L401-I409 PolarHBondContact O-N 3.46Å; T407-I409 PolarHBondContact O-N 2.87Å
410	T	89.7	Confident	85.7	Confident	16 Å²	16	63.2 Å²	63.2	10%	0.098	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	-178.5	176.4	-167.3	0	0	0	0	111.5	R90 A91 L401	R90-T410 HydrophobicContact CB-CG2 4.3Å; A91-T410 HydrophobicContact CB-CG2 4.23Å; L401-T410 HydrophobicContact CB-CG2 4.16Å; L401-T410 HydrophobicContact CD1-CG2 3.75Å; L401-T410 HydrophobicContact CG-CG2 4.11Å; L401-T410 PolarHBondContact N-O 3.17Å; L401-T410 PolarHBondContact O-N 2.94Å
411	R	88.4	Confident	85.6	Confident	108 Å²	108	67.3 Å²	67.3	41%	0.408	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141	175.4	166	-174.3	148.4	166.5	-1.6	109.8	Q398 T399 P413 S414	Q398-R411 HydrophobicContact CG-CG 4.49Å; Q398-R411 VanDerWaalsContact OE1-CD 3.28Å; T399-R411 CarbonylContact O-C 3.56Å; T399-R411 WeakPolarHBondContact O-CA 3.48Å; R411-P413 CarbonylContact O-C 3.52Å; R411-S414 PolarHBondContact O-N 3.25Å
412	L	86.3	Confident	85.5	Confident	2 Å²	2	73.3 Å²	73.3	1%	0.01	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	138.1	172.5	-45.2	179.5	0	0	0	110	A91 Q398 T399 L438 T440 W450	A91-L412 HydrophobicContact CB-CD2 3.26Å; Q398-L412 VanDerWaalsContact CA-O 3.3Å; Q398-L412 WeakPolarHBondContact CA-O 3.46Å; T399-L412 HydrophobicContact CG2-CD1 4.43Å; T399-L412 PolarHBondContact N-O 2.68Å; T399-L412 PolarHBondContact O-N 3.2Å; L412-L438 HydrophobicContact CD1-CD2 3.53Å; L412-T440 HydrophobicContact CD1-CG2 4.49Å; L412-W450 HydrophobicContact CB-CH2 4.19Å; L412-W450 HydrophobicContact CB-CZ2 4.22Å; L412-W450 HydrophobicContact CB-CZ3 4.36Å; L412-W450 HydrophobicContact CD1-CB 4.48Å; L412-W450 HydrophobicContact CD1-CD2 3.89Å; L412-W450 HydrophobicContact CD1-CE3 4.37Å; L412-W450 HydrophobicContact CD1-CG 3.92Å; L412-W450 HydrophobicContact CD2-CD2 4.46Å; L412-W450 HydrophobicContact CD2-CE3 4.13Å; L412-W450 HydrophobicContact CD2-CZ3 4.47Å
413	P	80.3	Confident	85.5	Confident	16 Å²	16	76.6 Å²	76.6	10%	0.104	38%	0.38	C	S	.	.	S	Bend	cis	-68.3	151.3	-17.7	35	-38.4	0	0	0	110.8	R411 T415 R418 W450	R411-P413 CarbonylContact O-C 3.52Å; P413-T415 VanDerWaalsContact C-N 3.27Å; P413-T415 WeakPolarHBondContact CB-O 3.43Å; P413-R418 VanDerWaalsContact CB-O 3.28Å; P413-R418 WeakPolarHBondContact CB-O 3.31Å; P413-W450 HydrophobicContact CB-CH2 4.04Å; P413-W450 HydrophobicContact CB-CZ3 4.5Å
414	S	65.3	Low	85.7	Confident	48 Å²	48	74.3 Å²	74.3	34%	0.336	37%	0.368	S	S	.	.	S	Bend	trans	-69.7	-28.1	171.8	-170.1	0	0	0	0	111.8	R411	R411-S414 PolarHBondContact O-N 3.25Å
415	T	66.9	Low	85.8	Confident	83 Å²	83	72.8 Å²	72.8	51%	0.509	36%	0.361	S	S	.	.	S	Bend	trans	-134.2	139	175.3	60.9	0	0	0	0	110.9	P413 R417 R418	P413-T415 VanDerWaalsContact C-N 3.27Å; P413-T415 WeakPolarHBondContact CB-O 3.43Å; T415-R417 PolarHBondContact O-N 2.68Å; T415-R418 PolarHBondContact O-N 3Å
416	S	64.2	Low	86	Confident	117 Å²	117	69.4 Å²	69.4	82%	0.818	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-4.1	-168.3	-44	0	0	0	0	116.5
417	R	70.3	Confident	86.3	Confident	235 Å²	235	68.5 Å²	68.5	89%	0.887	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-12.8	-175.8	-64.3	-169.2	-177.3	-151	2.5	114.8	T415	T415-R417 PolarHBondContact O-N 2.68Å
418	R	77.4	Confident	86.4	Confident	164 Å²	164	64.8 Å²	64.8	62%	0.619	30%	0.301	S	S	*	.	S	Bend	trans	-141.8	72.3	-175.2	-67.7	-172.3	178.5	-176.4	-0.8	111.2	F93 P413 T415 W450	F93-R418 HydrophobicContact CB-CB 4.46Å; P413-R418 VanDerWaalsContact CB-O 3.28Å; P413-R418 WeakPolarHBondContact CB-O 3.31Å; T415-R418 PolarHBondContact O-N 3Å; R418-W450 VanDerWaalsContact O-CH2 3.24Å; R418-W450 WeakPolarHBondContact O-CH2 3.39Å
419	G	87.4	Confident	86.6	Confident	10 Å²	10	57.7 Å²	57.7	10%	0.103	27%	0.274	C	S	.	.	S	Bend	trans	-160.2	-171.4	176.3	0	0	0	0	0	111.3	H421	G419-H421 PolarHBondContact O-CE1 2.93Å
420	H	93.6	Very high	86.8	Confident	15 Å²	15	56.9 Å²	56.9	7%	0.069	27%	0.272	C	S	.	.			trans	-71	145	-179.9	-70.5	-79.2	0	0	0	112.6	V424 T440 G442 D444 L446	H420-V424 HydrophobicContact CB-CG2 4.09Å; H420-T440 PolarHBondContact NE2-O 2.77Å; H420-T440 PolarHBondContact NE2-OG1 2.93Å; H420-G442 PolarHBondContact CE1-N 3.27Å; H420-D444 WeakPolarHBondContact CA-OD2 3.47Å; H420-D444 IonicContact CE1-OD1 3.31Å; H420-D444 IonicContact CG-OD1 2.76Å; H420-D444 IonicContact CG-OD2 3.73Å; H420-D444 IonicContact ND1-OD1 3.91Å; H420-D444 PolarHBondContact ND1-OD1 2.78Å; H420-D444 IonicContact ND1-OD2 3.8Å; H420-D444 PolarHBondContact ND1-OD2 2.83Å; H420-L446 PolarHBondContact CE1-O 2.28Å
421	H	91.6	Very high	86.6	Confident	125 Å²	125	58.3 Å²	58.3	58%	0.579	28%	0.279	S	S	*	.	S	Bend	trans	-94.2	-13	179.1	-56	82.2	0	0	0	112.5	R397 G419 D444	R397-H421 WeakPolarHBondContact CD-O 3.27Å; R397-H421 PolarHBondContact NE-O 2.91Å; R397-H421 PolarHBondContact NH1-O 3.39Å; G419-H421 PolarHBondContact O-CE1 2.93Å; H421-D444 HydrophobicContact CB-CB 4.17Å; H421-D444 IonicContact CG-OD2 3.21Å; H421-D444 PolarHBondContact N-OD2 2.63Å; H421-D444 IonicContact ND1-OD2 3.83Å; H421-D444 PolarHBondContact ND1-OD2 3.44Å
422	R	93.8	Very high	86.3	Confident	129 Å²	129	60.7 Å²	60.7	49%	0.487	30%	0.295	S	S	.	.	S	Bend	trans	-130.7	-174.2	174.3	-71.2	177.9	156.6	-166.1	-5.1	109.8	R397 F443 D444	R397-R422 WeakPolarHBondContact CB-O 3.5Å; R397-R422 WeakPolarHBondContact CG-O 3.16Å; R422-F443 HydrophobicContact CB-CB 4.2Å; R422-F443 WeakPolarHBondContact CD-O 3.47Å; R422-F443 PolarHBondContact NH1-O 2.79Å; R422-D444 HydrophobicContact CB-CB 4.05Å; R422-D444 HydrophobicContact CG-CB 4.25Å
423	M	94.2	Very high	86.1	Confident	72 Å²	72	62.1 Å²	62.1	36%	0.355	31%	0.305	S	S	.	.			trans	-52.2	145.2	177.2	60	173.4	60.4	0	0	111.8	G442 F443	M423-G442 VanDerWaalsContact O-CA 3.22Å; M423-G442 WeakPolarHBondContact O-CA 3.49Å; M423-F443 HydrophobicContact CG-CB 3.67Å; M423-F443 PolarHBondContact O-N 3.49Å; M423-F443 VanDerWaalsContact O-N 3.08Å; M423-F443 HydrophobicContact SD-CB 4.37Å
424	V	96.7	Very high	85.9	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.006	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.9	169.9	-167	0	0	0	0	107.3	N379 P393 T394 H420 C441	N379-V424 WeakPolarHBondContact CB-O 3.27Å; N379-V424 PolarHBondContact ND2-O 2.86Å; P393-V424 HydrophobicContact CB-CB 3.74Å; P393-V424 HydrophobicContact CB-CG1 3.58Å; T394-V424 PolarHBondContact O-N 3.41Å; H420-V424 HydrophobicContact CB-CG2 4.09Å; V424-C441 CarbonylContact C-O 3.53Å; V424-C441 WeakPolarHBondContact CA-O 3.36Å; V424-C441 VanDerWaalsContact CG1-O 3.26Å; V424-C441 WeakPolarHBondContact CG1-O 3.38Å
425	C	97.2	Very high	86.7	Confident	10 Å²	10	69 Å²	69	7%	0.068	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-43.3	-171.3	-54.8	0	0	0	0	112	V104 W105 N379 R380 C441	V104-C425 VanDerWaalsContact O-CB 3.31Å; V104-C425 WeakPolarHBondContact O-CB 3.38Å; V104-C425 PolarHBondContact O-SG 3.02Å; W105-C425 WeakPolarHBondContact O-CB 3.23Å; N379-C425 VanDerWaalsContact CB-O 3.29Å; N379-C425 WeakPolarHBondContact CB-O 3.25Å; R380-C425 WeakPolarHBondContact CB-O 3.49Å; R380-C425 PolarHBondContact N-O 2.64Å; C425-C441 PolarHBondContact N-O 3.09Å
426	C	98	Very high	87.7	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.007	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	161	-174.4	-168.2	0	0	0	0	111.3	W105 I107 R380 C441	W105-C426 WeakPolarHBondContact O-CB 3.33Å; I107-C426 HydrophobicContact CG2-CB 4.17Å; R380-C426 HydrophobicContact CB-CB 4Å; C426-C441 VanDerWaalsContact CB-SG 3.6Å; C426-C441 PolarHBondContact O-N 3.35Å
427	C	97.6	Very high	89.1	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.007	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	160.1	168.4	-63.9	0	0	0	0	110.3	R380 A382 A391 T399 L438 F439	R380-C427 PolarHBondContact O-N 3.16Å; A382-C427 HydrophobicContact CB-CB 3.95Å; A382-C427 WeakPolarHBondContact CB-O 3.45Å; A391-C427 HydrophobicContact CB-CB 3.91Å; T399-C427 WeakPolarHBondContact CG2-SG 3.37Å; C427-L438 HydrophobicContact CB-CD1 4.17Å; C427-F439 CarbonylContact C-O 3.45Å; C427-F439 WeakPolarHBondContact CA-O 3.37Å
428	A	97	Very high	90.2	Very high	4 Å²	4	49.4 Å²	49.4	3%	0.033	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	139	168.2	0	0	0	0	0	110.4	I107 A109 L438 F439	I107-A428 HydrophobicContact CG1-CB 4.15Å; I107-A428 HydrophobicContact CG2-CB 4.08Å; A109-A428 HydrophobicContact CB-CB 4.13Å; A428-L438 WeakPolarHBondContact O-CA 3.39Å; A428-L438 WeakPolarHBondContact O-CD1 3.41Å; A428-F439 PolarHBondContact N-O 2.78Å; A428-F439 PolarHBondContact O-N 3.23Å
429	W	94.9	Very high	91.2	Very high	23 Å²	23	41.6 Å²	41.6	9%	0.087	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136.6	174.8	-70.9	94.9	0	0	0	110.5	A382 I389 A391 L401 N437 L438 V452 M454	A382-W429 PolarHBondContact O-NE1 3.34Å; I389-W429 HydrophobicContact CB-CZ2 4.32Å; I389-W429 HydrophobicContact CG2-CH2 4.01Å; I389-W429 HydrophobicContact CG2-CZ2 3.72Å; I389-W429 PolarHBondContact O-NE1 3.25Å; A391-W429 HydrophobicContact CB-CZ2 3.88Å; L401-W429 HydrophobicContact CD1-CH2 4.19Å; L401-W429 HydrophobicContact CD2-CH2 4.47Å; L401-W429 HydrophobicContact CD2-CZ2 4.1Å; W429-N437 CarbonylContact C-O 3.57Å; W429-N437 WeakPolarHBondContact CA-O 3.25Å; W429-N437 VanDerWaalsContact CE3-O 3.27Å; W429-L438 HydrophobicContact CD2-CB 4.43Å; W429-L438 HydrophobicContact CD2-CD1 3.99Å; W429-L438 HydrophobicContact CE3-CB 3.96Å; W429-L438 HydrophobicContact CE3-CD1 4.37Å; W429-L438 HydrophobicContact CG-CD1 4.38Å; W429-L438 HydrophobicContact CH2-CB 4.29Å; W429-L438 HydrophobicContact CH2-CD2 3.96Å; W429-L438 HydrophobicContact CH2-CG 4.5Å; W429-L438 HydrophobicContact CZ2-CD1 4.17Å; W429-L438 HydrophobicContact CZ2-CD2 4.11Å; W429-L438 HydrophobicContact CZ3-CB 3.86Å; W429-L438 HydrophobicContact CZ3-CD2 4.38Å; W429-V452 HydrophobicContact CH2-CB 4.34Å; W429-V452 HydrophobicContact CH2-CG1 4.42Å; W429-V452 HydrophobicContact CH2-CG2 4.08Å; W429-V452 HydrophobicContact CZ3-CB 4.24Å; W429-V452 HydrophobicContact CZ3-CG2 4.14Å; W429-M454 HydrophobicContact CE3-CE 4.37Å; W429-M454 HydrophobicContact CH2-CE 3.59Å; W429-M454 HydrophobicContact CZ3-CE 3.39Å
430	A	92.8	Very high	91.6	Very high	14 Å²	14	41.1 Å²	41.1	12%	0.116	21%	0.211	C	C	.	.			trans	-114.4	78	166.8	0	0	0	0	0	107.9	A109 E432 S433 N437 F439	A109-A430 HydrophobicContact CB-CB 4.03Å; A430-E432 PolarHBondContact O-N 2.94Å; A430-E432 VanDerWaalsContact O-N 3.11Å; A430-S433 WeakPolarHBondContact O-CB 3.48Å; A430-S433 PolarHBondContact O-N 3.47Å; A430-N437 PolarHBondContact N-O 3.41Å; A430-N437 WeakPolarHBondContact O-CA 3.34Å; A430-N437 WeakPolarHBondContact O-CB 3.5Å; A430-F439 HydrophobicContact CB-CE2 3.82Å
431	D	85	Confident	91.9	Very high	47 Å²	47	40.4 Å²	40.4	25%	0.251	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.3	-170	-73.2	-42.6	0	0	0	114.4	S384 R385 S386	S384-D431 WeakPolarHBondContact CA-OD1 3.44Å; S384-D431 WeakPolarHBondContact CB-OD1 3.19Å; S384-D431 PolarHBondContact OG-OD1 3.29Å; R385-D431 WeakPolarHBondContact CB-OD2 3.32Å; R385-D431 PolarHBondContact N-OD2 3.12Å; S386-D431 WeakPolarHBondContact OG-CB 3.49Å; S386-D431 VanDerWaalsContact OG-CG 3.31Å; S386-D431 PolarHBondContact OG-OD1 3.28Å
432	E	81.7	Confident	92.1	Very high	158 Å²	158	34.4 Å²	34.4	74%	0.738	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-15.1	179	-63	174.5	-151.5	0	0	113.2	A111 A430 S434	A111-E432 VanDerWaalsContact CB-OE2 3.23Å; A111-E432 WeakPolarHBondContact CB-OE2 3.26Å; A430-E432 PolarHBondContact O-N 2.94Å; A430-E432 VanDerWaalsContact O-N 3.11Å; E432-S434 PolarHBondContact O-N 3.35Å
433	S	82.2	Confident	92.2	Very high	31 Å²	31	30.6 Å²	30.6	22%	0.217	17%	0.167	C	C	.	.			trans	-85	111.2	-176.7	177.9	0	0	0	0	111.6	A430 N435 C436 N437	A430-S433 WeakPolarHBondContact O-CB 3.48Å; A430-S433 PolarHBondContact O-N 3.47Å; S433-N435 VanDerWaalsContact C-N 3.25Å; S433-N435 PolarHBondContact O-N 3.22Å; S433-C436 WeakPolarHBondContact CB-O 3.24Å; S433-C436 VanDerWaalsContact OG-C 3.31Å; S433-C436 PolarHBondContact OG-N 3.28Å; S433-C436 PolarHBondContact OG-O 3.44Å; S433-N437 WeakPolarHBondContact O-CB 3.25Å
434	S	76.2	Confident	92.2	Very high	102 Å²	102	28.3 Å²	28.3	71%	0.713	16%	0.156	S	C	*	.	S	Bend	trans	-68.4	-24.4	174.5	61.2	0	0	0	0	113.4	E432 N451	E432-S434 PolarHBondContact O-N 3.35Å; S434-N451 PolarHBondContact O-ND2 3.15Å
435	N	82.7	Confident	92.2	Very high	108 Å²	108	34.3 Å²	34.3	58%	0.578	18%	0.179	S	C	*	.	S	Bend	trans	-98.8	-34	-170.9	-89	-31.5	0	0	0	114.3	R92 S433 N451	R92-N435 PolarHBondContact NH2-O 3.43Å; S433-N435 VanDerWaalsContact C-N 3.25Å; S433-N435 PolarHBondContact O-N 3.22Å; N435-N451 VanDerWaalsContact C-ND2 3.29Å; N435-N451 WeakPolarHBondContact O-CB 3.15Å; N435-N451 PolarHBondContact O-ND2 2.99Å
436	C	88.1	Confident	92.2	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.034	18%	0.183	C	C	.	.			trans	-151.2	95	179	-169.5	0	0	0	0	109	V94 S433 F439 G449 W450	V94-C436 HydrophobicContact CB-CB 4.5Å; V94-C436 HydrophobicContact CG1-CB 4.27Å; V94-C436 HydrophobicContact CG2-CB 4.36Å; S433-C436 WeakPolarHBondContact CB-O 3.24Å; S433-C436 VanDerWaalsContact OG-C 3.31Å; S433-C436 PolarHBondContact OG-N 3.28Å; S433-C436 PolarHBondContact OG-O 3.44Å; C436-F439 HydrophobicContact CB-CE1 4.45Å; C436-F439 HydrophobicContact CB-CZ 4.13Å; C436-F439 WeakPolarHBondContact SG-CE1 3.42Å; C436-F439 VanDerWaalsContact SG-CZ 3.53Å; C436-G449 VanDerWaalsContact SG-C 3.59Å; C436-G449 WeakPolarHBondContact SG-CA 3.4Å; C436-W450 CarbonylContact C-O 3.6Å; C436-W450 WeakPolarHBondContact CA-O 3.19Å; C436-W450 PolarHBondContact SG-N 3.09Å
437	N	92.1	Very high	92.1	Very high	17 Å²	17	35.3 Å²	35.3	9%	0.091	18%	0.183	C	C	.	.			trans	-104.1	-8.7	-168.8	57.4	0.2	0	0	0	114.5	W429 A430 S433 W450 N451 V452	W429-N437 CarbonylContact C-O 3.57Å; W429-N437 WeakPolarHBondContact CA-O 3.25Å; W429-N437 VanDerWaalsContact CE3-O 3.27Å; A430-N437 PolarHBondContact N-O 3.41Å; A430-N437 WeakPolarHBondContact O-CA 3.34Å; A430-N437 WeakPolarHBondContact O-CB 3.5Å; S433-N437 WeakPolarHBondContact O-CB 3.25Å; N437-W450 PolarHBondContact N-O 3.47Å; N437-W450 PolarHBondContact OD1-O 3.4Å; N437-N451 WeakPolarHBondContact OD1-CA 3.4Å; N437-V452 PolarHBondContact ND2-O 2.89Å; N437-V452 PolarHBondContact OD1-N 2.9Å
438	L	95	Very high	92	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	134	176.8	173.1	62.8	0	0	0	109.7	A391 L401 L412 C427 A428 W429 W450 V452	A391-L438 HydrophobicContact CB-CD1 3.9Å; A391-L438 HydrophobicContact CB-CD2 4.49Å; L401-L438 HydrophobicContact CD1-CD2 4.05Å; L401-L438 HydrophobicContact CD2-CD2 3.79Å; L412-L438 HydrophobicContact CD1-CD2 3.53Å; C427-L438 HydrophobicContact CB-CD1 4.17Å; A428-L438 WeakPolarHBondContact O-CA 3.39Å; A428-L438 WeakPolarHBondContact O-CD1 3.41Å; W429-L438 HydrophobicContact CD2-CB 4.43Å; W429-L438 HydrophobicContact CD2-CD1 3.99Å; W429-L438 HydrophobicContact CE3-CB 3.96Å; W429-L438 HydrophobicContact CE3-CD1 4.37Å; W429-L438 HydrophobicContact CG-CD1 4.38Å; W429-L438 HydrophobicContact CH2-CB 4.29Å; W429-L438 HydrophobicContact CH2-CD2 3.96Å; W429-L438 HydrophobicContact CH2-CG 4.5Å; W429-L438 HydrophobicContact CZ2-CD1 4.17Å; W429-L438 HydrophobicContact CZ2-CD2 4.11Å; W429-L438 HydrophobicContact CZ3-CB 3.86Å; W429-L438 HydrophobicContact CZ3-CD2 4.38Å; L438-W450 HydrophobicContact CB-CB 4.31Å; L438-W450 PolarHBondContact N-O 2.87Å; L438-W450 WeakPolarHBondContact O-CA 3.3Å; L438-W450 PolarHBondContact O-N 2.79Å; L438-V452 HydrophobicContact CB-CG2 4.01Å; L438-V452 HydrophobicContact CD2-CG2 3.77Å
439	F	96.6	Very high	92	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	142.8	174.2	-56.5	-88.9	0	0	0	109.9	F97 I107 A109 I115 T129 C427 A428 A430 C436 V447 L448	F97-F439 AromaticContact CE2-CD1 3.91Å; F97-F439 HydrophobicContact CE2-CD1 3.91Å; F97-F439 AromaticContact CE2-CE1 3.84Å; F97-F439 HydrophobicContact CE2-CE1 3.84Å; F97-F439 HydrophobicContact CZ-CD1 4.31Å; F97-F439 AromaticContact CZ-CE1 3.81Å; F97-F439 HydrophobicContact CZ-CE1 3.81Å; I107-F439 HydrophobicContact CD1-CB 3.49Å; I107-F439 VanDerWaalsContact CD1-CB 3.49Å; I107-F439 HydrophobicContact CD1-CG 4.22Å; I107-F439 HydrophobicContact CG1-CB 4.22Å; A109-F439 HydrophobicContact CB-CD2 4.2Å; A109-F439 HydrophobicContact CB-CE2 4.33Å; I115-F439 HydrophobicContact CD1-CD1 4.01Å; I115-F439 HydrophobicContact CD1-CE1 4.24Å; I115-F439 HydrophobicContact CG2-CD1 4.08Å; I115-F439 HydrophobicContact CG2-CD2 3.69Å; I115-F439 HydrophobicContact CG2-CE1 4.03Å; I115-F439 HydrophobicContact CG2-CE2 3.64Å; I115-F439 HydrophobicContact CG2-CG 3.93Å; I115-F439 HydrophobicContact CG2-CZ 3.82Å; T129-F439 HydrophobicContact CG2-CE1 3.95Å; T129-F439 HydrophobicContact CG2-CE2 4.27Å; T129-F439 HydrophobicContact CG2-CZ 3.46Å; T129-F439 VanDerWaalsContact CG2-CZ 3.46Å; C427-F439 CarbonylContact C-O 3.45Å; C427-F439 WeakPolarHBondContact CA-O 3.37Å; A428-F439 PolarHBondContact N-O 2.78Å; A428-F439 PolarHBondContact O-N 3.23Å; A430-F439 HydrophobicContact CB-CE2 3.82Å; C436-F439 HydrophobicContact CB-CE1 4.45Å; C436-F439 HydrophobicContact CB-CZ 4.13Å; C436-F439 WeakPolarHBondContact SG-CE1 3.42Å; C436-F439 VanDerWaalsContact SG-CZ 3.53Å; F439-V447 HydrophobicContact CB-CG1 4.46Å; F439-L448 CarbonylContact C-O 3.58Å; F439-L448 WeakPolarHBondContact CA-O 3.31Å
440	T	97.6	Very high	91.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.8	174.5	63.7	0	0	0	0	109.1	T399 L412 H420 V447 L448 W450	T399-T440 HydrophobicContact CG2-CG2 4.27Å; T399-T440 WeakPolarHBondContact OG1-CG2 3.33Å; L412-T440 HydrophobicContact CD1-CG2 4.49Å; H420-T440 PolarHBondContact NE2-O 2.77Å; H420-T440 PolarHBondContact NE2-OG1 2.93Å; T440-V447 CarbonylContact O-C 3.56Å; T440-V447 WeakPolarHBondContact O-CA 3.17Å; T440-L448 PolarHBondContact N-O 2.99Å; T440-L448 PolarHBondContact O-N 3.18Å; T440-W450 PolarHBondContact OG1-NE1 3.18Å
441	C	97.9	Very high	91.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.1	174.6	79.1	0	0	0	0	110.8	V104 I107 V424 C425 C426 L446 V447	V104-C441 HydrophobicContact CB-CB 3.91Å; V104-C441 HydrophobicContact CG1-CB 3.6Å; V104-C441 PolarHBondContact O-SG 3.5Å; V104-C441 VanDerWaalsContact O-SG 3.36Å; I107-C441 HydrophobicContact CB-CB 4.19Å; I107-C441 HydrophobicContact CG2-CB 4.02Å; V424-C441 CarbonylContact C-O 3.53Å; V424-C441 WeakPolarHBondContact CA-O 3.36Å; V424-C441 VanDerWaalsContact CG1-O 3.26Å; V424-C441 WeakPolarHBondContact CG1-O 3.38Å; C425-C441 PolarHBondContact N-O 3.09Å; C426-C441 VanDerWaalsContact CB-SG 3.6Å; C426-C441 PolarHBondContact O-N 3.35Å; C441-L446 WeakPolarHBondContact CA-O 3.39Å; C441-V447 HydrophobicContact CB-CG2 3.92Å
442	G	96.8	Very high	92.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	167.4	-173.5	0	0	0	0	0	115	V104 H420 M423 D444 R445 L446	V104-G442 PolarHBondContact N-O 2.57Å; H420-G442 PolarHBondContact CE1-N 3.27Å; M423-G442 VanDerWaalsContact O-CA 3.22Å; M423-G442 WeakPolarHBondContact O-CA 3.49Å; G442-D444 PolarHBondContact O-N 3.26Å; G442-D444 VanDerWaalsContact O-N 3.07Å; G442-R445 PolarHBondContact O-N 2.08Å; G442-L446 PolarHBondContact N-O 3.35Å; G442-L446 VanDerWaalsContact N-O 3.14Å
443	F	95	Very high	92.2	Very high	48 Å²	48	27.9 Å²	27.9	21%	0.211	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	9.9	178.8	-148.1	-104.4	0	0	0	113.5	W105 R422 M423	W105-F443 HydrophobicContact CE3-CD2 4.46Å; W105-F443 AromaticContact CH2-CD2 3.88Å; W105-F443 HydrophobicContact CH2-CD2 3.88Å; W105-F443 AromaticContact CH2-CE2 3.5Å; W105-F443 HydrophobicContact CH2-CE2 3.5Å; W105-F443 HydrophobicContact CH2-CZ 4.38Å; W105-F443 HydrophobicContact CZ2-CD2 4.23Å; W105-F443 AromaticContact CZ2-CE2 3.52Å; W105-F443 HydrophobicContact CZ2-CE2 3.52Å; W105-F443 HydrophobicContact CZ2-CZ 4.38Å; W105-F443 HydrophobicContact CZ3-CD2 4Å; W105-F443 HydrophobicContact CZ3-CE2 4.1Å; R422-F443 HydrophobicContact CB-CB 4.2Å; R422-F443 WeakPolarHBondContact CD-O 3.47Å; R422-F443 PolarHBondContact NH1-O 2.79Å; M423-F443 HydrophobicContact CG-CB 3.67Å; M423-F443 PolarHBondContact O-N 3.49Å; M423-F443 VanDerWaalsContact O-N 3.08Å; M423-F443 HydrophobicContact SD-CB 4.37Å
444	D	94.9	Very high	91.7	Very high	24 Å²	24	28.9 Å²	28.9	13%	0.128	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	17.1	169.4	65	-18.2	0	0	0	113.1	H420 H421 R422 G442 L446	H420-D444 WeakPolarHBondContact CA-OD2 3.47Å; H420-D444 IonicContact CE1-OD1 3.31Å; H420-D444 IonicContact CG-OD1 2.76Å; H420-D444 IonicContact CG-OD2 3.73Å; H420-D444 IonicContact ND1-OD1 3.91Å; H420-D444 PolarHBondContact ND1-OD1 2.78Å; H420-D444 IonicContact ND1-OD2 3.8Å; H420-D444 PolarHBondContact ND1-OD2 2.83Å; H421-D444 HydrophobicContact CB-CB 4.17Å; H421-D444 IonicContact CG-OD2 3.21Å; H421-D444 PolarHBondContact N-OD2 2.63Å; H421-D444 IonicContact ND1-OD2 3.83Å; H421-D444 PolarHBondContact ND1-OD2 3.44Å; R422-D444 HydrophobicContact CB-CB 4.05Å; R422-D444 HydrophobicContact CG-CB 4.25Å; G442-D444 PolarHBondContact O-N 3.26Å; G442-D444 VanDerWaalsContact O-N 3.07Å; D444-L446 PolarHBondContact O-N 2.89Å
445	R	97.1	Very high	90.8	Very high	128 Å²	128	27.9 Å²	27.9	48%	0.483	15%	0.147	S	C	.	.	S	Bend	trans	69.2	10	176.3	-40.1	-179.6	175.3	164.2	-9.1	114.6	R101 G442	R101-R445 WeakPolarHBondContact O-CD 3.45Å; R101-R445 PolarHBondContact O-NE 3.37Å; R101-R445 PolarHBondContact O-NH2 3.12Å; G442-R445 PolarHBondContact O-N 2.08Å
446	L	96.2	Very high	89	Confident	30 Å²	30	30.8 Å²	30.8	16%	0.157	16%	0.157	C	C	.	.			trans	-105.7	145.8	-176.1	-61.6	178.7	0	0	0	111.8	K98 H420 C441 G442 D444 L448	K98-L446 HydrophobicContact CD-CD2 4.48Å; K98-L446 HydrophobicContact CG-CD2 3.8Å; H420-L446 PolarHBondContact CE1-O 2.28Å; C441-L446 WeakPolarHBondContact CA-O 3.39Å; G442-L446 PolarHBondContact N-O 3.35Å; G442-L446 VanDerWaalsContact N-O 3.14Å; D444-L446 PolarHBondContact O-N 2.89Å; L446-L448 HydrophobicContact CB-CD2 4.12Å; L446-L448 HydrophobicContact CD1-CD2 4.17Å
447	V	97.3	Very high	86.7	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.7	151.2	173.3	0	0	0	0	107.8	A96 F97 V104 I107 I115 F439 T440 C441	A96-V447 CarbonylContact C-O 3.51Å; A96-V447 WeakPolarHBondContact CA-O 3.24Å; F97-V447 HydrophobicContact CB-CB 4.11Å; F97-V447 HydrophobicContact CD2-CB 4Å; F97-V447 HydrophobicContact CD2-CG1 3.65Å; F97-V447 HydrophobicContact CE2-CG1 4.23Å; F97-V447 HydrophobicContact CG-CB 4.41Å; F97-V447 HydrophobicContact CG-CG1 4.38Å; F97-V447 PolarHBondContact N-O 2.95Å; F97-V447 PolarHBondContact O-N 2.74Å; V104-V447 HydrophobicContact CG1-CG2 4.19Å; I107-V447 HydrophobicContact CD1-CB 4.25Å; I107-V447 HydrophobicContact CD1-CG1 3.24Å; I107-V447 HydrophobicContact CD1-CG2 3.97Å; I115-V447 HydrophobicContact CD1-CG1 3.97Å; F439-V447 HydrophobicContact CB-CG1 4.46Å; T440-V447 CarbonylContact O-C 3.56Å; T440-V447 WeakPolarHBondContact O-CA 3.17Å; C441-V447 HydrophobicContact CB-CG2 3.92Å
448	L	95.9	Very high	84	Confident	6 Å²	6	44.7 Å²	44.7	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.9	175.6	-51.6	178.9	0	0	0	109.4	F93 A96 F439 T440 L446 W450	F93-L448 HydrophobicContact CE2-CB 4.37Å; F93-L448 HydrophobicContact CE2-CD2 3.98Å; A96-L448 HydrophobicContact CB-CD2 3.66Å; F439-L448 CarbonylContact C-O 3.58Å; F439-L448 WeakPolarHBondContact CA-O 3.31Å; T440-L448 PolarHBondContact N-O 2.99Å; T440-L448 PolarHBondContact O-N 3.18Å; L446-L448 HydrophobicContact CB-CD2 4.12Å; L446-L448 HydrophobicContact CD1-CD2 4.17Å; L448-W450 HydrophobicContact CB-CZ2 4.02Å; L448-W450 HydrophobicContact CD1-CH2 4.5Å; L448-W450 HydrophobicContact CD1-CZ2 3.82Å; L448-W450 VanDerWaalsContact O-CD1 3.32Å; L448-W450 PolarHBondContact O-NE1 3.09Å
449	G	95	Very high	81.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	136.6	172.3	0	0	0	0	0	111.5	V94 R95 C436	V94-G449 PolarHBondContact N-O 3.42Å; R95-G449 PolarHBondContact N-O 3.49Å; R95-G449 PolarHBondContact O-N 3.47Å; C436-G449 VanDerWaalsContact SG-C 3.59Å; C436-G449 WeakPolarHBondContact SG-CA 3.4Å
450	W	93.9	Very high	78.4	Confident	7 Å²	7	63.2 Å²	63.2	3%	0.027	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	150.2	-176.6	-49	87.1	0	0	0	110.6	R92 F93 L412 P413 R418 C436 N437 L438 T440 L448	R92-W450 WeakPolarHBondContact O-CA 3.45Å; F93-W450 HydrophobicContact CB-CE3 4.16Å; F93-W450 HydrophobicContact CB-CZ3 4.02Å; L412-W450 HydrophobicContact CB-CH2 4.19Å; L412-W450 HydrophobicContact CB-CZ2 4.22Å; L412-W450 HydrophobicContact CB-CZ3 4.36Å; L412-W450 HydrophobicContact CD1-CB 4.48Å; L412-W450 HydrophobicContact CD1-CD2 3.89Å; L412-W450 HydrophobicContact CD1-CE3 4.37Å; L412-W450 HydrophobicContact CD1-CG 3.92Å; L412-W450 HydrophobicContact CD2-CD2 4.46Å; L412-W450 HydrophobicContact CD2-CE3 4.13Å; L412-W450 HydrophobicContact CD2-CZ3 4.47Å; P413-W450 HydrophobicContact CB-CH2 4.04Å; P413-W450 HydrophobicContact CB-CZ3 4.5Å; R418-W450 VanDerWaalsContact O-CH2 3.24Å; R418-W450 WeakPolarHBondContact O-CH2 3.39Å; C436-W450 CarbonylContact C-O 3.6Å; C436-W450 WeakPolarHBondContact CA-O 3.19Å; C436-W450 PolarHBondContact SG-N 3.09Å; N437-W450 PolarHBondContact N-O 3.47Å; N437-W450 PolarHBondContact OD1-O 3.4Å; L438-W450 HydrophobicContact CB-CB 4.31Å; L438-W450 PolarHBondContact N-O 2.87Å; L438-W450 WeakPolarHBondContact O-CA 3.3Å; L438-W450 PolarHBondContact O-N 2.79Å; T440-W450 PolarHBondContact OG1-NE1 3.18Å; L448-W450 HydrophobicContact CB-CZ2 4.02Å; L448-W450 HydrophobicContact CD1-CH2 4.5Å; L448-W450 HydrophobicContact CD1-CZ2 3.82Å; L448-W450 VanDerWaalsContact O-CD1 3.32Å; L448-W450 PolarHBondContact O-NE1 3.09Å
451	N	91.8	Very high	75.8	Confident	21 Å²	21	75.8 Å²	75.8	11%	0.112	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	108.2	169	178.5	-82.1	0	0	0	107.3	A91 R92 V94 S434 N435 N437	A91-N451 CarbonylContact C-O 3.44Å; A91-N451 VanDerWaalsContact CA-O 3.28Å; A91-N451 WeakPolarHBondContact CA-O 3.14Å; R92-N451 HydrophobicContact CG-CB 3.66Å; R92-N451 PolarHBondContact N-O 2.91Å; R92-N451 VanDerWaalsContact NE-CG 3.33Å; R92-N451 PolarHBondContact NE-OD1 2.81Å; R92-N451 VanDerWaalsContact NH2-CG 3.33Å; R92-N451 PolarHBondContact NH2-ND2 3.31Å; R92-N451 PolarHBondContact O-N 3.18Å; V94-N451 HydrophobicContact CG2-CB 3.6Å; S434-N451 PolarHBondContact O-ND2 3.15Å; N435-N451 VanDerWaalsContact C-ND2 3.29Å; N435-N451 WeakPolarHBondContact O-CB 3.15Å; N435-N451 PolarHBondContact O-ND2 2.99Å; N437-N451 WeakPolarHBondContact OD1-CA 3.4Å
452	V	90.2	Very high	74.7	Confident	3 Å²	3	79.6 Å²	79.6	2%	0.018	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.8	176.8	-174.3	0	0	0	0	107.7	R90 A91 L401 W429 N437 L438 M454	R90-V452 CarbonylContact O-C 3.53Å; R90-V452 WeakPolarHBondContact O-CA 3.08Å; A91-V452 HydrophobicContact CB-CG2 4.19Å; L401-V452 HydrophobicContact CD1-CB 4.37Å; L401-V452 HydrophobicContact CD1-CG1 3.71Å; L401-V452 HydrophobicContact CD1-CG2 3.68Å; W429-V452 HydrophobicContact CH2-CB 4.34Å; W429-V452 HydrophobicContact CH2-CG1 4.42Å; W429-V452 HydrophobicContact CH2-CG2 4.08Å; W429-V452 HydrophobicContact CZ3-CB 4.24Å; W429-V452 HydrophobicContact CZ3-CG2 4.14Å; N437-V452 PolarHBondContact ND2-O 2.89Å; N437-V452 PolarHBondContact OD1-N 2.9Å; L438-V452 HydrophobicContact CB-CG2 4.01Å; L438-V452 HydrophobicContact CD2-CG2 3.77Å; V452-M454 HydrophobicContact CB-CE 4.15Å; V452-M454 HydrophobicContact CB-SD 4.49Å; V452-M454 HydrophobicContact CG1-CE 3.87Å; V452-M454 HydrophobicContact CG1-SD 3.81Å; V452-M454 PolarHBondContact O-N 2.89Å
453	S	84.1	Confident	73.5	Confident	55 Å²	55	83.8 Å²	83.8	39%	0.385	41%	0.409	S	S	.	.			trans	-78.6	105.4	179.6	67	0	0	0	0	109.7	R90 S455	R90-S453 WeakPolarHBondContact CA-OG 3.48Å; R90-S453 PolarHBondContact O-N 3.12Å; R90-S453 PolarHBondContact O-OG 3.06Å; S453-S455 PolarHBondContact O-N 2.96Å; S453-S455 VanDerWaalsContact O-N 3.08Å
454	M	71.5	Confident	72.3	Confident	51 Å²	51	85.8 Å²	85.8	25%	0.251	42%	0.42	S	S	.	.			trans	-78.8	89.7	172.2	-51.4	-49.4	-170.6	0	0	108.7	I389 W429 V452 Q456	I389-M454 HydrophobicContact CD1-CE 3.54Å; I389-M454 HydrophobicContact CD1-SD 3.37Å; I389-M454 WeakPolarHBondContact CD1-SD 3.29Å; W429-M454 HydrophobicContact CE3-CE 4.37Å; W429-M454 HydrophobicContact CH2-CE 3.59Å; W429-M454 HydrophobicContact CZ3-CE 3.39Å; V452-M454 HydrophobicContact CB-CE 4.15Å; V452-M454 HydrophobicContact CB-SD 4.49Å; V452-M454 HydrophobicContact CG1-CE 3.87Å; V452-M454 HydrophobicContact CG1-SD 3.81Å; V452-M454 PolarHBondContact O-N 2.89Å; M454-Q456 PolarHBondContact O-N 3.34Å
455	S	57.7	Low	71	Confident	81 Å²	81	89.4 Å²	89.4	57%	0.566	44%	0.437	S	S	*	.			trans	-67.9	101.3	167.1	59.6	0	0	0	0	107.9	S453	S453-S455 PolarHBondContact O-N 2.96Å; S453-S455 VanDerWaalsContact O-N 3.08Å
456	Q	45	Very low	69.4	Low	169 Å²	169	87 Å²	87	79%	0.79	43%	0.434	S	S	*	.			trans	-52.8	137.1	159.2	-73.6	-174	-11.9	0	0	107.4	M454 K458	M454-Q456 PolarHBondContact O-N 3.34Å; Q456-K458 PolarHBondContact O-N 3.4Å
457	P	38.5	Very low	67.6	Low	117 Å²	117	90.8 Å²	90.8	76%	0.76	45%	0.453	S	S	*	.			trans	-57.8	119.9	170	25.9	-31.7	0	0	0	106.7	E459	P457-E459 PolarHBondContact O-N 3.2Å
458	K	35.7	Very low	65.5	Low	198 Å²	198	97.2 Å²	97.2	86%	0.861	49%	0.485	S	S	*	.			trans	-56.7	115.8	168.2	-73.2	-171.2	174.4	-169.2	0	106.4	Q456 K460	Q456-K458 PolarHBondContact O-N 3.4Å; K458-K460 PolarHBondContact O-N 3.14Å
459	E	35.3	Very low	63.1	Low	184 Å²	184	104.2 Å²	104.2	86%	0.86	52%	0.52	S	S	*	.			trans	-54.1	127.6	163.5	-67.7	-173.6	146	0	0	106.6	P457 E461	P457-E459 PolarHBondContact O-N 3.2Å; E459-E461 PolarHBondContact O-N 2.93Å
460	K	39.6	Very low	60.5	Low	205 Å²	205	112.9 Å²	112.9	89%	0.891	56%	0.563	S	S	*	*			trans	-79.3	108.4	168.1	-72.3	-177.2	175.7	-176.4	0	105.7	K458	K458-K460 PolarHBondContact O-N 3.14Å
461	E	42.3	Very low	57.4	Low	264 Å²	264	122.5 Å²	122.5	100%	1.234	61%	0.612	S	S	*	*			trans	-55.3	0	153.9	-64.1	-179.2	143.5	0	0	110.3	E459	E459-E461 PolarHBondContact O-N 2.93Å

Retrieved 461 of 461 residues in 207 ms (Link to these results)

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