A0A060WDD7_ONCMY Loading...

Fibroblast growth factor 23

AlphaFold DB , UniProt , Accession A0A060WDD7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110500073, Length 259 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	41.4	Very low	58.1	Low	254 Å²	254	141.4 Å²	141.4	100%	1.251	73%	0.731	S	S	*	*				0	76.4	0	-165.3	157.9	144.7	0	0	106.9
2	E	51.8	Low	59.6	Low	190 Å²	190	134.6 Å²	134.6	89%	0.888	71%	0.712	S	S	*	*			trans	-112.4	91	179.6	-87.2	-153.7	136.6	0	0	108.5
3	I	53.1	Low	61.1	Low	155 Å²	155	130.2 Å²	130.2	80%	0.795	69%	0.693	S	S	*	*			trans	-153.5	113.6	160.4	-48.3	174.7	0	0	0	105.6
4	T	52.5	Low	62.3	Low	128 Å²	128	127.4 Å²	127.4	79%	0.785	68%	0.678	S	S	*	*	S	Bend	trans	167.2	-4.4	148.9	40.6	0	0	0	0	114.5
5	K	52.2	Low	63.5	Low	196 Å²	196	125.5 Å²	125.5	85%	0.852	67%	0.673	S	S	*	*	H	α-helix	trans	-87.2	-17.8	-177.8	-152.8	170.6	-178.1	177.9	0	115.5
6	T	54.6	Low	64.4	Low	106 Å²	106	125.4 Å²	125.4	65%	0.65	67%	0.671	S	S	*	*	H	α-helix	trans	-85.3	-21.7	-176.7	54	0	0	0	0	113.9	R10	T6-R10 PolarHBondContact O-N 3.2Å
7	S	57.4	Low	65	Low	69 Å²	69	123.9 Å²	123.9	48%	0.483	66%	0.662	S	S	.	*	H	α-helix	trans	-72.7	-44.5	-176.8	-173.6	0	0	0	0	112.1	M9 R10 N11	S7-M9 VanDerWaalsContact C-N 3.34Å; S7-M9 PolarHBondContact O-N 3.01Å; S7-R10 PolarHBondContact O-N 3.38Å; S7-N11 WeakPolarHBondContact O-CB 3.48Å; S7-N11 PolarHBondContact O-N 3.38Å; S7-N11 PolarHBondContact O-ND2 3.37Å
8	G	61.2	Low	65.5	Low	49 Å²	49	122.5 Å²	122.5	51%	0.505	65%	0.654	S	S	.	*	H	α-helix	trans	-63.3	-37.9	-179.5	0	0	0	0	0	113.4	N11 A12	G8-N11 PolarHBondContact O-N 2.92Å; G8-A12 WeakPolarHBondContact O-CB 3.32Å; G8-A12 PolarHBondContact O-N 3.41Å
9	M	68.7	Low	65.9	Low	137 Å²	137	119.1 Å²	119.1	68%	0.675	65%	0.645	S	S	*	*	H	α-helix	trans	-72.7	-39.1	-179.9	-164.6	164.5	68.3	0	0	112	S7 A12 V13	S7-M9 VanDerWaalsContact C-N 3.34Å; S7-M9 PolarHBondContact O-N 3.01Å; M9-A12 PolarHBondContact O-N 2.89Å; M9-V13 WeakPolarHBondContact O-CB 3.23Å; M9-V13 WeakPolarHBondContact O-CG2 3.38Å; M9-V13 PolarHBondContact O-N 3.46Å
10	R	72.1	Confident	66.1	Low	183 Å²	183	117.6 Å²	117.6	69%	0.691	64%	0.64	S	S	*	*	H	α-helix	trans	-62.6	-42.9	172.1	-89.6	174.9	64.5	-178.4	-0.2	111.8	T6 S7 V13 L14	T6-R10 PolarHBondContact O-N 3.2Å; S7-R10 PolarHBondContact O-N 3.38Å; R10-V13 PolarHBondContact O-N 2.87Å; R10-L14 WeakPolarHBondContact O-CB 3.19Å; R10-L14 VanDerWaalsContact O-CG 3.23Å; R10-L14 WeakPolarHBondContact O-CG 3.42Å; R10-L14 PolarHBondContact O-N 2.87Å
11	N	73.8	Confident	66	Low	88 Å²	88	116.9 Å²	116.9	47%	0.471	64%	0.635	S	S	.	*	H	α-helix	trans	-66.8	-40.6	178.7	-65.6	-20.9	0	0	0	111.3	S7 G8 L14 V15	S7-N11 WeakPolarHBondContact O-CB 3.48Å; S7-N11 PolarHBondContact O-N 3.38Å; S7-N11 PolarHBondContact O-ND2 3.37Å; G8-N11 PolarHBondContact O-N 2.92Å; N11-L14 PolarHBondContact O-N 3.34Å; N11-V15 WeakPolarHBondContact O-CB 3.22Å; N11-V15 WeakPolarHBondContact O-CG2 3.43Å; N11-V15 PolarHBondContact O-N 3.35Å
12	A	76.1	Confident	67	Low	60 Å²	60	112.6 Å²	112.6	50%	0.496	61%	0.612	S	S	.	*	H	α-helix	trans	-63.2	-42	174.7	0	0	0	0	0	112.2	G8 M9 V15 L16	G8-A12 WeakPolarHBondContact O-CB 3.32Å; G8-A12 PolarHBondContact O-N 3.41Å; M9-A12 PolarHBondContact O-N 2.89Å; A12-V15 PolarHBondContact O-N 2.9Å; A12-L16 WeakPolarHBondContact O-CB 3.41Å; A12-L16 PolarHBondContact O-N 3.42Å
13	V	79.7	Confident	67.3	Low	77 Å²	77	106.6 Å²	106.6	47%	0.467	60%	0.601	S	S	.	*	H	α-helix	trans	-65.7	-41.4	176.2	170.9	0	0	0	0	111.2	M9 R10 L16 L17	M9-V13 WeakPolarHBondContact O-CB 3.23Å; M9-V13 WeakPolarHBondContact O-CG2 3.38Å; M9-V13 PolarHBondContact O-N 3.46Å; R10-V13 PolarHBondContact O-N 2.87Å; V13-L16 PolarHBondContact O-N 2.86Å; V13-L17 HydrophobicContact CG1-CD1 3.92Å; V13-L17 WeakPolarHBondContact O-CB 3.27Å; V13-L17 PolarHBondContact O-N 3.37Å
14	L	78.3	Confident	67.5	Low	92 Å²	92	106.4 Å²	106.4	48%	0.482	59%	0.594	S	S	.	*	H	α-helix	trans	-65.1	-42	176.3	-74.2	170.3	0	0	0	111.8	R10 N11 L16 L17 L18	R10-L14 WeakPolarHBondContact O-CB 3.19Å; R10-L14 VanDerWaalsContact O-CG 3.23Å; R10-L14 WeakPolarHBondContact O-CG 3.42Å; R10-L14 PolarHBondContact O-N 2.87Å; N11-L14 PolarHBondContact O-N 3.34Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L17 PolarHBondContact O-N 2.9Å; L14-L18 WeakPolarHBondContact O-CB 3.25Å; L14-L18 VanDerWaalsContact O-CG 3.24Å; L14-L18 WeakPolarHBondContact O-CG 3.33Å; L14-L18 PolarHBondContact O-N 2.87Å
15	V	80.2	Confident	67.9	Low	99 Å²	99	111.1 Å²	111.1	60%	0.6	60%	0.598	S	S	*	*	H	α-helix	trans	-63.9	-41	175.3	170.5	0	0	0	0	110.7	N11 A12 L18 A19	N11-V15 WeakPolarHBondContact O-CB 3.22Å; N11-V15 WeakPolarHBondContact O-CG2 3.43Å; N11-V15 PolarHBondContact O-N 3.35Å; A12-V15 PolarHBondContact O-N 2.9Å; V15-L18 PolarHBondContact O-N 2.97Å; V15-A19 WeakPolarHBondContact O-CB 3.38Å; V15-A19 PolarHBondContact O-N 2.98Å
16	L	77.1	Confident	68.2	Low	124 Å²	124	110 Å²	110	65%	0.649	60%	0.595	S	S	*	*	H	α-helix	trans	-64.1	-43.1	175.6	-153.3	91.3	0	0	0	111.4	A12 V13 L14 A19 V20	A12-L16 WeakPolarHBondContact O-CB 3.41Å; A12-L16 PolarHBondContact O-N 3.42Å; V13-L16 PolarHBondContact O-N 2.86Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L16-A19 PolarHBondContact O-N 3.3Å; L16-V20 VanDerWaalsContact O-CG2 3.27Å; L16-V20 WeakPolarHBondContact O-CG2 3.31Å; L16-V20 PolarHBondContact O-N 3.31Å
17	L	75.7	Confident	68.3	Low	99 Å²	99	111.3 Å²	111.3	52%	0.518	60%	0.603	S	S	.	*	H	α-helix	trans	-62.9	-43.7	176.3	-112.2	126.6	0	0	0	111.8	V13 L14 V20 L21	V13-L17 HydrophobicContact CG1-CD1 3.92Å; V13-L17 WeakPolarHBondContact O-CB 3.27Å; V13-L17 PolarHBondContact O-N 3.37Å; L14-L17 PolarHBondContact O-N 2.9Å; L17-V20 PolarHBondContact O-N 3.38Å; L17-L21 WeakPolarHBondContact O-CB 3.24Å; L17-L21 VanDerWaalsContact O-CG 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.4Å; L17-L21 PolarHBondContact O-N 3.41Å
18	L	73.1	Confident	68.5	Low	99 Å²	99	114.4 Å²	114.4	52%	0.518	62%	0.615	S	S	.	*	H	α-helix	trans	-67.2	-38.2	177.8	-70.4	170.6	0	0	0	111.7	L14 V15 L21 Q22	L14-L18 WeakPolarHBondContact O-CB 3.25Å; L14-L18 VanDerWaalsContact O-CG 3.24Å; L14-L18 WeakPolarHBondContact O-CG 3.33Å; L14-L18 PolarHBondContact O-N 2.87Å; V15-L18 PolarHBondContact O-N 2.97Å; L18-L21 PolarHBondContact O-N 3.38Å; L18-Q22 VanDerWaalsContact O-CG 3.27Å; L18-Q22 WeakPolarHBondContact O-CG 3.47Å; L18-Q22 PolarHBondContact O-N 3.32Å
19	A	73.1	Confident	68.6	Low	57 Å²	57	116.3 Å²	116.3	47%	0.471	63%	0.626	S	S	.	*	H	α-helix	trans	-65.3	-38.6	174.8	0	0	0	0	0	112.3	V15 L16 Q22 G23	V15-A19 WeakPolarHBondContact O-CB 3.38Å; V15-A19 PolarHBondContact O-N 2.98Å; L16-A19 PolarHBondContact O-N 3.3Å; A19-Q22 PolarHBondContact O-N 3.47Å; A19-G23 PolarHBondContact O-N 2.97Å
20	V	69.8	Low	68.2	Low	90 Å²	90	116.9 Å²	116.9	55%	0.545	63%	0.63	S	S	.	*	H	α-helix	trans	-66.6	-39.4	174.1	171.8	0	0	0	0	111.1	L16 L17 G23 F24	L16-V20 VanDerWaalsContact O-CG2 3.27Å; L16-V20 WeakPolarHBondContact O-CG2 3.31Å; L16-V20 PolarHBondContact O-N 3.31Å; L17-V20 PolarHBondContact O-N 3.38Å; V20-G23 PolarHBondContact O-N 2.96Å; V20-F24 HydrophobicContact CG1-CE2 4.3Å; V20-F24 VanDerWaalsContact O-CD2 3.31Å; V20-F24 WeakPolarHBondContact O-CD2 3.27Å
21	L	63.4	Low	67.4	Low	103 Å²	103	113.3 Å²	113.3	54%	0.539	63%	0.631	S	S	.	*	H	α-helix	trans	-69.6	-31.4	178	-71.8	166.8	0	0	0	113.1	L17 L18 G23 F24	L17-L21 WeakPolarHBondContact O-CB 3.24Å; L17-L21 VanDerWaalsContact O-CG 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.4Å; L17-L21 PolarHBondContact O-N 3.41Å; L18-L21 PolarHBondContact O-N 3.38Å; L21-G23 VanDerWaalsContact C-N 3.31Å; L21-F24 PolarHBondContact O-N 3.29Å
22	Q	62.9	Low	66.4	Low	163 Å²	163	114.9 Å²	114.9	76%	0.762	64%	0.64	S	S	*	*	H	α-helix	trans	-75.2	-17.3	174.5	-71	174.6	2.9	0	0	113.5	L18 A19 F24	L18-Q22 VanDerWaalsContact O-CG 3.27Å; L18-Q22 WeakPolarHBondContact O-CG 3.47Å; L18-Q22 PolarHBondContact O-N 3.32Å; A19-Q22 PolarHBondContact O-N 3.47Å; Q22-F24 VanDerWaalsContact C-N 3.35Å
23	G	59.3	Low	65.3	Low	64 Å²	64	116.7 Å²	116.7	66%	0.66	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-14.9	174.4	0	0	0	0	0	114.2	A19 V20 L21 R25	A19-G23 PolarHBondContact O-N 2.97Å; V20-G23 PolarHBondContact O-N 2.96Å; L21-G23 VanDerWaalsContact C-N 3.31Å; G23-R25 VanDerWaalsContact C-N 3.29Å; G23-R25 PolarHBondContact O-N 3.04Å
24	F	56.8	Low	64.1	Low	151 Å²	151	115.5 Å²	115.5	66%	0.662	64%	0.641	S	S	*	*	S	Bend	trans	-74.9	88	167.3	-72	-85.7	0	0	0	108.1	V20 L21 Q22 Q26	V20-F24 HydrophobicContact CG1-CE2 4.3Å; V20-F24 VanDerWaalsContact O-CD2 3.31Å; V20-F24 WeakPolarHBondContact O-CD2 3.27Å; L21-F24 PolarHBondContact O-N 3.29Å; Q22-F24 VanDerWaalsContact C-N 3.35Å; F24-Q26 PolarHBondContact O-N 3.5Å
25	R	61.3	Low	62.7	Low	227 Å²	227	115.6 Å²	115.6	86%	0.857	65%	0.647	S	S	*	*			trans	-48.7	121.7	158.2	-83.8	-140.8	169	-160.2	-2.2	106.5	G23 V27	G23-R25 VanDerWaalsContact C-N 3.29Å; G23-R25 PolarHBondContact O-N 3.04Å; R25-V27 PolarHBondContact O-N 2.84Å
26	Q	58.2	Low	61.1	Low	172 Å²	172	115.4 Å²	115.4	80%	0.804	64%	0.642	S	S	*	*			trans	-54.8	105.4	160.8	-67.9	-129.8	-15.1	0	0	104.8	F24 D28	F24-Q26 PolarHBondContact O-N 3.5Å; Q26-D28 PolarHBondContact O-N 2.79Å
27	V	56.8	Low	59.6	Low	135 Å²	135	116.6 Å²	116.6	82%	0.818	65%	0.649	S	S	*	*			trans	-67.4	87.9	161.7	176.9	0	0	0	0	102.1	R25 A29	R25-V27 PolarHBondContact O-N 2.84Å; V27-A29 VanDerWaalsContact C-N 3.34Å; V27-A29 PolarHBondContact O-N 2.85Å
28	D	61.6	Low	58.1	Low	134 Å²	134	115.2 Å²	115.2	72%	0.717	66%	0.658	S	S	*	*			trans	-50.5	112.2	163.1	-83.5	-37.6	0	0	0	104.4	Q26 L30	Q26-D28 PolarHBondContact O-N 2.79Å; D28-L30 VanDerWaalsContact C-N 3.33Å; D28-L30 PolarHBondContact O-N 2.91Å
29	A	62.2	Low	56.7	Low	89 Å²	89	113.4 Å²	113.4	74%	0.736	65%	0.654	S	S	*	*			trans	-56	110	170.7	0	0	0	0	0	104.7	V27	V27-A29 VanDerWaalsContact C-N 3.34Å; V27-A29 PolarHBondContact O-N 2.85Å
30	L	60.3	Low	55.6	Low	148 Å²	148	117 Å²	117	78%	0.775	67%	0.665	S	S	*	*			trans	-46.7	123.3	174.8	-163.8	73.4	0	0	0	105.4	D28 N32	D28-L30 VanDerWaalsContact C-N 3.33Å; D28-L30 PolarHBondContact O-N 2.91Å; L30-N32 PolarHBondContact O-N 2.75Å
31	P	56.7	Low	54.5	Low	109 Å²	109	118.6 Å²	118.6	71%	0.708	66%	0.662	S	S	*	*			trans	-53.6	109.9	-175.3	19.6	-30.8	0	0	0	105.5	P33	P31-P33 VanDerWaalsContact C-N 3.32Å; P31-P33 WeakPolarHBondContact O-CD 3.25Å
32	N	52	Low	53.5	Low	121 Å²	121	116.8 Å²	116.8	65%	0.647	67%	0.668	S	S	*	*			trans	-56.2	102.5	-176	174.9	2.2	0	0	0	104.8	L30 S34	L30-N32 PolarHBondContact O-N 2.75Å; N32-S34 PolarHBondContact O-N 3.49Å
33	P	52.8	Low	53	Low	98 Å²	98	112.1 Å²	112.1	64%	0.636	65%	0.648	S	S	*	*			trans	-72.2	93.8	174.7	26.6	-17.9	0	0	0	101.1	P31 P35	P31-P33 VanDerWaalsContact C-N 3.32Å; P31-P33 WeakPolarHBondContact O-CD 3.25Å; P33-P35 VanDerWaalsContact O-CD 3.28Å; P33-P35 WeakPolarHBondContact O-CD 2.91Å
34	S	54	Low	52.5	Low	51 Å²	51	114.4 Å²	114.4	36%	0.357	65%	0.652	S	S	.	*			trans	-47.2	117.8	-176.6	-73.2	0	0	0	0	104.8	N32 L36 L37	N32-S34 PolarHBondContact O-N 3.49Å; S34-L36 PolarHBondContact O-N 3.46Å; S34-L37 WeakPolarHBondContact O-CB 3.13Å; S34-L37 PolarHBondContact O-N 3.37Å
35	P	48.6	Very low	52.7	Low	95 Å²	95	116.8 Å²	116.8	62%	0.617	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-9.3	-170.6	16.6	-29.1	0	0	0	112.5	P33 S39	P33-P35 VanDerWaalsContact O-CD 3.28Å; P33-P35 WeakPolarHBondContact O-CD 2.91Å; P35-S39 PolarHBondContact O-N 2.72Å
36	L	47.2	Very low	53.3	Low	94 Å²	94	109.8 Å²	109.8	49%	0.492	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	-17.9	170.4	-53	-178.1	0	0	0	116.3	S34 N43	S34-L36 PolarHBondContact O-N 3.46Å; L36-N43 HydrophobicContact CD2-CB 4.48Å
37	L	45.7	Very low	54.8	Low	149 Å²	149	105 Å²	105	78%	0.78	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-20.3	-172.9	-81.3	164.1	0	0	0	113.8	S34	S34-L37 WeakPolarHBondContact O-CB 3.13Å; S34-L37 PolarHBondContact O-N 3.37Å
38	G	44.8	Very low	56.6	Low	70 Å²	70	99.3 Å²	99.3	72%	0.722	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.8	-18.6	-176.4	0	0	0	0	0	115.8
39	S	42.5	Very low	58.2	Low	62 Å²	62	93 Å²	93	43%	0.434	54%	0.536	S	S	.	.			trans	-112.5	114.3	176.1	-154.4	0	0	0	0	110.2	P35 W41	P35-S39 PolarHBondContact O-N 2.72Å; S39-W41 PolarHBondContact O-N 2.96Å
40	N	50.2	Low	59.8	Low	132 Å²	132	88.7 Å²	88.7	71%	0.706	50%	0.501	S	S	*	.	S	Bend	trans	-70	-14.7	-176.5	-56.4	-19.9	0	0	0	111.7	R46	N40-R46 PolarHBondContact O-NH1 3.17Å
41	W	46.7	Very low	61.5	Low	124 Å²	124	82.3 Å²	82.3	47%	0.47	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	113.3	171.4	-96.6	-75.4	0	0	0	110.9	S39 H125 L127	S39-W41 PolarHBondContact O-N 2.96Å; W41-H125 AromaticContact CE2-CE1 3.33Å; W41-H125 AromaticContact CE2-ND1 3.61Å; W41-H125 AromaticContact CH2-CE1 3.48Å; W41-H125 VanDerWaalsContact CH2-CE1 3.48Å; W41-H125 WeakPolarHBondContact CH2-CE1 3.28Å; W41-H125 AromaticContact CZ2-CE1 2.84Å; W41-H125 WeakPolarHBondContact CZ2-CE1 3.41Å; W41-H125 AromaticContact CZ2-ND1 3.18Å; W41-H125 WeakPolarHBondContact CZ2-ND1 3.49Å; W41-H125 AromaticContact CZ2-NE2 3.76Å; W41-H125 AromaticContact NE1-CE1 3.69Å; W41-H125 AromaticContact NE1-ND1 3.62Å; W41-L127 HydrophobicContact CH2-CB 3.61Å; W41-L127 HydrophobicContact CZ3-CB 3.89Å; W41-L127 HydrophobicContact CZ3-CD2 3.94Å
42	G	42.4	Very low	63.3	Low	65 Å²	65	77.1 Å²	77.1	67%	0.67	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	136.5	-1.6	169.3	0	0	0	0	0	117	P44	G42-P44 WeakPolarHBondContact O-CD 3.43Å
43	N	52	Low	65.1	Low	64 Å²	64	72.3 Å²	72.3	34%	0.342	41%	0.409	S	S	.	.			trans	-98.1	110.6	166.7	-175.7	-35.9	0	0	0	109.4	L36 R45 R46	L36-N43 HydrophobicContact CD2-CB 4.48Å; N43-R45 PolarHBondContact O-N 2.74Å; N43-R45 VanDerWaalsContact O-N 3.11Å; N43-R45 PolarHBondContact OD1-N 3.46Å; N43-R45 VanDerWaalsContact OD1-N 3.12Å; N43-R46 HydrophobicContact CB-CG 3.83Å; N43-R46 PolarHBondContact O-N 3.13Å
44	P	50.7	Low	66.7	Low	113 Å²	113	69.6 Å²	69.6	73%	0.734	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-4.6	-171.2	25.8	-33.1	0	0	0	115	G42	G42-P44 WeakPolarHBondContact O-CD 3.43Å
45	R	59.6	Low	68	Low	200 Å²	200	74.8 Å²	74.8	76%	0.755	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	35.4	178.7	-65.1	-171.5	179.9	-154.9	-0.1	113.3	N43 Y47	N43-R45 PolarHBondContact O-N 2.74Å; N43-R45 VanDerWaalsContact O-N 3.11Å; N43-R45 PolarHBondContact OD1-N 3.46Å; N43-R45 VanDerWaalsContact OD1-N 3.12Å; R45-Y47 PolarHBondContact O-N 2.81Å
46	R	74.1	Confident	69.7	Low	81 Å²	81	76.1 Å²	76.1	31%	0.306	42%	0.422	S	S	.	.			trans	-89.5	101.1	176.2	-76.4	-178.6	178.6	153.3	-1.6	111.1	N40 N43	N40-R46 PolarHBondContact O-NH1 3.17Å; N43-R46 HydrophobicContact CB-CG 3.83Å; N43-R46 PolarHBondContact O-N 3.13Å
47	Y	90.3	Very high	71.7	Confident	71 Å²	71	75.6 Å²	75.6	28%	0.278	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	127.1	162.3	-64.2	-31.2	0	0	0	110	R45 V80 M81 L82 V96 N170 L174 L177	R45-Y47 PolarHBondContact O-N 2.81Å; Y47-V80 HydrophobicContact CD1-CG1 4.37Å; Y47-V80 HydrophobicContact CG-CG1 3.98Å; Y47-M81 WeakPolarHBondContact CA-O 3.43Å; Y47-L82 HydrophobicContact CD1-CB 4.21Å; Y47-L82 HydrophobicContact CD1-CD1 4.2Å; Y47-L82 HydrophobicContact CE1-CB 4.26Å; Y47-L82 HydrophobicContact CE1-CD1 4.25Å; Y47-L82 HydrophobicContact CE1-CD2 4.5Å; Y47-V96 HydrophobicContact CD1-CB 4.49Å; Y47-V96 HydrophobicContact CD1-CG1 4.32Å; Y47-V96 HydrophobicContact CD1-CG2 3.48Å; Y47-V96 VanDerWaalsContact CD1-CG2 3.48Å; Y47-V96 HydrophobicContact CE1-CB 4.32Å; Y47-V96 HydrophobicContact CE1-CG1 3.78Å; Y47-V96 HydrophobicContact CE1-CG2 3.5Å; Y47-V96 HydrophobicContact CG-CG2 4.38Å; Y47-N170 WeakPolarHBondContact O-CB 3.29Å; Y47-N170 PolarHBondContact O-N 2.77Å; Y47-L174 HydrophobicContact CD2-CD2 3.7Å; Y47-L174 HydrophobicContact CE2-CD2 3.58Å; Y47-L177 HydrophobicContact CD2-CD1 3.67Å; Y47-L177 HydrophobicContact CE2-CD1 3.92Å; Y47-L177 HydrophobicContact CG-CD1 4.31Å
48	V	94	Very high	74	Confident	16 Å²	16	72.2 Å²	72.2	10%	0.097	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	160.6	-176.9	-62.5	0	0	0	0	111.2	L50 M81 L83 E168	V48-L50 HydrophobicContact CG2-CD2 4.39Å; V48-M81 HydrophobicContact CG2-CB 4.38Å; V48-M81 PolarHBondContact N-O 3.48Å; V48-M81 PolarHBondContact O-N 3.2Å; V48-L83 HydrophobicContact CG2-CD1 4.13Å; V48-L83 HydrophobicContact CG2-CG 4.01Å; V48-E168 CarbonylContact C-O 3.48Å; V48-E168 WeakPolarHBondContact CA-O 3.29Å; V48-E168 VanDerWaalsContact CB-O 3.3Å; V48-E168 WeakPolarHBondContact CB-O 3.22Å
49	H	95.6	Very high	76.4	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.9	162.3	-62.9	-93.8	0	0	0	107.7	Q51 Y60 S79 E168 N170	H49-Q51 PolarHBondContact O-N 3.44Å; H49-Y60 HydrophobicContact CB-CD1 3.69Å; H49-Y60 HydrophobicContact CB-CE1 4.15Å; H49-S79 PolarHBondContact CE1-OG 3.23Å; H49-S79 PolarHBondContact ND1-O 2.95Å; H49-S79 PolarHBondContact ND1-OG 3.18Å; H49-E168 HydrophobicContact CB-CB 4.42Å; H49-E168 PolarHBondContact N-O 2.88Å; H49-E168 PolarHBondContact O-N 2.89Å; H49-N170 PolarHBondContact NE2-OD1 3.01Å
50	L	96.8	Very high	78.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	96.4	173	-68.4	-179.2	0	0	0	108.5	V48 Y60 L61 M81 L83 I93 Y135 F165	V48-L50 HydrophobicContact CG2-CD2 4.39Å; L50-Y60 WeakPolarHBondContact O-CA 3.2Å; L50-L61 HydrophobicContact CB-CB 4.11Å; L50-L61 HydrophobicContact CD1-CD2 3.94Å; L50-L61 PolarHBondContact O-N 3.13Å; L50-M81 HydrophobicContact CD1-CG 4.4Å; L50-M81 HydrophobicContact CG-CG 4.37Å; L50-L83 HydrophobicContact CD1-CD2 4.31Å; L50-L83 HydrophobicContact CD2-CD2 4.43Å; L50-I93 HydrophobicContact CD1-CD1 4.08Å; L50-I93 HydrophobicContact CD1-CG2 4.03Å; L50-Y135 HydrophobicContact CD1-CE2 4.36Å; L50-Y135 HydrophobicContact CD2-CE2 4.07Å; L50-F165 HydrophobicContact CB-CD1 3.94Å
51	Q	95.9	Very high	81.2	Confident	13 Å²	13	61.9 Å²	61.9	6%	0.061	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.3	-178.3	-175.2	-169	-14.2	0	0	111.1	H49 N58 F59 Y60 F165 L166 E168	H49-Q51 PolarHBondContact O-N 3.44Å; Q51-N58 HydrophobicContact CG-CB 4.31Å; Q51-N58 PolarHBondContact NE2-OD1 3.26Å; Q51-F59 CarbonylContact C-O 3.23Å; Q51-F59 VanDerWaalsContact CA-O 3.25Å; Q51-F59 WeakPolarHBondContact CA-O 2.84Å; Q51-Y60 HydrophobicContact CB-CD1 3.76Å; Q51-Y60 HydrophobicContact CB-CE1 3.65Å; Q51-Y60 HydrophobicContact CG-CD1 4.09Å; Q51-Y60 HydrophobicContact CG-CE1 3.7Å; Q51-F165 CarbonylContact O-C 3.59Å; Q51-F165 WeakPolarHBondContact O-CA 3.44Å; Q51-L166 HydrophobicContact CB-CB 4.4Å; Q51-L166 PolarHBondContact N-O 3.3Å; Q51-L166 PolarHBondContact O-N 3.03Å; Q51-E168 HydrophobicContact CB-CG 4.36Å; Q51-E168 PolarHBondContact OE1-OE1 3.13Å; Q51-E168 VanDerWaalsContact OE1-OE1 3.05Å; Q51-E168 PolarHBondContact OE1-OE2 3.26Å
52	T	94.4	Very high	83.6	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	163.6	163.9	-166.7	0	0	0	0	110.4	N58 F59 L146 Q161 T162 L164	T52-N58 WeakPolarHBondContact O-CA 3.18Å; T52-F59 HydrophobicContact CG2-CB 4.07Å; T52-F59 PolarHBondContact N-O 2.74Å; T52-F59 PolarHBondContact O-N 3.05Å; T52-F59 VanDerWaalsContact O-O 3.09Å; T52-L146 HydrophobicContact CG2-CD1 3.88Å; T52-L146 HydrophobicContact CG2-CG 4.46Å; T52-Q161 PolarHBondContact OG1-O 3.07Å; T52-T162 VanDerWaalsContact OG1-CA 3.26Å; T52-T162 WeakPolarHBondContact OG1-CA 3.48Å; T52-L164 WeakPolarHBondContact CB-O 3.36Å; T52-L164 PolarHBondContact OG1-O 3.23Å
53	S	89	Confident	86.2	Confident	19 Å²	19	54.7 Å²	54.7	13%	0.133	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.7	179.8	48.4	0	0	0	0	110.2	Q161	S53-Q161 WeakPolarHBondContact O-CB 3.13Å
54	S	85.9	Confident	88.3	Confident	41 Å²	41	52.6 Å²	52.6	29%	0.287	27%	0.269	S	S	.	.			trans	-101.8	-177.5	161.1	-175	0	0	0	0	108.7	V56 N57	S54-V56 PolarHBondContact O-N 2.88Å; S54-N57 PolarHBondContact N-O 3.21Å
55	D	82	Confident	90.4	Very high	160 Å²	160	51.6 Å²	51.6	86%	0.856	26%	0.256	S	S	*	.	S	Bend	trans	-62.1	-27.3	179.8	-60	-35.4	0	0	0	112.5
56	V	85	Confident	92	Very high	123 Å²	123	48.2 Å²	48.2	75%	0.745	25%	0.253	S	S	*	.	S	Bend	trans	-110.9	-39.1	-172.1	-170.1	0	0	0	0	112.6	S54	S54-V56 PolarHBondContact O-N 2.88Å
57	N	88.8	Confident	92.9	Very high	83 Å²	83	45 Å²	45	44%	0.444	25%	0.245	S	C	.	.			trans	-137.4	152.3	-167.2	-76	-32.6	0	0	0	112.8	S54 F59	S54-N57 PolarHBondContact N-O 3.21Å; N57-F59 HydrophobicContact CB-CD2 4.49Å; N57-F59 HydrophobicContact CB-CE1 4.24Å; N57-F59 HydrophobicContact CB-CE2 3.78Å; N57-F59 HydrophobicContact CB-CZ 3.63Å
58	N	93.2	Very high	93.2	Very high	79 Å²	79	47 Å²	47	42%	0.422	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	136.8	165.7	-68	-53.9	0	0	0	109.9	Q51 T52	Q51-N58 HydrophobicContact CG-CB 4.31Å; Q51-N58 PolarHBondContact NE2-OD1 3.26Å; T52-N58 WeakPolarHBondContact O-CA 3.18Å
59	F	94.7	Very high	93.4	Very high	29 Å²	29	47.2 Å²	47.2	13%	0.127	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	153.4	177.8	-59.2	-80.3	0	0	0	110.5	Q51 T52 N57 K71 T72 T73	Q51-F59 CarbonylContact C-O 3.23Å; Q51-F59 VanDerWaalsContact CA-O 3.25Å; Q51-F59 WeakPolarHBondContact CA-O 2.84Å; T52-F59 HydrophobicContact CG2-CB 4.07Å; T52-F59 PolarHBondContact N-O 2.74Å; T52-F59 PolarHBondContact O-N 3.05Å; T52-F59 VanDerWaalsContact O-O 3.09Å; N57-F59 HydrophobicContact CB-CD2 4.49Å; N57-F59 HydrophobicContact CB-CE1 4.24Å; N57-F59 HydrophobicContact CB-CE2 3.78Å; N57-F59 HydrophobicContact CB-CZ 3.63Å; F59-K71 HydrophobicContact CB-CB 4.08Å; F59-K71 HydrophobicContact CB-CD 4.35Å; F59-K71 HydrophobicContact CD1-CB 4.48Å; F59-K71 HydrophobicContact CD1-CD 4.04Å; F59-K71 HydrophobicContact CD1-CG 4.16Å; F59-K71 HydrophobicContact CD2-CD 4.3Å; F59-K71 HydrophobicContact CE1-CD 4.4Å; F59-K71 HydrophobicContact CG-CB 4.46Å; F59-K71 HydrophobicContact CG-CD 3.98Å; F59-K71 HydrophobicContact CG-CG 4.41Å; F59-T72 CarbonylContact C-O 3.5Å; F59-T72 VanDerWaalsContact CA-O 3.26Å; F59-T72 WeakPolarHBondContact CA-O 3.29Å; F59-T73 HydrophobicContact CD1-CG2 3.56Å; F59-T73 HydrophobicContact CE1-CG2 3.45Å; F59-T73 VanDerWaalsContact CE1-CG2 3.45Å; F59-T73 HydrophobicContact CZ-CG2 4.44Å
60	Y	96.4	Very high	93.3	Very high	18 Å²	18	48.8 Å²	48.8	7%	0.071	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.7	176.1	-53.7	-80	0	0	0	108.9	H49 L50 Q51 E62 K71 T72 R75 E168	H49-Y60 HydrophobicContact CB-CD1 3.69Å; H49-Y60 HydrophobicContact CB-CE1 4.15Å; L50-Y60 WeakPolarHBondContact O-CA 3.2Å; Q51-Y60 HydrophobicContact CB-CD1 3.76Å; Q51-Y60 HydrophobicContact CB-CE1 3.65Å; Q51-Y60 HydrophobicContact CG-CD1 4.09Å; Q51-Y60 HydrophobicContact CG-CE1 3.7Å; Y60-E62 PolarHBondContact O-N 3.12Å; Y60-K71 WeakPolarHBondContact O-CA 3.35Å; Y60-T72 WeakPolarHBondContact CD2-O 3.42Å; Y60-T72 PolarHBondContact N-O 3.38Å; Y60-T72 PolarHBondContact O-N 3.11Å; Y60-R75 HydrophobicContact CD1-CG 4.45Å; Y60-R75 HydrophobicContact CD2-CG 4.16Å; Y60-R75 HydrophobicContact CE1-CG 4.01Å; Y60-R75 HydrophobicContact CE2-CG 3.73Å; Y60-R75 PolarHBondContact OH-NE 2.81Å; Y60-R75 PolarHBondContact OH-NH2 3.08Å; Y60-E168 WeakPolarHBondContact CE1-OE2 3.23Å; Y60-E168 PolarHBondContact OH-OE2 2.96Å
61	L	97.4	Very high	93.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	131.9	166.3	175.9	69.5	0	0	0	109.1	L50 V69 S79 M81 I93 L102 L146	L50-L61 HydrophobicContact CB-CB 4.11Å; L50-L61 HydrophobicContact CD1-CD2 3.94Å; L50-L61 PolarHBondContact O-N 3.13Å; L61-V69 HydrophobicContact CD1-CG1 3.61Å; L61-S79 WeakPolarHBondContact O-CA 3.41Å; L61-S79 VanDerWaalsContact O-CB 3.29Å; L61-S79 WeakPolarHBondContact O-CB 3.44Å; L61-M81 HydrophobicContact CB-CE 4.46Å; L61-M81 HydrophobicContact CD2-CE 4.13Å; L61-M81 HydrophobicContact CD2-CG 4.19Å; L61-M81 HydrophobicContact CD2-SD 4.02Å; L61-M81 HydrophobicContact CG-CE 3.96Å; L61-M81 HydrophobicContact CG-SD 4.5Å; L61-M81 VanDerWaalsContact O-CE 3.29Å; L61-M81 WeakPolarHBondContact O-CE 3.39Å; L61-I93 HydrophobicContact CD2-CG2 4.34Å; L61-L102 HydrophobicContact CD1-CD1 4.42Å; L61-L102 HydrophobicContact CD2-CD2 3.88Å; L61-L146 HydrophobicContact CB-CD1 4.29Å; L61-L146 HydrophobicContact CD1-CD2 3.63Å
62	E	97.3	Very high	93.2	Very high	37 Å²	37	52.8 Å²	52.8	17%	0.173	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.3	174.5	-175	172.7	68.9	0	0	110	Y60 V69 S70 T72 S76	Y60-E62 PolarHBondContact O-N 3.12Å; E62-V69 WeakPolarHBondContact O-CA 3.23Å; E62-S70 PolarHBondContact N-O 3.11Å; E62-S70 PolarHBondContact O-N 2.84Å; E62-S70 PolarHBondContact OE1-OG 3.49Å; E62-T72 HydrophobicContact CB-CG2 3.85Å; E62-T72 HydrophobicContact CG-CG2 4.44Å; E62-S76 PolarHBondContact OE2-OG 3.33Å
63	I	98	Very high	93.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	102.4	170.1	-55	174.2	0	0	0	106.5	V69 Y78 M81 S98 R100 L102	I63-V69 HydrophobicContact CG1-CG2 4.45Å; I63-Y78 PolarHBondContact N-O 3.27Å; I63-Y78 VanDerWaalsContact N-O 3.15Å; I63-Y78 WeakPolarHBondContact O-CD1 3.22Å; I63-M81 HydrophobicContact CB-CE 4.45Å; I63-M81 HydrophobicContact CD1-CE 4.25Å; I63-M81 HydrophobicContact CD1-SD 3.96Å; I63-M81 HydrophobicContact CG1-CE 3.95Å; I63-M81 HydrophobicContact CG1-SD 4.33Å; I63-S98 WeakPolarHBondContact CG2-OG 3.28Å; I63-S98 VanDerWaalsContact O-CB 3.29Å; I63-S98 WeakPolarHBondContact O-CB 3.33Å; I63-S98 PolarHBondContact O-OG 3.37Å; I63-R100 HydrophobicContact CG2-CB 4.07Å; I63-L102 HydrophobicContact CD1-CB 4.07Å
64	S	96.1	Very high	93.4	Very high	21 Å²	21	61.3 Å²	61.3	15%	0.147	34%	0.335	C	S	.	.			trans	-67.3	168.2	-178	60.8	0	0	0	0	112.1	N66 G67 H68 S98	S64-N66 VanDerWaalsContact C-N 3.3Å; S64-N66 WeakPolarHBondContact CB-OD1 3.31Å; S64-N66 PolarHBondContact O-N 3.47Å; S64-N66 PolarHBondContact OG-OD1 3.28Å; S64-G67 PolarHBondContact O-N 3.11Å; S64-H68 PolarHBondContact N-O 2.83Å; S64-H68 WeakPolarHBondContact OG-CA 3.39Å; S64-H68 VanDerWaalsContact OG-CB 3.3Å; S64-H68 WeakPolarHBondContact OG-CB 3.4Å; S64-H68 PolarHBondContact OG-N 2.94Å; S64-H68 PolarHBondContact OG-O 3.43Å; S64-H68 VanDerWaalsContact OG-O 3.06Å; S64-S98 VanDerWaalsContact O-CB 3.3Å; S64-S98 WeakPolarHBondContact O-CB 3.46Å
65	L	93.8	Very high	93.7	Very high	91 Å²	91	64.1 Å²	64.1	48%	0.476	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-38.4	-179.9	-170.4	62.7	0	0	0	113.1	G67 Y78	L65-G67 PolarHBondContact O-N 3.37Å; L65-Y78 HydrophobicContact CB-CE1 3.77Å; L65-Y78 HydrophobicContact CD1-CE1 4.4Å
66	N	93.9	Very high	94.3	Very high	129 Å²	129	57.9 Å²	57.9	69%	0.69	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-0.2	175.7	66.7	-17.4	0	0	0	113.2	S64 H68	S64-N66 VanDerWaalsContact C-N 3.3Å; S64-N66 WeakPolarHBondContact CB-OD1 3.31Å; S64-N66 PolarHBondContact O-N 3.47Å; S64-N66 PolarHBondContact OG-OD1 3.28Å; N66-H68 PolarHBondContact OD1-N 3.36Å
67	G	93.4	Very high	94.8	Very high	13 Å²	13	53.3 Å²	53.3	13%	0.134	28%	0.281	C	S	.	.			trans	83.9	11.4	176.9	0	0	0	0	0	115.1	S64 L65 S112	S64-G67 PolarHBondContact O-N 3.11Å; L65-G67 PolarHBondContact O-N 3.37Å; G67-S112 WeakPolarHBondContact CA-OG 3.41Å; G67-S112 WeakPolarHBondContact O-CB 3.2Å; G67-S112 PolarHBondContact O-OG 3.49Å
68	H	96.5	Very high	95.1	Very high	113 Å²	113	52.2 Å²	52.2	52%	0.523	27%	0.271	S	S	.	.			trans	-70.2	133.4	170.8	-175	-68.7	0	0	0	109.8	S64 N66	S64-H68 PolarHBondContact N-O 2.83Å; S64-H68 WeakPolarHBondContact OG-CA 3.39Å; S64-H68 VanDerWaalsContact OG-CB 3.3Å; S64-H68 WeakPolarHBondContact OG-CB 3.4Å; S64-H68 PolarHBondContact OG-N 2.94Å; S64-H68 PolarHBondContact OG-O 3.43Å; S64-H68 VanDerWaalsContact OG-O 3.06Å; N66-H68 PolarHBondContact OD1-N 3.36Å
69	V	97.1	Very high	95.3	Very high	22 Å²	22	48.5 Å²	48.5	13%	0.133	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.3	174.5	-176.3	0	0	0	0	108.9	L61 E62 I63 L102 P110 F111	L61-V69 HydrophobicContact CD1-CG1 3.61Å; E62-V69 WeakPolarHBondContact O-CA 3.23Å; I63-V69 HydrophobicContact CG1-CG2 4.45Å; V69-L102 HydrophobicContact CB-CD1 4.44Å; V69-L102 HydrophobicContact CG1-CD1 3.69Å; V69-L102 HydrophobicContact CG2-CD1 3.9Å; V69-P110 HydrophobicContact CB-CB 4.42Å; V69-P110 HydrophobicContact CG1-CB 4.06Å; V69-P110 HydrophobicContact CG1-CG 4.43Å; V69-F111 VanDerWaalsContact CG2-C 3.48Å
70	S	94.6	Very high	95.4	Very high	32 Å²	32	47.1 Å²	47.1	22%	0.224	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	173.7	-175.6	43.4	0	0	0	0	111.7	E62	E62-S70 PolarHBondContact N-O 3.11Å; E62-S70 PolarHBondContact O-N 2.84Å; E62-S70 PolarHBondContact OE1-OG 3.49Å
71	K	94.3	Very high	95.4	Very high	77 Å²	77	46.2 Å²	46.2	34%	0.335	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	141.6	166.9	69	179.5	179.2	175.8	0	110.1	F59 Y60 L146 E147	F59-K71 HydrophobicContact CB-CB 4.08Å; F59-K71 HydrophobicContact CB-CD 4.35Å; F59-K71 HydrophobicContact CD1-CB 4.48Å; F59-K71 HydrophobicContact CD1-CD 4.04Å; F59-K71 HydrophobicContact CD1-CG 4.16Å; F59-K71 HydrophobicContact CD2-CD 4.3Å; F59-K71 HydrophobicContact CE1-CD 4.4Å; F59-K71 HydrophobicContact CG-CB 4.46Å; F59-K71 HydrophobicContact CG-CD 3.98Å; F59-K71 HydrophobicContact CG-CG 4.41Å; Y60-K71 WeakPolarHBondContact O-CA 3.35Å; K71-L146 HydrophobicContact CB-CB 4.21Å; K71-L146 HydrophobicContact CB-CD1 4Å; K71-E147 IonicContact NZ-OE1 2.88Å; K71-E147 PolarHBondContact NZ-OE1 3.38Å
72	T	94.7	Very high	95.2	Very high	21 Å²	21	47.4 Å²	47.4	13%	0.129	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148.5	177.6	-176.5	0	0	0	0	110.5	F59 Y60 E62 L74	F59-T72 CarbonylContact C-O 3.5Å; F59-T72 VanDerWaalsContact CA-O 3.26Å; F59-T72 WeakPolarHBondContact CA-O 3.29Å; Y60-T72 WeakPolarHBondContact CD2-O 3.42Å; Y60-T72 PolarHBondContact N-O 3.38Å; Y60-T72 PolarHBondContact O-N 3.11Å; E62-T72 HydrophobicContact CB-CG2 3.85Å; E62-T72 HydrophobicContact CG-CG2 4.44Å; T72-L74 VanDerWaalsContact C-N 3.32Å; T72-L74 WeakPolarHBondContact CG2-O 3.34Å; T72-L74 PolarHBondContact OG1-N 2.88Å
73	T	94.8	Very high	95	Very high	78 Å²	78	48 Å²	48	48%	0.479	25%	0.252	S	S	.	.	S	Bend	trans	-86.6	-8.5	172.1	53.2	0	0	0	0	112.3	F59	F59-T73 HydrophobicContact CD1-CG2 3.56Å; F59-T73 HydrophobicContact CE1-CG2 3.45Å; F59-T73 VanDerWaalsContact CE1-CG2 3.45Å; F59-T73 HydrophobicContact CZ-CG2 4.44Å
74	L	93.2	Very high	94.8	Very high	121 Å²	121	51.8 Å²	51.8	63%	0.634	27%	0.268	S	S	*	.	S	Bend	trans	-103.1	137.8	-175.8	-59	177.3	0	0	0	110.8	T72 S76	T72-L74 VanDerWaalsContact C-N 3.32Å; T72-L74 WeakPolarHBondContact CG2-O 3.34Å; T72-L74 PolarHBondContact OG1-N 2.88Å; L74-S76 VanDerWaalsContact C-N 3.28Å; L74-S76 PolarHBondContact O-N 3.13Å
75	R	92.8	Very high	94.5	Very high	99 Å²	99	54.6 Å²	54.6	37%	0.374	29%	0.293	S	S	.	.			trans	-77	82.6	168	-65.4	-172.1	-164.7	171.2	8.2	109.5	Y60 E168	Y60-R75 HydrophobicContact CD1-CG 4.45Å; Y60-R75 HydrophobicContact CD2-CG 4.16Å; Y60-R75 HydrophobicContact CE1-CG 4.01Å; Y60-R75 HydrophobicContact CE2-CG 3.73Å; Y60-R75 PolarHBondContact OH-NE 2.81Å; Y60-R75 PolarHBondContact OH-NH2 3.08Å; R75-E168 IonicContact CZ-OE1 3.71Å; R75-E168 IonicContact CZ-OE2 2.88Å; R75-E168 IonicContact NE-OE2 3.6Å; R75-E168 PolarHBondContact NE-OE2 2.88Å; R75-E168 VanDerWaalsContact NE-OE2 3.14Å; R75-E168 IonicContact NH1-OE2 3.62Å; R75-E168 IonicContact NH2-OE1 2.85Å; R75-E168 PolarHBondContact NH2-OE1 2.96Å; R75-E168 IonicContact NH2-OE2 2.65Å; R75-E168 PolarHBondContact NH2-OE2 2.81Å
76	S	93.8	Very high	94.4	Very high	29 Å²	29	53.8 Å²	53.8	20%	0.203	29%	0.287	C	S	.	.			trans	-86.3	172.8	179.8	83	0	0	0	0	111.1	E62 L74 Y78 S79	E62-S76 PolarHBondContact OE2-OG 3.33Å; L74-S76 VanDerWaalsContact C-N 3.28Å; L74-S76 PolarHBondContact O-N 3.13Å; S76-Y78 PolarHBondContact O-N 2.89Å; S76-Y78 PolarHBondContact OG-N 3.44Å; S76-Y78 VanDerWaalsContact OG-N 3.1Å; S76-S79 PolarHBondContact N-OG 3.07Å; S76-S79 PolarHBondContact O-N 2.76Å; S76-S79 PolarHBondContact O-OG 2.87Å; S76-S79 PolarHBondContact OG-N 3.17Å
77	S	94.9	Very high	94.3	Very high	27 Å²	27	50.9 Å²	50.9	19%	0.189	27%	0.274	C	S	.	.	S	Bend	trans	-66.1	-26.5	168.8	46.5	0	0	0	0	112.4	K97	S77-K97 VanDerWaalsContact O-CB 3.24Å; S77-K97 WeakPolarHBondContact O-CB 3.12Å
78	Y	96.9	Very high	93.9	Very high	61 Å²	61	61.4 Å²	61.4	24%	0.239	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-14.3	179	-67.1	-77.6	0	0	0	113.7	I63 L65 S76 V80 M81 K97	I63-Y78 PolarHBondContact N-O 3.27Å; I63-Y78 VanDerWaalsContact N-O 3.15Å; I63-Y78 WeakPolarHBondContact O-CD1 3.22Å; L65-Y78 HydrophobicContact CB-CE1 3.77Å; L65-Y78 HydrophobicContact CD1-CE1 4.4Å; S76-Y78 PolarHBondContact O-N 2.89Å; S76-Y78 PolarHBondContact OG-N 3.44Å; S76-Y78 VanDerWaalsContact OG-N 3.1Å; Y78-V80 VanDerWaalsContact C-N 3.32Å; Y78-M81 WeakPolarHBondContact O-CE 3.48Å; Y78-K97 HydrophobicContact CD1-CB 3.87Å; Y78-K97 HydrophobicContact CD1-CG 3.65Å; Y78-K97 HydrophobicContact CE1-CB 4.12Å; Y78-K97 HydrophobicContact CE1-CG 3.41Å; Y78-K97 VanDerWaalsContact CE1-CG 3.41Å; Y78-K97 HydrophobicContact CE2-CG 4.34Å; Y78-K97 HydrophobicContact CG-CB 4.39Å; Y78-K97 HydrophobicContact CG-CG 4.21Å
79	S	96.9	Very high	93.6	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-0.6	172.2	68.4	0	0	0	0	113.7	H49 L61 S76 M81	H49-S79 PolarHBondContact CE1-OG 3.23Å; H49-S79 PolarHBondContact ND1-O 2.95Å; H49-S79 PolarHBondContact ND1-OG 3.18Å; L61-S79 WeakPolarHBondContact O-CA 3.41Å; L61-S79 VanDerWaalsContact O-CB 3.29Å; L61-S79 WeakPolarHBondContact O-CB 3.44Å; S76-S79 PolarHBondContact N-OG 3.07Å; S76-S79 PolarHBondContact O-N 2.76Å; S76-S79 PolarHBondContact O-OG 2.87Å; S76-S79 PolarHBondContact OG-N 3.17Å; S79-M81 PolarHBondContact O-N 3.47Å
80	V	96.1	Very high	93.5	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	119.9	176.5	-176.4	0	0	0	0	110.7	Y47 Y78 V96 N170 V172 L177	Y47-V80 HydrophobicContact CD1-CG1 4.37Å; Y47-V80 HydrophobicContact CG-CG1 3.98Å; Y78-V80 VanDerWaalsContact C-N 3.32Å; V80-V96 HydrophobicContact CG1-CB 4.22Å; V80-V96 HydrophobicContact CG1-CG2 4Å; V80-V96 PolarHBondContact O-N 2.81Å; V80-N170 HydrophobicContact CG1-CB 4.45Å; V80-N170 WeakPolarHBondContact CG2-OD1 3.48Å; V80-V172 HydrophobicContact CG2-CB 4.24Å; V80-V172 HydrophobicContact CG2-CG2 4.16Å; V80-L177 HydrophobicContact CB-CD2 4Å; V80-L177 HydrophobicContact CG1-CD1 3.99Å; V80-L177 HydrophobicContact CG1-CD2 4.32Å; V80-L177 HydrophobicContact CG2-CD2 3.75Å
81	M	96.2	Very high	93.6	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145.2	-178.2	-55.5	-60.7	149.7	0	0	111.1	Y47 V48 L50 L61 I63 Y78 S79 I93 L94	Y47-M81 WeakPolarHBondContact CA-O 3.43Å; V48-M81 HydrophobicContact CG2-CB 4.38Å; V48-M81 PolarHBondContact N-O 3.48Å; V48-M81 PolarHBondContact O-N 3.2Å; L50-M81 HydrophobicContact CD1-CG 4.4Å; L50-M81 HydrophobicContact CG-CG 4.37Å; L61-M81 HydrophobicContact CB-CE 4.46Å; L61-M81 HydrophobicContact CD2-CE 4.13Å; L61-M81 HydrophobicContact CD2-CG 4.19Å; L61-M81 HydrophobicContact CD2-SD 4.02Å; L61-M81 HydrophobicContact CG-CE 3.96Å; L61-M81 HydrophobicContact CG-SD 4.5Å; L61-M81 VanDerWaalsContact O-CE 3.29Å; L61-M81 WeakPolarHBondContact O-CE 3.39Å; I63-M81 HydrophobicContact CB-CE 4.45Å; I63-M81 HydrophobicContact CD1-CE 4.25Å; I63-M81 HydrophobicContact CD1-SD 3.96Å; I63-M81 HydrophobicContact CG1-CE 3.95Å; I63-M81 HydrophobicContact CG1-SD 4.33Å; Y78-M81 WeakPolarHBondContact O-CE 3.48Å; S79-M81 PolarHBondContact O-N 3.47Å; M81-I93 HydrophobicContact CB-CG2 4.17Å; M81-I93 HydrophobicContact CG-CG2 4.29Å; M81-I93 HydrophobicContact SD-CG2 4.25Å; M81-L94 CarbonylContact C-O 3.48Å; M81-L94 WeakPolarHBondContact CA-O 3.15Å
82	L	94.3	Very high	93.7	Very high	25 Å²	25	62.1 Å²	62.1	13%	0.131	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.2	166.6	177.6	65.6	0	0	0	108.7	Y47 K84 L94 V96	Y47-L82 HydrophobicContact CD1-CB 4.21Å; Y47-L82 HydrophobicContact CD1-CD1 4.2Å; Y47-L82 HydrophobicContact CE1-CB 4.26Å; Y47-L82 HydrophobicContact CE1-CD1 4.25Å; Y47-L82 HydrophobicContact CE1-CD2 4.5Å; L82-K84 HydrophobicContact CD2-CG 4.13Å; L82-K84 HydrophobicContact CG-CG 4.14Å; L82-L94 HydrophobicContact CB-CB 4.31Å; L82-L94 HydrophobicContact CD2-CD2 4.33Å; L82-L94 PolarHBondContact N-O 3.21Å; L82-L94 PolarHBondContact O-N 2.89Å; L82-V96 HydrophobicContact CB-CG2 3.82Å
83	L	93.6	Very high	93.8	Very high	49 Å²	49	61.1 Å²	61.1	26%	0.257	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	108.3	175.8	-56.6	-176.3	0	0	0	109.1	V48 L50 V91 I93	V48-L83 HydrophobicContact CG2-CD1 4.13Å; V48-L83 HydrophobicContact CG2-CG 4.01Å; L50-L83 HydrophobicContact CD1-CD2 4.31Å; L50-L83 HydrophobicContact CD2-CD2 4.43Å; L83-V91 HydrophobicContact CB-CG2 3.89Å; L83-V91 HydrophobicContact CD2-CG2 4.38Å; L83-I93 HydrophobicContact CD2-CB 4.39Å; L83-I93 HydrophobicContact CD2-CD1 4.45Å; L83-I93 HydrophobicContact CD2-CG1 3.8Å; L83-I93 HydrophobicContact CD2-CG2 4.14Å
84	K	92.5	Very high	93.9	Very high	79 Å²	79	58 Å²	58	34%	0.343	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	106.4	177.9	-64.9	-172.2	179.7	-178.5	0	109.4	L82 E86 V91 A92 Y101	L82-K84 HydrophobicContact CD2-CG 4.13Å; L82-K84 HydrophobicContact CG-CG 4.14Å; K84-E86 PolarHBondContact O-N 3.01Å; K84-V91 CarbonylContact O-C 3.42Å; K84-V91 WeakPolarHBondContact O-CA 3.47Å; K84-A92 HydrophobicContact CB-CB 4.37Å; K84-A92 PolarHBondContact N-O 3.09Å; K84-A92 PolarHBondContact O-N 2.78Å; K84-Y101 HydrophobicContact CD-CE1 4.3Å; K84-Y101 PolarHBondContact NZ-OH 3.21Å
85	A	91.3	Very high	94.1	Very high	80 Å²	80	52.2 Å²	52.2	66%	0.661	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.4	177.6	0	0	0	0	0	110.7
86	E	91	Very high	94.1	Very high	74 Å²	74	48.5 Å²	48.5	35%	0.346	24%	0.239	S	C	.	.	S	Bend	trans	-86.1	-44.1	166.1	-175.5	-168.7	-139.8	0	0	109.6	K84 R90 K118 L122	K84-E86 PolarHBondContact O-N 3.01Å; E86-R90 HydrophobicContact CB-CB 4.36Å; E86-R90 PolarHBondContact N-O 2.05Å; E86-K118 WeakPolarHBondContact OE1-CE 3.37Å; E86-K118 IonicContact OE1-NZ 2.77Å; E86-K118 PolarHBondContact OE1-NZ 3.38Å; E86-L122 HydrophobicContact CB-CD2 3.94Å; E86-L122 VanDerWaalsContact OE2-CD1 3.22Å; E86-L122 WeakPolarHBondContact OE2-CD1 3.39Å
87	T	90.6	Very high	94.2	Very high	69 Å²	69	48.6 Å²	48.6	42%	0.423	24%	0.236	S	C	.	.	S	Bend	trans	-136.8	-176.1	174.2	73.5	0	0	0	0	109.2	E89 R90	T87-E89 PolarHBondContact O-N 3.48Å; T87-E89 PolarHBondContact OG1-N 2.83Å; T87-R90 PolarHBondContact N-O 3.32Å; T87-R90 WeakPolarHBondContact OG1-CB 3.31Å; T87-R90 PolarHBondContact OG1-N 3.08Å; T87-R90 VanDerWaalsContact OG1-N 3.13Å
88	R	87	Confident	94.2	Very high	233 Å²	233	47.8 Å²	47.8	88%	0.879	23%	0.23	S	C	*	.	S	Bend	trans	-61.2	-27.5	174.8	-69.5	-174.8	175.9	-178.2	-1.1	113.3
89	E	89.9	Confident	94.1	Very high	131 Å²	131	50 Å²	50	61%	0.612	25%	0.246	S	C	*	.	S	Bend	trans	-114	-6.9	-172.8	-64.3	175.2	-175	0	0	112.2	T87 N124 H125	T87-E89 PolarHBondContact O-N 3.48Å; T87-E89 PolarHBondContact OG1-N 2.83Å; E89-N124 CarbonylContact O-C 3.58Å; E89-N124 WeakPolarHBondContact O-CA 3.26Å; E89-H125 PolarHBondContact O-N 2.66Å
90	R	94.3	Very high	94.1	Very high	113 Å²	113	53.2 Å²	53.2	43%	0.426	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.8	-176.3	-62.9	-178.7	-172.5	169.9	2.3	112.1	E86 T87 F123	E86-R90 HydrophobicContact CB-CB 4.36Å; E86-R90 PolarHBondContact N-O 2.05Å; T87-R90 PolarHBondContact N-O 3.32Å; T87-R90 WeakPolarHBondContact OG1-CB 3.31Å; T87-R90 PolarHBondContact OG1-N 3.08Å; T87-R90 VanDerWaalsContact OG1-N 3.13Å; R90-F123 CarbonylContact C-O 3.55Å; R90-F123 VanDerWaalsContact CA-O 3.29Å; R90-F123 WeakPolarHBondContact CA-O 3.29Å
91	V	95.7	Very high	94.2	Very high	8 Å²	8	54.7 Å²	54.7	5%	0.048	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	140.2	-174.3	62.2	0	0	0	0	110.9	L83 K84 F123 H125 Y135	L83-V91 HydrophobicContact CB-CG2 3.89Å; L83-V91 HydrophobicContact CD2-CG2 4.38Å; K84-V91 CarbonylContact O-C 3.42Å; K84-V91 WeakPolarHBondContact O-CA 3.47Å; V91-F123 HydrophobicContact CG1-CB 4.38Å; V91-F123 PolarHBondContact N-O 3.16Å; V91-F123 PolarHBondContact O-N 2.68Å; V91-H125 HydrophobicContact CG1-CB 3.82Å; V91-Y135 HydrophobicContact CG1-CD1 3.82Å; V91-Y135 HydrophobicContact CG1-CE1 3.82Å
92	A	96.9	Very high	94.4	Very high	8 Å²	8	54.7 Å²	54.7	7%	0.066	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	136.1	162.3	0	0	0	0	0	109	K84 Y101 L122	K84-A92 HydrophobicContact CB-CB 4.37Å; K84-A92 PolarHBondContact N-O 3.09Å; K84-A92 PolarHBondContact O-N 2.78Å; A92-Y101 HydrophobicContact CB-CD1 4.19Å; A92-Y101 HydrophobicContact CB-CE1 4.28Å; A92-L122 HydrophobicContact CB-CD2 4.12Å
93	I	97.4	Very high	94.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	116.2	-177.4	-57.6	172.6	0	0	0	107.7	L50 L61 M81 L83 Y101 L102 F123 Y135	L50-I93 HydrophobicContact CD1-CD1 4.08Å; L50-I93 HydrophobicContact CD1-CG2 4.03Å; L61-I93 HydrophobicContact CD2-CG2 4.34Å; M81-I93 HydrophobicContact CB-CG2 4.17Å; M81-I93 HydrophobicContact CG-CG2 4.29Å; M81-I93 HydrophobicContact SD-CG2 4.25Å; L83-I93 HydrophobicContact CD2-CB 4.39Å; L83-I93 HydrophobicContact CD2-CD1 4.45Å; L83-I93 HydrophobicContact CD2-CG1 3.8Å; L83-I93 HydrophobicContact CD2-CG2 4.14Å; I93-Y101 CarbonylContact O-C 3.53Å; I93-Y101 WeakPolarHBondContact O-CA 3.36Å; I93-L102 HydrophobicContact CB-CB 4.04Å; I93-L102 HydrophobicContact CB-CD2 4.34Å; I93-L102 HydrophobicContact CD1-CD2 4.01Å; I93-L102 HydrophobicContact CG2-CB 4.27Å; I93-L102 HydrophobicContact CG2-CD2 4.37Å; I93-L102 PolarHBondContact O-N 2.78Å; I93-F123 HydrophobicContact CD1-CD2 4.15Å; I93-F123 HydrophobicContact CG1-CD2 4.44Å; I93-Y135 HydrophobicContact CD1-CD1 4.08Å; I93-Y135 HydrophobicContact CD1-CE1 4.36Å; I93-Y135 HydrophobicContact CD1-CG 4.2Å
94	L	96.8	Very high	94.7	Very high	11 Å²	11	51.1 Å²	51.1	6%	0.058	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	122	-178.1	176.3	67	0	0	0	110.7	M81 L82 V96 Y101	M81-L94 CarbonylContact C-O 3.48Å; M81-L94 WeakPolarHBondContact CA-O 3.15Å; L82-L94 HydrophobicContact CB-CB 4.31Å; L82-L94 HydrophobicContact CD2-CD2 4.33Å; L82-L94 PolarHBondContact N-O 3.21Å; L82-L94 PolarHBondContact O-N 2.89Å; L94-V96 PolarHBondContact O-N 2.81Å; L94-Y101 HydrophobicContact CB-CD1 4.18Å; L94-Y101 HydrophobicContact CB-CE1 4.09Å; L94-Y101 HydrophobicContact CD1-CD1 4.16Å; L94-Y101 HydrophobicContact CD1-CD2 4.21Å; L94-Y101 HydrophobicContact CD1-CE1 4.11Å; L94-Y101 HydrophobicContact CD1-CE2 4.15Å; L94-Y101 HydrophobicContact CD1-CG 4.21Å
95	G	96.8	Very high	94.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	112.3	166	0	0	0	0	0	109.8	N99 R100	G95-N99 VanDerWaalsContact O-CA 3.28Å; G95-N99 WeakPolarHBondContact O-CA 3.14Å; G95-N99 PolarHBondContact O-N 3.21Å; G95-R100 PolarHBondContact N-O 3.24Å; G95-R100 PolarHBondContact O-N 2.85Å
96	V	94.3	Very high	95.2	Very high	22 Å²	22	48.6 Å²	48.6	13%	0.133	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-47.2	-169.5	178.2	0	0	0	0	110.8	Y47 V80 L82 L94 L177	Y47-V96 HydrophobicContact CD1-CB 4.49Å; Y47-V96 HydrophobicContact CD1-CG1 4.32Å; Y47-V96 HydrophobicContact CD1-CG2 3.48Å; Y47-V96 VanDerWaalsContact CD1-CG2 3.48Å; Y47-V96 HydrophobicContact CE1-CB 4.32Å; Y47-V96 HydrophobicContact CE1-CG1 3.78Å; Y47-V96 HydrophobicContact CE1-CG2 3.5Å; Y47-V96 HydrophobicContact CG-CG2 4.38Å; V80-V96 HydrophobicContact CG1-CB 4.22Å; V80-V96 HydrophobicContact CG1-CG2 4Å; V80-V96 PolarHBondContact O-N 2.81Å; L82-V96 HydrophobicContact CB-CG2 3.82Å; L94-V96 PolarHBondContact O-N 2.81Å; V96-L177 HydrophobicContact CG1-CB 4.1Å; V96-L177 HydrophobicContact CG1-CD1 4.34Å
97	K	94.4	Very high	95.4	Very high	31 Å²	31	51 Å²	51	14%	0.135	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-52.9	-179.7	-176.7	62.3	177.8	-171.9	0	110.5	S77 Y78 N99 R176 L177 L178 H179	S77-K97 VanDerWaalsContact O-CB 3.24Å; S77-K97 WeakPolarHBondContact O-CB 3.12Å; Y78-K97 HydrophobicContact CD1-CB 3.87Å; Y78-K97 HydrophobicContact CD1-CG 3.65Å; Y78-K97 HydrophobicContact CE1-CB 4.12Å; Y78-K97 HydrophobicContact CE1-CG 3.41Å; Y78-K97 VanDerWaalsContact CE1-CG 3.41Å; Y78-K97 HydrophobicContact CE2-CG 4.34Å; Y78-K97 HydrophobicContact CG-CB 4.39Å; Y78-K97 HydrophobicContact CG-CG 4.21Å; K97-N99 PolarHBondContact O-N 2.9Å; K97-R176 WeakPolarHBondContact CD-O 3.41Å; K97-R176 PolarHBondContact NZ-O 3.21Å; K97-L177 WeakPolarHBondContact CD-O 3.5Å; K97-L178 PolarHBondContact NZ-O 2.79Å; K97-H179 PolarHBondContact O-CE1 3.02Å; K97-H179 PolarHBondContact O-ND1 3.13Å
98	S	95.6	Very high	95.7	Very high	10 Å²	10	47.8 Å²	47.8	7%	0.07	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-13.3	-177.1	48.9	0	0	0	0	114.5	I63 S64 R100	I63-S98 WeakPolarHBondContact CG2-OG 3.28Å; I63-S98 VanDerWaalsContact O-CB 3.29Å; I63-S98 WeakPolarHBondContact O-CB 3.33Å; I63-S98 PolarHBondContact O-OG 3.37Å; S64-S98 VanDerWaalsContact O-CB 3.3Å; S64-S98 WeakPolarHBondContact O-CB 3.46Å; S98-R100 VanDerWaalsContact C-N 3.26Å; S98-R100 WeakPolarHBondContact O-CG 3.42Å; S98-R100 PolarHBondContact O-N 3.42Å
99	N	95.1	Very high	96.1	Very high	108 Å²	108	39.8 Å²	39.8	58%	0.578	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	43.6	-173.5	-163.8	34	0	0	0	112.8	G95 K97	G95-N99 VanDerWaalsContact O-CA 3.28Å; G95-N99 WeakPolarHBondContact O-CA 3.14Å; G95-N99 PolarHBondContact O-N 3.21Å; K97-N99 PolarHBondContact O-N 2.9Å
100	R	97.6	Very high	96.4	Very high	67 Å²	67	35.3 Å²	35.3	25%	0.253	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.3	-178	-71.5	173	178.6	-81.4	-4.7	111	I63 G95 S98 S112 S113 T114	I63-R100 HydrophobicContact CG2-CB 4.07Å; G95-R100 PolarHBondContact N-O 3.24Å; G95-R100 PolarHBondContact O-N 2.85Å; S98-R100 VanDerWaalsContact C-N 3.26Å; S98-R100 WeakPolarHBondContact O-CG 3.42Å; S98-R100 PolarHBondContact O-N 3.42Å; R100-S112 WeakPolarHBondContact CD-OG 3.19Å; R100-S113 CarbonylContact C-O 3.46Å; R100-S113 WeakPolarHBondContact CA-O 3.43Å; R100-T114 HydrophobicContact CG-CG2 4.14Å
101	Y	98.1	Very high	96.5	Very high	30 Å²	30	33.3 Å²	33.3	12%	0.118	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138.5	172.3	-67.1	-83.1	0	0	0	110.1	K84 A92 I93 L94 S112 S113 C116	K84-Y101 HydrophobicContact CD-CE1 4.3Å; K84-Y101 PolarHBondContact NZ-OH 3.21Å; A92-Y101 HydrophobicContact CB-CD1 4.19Å; A92-Y101 HydrophobicContact CB-CE1 4.28Å; I93-Y101 CarbonylContact O-C 3.53Å; I93-Y101 WeakPolarHBondContact O-CA 3.36Å; L94-Y101 HydrophobicContact CB-CD1 4.18Å; L94-Y101 HydrophobicContact CB-CE1 4.09Å; L94-Y101 HydrophobicContact CD1-CD1 4.16Å; L94-Y101 HydrophobicContact CD1-CD2 4.21Å; L94-Y101 HydrophobicContact CD1-CE1 4.11Å; L94-Y101 HydrophobicContact CD1-CE2 4.15Å; L94-Y101 HydrophobicContact CD1-CG 4.21Å; Y101-S112 CarbonylContact O-C 3.49Å; Y101-S112 WeakPolarHBondContact O-CA 3.26Å; Y101-S112 WeakPolarHBondContact O-CB 3.42Å; Y101-S113 PolarHBondContact N-O 2.87Å; Y101-S113 PolarHBondContact O-N 2.85Å; Y101-C116 HydrophobicContact CD1-CB 3.9Å; Y101-C116 HydrophobicContact CD2-CB 3.7Å; Y101-C116 HydrophobicContact CE1-CB 3.91Å; Y101-C116 HydrophobicContact CE2-CB 3.71Å; Y101-C116 HydrophobicContact CG-CB 3.79Å
102	L	98.5	Very high	96.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	132.8	162.9	-177.7	68.1	0	0	0	108.4	L61 I63 V69 I93 P110 F123 L144	L61-L102 HydrophobicContact CD1-CD1 4.42Å; L61-L102 HydrophobicContact CD2-CD2 3.88Å; I63-L102 HydrophobicContact CD1-CB 4.07Å; V69-L102 HydrophobicContact CB-CD1 4.44Å; V69-L102 HydrophobicContact CG1-CD1 3.69Å; V69-L102 HydrophobicContact CG2-CD1 3.9Å; I93-L102 HydrophobicContact CB-CB 4.04Å; I93-L102 HydrophobicContact CB-CD2 4.34Å; I93-L102 HydrophobicContact CD1-CD2 4.01Å; I93-L102 HydrophobicContact CG2-CB 4.27Å; I93-L102 HydrophobicContact CG2-CD2 4.37Å; I93-L102 PolarHBondContact O-N 2.78Å; L102-P110 HydrophobicContact CD1-CB 4.16Å; L102-F123 HydrophobicContact CB-CE2 4.38Å; L102-F123 HydrophobicContact CD2-CE2 4.14Å; L102-F123 HydrophobicContact CD2-CZ 4.13Å; L102-F123 HydrophobicContact CG-CE2 4.1Å; L102-F123 HydrophobicContact CG-CZ 4.05Å; L102-F123 WeakPolarHBondContact O-CE2 3.31Å; L102-L144 HydrophobicContact CD2-CD1 3.95Å; L102-L144 HydrophobicContact CD2-CD2 3.57Å; L102-L144 HydrophobicContact CD2-CG 4.43Å
103	C	98.1	Very high	96.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	166.3	178.1	-48.3	0	0	0	0	109.7	P110 F111 D120 C121	C103-P110 CarbonylContact O-C 3.45Å; C103-P110 VanDerWaalsContact O-CA 3.31Å; C103-P110 WeakPolarHBondContact O-CA 3.3Å; C103-F111 HydrophobicContact CB-CD1 4.09Å; C103-F111 HydrophobicContact CB-CD2 4.03Å; C103-F111 HydrophobicContact CB-CE1 3.65Å; C103-F111 HydrophobicContact CB-CE2 3.59Å; C103-F111 HydrophobicContact CB-CG 4.27Å; C103-F111 HydrophobicContact CB-CZ 3.39Å; C103-F111 PolarHBondContact N-O 3.13Å; C103-F111 PolarHBondContact O-N 3.45Å; C103-F111 VanDerWaalsContact O-O 3.09Å; C103-D120 CarbonylContact C-O 3.57Å; C103-D120 VanDerWaalsContact CA-O 3.28Å; C103-D120 WeakPolarHBondContact CA-O 3.39Å; C103-D120 HydrophobicContact CB-CB 4.04Å; C103-C121 HydrophobicContact CB-CB 3.99Å; C103-C121 WeakPolarHBondContact CB-SG 3.34Å; C103-C121 WeakPolarHBondContact SG-CB 3.15Å; C103-C121 CovalentContact SG-SG 2.05Å; C103-C121 PolarHBondContact SG-SG 3.35Å
104	M	97.9	Very high	96.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	126.9	-179.2	-174.6	179.3	-77	0	0	110.6	N109 D120 F123 R139 I142 L144	M104-N109 WeakPolarHBondContact CA-O 3.45Å; M104-D120 PolarHBondContact N-O 3.04Å; M104-F123 HydrophobicContact CB-CE1 3.92Å; M104-F123 HydrophobicContact CB-CZ 4.07Å; M104-F123 HydrophobicContact CE-CE1 3.98Å; M104-F123 HydrophobicContact SD-CE1 4.46Å; M104-R139 PolarHBondContact O-NH2 3.49Å; M104-I142 HydrophobicContact SD-CB 4.2Å; M104-I142 HydrophobicContact SD-CG2 4.29Å; M104-L144 HydrophobicContact CE-CB 4.1Å; M104-L144 HydrophobicContact CE-CD1 4Å
105	D	96.4	Very high	96.6	Very high	45 Å²	45	42.4 Å²	42.4	24%	0.241	24%	0.236	C	C	.	.			trans	-72.5	176.1	178.6	74.7	11.3	0	0	0	111.6	L107 G108 N109 F111 R139	D105-L107 PolarHBondContact O-N 3.29Å; D105-L107 VanDerWaalsContact OD1-C 3.28Å; D105-L107 VanDerWaalsContact OD1-CA 3.31Å; D105-L107 WeakPolarHBondContact OD1-CA 3.14Å; D105-L107 WeakPolarHBondContact OD1-CB 3.34Å; D105-L107 PolarHBondContact OD1-N 2.92Å; D105-G108 PolarHBondContact O-N 2.83Å; D105-G108 PolarHBondContact OD1-N 2.81Å; D105-N109 PolarHBondContact N-O 2.77Å; D105-N109 PolarHBondContact OD1-N 3.34Å; D105-N109 VanDerWaalsContact OD2-CB 3.32Å; D105-N109 WeakPolarHBondContact OD2-CB 3.42Å; D105-N109 PolarHBondContact OD2-ND2 2.82Å; D105-F111 HydrophobicContact CB-CD1 4.27Å; D105-F111 HydrophobicContact CB-CE1 4.13Å; D105-R139 VanDerWaalsContact C-NH2 3.28Å
106	A	96.4	Very high	96.5	Very high	60 Å²	60	44.6 Å²	44.6	50%	0.496	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.1	-179.6	0	0	0	0	0	113.3	G108 R139	A106-G108 VanDerWaalsContact C-N 3.34Å; A106-R139 VanDerWaalsContact N-NH2 3.12Å
107	L	96.1	Very high	96.6	Very high	125 Å²	125	47.4 Å²	47.4	65%	0.654	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-2.5	177.6	-57.6	177	0	0	0	112.2	D105 K150	D105-L107 PolarHBondContact O-N 3.29Å; D105-L107 VanDerWaalsContact OD1-C 3.28Å; D105-L107 VanDerWaalsContact OD1-CA 3.31Å; D105-L107 WeakPolarHBondContact OD1-CA 3.14Å; D105-L107 WeakPolarHBondContact OD1-CB 3.34Å; D105-L107 PolarHBondContact OD1-N 2.92Å; L107-K150 WeakPolarHBondContact O-CD 3.48Å; L107-K150 VanDerWaalsContact O-CE 3.31Å; L107-K150 WeakPolarHBondContact O-CE 3.44Å
108	G	95.6	Very high	96.6	Very high	2 Å²	2	51 Å²	51	2%	0.021	28%	0.28	C	S	.	.			trans	84	14.5	-179.1	0	0	0	0	0	114.3	D105 A106 K150	D105-G108 PolarHBondContact O-N 2.83Å; D105-G108 PolarHBondContact OD1-N 2.81Å; A106-G108 VanDerWaalsContact C-N 3.34Å; G108-K150 PolarHBondContact O-NZ 3.34Å
109	N	96.2	Very high	96.6	Very high	65 Å²	65	55.8 Å²	55.8	35%	0.348	30%	0.302	S	S	.	.			trans	-80.2	126.3	175	-53.9	-55.1	0	0	0	110.4	M104 D105 K150	M104-N109 WeakPolarHBondContact CA-O 3.45Å; D105-N109 PolarHBondContact N-O 2.77Å; D105-N109 PolarHBondContact OD1-N 3.34Å; D105-N109 VanDerWaalsContact OD2-CB 3.32Å; D105-N109 WeakPolarHBondContact OD2-CB 3.42Å; D105-N109 PolarHBondContact OD2-ND2 2.82Å; N109-K150 VanDerWaalsContact OD1-CE 3.23Å; N109-K150 WeakPolarHBondContact OD1-CE 3.3Å; N109-K150 PolarHBondContact OD1-NZ 3.02Å
110	P	96.1	Very high	96.7	Very high	36 Å²	36	51.7 Å²	51.7	23%	0.234	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	134.4	173.8	30.2	-32.7	0	0	0	109.9	V69 L102 C103 L144	V69-P110 HydrophobicContact CB-CB 4.42Å; V69-P110 HydrophobicContact CG1-CB 4.06Å; V69-P110 HydrophobicContact CG1-CG 4.43Å; L102-P110 HydrophobicContact CD1-CB 4.16Å; C103-P110 CarbonylContact O-C 3.45Å; C103-P110 VanDerWaalsContact O-CA 3.31Å; C103-P110 WeakPolarHBondContact O-CA 3.3Å; P110-L144 HydrophobicContact CB-CD1 4.14Å
111	F	96.8	Very high	96.7	Very high	71 Å²	71	48.6 Å²	48.6	31%	0.311	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	178.9	171.1	70.6	-85.7	0	0	0	108.9	V69 C103 D105 D120	V69-F111 VanDerWaalsContact CG2-C 3.48Å; C103-F111 HydrophobicContact CB-CD1 4.09Å; C103-F111 HydrophobicContact CB-CD2 4.03Å; C103-F111 HydrophobicContact CB-CE1 3.65Å; C103-F111 HydrophobicContact CB-CE2 3.59Å; C103-F111 HydrophobicContact CB-CG 4.27Å; C103-F111 HydrophobicContact CB-CZ 3.39Å; C103-F111 PolarHBondContact N-O 3.13Å; C103-F111 PolarHBondContact O-N 3.45Å; C103-F111 VanDerWaalsContact O-O 3.09Å; D105-F111 HydrophobicContact CB-CD1 4.27Å; D105-F111 HydrophobicContact CB-CE1 4.13Å; F111-D120 HydrophobicContact CE1-CB 4.28Å; F111-D120 HydrophobicContact CZ-CB 3.9Å
112	S	97.9	Very high	96.7	Very high	17 Å²	17	47.7 Å²	47.7	12%	0.119	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	150	174.7	78.8	0	0	0	0	112.9	G67 R100 Y101	G67-S112 WeakPolarHBondContact CA-OG 3.41Å; G67-S112 WeakPolarHBondContact O-CB 3.2Å; G67-S112 PolarHBondContact O-OG 3.49Å; R100-S112 WeakPolarHBondContact CD-OG 3.19Å; Y101-S112 CarbonylContact O-C 3.49Å; Y101-S112 WeakPolarHBondContact O-CA 3.26Å; Y101-S112 WeakPolarHBondContact O-CB 3.42Å
113	S	97.8	Very high	96.7	Very high	25 Å²	25	47.7 Å²	47.7	18%	0.175	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.1	179.9	179.8	0	0	0	0	110.6	R100 Y101 V115	R100-S113 CarbonylContact C-O 3.46Å; R100-S113 WeakPolarHBondContact CA-O 3.43Å; Y101-S113 PolarHBondContact N-O 2.87Å; Y101-S113 PolarHBondContact O-N 2.85Å; S113-V115 VanDerWaalsContact CB-O 3.31Å; S113-V115 WeakPolarHBondContact CB-O 3.43Å; S113-V115 PolarHBondContact OG-N 2.88Å; S113-V115 VanDerWaalsContact OG-N 3.16Å; S113-V115 PolarHBondContact OG-O 2.95Å
114	T	96.3	Very high	96.7	Very high	88 Å²	88	48.8 Å²	48.8	54%	0.54	27%	0.271	S	S	.	.	S	Bend	trans	-72.7	-22.7	171.2	48.9	0	0	0	0	112	R100	R100-T114 HydrophobicContact CG-CG2 4.14Å
115	V	95.8	Very high	96.5	Very high	89 Å²	89	49.9 Å²	49.9	54%	0.539	28%	0.276	S	S	.	.	S	Bend	trans	-110.2	132.9	178.8	-177.7	0	0	0	0	109.6	S113 L117	S113-V115 VanDerWaalsContact CB-O 3.31Å; S113-V115 WeakPolarHBondContact CB-O 3.43Å; S113-V115 PolarHBondContact OG-N 2.88Å; S113-V115 VanDerWaalsContact OG-N 3.16Å; S113-V115 PolarHBondContact OG-O 2.95Å; V115-L117 HydrophobicContact CG1-CD2 4.32Å; V115-L117 PolarHBondContact O-N 2.79Å
116	C	96.4	Very high	96.4	Very high	45 Å²	45	51.5 Å²	51.5	30%	0.304	28%	0.281	S	S	.	.			trans	-81.9	95.7	176.5	-171.2	0	0	0	0	110.4	Y101	Y101-C116 HydrophobicContact CD1-CB 3.9Å; Y101-C116 HydrophobicContact CD2-CB 3.7Å; Y101-C116 HydrophobicContact CE1-CB 3.91Å; Y101-C116 HydrophobicContact CE2-CB 3.71Å; Y101-C116 HydrophobicContact CG-CB 3.79Å
117	L	95.9	Very high	96.2	Very high	82 Å²	82	52.4 Å²	52.4	43%	0.429	28%	0.277	S	S	.	.			trans	-83.4	118.1	169.5	-62.2	179.1	0	0	0	109	V115 E119 D120 C121	V115-L117 HydrophobicContact CG1-CD2 4.32Å; V115-L117 PolarHBondContact O-N 2.79Å; L117-E119 HydrophobicContact CB-CG 4.35Å; L117-E119 PolarHBondContact O-N 2.94Å; L117-E119 VanDerWaalsContact O-N 3.11Å; L117-D120 PolarHBondContact O-N 2.94Å; L117-D120 VanDerWaalsContact O-N 3.08Å; L117-C121 WeakPolarHBondContact O-CB 3.42Å; L117-C121 PolarHBondContact O-N 3.24Å; L117-C121 PolarHBondContact O-SG 3.09Å
118	K	94.9	Very high	96	Very high	106 Å²	106	48.1 Å²	48.1	46%	0.461	26%	0.255	S	S	.	.	H	α-helix	trans	-55.1	-33.9	-173.1	-68.9	-159.8	-178.9	-157.7	0	113.8	E86 L122	E86-K118 WeakPolarHBondContact OE1-CE 3.37Å; E86-K118 IonicContact OE1-NZ 2.77Å; E86-K118 PolarHBondContact OE1-NZ 3.38Å; K118-L122 HydrophobicContact CB-CD1 3.69Å; K118-L122 HydrophobicContact CD-CD1 4.09Å; K118-L122 HydrophobicContact CG-CD1 3.81Å; K118-L122 WeakPolarHBondContact O-CB 3.28Å
119	E	94.8	Very high	95.8	Very high	111 Å²	111	57.2 Å²	57.2	52%	0.519	30%	0.297	S	S	.	.	H	α-helix	trans	-68	-32.8	-179.4	60.2	-168.6	163.4	0	0	114.1	L117 R139	L117-E119 HydrophobicContact CB-CG 4.35Å; L117-E119 PolarHBondContact O-N 2.94Å; L117-E119 VanDerWaalsContact O-N 3.11Å; E119-R139 WeakPolarHBondContact O-CB 3.39Å
120	D	97.4	Very high	95.4	Very high	22 Å²	22	58 Å²	58	12%	0.118	30%	0.301	C	S	.	.	H	α-helix	trans	-107.8	-33.3	-174.4	-67	-22.7	0	0	0	112.6	C103 M104 F111 L117 R139	C103-D120 CarbonylContact C-O 3.57Å; C103-D120 VanDerWaalsContact CA-O 3.28Å; C103-D120 WeakPolarHBondContact CA-O 3.39Å; C103-D120 HydrophobicContact CB-CB 4.04Å; M104-D120 PolarHBondContact N-O 3.04Å; F111-D120 HydrophobicContact CE1-CB 4.28Å; F111-D120 HydrophobicContact CZ-CB 3.9Å; L117-D120 PolarHBondContact O-N 2.94Å; L117-D120 VanDerWaalsContact O-N 3.08Å; D120-R139 IonicContact OD1-CZ 2.94Å; D120-R139 IonicContact OD1-NH1 2.68Å; D120-R139 PolarHBondContact OD1-NH1 2.77Å; D120-R139 IonicContact OD1-NH2 2.66Å; D120-R139 PolarHBondContact OD1-NH2 2.91Å
121	C	98.1	Very high	95.1	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.007	32%	0.322	C	S	.	.	H	α-helix	trans	-104.7	-2.2	-166	-48.7	0	0	0	0	114.2	C103 L117	C103-C121 HydrophobicContact CB-CB 3.99Å; C103-C121 WeakPolarHBondContact CB-SG 3.34Å; C103-C121 WeakPolarHBondContact SG-CB 3.15Å; C103-C121 CovalentContact SG-SG 2.05Å; C103-C121 PolarHBondContact SG-SG 3.35Å; L117-C121 WeakPolarHBondContact O-CB 3.42Å; L117-C121 PolarHBondContact O-N 3.24Å; L117-C121 PolarHBondContact O-SG 3.09Å
122	L	97.5	Very high	94.9	Very high	11 Å²	11	62.8 Å²	62.8	6%	0.058	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	134.5	171.1	-74.5	166.4	0	0	0	111.3	E86 A92 K118 C138	E86-L122 HydrophobicContact CB-CD2 3.94Å; E86-L122 VanDerWaalsContact OE2-CD1 3.22Å; E86-L122 WeakPolarHBondContact OE2-CD1 3.39Å; A92-L122 HydrophobicContact CB-CD2 4.12Å; K118-L122 HydrophobicContact CB-CD1 3.69Å; K118-L122 HydrophobicContact CD-CD1 4.09Å; K118-L122 HydrophobicContact CG-CD1 3.81Å; K118-L122 WeakPolarHBondContact O-CB 3.28Å; L122-C138 PolarHBondContact O-N 2.88Å; L122-C138 PolarHBondContact O-SG 2.88Å
123	F	98.2	Very high	94.7	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	140.3	175.7	-60.7	-89	0	0	0	109.6	R90 V91 I93 L102 M104 Y136 C138	R90-F123 CarbonylContact C-O 3.55Å; R90-F123 VanDerWaalsContact CA-O 3.29Å; R90-F123 WeakPolarHBondContact CA-O 3.29Å; V91-F123 HydrophobicContact CG1-CB 4.38Å; V91-F123 PolarHBondContact N-O 3.16Å; V91-F123 PolarHBondContact O-N 2.68Å; I93-F123 HydrophobicContact CD1-CD2 4.15Å; I93-F123 HydrophobicContact CG1-CD2 4.44Å; L102-F123 HydrophobicContact CB-CE2 4.38Å; L102-F123 HydrophobicContact CD2-CE2 4.14Å; L102-F123 HydrophobicContact CD2-CZ 4.13Å; L102-F123 HydrophobicContact CG-CE2 4.1Å; L102-F123 HydrophobicContact CG-CZ 4.05Å; L102-F123 WeakPolarHBondContact O-CE2 3.31Å; M104-F123 HydrophobicContact CB-CE1 3.92Å; M104-F123 HydrophobicContact CB-CZ 4.07Å; M104-F123 HydrophobicContact CE-CE1 3.98Å; M104-F123 HydrophobicContact SD-CE1 4.46Å; F123-Y136 CarbonylContact C-O 3.6Å; F123-Y136 VanDerWaalsContact CA-O 3.31Å; F123-Y136 WeakPolarHBondContact CA-O 3.26Å; F123-C138 VanDerWaalsContact C-SG 3.59Å
124	N	97.4	Very high	94.7	Very high	24 Å²	24	61.5 Å²	61.5	13%	0.128	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	141.9	159.4	-66.4	-59	0	0	0	108.7	E89 Y135 Y136 C138	E89-N124 CarbonylContact O-C 3.58Å; E89-N124 WeakPolarHBondContact O-CA 3.26Å; N124-Y135 VanDerWaalsContact O-CA 3.29Å; N124-Y135 WeakPolarHBondContact O-CA 3.41Å; N124-Y136 HydrophobicContact CB-CD1 4.08Å; N124-Y136 HydrophobicContact CB-CD2 3.78Å; N124-Y136 HydrophobicContact CB-CE1 3.65Å; N124-Y136 HydrophobicContact CB-CE2 3.34Å; N124-Y136 HydrophobicContact CB-CG 4.14Å; N124-Y136 PolarHBondContact N-O 2.88Å; N124-Y136 WeakPolarHBondContact ND2-CE2 3.31Å; N124-Y136 PolarHBondContact O-N 2.75Å; N124-Y136 VanDerWaalsContact O-N 3.08Å; N124-C138 PolarHBondContact N-SG 3.5Å
125	H	94.6	Very high	94.7	Very high	22 Å²	22	57.3 Å²	57.3	10%	0.102	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	132.3	-177.8	171.1	-140.2	0	0	0	110.1	W41 E89 V91 N133 V134 Y135	W41-H125 AromaticContact CE2-CE1 3.33Å; W41-H125 AromaticContact CE2-ND1 3.61Å; W41-H125 AromaticContact CH2-CE1 3.48Å; W41-H125 VanDerWaalsContact CH2-CE1 3.48Å; W41-H125 WeakPolarHBondContact CH2-CE1 3.28Å; W41-H125 AromaticContact CZ2-CE1 2.84Å; W41-H125 WeakPolarHBondContact CZ2-CE1 3.41Å; W41-H125 AromaticContact CZ2-ND1 3.18Å; W41-H125 WeakPolarHBondContact CZ2-ND1 3.49Å; W41-H125 AromaticContact CZ2-NE2 3.76Å; W41-H125 AromaticContact NE1-CE1 3.69Å; W41-H125 AromaticContact NE1-ND1 3.62Å; E89-H125 PolarHBondContact O-N 2.66Å; V91-H125 HydrophobicContact CG1-CB 3.82Å; H125-N133 PolarHBondContact NE2-OD1 3.39Å; H125-V134 WeakPolarHBondContact CA-O 3.45Å; H125-Y135 HydrophobicContact CB-CD1 4.02Å; H125-Y135 HydrophobicContact CB-CE1 3.97Å; H125-Y135 AromaticContact CD2-CD1 3.98Å; H125-Y135 AromaticContact CD2-CE1 3.41Å; H125-Y135 VanDerWaalsContact CD2-CE1 3.41Å; H125-Y135 WeakPolarHBondContact CD2-CE1 3.48Å; H125-Y135 AromaticContact CD2-CZ 3.86Å; H125-Y135 AromaticContact CG-CE1 3.71Å
126	K	93.4	Very high	94.8	Very high	79 Å²	79	55.2 Å²	55.2	34%	0.343	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136	173.8	-170.3	170	174.8	-178.1	0	110.9	L128 N133 V134 Y153	K126-L128 HydrophobicContact CG-CD2 4.49Å; K126-N133 WeakPolarHBondContact O-CA 3.31Å; K126-V134 HydrophobicContact CB-CG2 3.87Å; K126-V134 PolarHBondContact N-O 2.87Å; K126-V134 VanDerWaalsContact N-O 3.13Å; K126-V134 WeakPolarHBondContact O-CG2 3.38Å; K126-V134 PolarHBondContact O-N 2.76Å; K126-Y153 HydrophobicContact CD-CE1 4.41Å; K126-Y153 WeakPolarHBondContact CD-OH 3.45Å; K126-Y153 PolarHBondContact NZ-OH 3.41Å
127	L	92.6	Very high	94.9	Very high	79 Å²	79	53.1 Å²	53.1	41%	0.414	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.8	165.9	179.5	66.8	0	0	0	108.4	W41	W41-L127 HydrophobicContact CH2-CB 3.61Å; W41-L127 HydrophobicContact CZ3-CB 3.89Å; W41-L127 HydrophobicContact CZ3-CD2 3.94Å
128	L	91.9	Very high	94.9	Very high	35 Å²	35	51.2 Å²	51.2	18%	0.183	24%	0.244	C	C	.	.			trans	-87.5	166.2	177.2	-59.1	-177.5	0	0	0	111.1	K126 N130 H131 R132 V134 Y153 L159 L164	K126-L128 HydrophobicContact CG-CD2 4.49Å; L128-N130 VanDerWaalsContact CB-OD1 3.26Å; L128-N130 WeakPolarHBondContact CB-OD1 3.24Å; L128-N130 PolarHBondContact O-N 2.96Å; L128-H131 PolarHBondContact O-N 3.2Å; L128-R132 WeakPolarHBondContact CB-O 3.35Å; L128-R132 PolarHBondContact N-O 3.01Å; L128-V134 HydrophobicContact CD1-CG1 3.65Å; L128-V134 HydrophobicContact CD2-CG2 4.09Å; L128-V134 HydrophobicContact CG-CG1 4.13Å; L128-V134 HydrophobicContact CG-CG2 4.23Å; L128-Y153 HydrophobicContact CD2-CE2 4.48Å; L128-L159 HydrophobicContact CD1-CD1 3.87Å; L128-L164 HydrophobicContact CD1-CD2 3.67Å
129	E	91.1	Very high	94.9	Very high	193 Å²	193	51.2 Å²	51.2	90%	0.902	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.7	178.5	-63.1	177.4	-175.5	0	0	113.1	H131	E129-H131 PolarHBondContact O-CE1 2.82Å; E129-H131 PolarHBondContact O-N 3.25Å; E129-H131 VanDerWaalsContact O-N 3.17Å; E129-H131 PolarHBondContact O-ND1 2.94Å
130	N	88.5	Confident	95	Very high	83 Å²	83	48 Å²	48	44%	0.444	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	12.7	174.4	69	-0.5	0	0	0	113.5	L128 R132	L128-N130 VanDerWaalsContact CB-OD1 3.26Å; L128-N130 WeakPolarHBondContact CB-OD1 3.24Å; L128-N130 PolarHBondContact O-N 2.96Å; N130-R132 PolarHBondContact O-N 2.96Å; N130-R132 VanDerWaalsContact OD1-CB 3.29Å; N130-R132 WeakPolarHBondContact OD1-CB 3.29Å; N130-R132 PolarHBondContact OD1-N 2.84Å; N130-R132 VanDerWaalsContact OD1-N 3.07Å
131	H	90.1	Very high	95	Very high	146 Å²	146	47.9 Å²	47.9	68%	0.676	23%	0.233	S	C	*	.	S	Bend	trans	60	22.1	-178.9	-53.6	80	0	0	0	114.2	L128 E129	L128-H131 PolarHBondContact O-N 3.2Å; E129-H131 PolarHBondContact O-CE1 2.82Å; E129-H131 PolarHBondContact O-N 3.25Å; E129-H131 VanDerWaalsContact O-N 3.17Å; E129-H131 PolarHBondContact O-ND1 2.94Å
132	R	92.8	Very high	95	Very high	60 Å²	60	48.9 Å²	48.9	23%	0.226	24%	0.238	C	C	.	.			trans	-103.9	145.8	171.9	-59.4	-71.7	-173.8	157	2.2	110.5	L128 N130 L164 L166	L128-R132 WeakPolarHBondContact CB-O 3.35Å; L128-R132 PolarHBondContact N-O 3.01Å; N130-R132 PolarHBondContact O-N 2.96Å; N130-R132 VanDerWaalsContact OD1-CB 3.29Å; N130-R132 WeakPolarHBondContact OD1-CB 3.29Å; N130-R132 PolarHBondContact OD1-N 2.84Å; N130-R132 VanDerWaalsContact OD1-N 3.07Å; R132-L164 HydrophobicContact CB-CB 4Å; R132-L164 HydrophobicContact CB-CD2 4.43Å; R132-L164 HydrophobicContact CG-CB 4.21Å; R132-L166 VanDerWaalsContact NH1-CB 3.33Å
133	N	94.1	Very high	95	Very high	16 Å²	16	48.4 Å²	48.4	9%	0.086	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	142.9	173.5	-63.3	-61.2	0	0	0	110.3	H125 K126 Y135 F165 S167	H125-N133 PolarHBondContact NE2-OD1 3.39Å; K126-N133 WeakPolarHBondContact O-CA 3.31Å; N133-Y135 HydrophobicContact CB-CE2 3.97Å; N133-F165 HydrophobicContact CB-CB 4.43Å; N133-F165 PolarHBondContact N-O 2.89Å; N133-F165 PolarHBondContact O-N 2.84Å; N133-S167 PolarHBondContact ND2-OG 2.91Å
134	V	95.9	Very high	94.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144.2	165.9	-68.6	0	0	0	0	109.9	H125 K126 L128 L143 Y153 L159 L164	H125-V134 WeakPolarHBondContact CA-O 3.45Å; K126-V134 HydrophobicContact CB-CG2 3.87Å; K126-V134 PolarHBondContact N-O 2.87Å; K126-V134 VanDerWaalsContact N-O 3.13Å; K126-V134 WeakPolarHBondContact O-CG2 3.38Å; K126-V134 PolarHBondContact O-N 2.76Å; L128-V134 HydrophobicContact CD1-CG1 3.65Å; L128-V134 HydrophobicContact CD2-CG2 4.09Å; L128-V134 HydrophobicContact CG-CG1 4.13Å; L128-V134 HydrophobicContact CG-CG2 4.23Å; V134-L143 HydrophobicContact CB-CD2 4.28Å; V134-Y153 HydrophobicContact CG2-CD2 4.45Å; V134-Y153 HydrophobicContact CG2-CE2 4.14Å; V134-L159 HydrophobicContact CG1-CD1 3.66Å; V134-L164 HydrophobicContact CG1-CD2 3.58Å
135	Y	97.6	Very high	94.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.4	174.6	-56.5	-81.3	0	0	0	108.3	L50 V91 I93 N124 H125 N133 L144 F165	L50-Y135 HydrophobicContact CD1-CE2 4.36Å; L50-Y135 HydrophobicContact CD2-CE2 4.07Å; V91-Y135 HydrophobicContact CG1-CD1 3.82Å; V91-Y135 HydrophobicContact CG1-CE1 3.82Å; I93-Y135 HydrophobicContact CD1-CD1 4.08Å; I93-Y135 HydrophobicContact CD1-CE1 4.36Å; I93-Y135 HydrophobicContact CD1-CG 4.2Å; N124-Y135 VanDerWaalsContact O-CA 3.29Å; N124-Y135 WeakPolarHBondContact O-CA 3.41Å; H125-Y135 HydrophobicContact CB-CD1 4.02Å; H125-Y135 HydrophobicContact CB-CE1 3.97Å; H125-Y135 AromaticContact CD2-CD1 3.98Å; H125-Y135 AromaticContact CD2-CE1 3.41Å; H125-Y135 VanDerWaalsContact CD2-CE1 3.41Å; H125-Y135 WeakPolarHBondContact CD2-CE1 3.48Å; H125-Y135 AromaticContact CD2-CZ 3.86Å; H125-Y135 AromaticContact CG-CE1 3.71Å; N133-Y135 HydrophobicContact CB-CE2 3.97Å; Y135-L144 WeakPolarHBondContact O-CB 3.38Å; Y135-L144 PolarHBondContact O-N 2.96Å; Y135-F165 HydrophobicContact CD2-CB 4.4Å; Y135-F165 AromaticContact CD2-CD2 3.74Å; Y135-F165 HydrophobicContact CD2-CD2 3.74Å; Y135-F165 HydrophobicContact CD2-CE2 4.31Å; Y135-F165 HydrophobicContact CD2-CG 4.2Å; Y135-F165 HydrophobicContact CE2-CB 3.94Å; Y135-F165 HydrophobicContact CE2-CD2 4.15Å; Y135-F165 HydrophobicContact CE2-CG 4.15Å
136	Y	97.6	Very high	94.5	Very high	45 Å²	45	47.7 Å²	47.7	18%	0.176	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	147.5	177.7	55.5	-83.4	0	0	0	110.9	F123 N124 C138 I142 Y153	F123-Y136 CarbonylContact C-O 3.6Å; F123-Y136 VanDerWaalsContact CA-O 3.31Å; F123-Y136 WeakPolarHBondContact CA-O 3.26Å; N124-Y136 HydrophobicContact CB-CD1 4.08Å; N124-Y136 HydrophobicContact CB-CD2 3.78Å; N124-Y136 HydrophobicContact CB-CE1 3.65Å; N124-Y136 HydrophobicContact CB-CE2 3.34Å; N124-Y136 HydrophobicContact CB-CG 4.14Å; N124-Y136 PolarHBondContact N-O 2.88Å; N124-Y136 WeakPolarHBondContact ND2-CE2 3.31Å; N124-Y136 PolarHBondContact O-N 2.75Å; N124-Y136 VanDerWaalsContact O-N 3.08Å; Y136-C138 PolarHBondContact O-N 2.98Å; Y136-I142 CarbonylContact C-O 3.52Å; Y136-I142 WeakPolarHBondContact CA-O 3.29Å; Y136-I142 WeakPolarHBondContact CB-O 3.49Å; Y136-Y153 HydrophobicContact CD1-CD1 4.06Å; Y136-Y153 AromaticContact CD1-CG 3.91Å; Y136-Y153 HydrophobicContact CD1-CG 3.91Å; Y136-Y153 AromaticContact CE1-CD1 3.6Å; Y136-Y153 HydrophobicContact CE1-CD1 3.6Å; Y136-Y153 HydrophobicContact CE1-CE1 4.06Å; Y136-Y153 AromaticContact CE1-CG 3.93Å; Y136-Y153 HydrophobicContact CE1-CG 3.93Å; Y136-Y153 HydrophobicContact CE2-CD1 4.14Å; Y136-Y153 HydrophobicContact CG-CG 4.31Å; Y136-Y153 AromaticContact CZ-CD1 3.64Å
137	S	97.6	Very high	94.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	131.8	-177	175	0	0	0	0	111.1	R139 T140 G141 I142	S137-R139 PolarHBondContact O-N 2.79Å; S137-R139 PolarHBondContact OG-N 3.38Å; S137-R139 VanDerWaalsContact OG-N 3.11Å; S137-T140 VanDerWaalsContact CB-OG1 3.26Å; S137-T140 WeakPolarHBondContact CB-OG1 3.35Å; S137-T140 PolarHBondContact OG-N 3.35Å; S137-T140 PolarHBondContact OG-OG1 3.21Å; S137-G141 WeakPolarHBondContact O-CA 3.2Å; S137-G141 PolarHBondContact O-N 2.89Å; S137-I142 PolarHBondContact N-O 3.07Å
138	C	96.4	Very high	94.1	Very high	43 Å²	43	46 Å²	46	29%	0.291	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-27.9	170.5	-73.2	0	0	0	0	112.6	L122 F123 N124 Y136	L122-C138 PolarHBondContact O-N 2.88Å; L122-C138 PolarHBondContact O-SG 2.88Å; F123-C138 VanDerWaalsContact C-SG 3.59Å; N124-C138 PolarHBondContact N-SG 3.5Å; Y136-C138 PolarHBondContact O-N 2.98Å
139	R	95.8	Very high	94.1	Very high	106 Å²	106	47.9 Å²	47.9	40%	0.4	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-48.6	-177.9	-177.9	175.2	66	-160.1	-13.2	112.6	M104 D105 A106 E119 D120 S137	M104-R139 PolarHBondContact O-NH2 3.49Å; D105-R139 VanDerWaalsContact C-NH2 3.28Å; A106-R139 VanDerWaalsContact N-NH2 3.12Å; E119-R139 WeakPolarHBondContact O-CB 3.39Å; D120-R139 IonicContact OD1-CZ 2.94Å; D120-R139 IonicContact OD1-NH1 2.68Å; D120-R139 PolarHBondContact OD1-NH1 2.77Å; D120-R139 IonicContact OD1-NH2 2.66Å; D120-R139 PolarHBondContact OD1-NH2 2.91Å; S137-R139 PolarHBondContact O-N 2.79Å; S137-R139 PolarHBondContact OG-N 3.38Å; S137-R139 VanDerWaalsContact OG-N 3.11Å
140	T	96.7	Very high	94.3	Very high	43 Å²	43	42.8 Å²	42.8	26%	0.264	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-13.3	-169.4	61.3	0	0	0	0	114.1	S137 I142	S137-T140 VanDerWaalsContact CB-OG1 3.26Å; S137-T140 WeakPolarHBondContact CB-OG1 3.35Å; S137-T140 PolarHBondContact OG-N 3.35Å; S137-T140 PolarHBondContact OG-OG1 3.21Å; T140-I142 PolarHBondContact O-N 3Å; T140-I142 WeakPolarHBondContact OG1-CG1 3.31Å; T140-I142 PolarHBondContact OG1-N 3.3Å
141	G	96.7	Very high	94.7	Very high	19 Å²	19	40.6 Å²	40.6	20%	0.196	21%	0.206	C	C	.	.			trans	72.8	0.6	-173.1	0	0	0	0	0	114.5	S137 V152 Y153	S137-G141 WeakPolarHBondContact O-CA 3.2Å; S137-G141 PolarHBondContact O-N 2.89Å; G141-V152 WeakPolarHBondContact O-CA 3.25Å; G141-Y153 PolarHBondContact O-N 2.95Å
142	I	97.7	Very high	95	Very high	22 Å²	22	37.3 Å²	37.3	11%	0.113	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-71.6	134.3	-179.5	-60.2	170.3	0	0	0	109.9	M104 Y136 S137 T140 V152	M104-I142 HydrophobicContact SD-CB 4.2Å; M104-I142 HydrophobicContact SD-CG2 4.29Å; Y136-I142 CarbonylContact C-O 3.52Å; Y136-I142 WeakPolarHBondContact CA-O 3.29Å; Y136-I142 WeakPolarHBondContact CB-O 3.49Å; S137-I142 PolarHBondContact N-O 3.07Å; T140-I142 PolarHBondContact O-N 3Å; T140-I142 WeakPolarHBondContact OG1-CG1 3.31Å; T140-I142 PolarHBondContact OG1-N 3.3Å; I142-V152 HydrophobicContact CG1-CG2 4.11Å
143	L	97.6	Very high	95.2	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-66.2	141.6	177.4	-71.4	159.2	0	0	0	111.8	V134 N145 Q151 Y153 L159	V134-L143 HydrophobicContact CB-CD2 4.28Å; L143-N145 PolarHBondContact O-N 3.2Å; L143-Q151 WeakPolarHBondContact CB-O 3.04Å; L143-Q151 HydrophobicContact CD1-CB 4.1Å; L143-Q151 HydrophobicContact CD1-CG 4.04Å; L143-Q151 WeakPolarHBondContact CG-O 3.49Å; L143-Q151 PolarHBondContact N-O 3.02Å; L143-Y153 HydrophobicContact CD2-CD2 4.1Å; L143-Y153 HydrophobicContact CD2-CG 4.45Å; L143-L159 HydrophobicContact CD1-CD2 3.86Å
144	L	97.1	Very high	95.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-66.4	120	162	-178.7	63.8	0	0	0	108.5	L102 M104 P110 Y135 S163 F165	L102-L144 HydrophobicContact CD2-CD1 3.95Å; L102-L144 HydrophobicContact CD2-CD2 3.57Å; L102-L144 HydrophobicContact CD2-CG 4.43Å; M104-L144 HydrophobicContact CE-CB 4.1Å; M104-L144 HydrophobicContact CE-CD1 4Å; P110-L144 HydrophobicContact CB-CD1 4.14Å; Y135-L144 WeakPolarHBondContact O-CB 3.38Å; Y135-L144 PolarHBondContact O-N 2.96Å; L144-S163 VanDerWaalsContact O-CA 3.31Å; L144-S163 WeakPolarHBondContact O-CA 3.26Å; L144-S163 WeakPolarHBondContact O-CB 3.41Å; L144-S163 PolarHBondContact O-OG 3.24Å; L144-F165 HydrophobicContact CB-CE2 4.31Å; L144-F165 HydrophobicContact CD2-CE2 4.07Å; L144-F165 HydrophobicContact CD2-CZ 3.94Å; L144-F165 HydrophobicContact CG-CE2 4.14Å; L144-F165 HydrophobicContact CG-CZ 4Å
145	N	94.7	Very high	95	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.027	24%	0.238	C	C	.	.			trans	-137.6	126.4	179	-169.8	-70.3	0	0	0	109.5	L143 E147 G148 I149 T162 S163	L143-N145 PolarHBondContact O-N 3.2Å; N145-E147 VanDerWaalsContact C-N 3.3Å; N145-E147 PolarHBondContact O-N 3.49Å; N145-E147 VanDerWaalsContact OD1-CA 3.32Å; N145-E147 WeakPolarHBondContact OD1-CA 3.5Å; N145-E147 WeakPolarHBondContact OD1-CB 3.32Å; N145-E147 PolarHBondContact OD1-N 3.14Å; N145-G148 PolarHBondContact OD1-N 3.05Å; N145-I149 VanDerWaalsContact CB-O 3.26Å; N145-I149 WeakPolarHBondContact CB-O 3.17Å; N145-I149 PolarHBondContact OD1-N 2.85Å; N145-T162 PolarHBondContact ND2-OG1 2.65Å; N145-T162 PolarHBondContact OD1-OG1 3.3Å; N145-S163 VanDerWaalsContact CB-OG 3.29Å; N145-S163 WeakPolarHBondContact CB-OG 3.39Å; N145-S163 PolarHBondContact ND2-OG 3.3Å
146	L	89.3	Confident	94.5	Very high	27 Å²	27	47.7 Å²	47.7	14%	0.141	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.5	-177.9	-54.9	-172.2	0	0	0	114.2	T52 L61 K71 F165	T52-L146 HydrophobicContact CG2-CD1 3.88Å; T52-L146 HydrophobicContact CG2-CG 4.46Å; L61-L146 HydrophobicContact CB-CD1 4.29Å; L61-L146 HydrophobicContact CD1-CD2 3.63Å; K71-L146 HydrophobicContact CB-CB 4.21Å; K71-L146 HydrophobicContact CB-CD1 4Å; L146-F165 HydrophobicContact CD1-CE1 4.09Å; L146-F165 HydrophobicContact CD2-CZ 4.42Å; L146-F165 HydrophobicContact CG-CE1 4.18Å; L146-F165 HydrophobicContact CG-CZ 4.13Å
147	E	89.4	Confident	94.2	Very high	83 Å²	83	50.2 Å²	50.2	39%	0.388	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	4.7	174.6	-65.4	-172.4	156.4	0	0	112.6	K71 N145 I149 T162	K71-E147 IonicContact NZ-OE1 2.88Å; K71-E147 PolarHBondContact NZ-OE1 3.38Å; N145-E147 VanDerWaalsContact C-N 3.3Å; N145-E147 PolarHBondContact O-N 3.49Å; N145-E147 VanDerWaalsContact OD1-CA 3.32Å; N145-E147 WeakPolarHBondContact OD1-CA 3.5Å; N145-E147 WeakPolarHBondContact OD1-CB 3.32Å; N145-E147 PolarHBondContact OD1-N 3.14Å; E147-I149 VanDerWaalsContact C-N 3.29Å; E147-I149 PolarHBondContact O-N 2.75Å; E147-T162 HydrophobicContact CG-CG2 3.74Å; E147-T162 WeakPolarHBondContact OE2-CG2 3.49Å; E147-T162 PolarHBondContact OE2-OG1 3.21Å
148	G	87.9	Confident	93.9	Very high	38 Å²	38	57.3 Å²	57.3	39%	0.392	33%	0.331	S	S	.	.			trans	81.2	3.4	174.8	0	0	0	0	0	114.7	N145 K150	N145-G148 PolarHBondContact OD1-N 3.05Å; G148-K150 WeakPolarHBondContact O-CD 3.5Å; G148-K150 WeakPolarHBondContact O-CE 3.29Å; G148-K150 PolarHBondContact O-N 3.02Å
149	I	92.1	Very high	93.8	Very high	76 Å²	76	56.6 Å²	56.6	39%	0.39	32%	0.324	S	S	.	.			trans	-63.7	121.6	174.6	-56.3	174.1	0	0	0	108.9	N145 E147 P160	N145-I149 VanDerWaalsContact CB-O 3.26Å; N145-I149 WeakPolarHBondContact CB-O 3.17Å; N145-I149 PolarHBondContact OD1-N 2.85Å; E147-I149 VanDerWaalsContact C-N 3.29Å; E147-I149 PolarHBondContact O-N 2.75Å; I149-P160 HydrophobicContact CD1-CB 4.16Å
150	K	95.4	Very high	93.6	Very high	85 Å²	85	52.7 Å²	52.7	37%	0.37	31%	0.312	S	S	.	.			trans	-95.4	108	177.6	-50.3	-51.6	-173.1	-161.3	0	109.2	L107 G108 N109 G148	L107-K150 WeakPolarHBondContact O-CD 3.48Å; L107-K150 VanDerWaalsContact O-CE 3.31Å; L107-K150 WeakPolarHBondContact O-CE 3.44Å; G108-K150 PolarHBondContact O-NZ 3.34Å; N109-K150 VanDerWaalsContact OD1-CE 3.23Å; N109-K150 WeakPolarHBondContact OD1-CE 3.3Å; N109-K150 PolarHBondContact OD1-NZ 3.02Å; G148-K150 WeakPolarHBondContact O-CD 3.5Å; G148-K150 WeakPolarHBondContact O-CE 3.29Å; G148-K150 PolarHBondContact O-N 3.02Å
151	Q	95.8	Very high	93.4	Very high	38 Å²	38	55.5 Å²	55.5	18%	0.178	32%	0.322	C	S	.	.			trans	-136.4	135	175.1	176.2	174.4	-6.8	0	0	109.7	L143 N158	L143-Q151 WeakPolarHBondContact CB-O 3.04Å; L143-Q151 HydrophobicContact CD1-CB 4.1Å; L143-Q151 HydrophobicContact CD1-CG 4.04Å; L143-Q151 WeakPolarHBondContact CG-O 3.49Å; L143-Q151 PolarHBondContact N-O 3.02Å; Q151-N158 PolarHBondContact NE2-O 3.25Å; Q151-N158 VanDerWaalsContact NE2-O 3.13Å
152	V	96.9	Very high	93.2	Very high	77 Å²	77	54.9 Å²	54.9	47%	0.467	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-78.5	136.1	173.3	178.3	0	0	0	0	109.3	G141 I142 T154	G141-V152 WeakPolarHBondContact O-CA 3.25Å; I142-V152 HydrophobicContact CG1-CG2 4.11Å; V152-T154 PolarHBondContact O-N 2.9Å
153	Y	96.5	Very high	93	Very high	31 Å²	31	53.8 Å²	53.8	12%	0.122	31%	0.309	C	S	.	.			trans	-68	122.7	177.1	177.3	-106.3	0	0	0	111.1	K126 L128 V134 Y136 G141 L143 V155 L159	K126-Y153 HydrophobicContact CD-CE1 4.41Å; K126-Y153 WeakPolarHBondContact CD-OH 3.45Å; K126-Y153 PolarHBondContact NZ-OH 3.41Å; L128-Y153 HydrophobicContact CD2-CE2 4.48Å; V134-Y153 HydrophobicContact CG2-CD2 4.45Å; V134-Y153 HydrophobicContact CG2-CE2 4.14Å; Y136-Y153 HydrophobicContact CD1-CD1 4.06Å; Y136-Y153 AromaticContact CD1-CG 3.91Å; Y136-Y153 HydrophobicContact CD1-CG 3.91Å; Y136-Y153 AromaticContact CE1-CD1 3.6Å; Y136-Y153 HydrophobicContact CE1-CD1 3.6Å; Y136-Y153 HydrophobicContact CE1-CE1 4.06Å; Y136-Y153 AromaticContact CE1-CG 3.93Å; Y136-Y153 HydrophobicContact CE1-CG 3.93Å; Y136-Y153 HydrophobicContact CE2-CD1 4.14Å; Y136-Y153 HydrophobicContact CG-CG 4.31Å; Y136-Y153 AromaticContact CZ-CD1 3.64Å; G141-Y153 PolarHBondContact O-N 2.95Å; L143-Y153 HydrophobicContact CD2-CD2 4.1Å; L143-Y153 HydrophobicContact CD2-CG 4.45Å; Y153-V155 HydrophobicContact CE1-CG2 4.11Å; Y153-L159 HydrophobicContact CD2-CD1 4.09Å; Y153-L159 HydrophobicContact CD2-CD2 4.29Å; Y153-L159 HydrophobicContact CE2-CD1 4.03Å
154	T	94.9	Very high	92.9	Very high	71 Å²	71	54 Å²	54	44%	0.436	31%	0.311	S	S	.	.			trans	-127.7	135.7	172.6	-50.3	0	0	0	0	109.4	V152 G156 Q157	V152-T154 PolarHBondContact O-N 2.9Å; T154-G156 PolarHBondContact O-N 3.11Å; T154-Q157 PolarHBondContact O-N 2.95Å; T154-Q157 PolarHBondContact OG1-OE1 2.92Å
155	V	90.8	Very high	92.9	Very high	107 Å²	107	54 Å²	54	65%	0.648	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	132.4	178.9	-177.2	0	0	0	0	109.9	Y153 Q157	Y153-V155 HydrophobicContact CE1-CG2 4.11Å; V155-Q157 VanDerWaalsContact C-N 3.26Å; V155-Q157 PolarHBondContact O-N 2.9Å
156	G	87.6	Confident	92.8	Very high	84 Å²	84	56.8 Å²	56.8	87%	0.866	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-2.4	179	0	0	0	0	0	115.1	T154	T154-G156 PolarHBondContact O-N 3.11Å
157	Q	91.6	Very high	93	Very high	98 Å²	98	57.5 Å²	57.5	46%	0.458	33%	0.332	S	S	.	.	S	Bend	trans	-85	146.3	175	-167.5	179	4.5	0	0	111.3	T154 V155 L159	T154-Q157 PolarHBondContact O-N 2.95Å; T154-Q157 PolarHBondContact OG1-OE1 2.92Å; V155-Q157 VanDerWaalsContact C-N 3.26Å; V155-Q157 PolarHBondContact O-N 2.9Å; Q157-L159 PolarHBondContact O-N 3.08Å
158	N	91.7	Very high	93.1	Very high	150 Å²	150	55.4 Å²	55.4	80%	0.802	32%	0.322	S	S	*	.			trans	-64.1	132.3	169.5	-69.3	-41.4	0	0	0	110.7	Q151	Q151-N158 PolarHBondContact NE2-O 3.25Å; Q151-N158 VanDerWaalsContact NE2-O 3.13Å
159	L	93.6	Very high	93.2	Very high	28 Å²	28	62 Å²	62	15%	0.147	34%	0.341	C	S	.	.			trans	-110.2	147.5	-179.2	-53.5	-177.1	0	0	0	110.2	L128 V134 L143 Y153 Q157 L164	L128-L159 HydrophobicContact CD1-CD1 3.87Å; V134-L159 HydrophobicContact CG1-CD1 3.66Å; L143-L159 HydrophobicContact CD1-CD2 3.86Å; Y153-L159 HydrophobicContact CD2-CD1 4.09Å; Y153-L159 HydrophobicContact CD2-CD2 4.29Å; Y153-L159 HydrophobicContact CE2-CD1 4.03Å; Q157-L159 PolarHBondContact O-N 3.08Å; L159-L164 HydrophobicContact CB-CD2 4.21Å; L159-L164 HydrophobicContact CD1-CD2 4.1Å
160	P	92.5	Very high	93	Very high	23 Å²	23	59.5 Å²	59.5	15%	0.149	33%	0.328	C	S	.	.			trans	-63.6	139.8	174.6	24.6	-33.1	0	0	0	109.7	I149 T162 S163	I149-P160 HydrophobicContact CD1-CB 4.16Å; P160-T162 PolarHBondContact O-N 3.39Å; P160-T162 VanDerWaalsContact O-N 3.11Å; P160-S163 PolarHBondContact O-N 2.88Å
161	Q	91.7	Very high	92.6	Very high	102 Å²	102	60.3 Å²	60.3	48%	0.477	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-55.3	-32.8	178.8	-65.7	-62.5	-38.1	0	0	111.8	T52 S53 S163 L164	T52-Q161 PolarHBondContact OG1-O 3.07Å; S53-Q161 WeakPolarHBondContact O-CB 3.13Å; Q161-S163 PolarHBondContact O-N 2.68Å; Q161-L164 WeakPolarHBondContact O-CB 3.24Å; Q161-L164 PolarHBondContact O-N 2.98Å
162	T	91.9	Very high	92.2	Very high	6 Å²	6	59.1 Å²	59.1	4%	0.037	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-75.9	-1.6	179.7	53.1	0	0	0	0	115.5	T52 N145 E147 P160	T52-T162 VanDerWaalsContact OG1-CA 3.26Å; T52-T162 WeakPolarHBondContact OG1-CA 3.48Å; N145-T162 PolarHBondContact ND2-OG1 2.65Å; N145-T162 PolarHBondContact OD1-OG1 3.3Å; E147-T162 HydrophobicContact CG-CG2 3.74Å; E147-T162 WeakPolarHBondContact OE2-CG2 3.49Å; E147-T162 PolarHBondContact OE2-OG1 3.21Å; P160-T162 PolarHBondContact O-N 3.39Å; P160-T162 VanDerWaalsContact O-N 3.11Å
163	S	94.8	Very high	91.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-105.3	-2.4	166.4	-70	0	0	0	0	113.7	L144 N145 P160 Q161 F165	L144-S163 VanDerWaalsContact O-CA 3.31Å; L144-S163 WeakPolarHBondContact O-CA 3.26Å; L144-S163 WeakPolarHBondContact O-CB 3.41Å; L144-S163 PolarHBondContact O-OG 3.24Å; N145-S163 VanDerWaalsContact CB-OG 3.29Å; N145-S163 WeakPolarHBondContact CB-OG 3.39Å; N145-S163 PolarHBondContact ND2-OG 3.3Å; P160-S163 PolarHBondContact O-N 2.88Å; Q161-S163 PolarHBondContact O-N 2.68Å; S163-F165 WeakPolarHBondContact O-CD2 3.5Å; S163-F165 WeakPolarHBondContact O-CE2 3.32Å
164	L	95.2	Very high	91	Very high	6 Å²	6	60.8 Å²	60.8	3%	0.031	35%	0.346	C	S	.	.			trans	-95.5	126.4	175.9	-58.2	-178.6	0	0	0	109.3	T52 L128 R132 V134 L159 Q161	T52-L164 WeakPolarHBondContact CB-O 3.36Å; T52-L164 PolarHBondContact OG1-O 3.23Å; L128-L164 HydrophobicContact CD1-CD2 3.67Å; R132-L164 HydrophobicContact CB-CB 4Å; R132-L164 HydrophobicContact CB-CD2 4.43Å; R132-L164 HydrophobicContact CG-CB 4.21Å; V134-L164 HydrophobicContact CG1-CD2 3.58Å; L159-L164 HydrophobicContact CB-CD2 4.21Å; L159-L164 HydrophobicContact CD1-CD2 4.1Å; Q161-L164 WeakPolarHBondContact O-CB 3.24Å; Q161-L164 PolarHBondContact O-N 2.98Å
165	F	96	Very high	90.3	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-117.8	139.6	-175.7	-66.1	-86.8	0	0	0	112.2	L50 Q51 N133 Y135 L144 L146 S163	L50-F165 HydrophobicContact CB-CD1 3.94Å; Q51-F165 CarbonylContact O-C 3.59Å; Q51-F165 WeakPolarHBondContact O-CA 3.44Å; N133-F165 HydrophobicContact CB-CB 4.43Å; N133-F165 PolarHBondContact N-O 2.89Å; N133-F165 PolarHBondContact O-N 2.84Å; Y135-F165 HydrophobicContact CD2-CB 4.4Å; Y135-F165 AromaticContact CD2-CD2 3.74Å; Y135-F165 HydrophobicContact CD2-CD2 3.74Å; Y135-F165 HydrophobicContact CD2-CE2 4.31Å; Y135-F165 HydrophobicContact CD2-CG 4.2Å; Y135-F165 HydrophobicContact CE2-CB 3.94Å; Y135-F165 HydrophobicContact CE2-CD2 4.15Å; Y135-F165 HydrophobicContact CE2-CG 4.15Å; L144-F165 HydrophobicContact CB-CE2 4.31Å; L144-F165 HydrophobicContact CD2-CE2 4.07Å; L144-F165 HydrophobicContact CD2-CZ 3.94Å; L144-F165 HydrophobicContact CG-CE2 4.14Å; L144-F165 HydrophobicContact CG-CZ 4Å; L146-F165 HydrophobicContact CD1-CE1 4.09Å; L146-F165 HydrophobicContact CD2-CZ 4.42Å; L146-F165 HydrophobicContact CG-CE1 4.18Å; L146-F165 HydrophobicContact CG-CZ 4.13Å; S163-F165 WeakPolarHBondContact O-CD2 3.5Å; S163-F165 WeakPolarHBondContact O-CE2 3.32Å
166	L	94.4	Very high	89.9	Confident	62 Å²	62	66.6 Å²	66.6	33%	0.325	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.8	163.9	178.9	65.9	0	0	0	108.6	Q51 R132 E168	Q51-L166 HydrophobicContact CB-CB 4.4Å; Q51-L166 PolarHBondContact N-O 3.3Å; Q51-L166 PolarHBondContact O-N 3.03Å; R132-L166 VanDerWaalsContact NH1-CB 3.33Å; L166-E168 HydrophobicContact CD2-CG 4.05Å; L166-E168 HydrophobicContact CG-CG 4.11Å; L166-E168 PolarHBondContact O-N 3.29Å
167	S	93.1	Very high	89.6	Confident	42 Å²	42	62.9 Å²	62.9	29%	0.294	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	98.3	175.7	-62.4	0	0	0	0	109	N133	N133-S167 PolarHBondContact ND2-OG 2.91Å
168	E	91.6	Very high	89	Confident	39 Å²	39	61.5 Å²	61.5	18%	0.182	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	145.7	179.4	-69.4	-163.8	124.4	0	0	112	V48 H49 Q51 Y60 R75 L166 N170	V48-E168 CarbonylContact C-O 3.48Å; V48-E168 WeakPolarHBondContact CA-O 3.29Å; V48-E168 VanDerWaalsContact CB-O 3.3Å; V48-E168 WeakPolarHBondContact CB-O 3.22Å; H49-E168 HydrophobicContact CB-CB 4.42Å; H49-E168 PolarHBondContact N-O 2.88Å; H49-E168 PolarHBondContact O-N 2.89Å; Q51-E168 HydrophobicContact CB-CG 4.36Å; Q51-E168 PolarHBondContact OE1-OE1 3.13Å; Q51-E168 VanDerWaalsContact OE1-OE1 3.05Å; Q51-E168 PolarHBondContact OE1-OE2 3.26Å; Y60-E168 WeakPolarHBondContact CE1-OE2 3.23Å; Y60-E168 PolarHBondContact OH-OE2 2.96Å; R75-E168 IonicContact CZ-OE1 3.71Å; R75-E168 IonicContact CZ-OE2 2.88Å; R75-E168 IonicContact NE-OE2 3.6Å; R75-E168 PolarHBondContact NE-OE2 2.88Å; R75-E168 VanDerWaalsContact NE-OE2 3.14Å; R75-E168 IonicContact NH1-OE2 3.62Å; R75-E168 IonicContact NH2-OE1 2.85Å; R75-E168 PolarHBondContact NH2-OE1 2.96Å; R75-E168 IonicContact NH2-OE2 2.65Å; R75-E168 PolarHBondContact NH2-OE2 2.81Å; L166-E168 HydrophobicContact CD2-CG 4.05Å; L166-E168 HydrophobicContact CG-CG 4.11Å; L166-E168 PolarHBondContact O-N 3.29Å; E168-N170 PolarHBondContact O-N 2.64Å
169	K	88.7	Confident	87.7	Confident	178 Å²	178	59.7 Å²	59.7	77%	0.774	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	133.5	177.7	-174.6	-179.2	177.3	-177	0	110.7	T171	K169-T171 PolarHBondContact O-N 3.45Å
170	N	88.9	Confident	86	Confident	23 Å²	23	65.3 Å²	65.3	12%	0.123	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-65.3	132.9	172.4	179	43.9	0	0	0	112.3	Y47 H49 V80 E168 V172	Y47-N170 WeakPolarHBondContact O-CB 3.29Å; Y47-N170 PolarHBondContact O-N 2.77Å; H49-N170 PolarHBondContact NE2-OD1 3.01Å; V80-N170 HydrophobicContact CG1-CB 4.45Å; V80-N170 WeakPolarHBondContact CG2-OD1 3.48Å; E168-N170 PolarHBondContact O-N 2.64Å; N170-V172 PolarHBondContact ND2-O 3.2Å; N170-V172 VanDerWaalsContact OD1-CB 3.24Å; N170-V172 WeakPolarHBondContact OD1-CB 3.4Å; N170-V172 WeakPolarHBondContact OD1-CG2 3.49Å; N170-V172 PolarHBondContact OD1-N 3.46Å
171	T	87.3	Confident	84.2	Confident	102 Å²	102	71.1 Å²	71.1	63%	0.626	34%	0.341	S	S	*	.			trans	-112.6	-5.3	172.6	55.3	0	0	0	0	112.8	K169	K169-T171 PolarHBondContact O-N 3.45Å
172	V	86.3	Confident	82.3	Confident	12 Å²	12	73.9 Å²	73.9	7%	0.073	35%	0.351	C	S	.	.	S	Bend	trans	-72.2	127.6	177.1	-178.4	0	0	0	0	109.1	V80 N170 R176 L177	V80-V172 HydrophobicContact CG2-CB 4.24Å; V80-V172 HydrophobicContact CG2-CG2 4.16Å; N170-V172 PolarHBondContact ND2-O 3.2Å; N170-V172 VanDerWaalsContact OD1-CB 3.24Å; N170-V172 WeakPolarHBondContact OD1-CB 3.4Å; N170-V172 WeakPolarHBondContact OD1-CG2 3.49Å; N170-V172 PolarHBondContact OD1-N 3.46Å; V172-R176 HydrophobicContact CG1-CB 4.08Å; V172-L177 HydrophobicContact CB-CD2 4.39Å; V172-L177 HydrophobicContact CG1-CD2 3.88Å; V172-L177 HydrophobicContact CG1-CG 4.49Å
173	P	85.3	Confident	80.4	Confident	48 Å²	48	80.8 Å²	80.8	31%	0.312	38%	0.376	S	S	.	.			trans	-58.1	144.1	177.6	-23	33	0	0	0	112.5	E175 R176	P173-E175 WeakPolarHBondContact CB-OE2 3.32Å; P173-E175 PolarHBondContact O-N 2.96Å; P173-R176 PolarHBondContact O-N 3.43Å; P173-R176 VanDerWaalsContact O-N 3.13Å
174	L	82.6	Confident	78.6	Confident	96 Å²	96	86.8 Å²	86.8	50%	0.503	41%	0.409	S	S	.	.	H	α-helix	trans	-61.7	-32.8	-174.5	-65.1	-177.9	0	0	0	112.4	Y47 R176 L177 L178	Y47-L174 HydrophobicContact CD2-CD2 3.7Å; Y47-L174 HydrophobicContact CE2-CD2 3.58Å; L174-R176 PolarHBondContact O-N 3.15Å; L174-L177 HydrophobicContact CD2-CD1 4.16Å; L174-L177 WeakPolarHBondContact O-CB 3.36Å; L174-L177 PolarHBondContact O-N 3.1Å; L174-L178 PolarHBondContact O-N 2.87Å
175	E	80.4	Confident	76.9	Confident	146 Å²	146	92.9 Å²	92.9	68%	0.682	43%	0.431	S	S	*	.	H	α-helix	trans	-60.2	-30.6	-179.9	-56.9	71.4	-152.7	0	0	111.5	P173	P173-E175 WeakPolarHBondContact CB-OE2 3.32Å; P173-E175 PolarHBondContact O-N 2.96Å
176	R	82.2	Confident	75.2	Confident	154 Å²	154	97.8 Å²	97.8	58%	0.581	47%	0.472	S	S	*	.	H	α-helix	trans	-79	-21.5	177.3	-59.8	-165.8	-164.9	132.3	4	113.1	K97 V172 P173 L174	K97-R176 WeakPolarHBondContact CD-O 3.41Å; K97-R176 PolarHBondContact NZ-O 3.21Å; V172-R176 HydrophobicContact CG1-CB 4.08Å; P173-R176 PolarHBondContact O-N 3.43Å; P173-R176 VanDerWaalsContact O-N 3.13Å; L174-R176 PolarHBondContact O-N 3.15Å
177	L	83	Confident	73.9	Confident	6 Å²	6	99.6 Å²	99.6	3%	0.031	49%	0.485	C	S	.	.	H	α-helix	trans	-82.9	-33.3	-178.8	-54.9	-176.7	0	0	0	111.6	Y47 V80 V96 K97 V172 L174	Y47-L177 HydrophobicContact CD2-CD1 3.67Å; Y47-L177 HydrophobicContact CE2-CD1 3.92Å; Y47-L177 HydrophobicContact CG-CD1 4.31Å; V80-L177 HydrophobicContact CB-CD2 4Å; V80-L177 HydrophobicContact CG1-CD1 3.99Å; V80-L177 HydrophobicContact CG1-CD2 4.32Å; V80-L177 HydrophobicContact CG2-CD2 3.75Å; V96-L177 HydrophobicContact CG1-CB 4.1Å; V96-L177 HydrophobicContact CG1-CD1 4.34Å; K97-L177 WeakPolarHBondContact CD-O 3.5Å; V172-L177 HydrophobicContact CB-CD2 4.39Å; V172-L177 HydrophobicContact CG1-CD2 3.88Å; V172-L177 HydrophobicContact CG1-CG 4.49Å; L174-L177 HydrophobicContact CD2-CD1 4.16Å; L174-L177 WeakPolarHBondContact O-CB 3.36Å; L174-L177 PolarHBondContact O-N 3.1Å
178	L	77.4	Confident	72.8	Confident	69 Å²	69	101.7 Å²	101.7	36%	0.361	49%	0.493	S	S	.	.	S	Bend	trans	-66.8	137.3	178.2	-62.7	174.1	0	0	0	110.7	K97 L174 R180	K97-L178 PolarHBondContact NZ-O 2.79Å; L174-L178 PolarHBondContact O-N 2.87Å; L178-R180 PolarHBondContact O-N 2.8Å
179	H	64.4	Low	71.9	Confident	111 Å²	111	105.6 Å²	105.6	51%	0.514	52%	0.522	S	S	.	.			trans	-78.5	102.1	163.6	-92.6	86.4	0	0	0	106.8	K97 E181	K97-H179 PolarHBondContact O-CE1 3.02Å; K97-H179 PolarHBondContact O-ND1 3.13Å; H179-E181 PolarHBondContact O-N 2.73Å
180	R	58.9	Low	71.2	Confident	147 Å²	147	102.1 Å²	102.1	56%	0.555	52%	0.52	S	S	*	.			trans	-75.4	108	169.2	-177.5	176.3	161.6	-161.4	2.7	107.5	L178 K182 E230	L178-R180 PolarHBondContact O-N 2.8Å; R180-K182 PolarHBondContact O-N 3.23Å; R180-K182 VanDerWaalsContact O-N 3.08Å; R180-E230 WeakPolarHBondContact CD-OE2 3.11Å; R180-E230 IonicContact CZ-OE1 3.36Å; R180-E230 IonicContact CZ-OE2 3.14Å; R180-E230 IonicContact NE-OE1 3Å; R180-E230 IonicContact NE-OE2 2.88Å; R180-E230 PolarHBondContact NE-OE2 2.96Å; R180-E230 IonicContact NH1-OE1 2.99Å; R180-E230 PolarHBondContact NH1-OE1 3.01Å; R180-E230 IonicContact NH1-OE2 2.57Å; R180-E230 PolarHBondContact NH1-OE2 3.04Å; R180-E230 IonicContact NH2-OE1 3.39Å; R180-E230 PolarHBondContact NH2-OE1 2.93Å; R180-E230 IonicContact NH2-OE2 2.68Å
181	E	54.6	Low	70.6	Confident	145 Å²	145	102.1 Å²	102.1	68%	0.678	52%	0.52	S	S	*	.			trans	-63.3	110.5	168.8	-167.6	172.5	-153.5	0	0	108	H179 R183	H179-E181 PolarHBondContact O-N 2.73Å; E181-R183 VanDerWaalsContact C-N 3.3Å; E181-R183 PolarHBondContact O-N 2.78Å
182	K	51.6	Low	69.9	Low	160 Å²	160	101 Å²	101	70%	0.696	51%	0.514	S	S	*	.			trans	-72.8	92.3	173	-168.3	-178.9	-176.6	-177.5	0	106.4	R180 N184	R180-K182 PolarHBondContact O-N 3.23Å; R180-K182 VanDerWaalsContact O-N 3.08Å; K182-N184 VanDerWaalsContact CE-OD1 3.23Å; K182-N184 WeakPolarHBondContact CE-OD1 3.49Å; K182-N184 PolarHBondContact O-N 3.47Å
183	R	52.9	Low	69.2	Low	150 Å²	150	109.9 Å²	109.9	57%	0.566	55%	0.548	S	S	*	.			trans	-67.3	79.2	168	-70.2	-171.9	-166.5	157.9	5.1	108.6	E181 R185	E181-R183 VanDerWaalsContact C-N 3.3Å; E181-R183 PolarHBondContact O-N 2.78Å; R183-R185 PolarHBondContact O-N 3.37Å
184	N	55.9	Low	68.4	Low	126 Å²	126	111.8 Å²	111.8	67%	0.674	56%	0.555	S	S	*	*			trans	-75.9	47	155	-71.6	-12.2	0	0	0	108.7	K182	K182-N184 VanDerWaalsContact CE-OD1 3.23Å; K182-N184 WeakPolarHBondContact CE-OD1 3.49Å; K182-N184 PolarHBondContact O-N 3.47Å
185	R	60.3	Low	67.7	Low	135 Å²	135	115.1 Å²	115.1	51%	0.509	57%	0.57	S	S	.	*			trans	-79.2	127.7	165.7	-75.1	-174.7	178.9	-174.2	-5.3	105.3	R183 V187 E200	R183-R185 PolarHBondContact O-N 3.37Å; R185-V187 PolarHBondContact O-N 3.42Å; R185-E200 IonicContact CZ-OE1 2.84Å; R185-E200 IonicContact NH1-OE1 3.87Å; R185-E200 PolarHBondContact NH1-OE1 2.57Å; R185-E200 IonicContact NH2-OE1 3.24Å; R185-E200 PolarHBondContact NH2-OE1 3.26Å
186	A	59.9	Low	66.9	Low	103 Å²	103	115.4 Å²	115.4	85%	0.851	58%	0.576	S	S	*	*			trans	-52.3	113.1	167	0	0	0	0	0	106.4	D188	A186-D188 PolarHBondContact O-N 3.42Å
187	V	67.2	Low	65.6	Low	100 Å²	100	109.8 Å²	109.8	61%	0.606	57%	0.566	S	S	*	*			trans	-70.1	118.5	178.1	177.6	0	0	0	0	105.3	R185 P189 P192	R185-V187 PolarHBondContact O-N 3.42Å; V187-P189 VanDerWaalsContact O-CD 3.32Å; V187-P189 WeakPolarHBondContact O-CD 3.21Å; V187-P189 VanDerWaalsContact O-N 3.14Å; V187-P192 HydrophobicContact CG1-CB 4.45Å
188	D	68.8	Low	64	Low	86 Å²	86	116.6 Å²	116.6	46%	0.46	60%	0.598	S	S	.	*			trans	-57.5	119.2	171.3	-179.1	-8.2	0	0	0	107.5	A186 S190 D191	A186-D188 PolarHBondContact O-N 3.42Å; D188-S190 PolarHBondContact O-N 2.84Å; D188-S190 WeakPolarHBondContact OD1-CB 3.39Å; D188-S190 PolarHBondContact OD1-N 2.96Å; D188-S190 PolarHBondContact OD1-OG 3.31Å; D188-D191 CarbonylContact O-C 3.44Å; D188-D191 VanDerWaalsContact O-C 3.23Å; D188-D191 PolarHBondContact O-N 2.91Å
189	P	73.7	Confident	62.3	Low	121 Å²	121	119.5 Å²	119.5	79%	0.786	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-18.3	178.7	23.7	-32.9	0	0	0	112.9	V187	V187-P189 VanDerWaalsContact O-CD 3.32Å; V187-P189 WeakPolarHBondContact O-CD 3.21Å; V187-P189 VanDerWaalsContact O-N 3.14Å
190	S	74.8	Confident	61.5	Low	104 Å²	104	120.4 Å²	120.4	73%	0.727	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-23	175.9	-38.6	0	0	0	0	113.1	D188	D188-S190 PolarHBondContact O-N 2.84Å; D188-S190 WeakPolarHBondContact OD1-CB 3.39Å; D188-S190 PolarHBondContact OD1-N 2.96Å; D188-S190 PolarHBondContact OD1-OG 3.31Å
191	D	74.2	Confident	60.4	Low	23 Å²	23	122 Å²	122	12%	0.123	64%	0.636	C	S	.	*			trans	-135.8	71.2	176.2	-170.8	7	0	0	0	111.7	D188 Y193 N194 M195 L196	D188-D191 CarbonylContact O-C 3.44Å; D188-D191 VanDerWaalsContact O-C 3.23Å; D188-D191 PolarHBondContact O-N 2.91Å; D191-Y193 PolarHBondContact O-N 3.21Å; D191-Y193 VanDerWaalsContact O-N 3.07Å; D191-N194 VanDerWaalsContact CG-CA 3.43Å; D191-N194 PolarHBondContact O-N 2.9Å; D191-N194 VanDerWaalsContact O-N 3.08Å; D191-N194 WeakPolarHBondContact OD1-CA 3.35Å; D191-N194 PolarHBondContact OD1-N 2.86Å; D191-N194 WeakPolarHBondContact OD2-CA 3.3Å; D191-M195 PolarHBondContact OD1-N 3.06Å; D191-M195 PolarHBondContact OD2-N 3.26Å; D191-L196 WeakPolarHBondContact OD2-CB 3.46Å; D191-L196 PolarHBondContact OD2-N 3.06Å
192	P	72.6	Confident	59.6	Low	78 Å²	78	122.7 Å²	122.7	51%	0.506	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.9	-14.7	-177.9	23.5	-31.7	0	0	0	113.9	V187	V187-P192 HydrophobicContact CG1-CB 4.45Å
193	Y	73.5	Confident	59.1	Low	199 Å²	199	119.7 Å²	119.7	78%	0.78	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-1.7	179.3	-64.3	-73.5	0	0	0	113.1	D191 M195	D191-Y193 PolarHBondContact O-N 3.21Å; D191-Y193 VanDerWaalsContact O-N 3.07Å; Y193-M195 PolarHBondContact O-N 2.95Å
194	N	66.8	Low	58.3	Low	88 Å²	88	124.4 Å²	124.4	47%	0.471	66%	0.661	S	S	.	*			trans	50	39.9	-177.4	-161.2	41.5	0	0	0	112.4	D191 L196 G197	D191-N194 VanDerWaalsContact CG-CA 3.43Å; D191-N194 PolarHBondContact O-N 2.9Å; D191-N194 VanDerWaalsContact O-N 3.08Å; D191-N194 WeakPolarHBondContact OD1-CA 3.35Å; D191-N194 PolarHBondContact OD1-N 2.86Å; D191-N194 WeakPolarHBondContact OD2-CA 3.3Å; N194-L196 PolarHBondContact O-N 2.79Å; N194-G197 PolarHBondContact O-N 2.97Å
195	M	69.1	Low	57	Low	167 Å²	167	122.7 Å²	122.7	82%	0.823	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-20.5	179.1	-66	-147.4	-61.6	0	0	112.3	D191 Y193	D191-M195 PolarHBondContact OD1-N 3.06Å; D191-M195 PolarHBondContact OD2-N 3.26Å; Y193-M195 PolarHBondContact O-N 2.95Å
196	L	64	Low	55.6	Low	151 Å²	151	123.8 Å²	123.8	79%	0.791	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-1.1	178.6	-77.3	147.4	0	0	0	113.8	D191 N194 Q198	D191-L196 WeakPolarHBondContact OD2-CB 3.46Å; D191-L196 PolarHBondContact OD2-N 3.06Å; N194-L196 PolarHBondContact O-N 2.79Å; L196-Q198 PolarHBondContact O-N 2.95Å
197	G	53.5	Low	54.5	Low	36 Å²	36	124.3 Å²	124.3	37%	0.371	67%	0.673	S	S	.	*			trans	29.8	89.6	169.7	0	0	0	0	0	114.6	N194 T199	N194-G197 PolarHBondContact O-N 2.97Å; G197-T199 PolarHBondContact O-N 2.84Å
198	Q	49.9	Very low	52.9	Low	150 Å²	150	128.1 Å²	128.1	70%	0.701	68%	0.684	S	S	*	*			trans	-48	110.6	175.1	-72.9	-178.8	-13.3	0	0	109.9	L196 E200	L196-Q198 PolarHBondContact O-N 2.95Å; Q198-E200 VanDerWaalsContact C-N 3.34Å; Q198-E200 PolarHBondContact O-N 3.08Å; Q198-E200 VanDerWaalsContact O-N 3.09Å
199	T	42.5	Very low	51.4	Low	129 Å²	129	131 Å²	131	79%	0.791	70%	0.698	S	S	*	*			trans	-71.4	100.9	165	-26.4	0	0	0	0	103.7	G197 E201	G197-T199 PolarHBondContact O-N 2.84Å; T199-E201 PolarHBondContact O-N 3.24Å
200	E	45.9	Very low	49.4	Very low	131 Å²	131	133 Å²	133	61%	0.612	70%	0.703	S	S	*	*			trans	-62.8	98.8	169.9	-73.7	178.7	-166	0	0	106	R185 Q198 D202	R185-E200 IonicContact CZ-OE1 2.84Å; R185-E200 IonicContact NH1-OE1 3.87Å; R185-E200 PolarHBondContact NH1-OE1 2.57Å; R185-E200 IonicContact NH2-OE1 3.24Å; R185-E200 PolarHBondContact NH2-OE1 3.26Å; Q198-E200 VanDerWaalsContact C-N 3.34Å; Q198-E200 PolarHBondContact O-N 3.08Å; Q198-E200 VanDerWaalsContact O-N 3.09Å; E200-D202 VanDerWaalsContact C-N 3.33Å; E200-D202 PolarHBondContact O-N 3.35Å
201	E	35.8	Very low	47.3	Very low	179 Å²	179	134.9 Å²	134.9	84%	0.836	70%	0.704	S	S	*	*			trans	-59.8	102	166.8	-72.1	-174.5	152.1	0	0	107	T199 S203	T199-E201 PolarHBondContact O-N 3.24Å; E201-S203 PolarHBondContact O-N 2.96Å
202	D	38.4	Very low	45.1	Very low	161 Å²	161	140.1 Å²	140.1	86%	0.861	74%	0.737	S	S	*	*			trans	-57.6	80.5	164.4	-172.8	21.3	0	0	0	108.9	E200	E200-D202 VanDerWaalsContact C-N 3.33Å; E200-D202 PolarHBondContact O-N 3.35Å
203	S	42.2	Very low	43.2	Very low	96 Å²	96	143.4 Å²	143.4	67%	0.671	75%	0.75	S	S	*	*			trans	-167.7	94.4	172.8	-80	0	0	0	0	109.8	E201	E201-S203 PolarHBondContact O-N 2.96Å
204	R	34.5	Very low	41.3	Very low	249 Å²	249	142.1 Å²	142.1	94%	0.94	75%	0.751	S	S	*	*			trans	-155.1	94.4	144	-114.7	173.4	-97.7	-160.6	-2	111.3
205	A	29.9	Very low	39.5	Very low	90 Å²	90	144.7 Å²	144.7	74%	0.744	77%	0.77	S	S	*	*			trans	-53.5	145.6	156.1	0	0	0	0	0	110.6	P207	A205-P207 WeakPolarHBondContact O-CD 3.17Å
206	M	31.4	Very low	37.7	Very low	159 Å²	159	144.1 Å²	144.1	78%	0.783	77%	0.77	S	S	*	*			trans	-47.1	142.3	166.6	-95	-115.6	79.3	0	0	112.1
207	P	35.4	Very low	36.1	Very low	114 Å²	114	146.2 Å²	146.2	74%	0.74	78%	0.776	S	S	*	*			trans	-123.8	149.3	130.3	1.8	19.6	0	0	0	113.3	A205	A205-P207 WeakPolarHBondContact O-CD 3.17Å
208	Q	34.1	Very low	35.1	Very low	180 Å²	180	153.7 Å²	153.7	84%	0.841	80%	0.801	S	S	*	*			trans	-60.8	164.1	-177.8	-70.2	170.1	-47.3	0	0	114.5
209	L	37.3	Very low	34.2	Very low	146 Å²	146	151.5 Å²	151.5	76%	0.764	81%	0.808	S	S	*	*			trans	-44.6	150.3	176.4	-78.9	88.5	0	0	0	114.8
210	D	31	Very low	33.6	Very low	164 Å²	164	153.9 Å²	153.9	88%	0.877	81%	0.81	S	S	*	*				-163.1	147.6	117.3	-85.2	-21.5	0	0	0	111.7
211	D	30.4	Very low	33.2	Very low	143 Å²	143	154.1 Å²	154.1	77%	0.765	82%	0.815	S	S	*	*			trans	-64.4	144	-173	-72.6	-50.9	0	0	0	115.7
212	T	29.5	Very low	33.4	Very low	132 Å²	132	151.7 Å²	151.7	81%	0.81	82%	0.815	S	S	*	*				176.7	122.3	116.8	16	0	0	0	0	115
213	L	33.1	Very low	33.7	Very low	148 Å²	148	153 Å²	153	78%	0.775	82%	0.816	S	S	*	*			trans	30.2	125.5	143.8	-57.1	173.8	0	0	0	124.5
214	E	31.9	Very low	33.3	Very low	172 Å²	172	151.4 Å²	151.4	80%	0.804	81%	0.814	S	S	*	*			trans	59	128.1	135	-58.5	-172.3	-178.9	0	0	122.6
215	V	30.4	Very low	33.6	Very low	142 Å²	142	150.8 Å²	150.8	86%	0.861	81%	0.812	S	S	*	*				176.1	137.1	110.4	159.4	0	0	0	0	110.5
216	D	30.2	Very low	33.8	Very low	154 Å²	154	153.9 Å²	153.9	82%	0.824	82%	0.816	S	S	*	*			trans	-60.1	146.5	175.9	-65.9	-51.9	0	0	0	114.9
217	Q	30.1	Very low	34	Very low	196 Å²	196	153.9 Å²	153.9	92%	0.916	82%	0.817	S	S	*	*			trans	-158.7	120.2	136.6	-141.2	155.2	49.9	0	0	113.4
218	E	32.6	Very low	34.2	Very low	193 Å²	193	152.9 Å²	152.9	90%	0.902	81%	0.813	S	S	*	*			trans	-66.6	139.8	166.5	-63.4	178.5	117.4	0	0	111.1
219	A	31.1	Very low	35	Very low	104 Å²	104	156.2 Å²	156.2	86%	0.86	82%	0.818	S	S	*	*			trans	-148.7	122.5	158.4	0	0	0	0	0	110.1
220	E	31	Very low	35.2	Very low	178 Å²	178	154.7 Å²	154.7	83%	0.832	81%	0.807	S	S	*	*			trans	-79.2	137.5	-179	-63.8	-155.4	133.9	0	0	113.8
221	L	37.8	Very low	35.6	Very low	136 Å²	136	153.3 Å²	153.3	71%	0.712	81%	0.805	S	S	*	*			trans	49.9	142.8	136	-74.9	163.5	0	0	0	121.2
222	P	39.8	Very low	35.9	Very low	128 Å²	128	151.6 Å²	151.6	83%	0.831	80%	0.802	S	S	*	*				-144	159.2	77.2	32.6	-11.6	0	0	0	117.9	G224	P222-G224 PolarHBondContact O-N 2.5Å
223	E	44.6	Very low	36.4	Very low	190 Å²	190	152.1 Å²	152.1	89%	0.888	80%	0.795	S	S	*	*			trans	-57.5	122.7	176.5	-70.3	179.3	127.1	0	0	113.4
224	G	33.9	Very low	36.5	Very low	61 Å²	61	149.3 Å²	149.3	63%	0.629	79%	0.788	S	S	*	*			trans	-115.8	119.2	169.9	0	0	0	0	0	110.9	P222 N226	P222-G224 PolarHBondContact O-N 2.5Å; G224-N226 PolarHBondContact O-N 3.49Å
225	R	40.6	Very low	37.2	Very low	236 Å²	236	146.3 Å²	146.3	89%	0.891	78%	0.783	S	S	*	*			trans	-57.7	113.9	-177.1	-167	176.2	-176.1	177	1.3	112.2	I227	R225-I227 PolarHBondContact O-N 3.06Å
226	N	33.2	Very low	38.2	Very low	156 Å²	156	144.6 Å²	144.6	83%	0.834	78%	0.777	S	S	*	*			trans	-74	112.1	-179.8	-62.5	-48.3	0	0	0	111.6	G224	G224-N226 PolarHBondContact O-N 3.49Å
227	I	36.4	Very low	38.9	Very low	158 Å²	158	144.6 Å²	144.6	81%	0.81	78%	0.777	S	S	*	*			trans	-112.6	103.7	169.1	-33.2	170.9	0	0	0	107.3	R225	R225-I227 PolarHBondContact O-N 3.06Å
228	S	39.9	Very low	39.6	Very low	94 Å²	94	139.8 Å²	139.8	66%	0.657	76%	0.758	S	S	*	*			trans	-77.7	129.4	-177.8	-73.1	0	0	0	0	111.5
229	R	51.2	Low	40.2	Very low	250 Å²	250	135.1 Å²	135.1	94%	0.943	74%	0.744	S	S	*	*			trans	-132.8	131.1	165.5	-163.2	172.2	166.7	170.9	-4.9	109.3
230	E	39.8	Very low	41.2	Very low	113 Å²	113	138.5 Å²	138.5	53%	0.528	74%	0.735	S	S	.	*			trans	-117.9	141.6	-163	-46.8	-179.8	-169.3	0	0	111.1	R180	R180-E230 WeakPolarHBondContact CD-OE2 3.11Å; R180-E230 IonicContact CZ-OE1 3.36Å; R180-E230 IonicContact CZ-OE2 3.14Å; R180-E230 IonicContact NE-OE1 3Å; R180-E230 IonicContact NE-OE2 2.88Å; R180-E230 PolarHBondContact NE-OE2 2.96Å; R180-E230 IonicContact NH1-OE1 2.99Å; R180-E230 PolarHBondContact NH1-OE1 3.01Å; R180-E230 IonicContact NH1-OE2 2.57Å; R180-E230 PolarHBondContact NH1-OE2 3.04Å; R180-E230 IonicContact NH2-OE1 3.39Å; R180-E230 PolarHBondContact NH2-OE1 2.93Å; R180-E230 IonicContact NH2-OE2 2.68Å
231	T	40	Very low	42	Very low	136 Å²	136	136 Å²	136	83%	0.834	73%	0.727	S	S	*	*			trans	-124.3	125.9	168.4	-51.3	0	0	0	0	108.6
232	P	36.6	Very low	42.6	Very low	107 Å²	107	134.4 Å²	134.4	70%	0.695	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-74.9	128.1	-179.7	22.3	-23.3	0	0	0	111.3
233	Q	39.6	Very low	43	Very low	143 Å²	143	136.4 Å²	136.4	67%	0.668	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-92.1	126.9	172.5	-162.7	134.1	4.5	0	0	109.6
234	S	36.7	Very low	42.6	Very low	89 Å²	89	131.5 Å²	131.5	62%	0.622	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-81.7	132.2	174.1	-160.2	0	0	0	0	109.1	S236	S234-S236 PolarHBondContact O-N 2.86Å; S234-S236 VanDerWaalsContact O-N 3.09Å
235	P	45.4	Very low	42.9	Very low	109 Å²	109	136.7 Å²	136.7	71%	0.708	72%	0.72	S	S	*	*			trans	-76.4	101.7	175.6	29	-28.1	0	0	0	108.4
236	S	51.9	Low	42.9	Very low	105 Å²	105	132.8 Å²	132.8	73%	0.734	72%	0.717	S	S	*	*			trans	-105.4	72	173.3	178.2	0	0	0	0	109.4	S234	S234-S236 PolarHBondContact O-N 2.86Å; S234-S236 VanDerWaalsContact O-N 3.09Å
237	D	44.4	Very low	43.4	Very low	155 Å²	155	130.8 Å²	130.8	83%	0.829	71%	0.712	S	S	*	*			trans	-125.2	86.8	163	-70.5	-47.8	0	0	0	107.7	P239	D237-P239 WeakPolarHBondContact O-CD 3.26Å
238	D	44.9	Very low	43.9	Very low	94 Å²	94	128.6 Å²	128.6	50%	0.503	71%	0.708	S	S	.	*			trans	-91.3	110.8	169.7	179.4	15.9	0	0	0	109	W240	D238-W240 PolarHBondContact O-N 3.49Å; D238-W240 VanDerWaalsContact O-N 3.17Å; D238-W240 PolarHBondContact OD1-N 3.25Å; D238-W240 VanDerWaalsContact OD1-N 3.13Å
239	P	44.9	Very low	44	Very low	96 Å²	96	130.2 Å²	130.2	62%	0.623	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	0.2	-178.9	28.8	-32.1	0	0	0	113.8	D237	D237-P239 WeakPolarHBondContact O-CD 3.26Å
240	W	51.8	Low	43.4	Very low	175 Å²	175	123.5 Å²	123.5	66%	0.663	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	7.2	-176.6	-64	100.9	0	0	0	115.7	D238 V242	D238-W240 PolarHBondContact O-N 3.49Å; D238-W240 VanDerWaalsContact O-N 3.17Å; D238-W240 PolarHBondContact OD1-N 3.25Å; D238-W240 VanDerWaalsContact OD1-N 3.13Å; W240-V242 VanDerWaalsContact C-N 3.28Å; W240-V242 HydrophobicContact CB-CG2 4.13Å; W240-V242 WeakPolarHBondContact O-CG2 3.32Å; W240-V242 PolarHBondContact O-N 3.32Å
241	N	49	Very low	43.4	Very low	126 Å²	126	124 Å²	124	67%	0.674	72%	0.721	S	S	*	*			trans	38.7	47.1	165.2	-141.2	9.1	0	0	0	115.9	H243	N241-H243 VanDerWaalsContact C-N 3.31Å; N241-H243 PolarHBondContact O-N 2.99Å
242	V	50.6	Low	43.4	Very low	101 Å²	101	129.3 Å²	129.3	61%	0.612	73%	0.726	S	S	*	*			trans	-85.3	-3.5	-173.1	-163.6	0	0	0	0	112.7	W240	W240-V242 VanDerWaalsContact C-N 3.28Å; W240-V242 HydrophobicContact CB-CG2 4.13Å; W240-V242 WeakPolarHBondContact O-CG2 3.32Å; W240-V242 PolarHBondContact O-N 3.32Å
243	H	46.9	Very low	43.5	Very low	170 Å²	170	131.5 Å²	131.5	79%	0.787	73%	0.73	S	S	*	*			trans	-130.7	68.3	-176.2	-63.2	-47.3	0	0	0	112.3	N241	N241-H243 VanDerWaalsContact C-N 3.31Å; N241-H243 PolarHBondContact O-N 2.99Å
244	S	37.3	Very low	43.7	Very low	87 Å²	87	133.4 Å²	133.4	61%	0.608	74%	0.741	S	S	*	*			trans	-122.8	69.7	161.2	-71.7	0	0	0	0	110
245	L	39.1	Very low	43.7	Very low	170 Å²	170	136.3 Å²	136.3	89%	0.89	75%	0.75	S	S	*	*			trans	-107.7	101.4	152.6	-77.3	168.3	0	0	0	105.6	P247	L245-P247 VanDerWaalsContact O-CD 3.25Å; L245-P247 WeakPolarHBondContact O-CD 3.23Å; L245-P247 VanDerWaalsContact O-N 3.17Å
246	N	41.3	Very low	43.3	Very low	155 Å²	155	134.7 Å²	134.7	83%	0.829	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-52.7	117	175.6	-73.7	-28.5	0	0	0	109.4
247	P	44	Very low	42.5	Very low	114 Å²	114	138.9 Å²	138.9	74%	0.74	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-70.9	141.9	166.6	28.1	-29.4	0	0	0	109.1	L245	L245-P247 VanDerWaalsContact O-CD 3.25Å; L245-P247 WeakPolarHBondContact O-CD 3.23Å; L245-P247 VanDerWaalsContact O-N 3.17Å
248	P	46.2	Very low	42.2	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-66.9	152.9	179.1	27.7	-32.9	0	0	0	111.1	S250	P248-S250 PolarHBondContact O-N 3.49Å
249	P	42.6	Very low	41.8	Very low	129 Å²	129	143.8 Å²	143.8	84%	0.838	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-69.2	125.6	-179.1	27	-32.1	0	0	0	111.3
250	S	38.5	Very low	41.7	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-69.4	150.9	172.2	-77.7	0	0	0	0	112.3	P248	P248-S250 PolarHBondContact O-N 3.49Å
251	P	40.3	Very low	41.1	Very low	123 Å²	123	144.6 Å²	144.6	80%	0.799	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-76	141.5	-168.5	30.6	-33.6	0	0	0	112.6
252	R	40.3	Very low	40.7	Very low	247 Å²	247	145.7 Å²	145.7	93%	0.932	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-74.9	127.4	173.2	-68.1	-176.1	-173.9	-164	1.6	110.1	M254	R252-M254 PolarHBondContact O-N 3.27Å
253	I	38.1	Very low	40.1	Very low	153 Å²	153	148.3 Å²	148.3	79%	0.785	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-75.6	117.8	166	-63.8	173.6	0	0	0	107.5
254	M	42.7	Very low	39.7	Very low	183 Å²	183	146.9 Å²	146.9	90%	0.901	87%	0.867	S	S	*	*			trans	-96.8	105	173.2	-164.1	160.5	110.4	0	0	107.8	R252	R252-M254 PolarHBondContact O-N 3.27Å
255	N	37.6	Very low	39.8	Very low	150 Å²	150	150.9 Å²	150.9	80%	0.802	88%	0.884	S	S	*	*	P	Polyproline II helix	trans	-86.8	117.7	167.8	-86.5	-1	0	0	0	108.8
256	G	35.9	Very low	39.9	Very low	75 Å²	75	149.6 Å²	149.6	77%	0.773	88%	0.884	S	S	*	*	P	Polyproline II helix	trans	-67.7	139.1	175.6	0	0	0	0	0	112.1
257	M	35.5	Very low	39.8	Very low	194 Å²	194	149.2 Å²	149.2	96%	0.956	89%	0.888	S	S	*	*	P	Polyproline II helix	trans	-76.7	122.6	169.7	-131.6	147.2	77.3	0	0	108.1
258	M	39.6	Very low	39.4	Very low	201 Å²	201	152.1 Å²	152.1	99%	0.99	90%	0.9	S	S	*	*			trans	-112.9	119.1	164.3	-136.3	155.8	-173.8	0	0	105.8
259	G	35.7	Very low	38.8	Very low	150 Å²	150	155.8 Å²	155.8	100%	1.546	92%	0.917	S	S	*	*			trans	165.6	0	-175.5	0	0	0	0	0	109.5

Retrieved 259 of 259 residues in 997.4 ms (Link to these results)

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