A0A087Y5P1_POEFO Loading...

Asialoglycoprotein receptor-like 1

AlphaFold DB , UniProt , Accession A0A087Y5P1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 236 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	39.5	Very low	47.3	Very low	242 Å²	242	158.9 Å²	158.9	100%	1.192	81%	0.81	S	S	*	*				0	127.6	0	-159.6	164.9	-178.9	0	0	106.6
2	E	46.2	Very low	48.1	Very low	174 Å²	174	155.6 Å²	155.6	81%	0.813	80%	0.796	S	S	*	*			trans	-52.9	151.2	-169.5	-66.8	145.9	133.2	0	0	112.6
3	T	43	Very low	49	Very low	135 Å²	135	150.2 Å²	150.2	83%	0.828	78%	0.781	S	S	*	*				-169	125	70.9	28.3	0	0	0	0	109.4
4	Q	46.1	Very low	49.7	Very low	196 Å²	196	144.8 Å²	144.8	92%	0.916	76%	0.762	S	S	*	*			trans	-83.8	115.6	164.6	-88.4	-170	-43.4	0	0	108.5
5	Y	47.1	Very low	50.3	Low	219 Å²	219	142.4 Å²	142.4	86%	0.859	75%	0.749	S	S	*	*			trans	-87.5	111.1	169.8	-166.7	-95.2	0	0	0	108.4
6	Q	51.6	Low	51	Low	171 Å²	171	138.4 Å²	138.4	80%	0.799	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-89.5	130.5	168.2	-73.7	-157.6	-61.5	0	0	109.5	F8	Q6-F8 PolarHBondContact O-N 2.76Å
7	P	45.9	Very low	51.8	Low	112 Å²	112	136.6 Å²	136.6	73%	0.727	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-70.6	126.9	175.3	28.2	-30.2	0	0	0	109.5	S9	P7-S9 PolarHBondContact O-N 3.27Å
8	F	45.4	Very low	52.4	Low	203 Å²	203	131.3 Å²	131.3	89%	0.89	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-67	123.6	178.1	-156.8	-99.5	0	0	0	109.6	Q6	Q6-F8 PolarHBondContact O-N 2.76Å
9	S	46.8	Very low	52.9	Low	81 Å²	81	129.8 Å²	129.8	57%	0.566	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-57.2	138.7	-176.3	168.1	0	0	0	0	113	P7 T11	P7-S9 PolarHBondContact O-N 3.27Å; S9-T11 PolarHBondContact O-N 2.79Å; S9-T11 VanDerWaalsContact O-N 3.07Å; S9-T11 PolarHBondContact O-OG1 3.28Å
10	T	56	Low	53.5	Low	132 Å²	132	129.9 Å²	129.9	81%	0.81	68%	0.677	S	S	*	*			trans	-67.6	90.7	170.9	50.6	0	0	0	0	111
11	T	53.1	Low	54	Low	83 Å²	83	127.8 Å²	127.8	51%	0.509	67%	0.667	S	S	.	*			trans	-122.4	-3.3	171.9	27.8	0	0	0	0	114.3	S9 S14	S9-T11 PolarHBondContact O-N 2.79Å; S9-T11 VanDerWaalsContact O-N 3.07Å; S9-T11 PolarHBondContact O-OG1 3.28Å; T11-S14 PolarHBondContact O-OG 3.12Å
12	D	57.1	Low	55.3	Low	119 Å²	119	120.7 Å²	120.7	64%	0.636	63%	0.633	S	S	*	*	H	α-helix	trans	-82.3	-37.1	-172.6	-137.6	3.7	0	0	0	113.2	S14 L15 D16	D12-S14 VanDerWaalsContact C-N 3.34Å; D12-S14 PolarHBondContact O-N 3.23Å; D12-L15 PolarHBondContact O-N 3.27Å; D12-D16 PolarHBondContact O-N 3Å
13	S	58.8	Low	56.2	Low	86 Å²	86	116.4 Å²	116.4	60%	0.601	62%	0.622	S	S	*	*	H	α-helix	trans	-66.2	-29.7	-174.9	66.9	0	0	0	0	114.8	Q17	S13-Q17 WeakPolarHBondContact O-CB 3.5Å; S13-Q17 PolarHBondContact O-N 2.96Å; S13-Q17 VanDerWaalsContact O-N 3.15Å
14	S	58.9	Low	57.6	Low	74 Å²	74	116.5 Å²	116.5	52%	0.517	61%	0.613	S	S	.	*	H	α-helix	trans	-78.3	-32.8	-179.5	49.1	0	0	0	0	113	T11 D12 A18	T11-S14 PolarHBondContact O-OG 3.12Å; D12-S14 VanDerWaalsContact C-N 3.34Å; D12-S14 PolarHBondContact O-N 3.23Å; S14-A18 WeakPolarHBondContact O-CB 3.15Å; S14-A18 PolarHBondContact O-N 3.19Å; S14-A18 VanDerWaalsContact O-N 3.09Å
15	L	59.9	Low	58.8	Low	109 Å²	109	112.3 Å²	112.3	57%	0.571	59%	0.594	S	S	*	*	H	α-helix	trans	-72.5	-44.1	176.4	-69.4	170	0	0	0	110.1	D12 Q17 A18 D19	D12-L15 PolarHBondContact O-N 3.27Å; L15-Q17 VanDerWaalsContact C-N 3.33Å; L15-Q17 PolarHBondContact O-N 2.69Å; L15-A18 PolarHBondContact O-N 2.97Å; L15-A18 VanDerWaalsContact O-N 3.15Å; L15-D19 PolarHBondContact O-N 3.45Å
16	D	61.5	Low	60.1	Low	79 Å²	79	105.2 Å²	105.2	42%	0.422	57%	0.573	S	S	.	*	H	α-helix	trans	-59.7	-39	173.5	-90.3	-10.5	0	0	0	113.3	D12 R20	D12-D16 PolarHBondContact O-N 3Å; D16-R20 WeakPolarHBondContact O-CB 3Å; D16-R20 VanDerWaalsContact O-CG 3.28Å; D16-R20 WeakPolarHBondContact O-CG 3.35Å; D16-R20 PolarHBondContact O-N 3.13Å
17	Q	64.3	Low	61.3	Low	108 Å²	108	98.5 Å²	98.5	51%	0.505	55%	0.55	S	S	.	*	H	α-helix	trans	-67.7	-40.5	175.7	-164.3	98.1	-19.3	0	0	111.4	S13 L15 N21	S13-Q17 WeakPolarHBondContact O-CB 3.5Å; S13-Q17 PolarHBondContact O-N 2.96Å; S13-Q17 VanDerWaalsContact O-N 3.15Å; L15-Q17 VanDerWaalsContact C-N 3.33Å; L15-Q17 PolarHBondContact O-N 2.69Å; Q17-N21 WeakPolarHBondContact O-CB 3.05Å; Q17-N21 PolarHBondContact O-N 2.91Å; Q17-N21 VanDerWaalsContact O-N 3.08Å; Q17-N21 PolarHBondContact O-ND2 2.9Å
18	A	62.2	Low	63	Low	41 Å²	41	99.6 Å²	99.6	34%	0.339	55%	0.547	S	S	.	.	H	α-helix	trans	-67	-44.1	177.8	0	0	0	0	0	111.5	S14 L15 N21 I22	S14-A18 WeakPolarHBondContact O-CB 3.15Å; S14-A18 PolarHBondContact O-N 3.19Å; S14-A18 VanDerWaalsContact O-N 3.09Å; L15-A18 PolarHBondContact O-N 2.97Å; L15-A18 VanDerWaalsContact O-N 3.15Å; A18-N21 PolarHBondContact O-N 3.26Å; A18-I22 WeakPolarHBondContact O-CB 3.41Å; A18-I22 WeakPolarHBondContact O-CD1 3.43Å; A18-I22 WeakPolarHBondContact O-CG1 3.36Å; A18-I22 PolarHBondContact O-N 2.75Å
19	D	62.8	Low	64.8	Low	102 Å²	102	95.8 Å²	95.8	55%	0.545	53%	0.53	S	S	.	.	H	α-helix	trans	-66.4	-38.8	178.5	-79.6	-17.7	0	0	0	112.3	L15 I22 S23	L15-D19 PolarHBondContact O-N 3.45Å; D19-I22 PolarHBondContact O-N 3.02Å; D19-S23 VanDerWaalsContact O-CB 3.24Å; D19-S23 WeakPolarHBondContact O-CB 3.19Å; D19-S23 PolarHBondContact O-N 3.45Å
20	R	63.8	Low	66.6	Low	131 Å²	131	101 Å²	101	49%	0.494	54%	0.537	S	S	.	.	H	α-helix	trans	-61.5	-43.1	171.4	-76.2	-171	-64.2	-98.3	2	112.1	D16 S23 Q24	D16-R20 WeakPolarHBondContact O-CB 3Å; D16-R20 VanDerWaalsContact O-CG 3.28Å; D16-R20 WeakPolarHBondContact O-CG 3.35Å; D16-R20 PolarHBondContact O-N 3.13Å; R20-S23 PolarHBondContact O-N 2.83Å; R20-Q24 WeakPolarHBondContact O-CB 3.49Å; R20-Q24 PolarHBondContact O-N 3.34Å
21	N	64.7	Low	68	Low	87 Å²	87	99.8 Å²	99.8	47%	0.465	53%	0.525	S	S	.	.	H	α-helix	trans	-69.2	-39.2	179	-72.1	-16.1	0	0	0	112.3	Q17 A18 Q24 Q25	Q17-N21 WeakPolarHBondContact O-CB 3.05Å; Q17-N21 PolarHBondContact O-N 2.91Å; Q17-N21 VanDerWaalsContact O-N 3.08Å; Q17-N21 PolarHBondContact O-ND2 2.9Å; A18-N21 PolarHBondContact O-N 3.26Å; N21-Q24 PolarHBondContact O-N 2.95Å; N21-Q25 WeakPolarHBondContact O-CB 3.49Å; N21-Q25 PolarHBondContact O-N 2.85Å
22	I	65.9	Low	69.6	Low	92 Å²	92	100.8 Å²	100.8	47%	0.472	53%	0.526	S	S	.	.	H	α-helix	trans	-66.4	-42.2	175.6	-69.3	164	0	0	0	110.3	A18 D19 Q25 T26	A18-I22 WeakPolarHBondContact O-CB 3.41Å; A18-I22 WeakPolarHBondContact O-CD1 3.43Å; A18-I22 WeakPolarHBondContact O-CG1 3.36Å; A18-I22 PolarHBondContact O-N 2.75Å; D19-I22 PolarHBondContact O-N 3.02Å; I22-Q25 PolarHBondContact O-N 2.9Å; I22-T26 VanDerWaalsContact O-CB 3.24Å; I22-T26 WeakPolarHBondContact O-CB 3.18Å; I22-T26 PolarHBondContact O-N 3.05Å; I22-T26 PolarHBondContact O-OG1 2.03Å
23	S	66.4	Low	71.1	Confident	85 Å²	85	98.3 Å²	98.3	59%	0.594	52%	0.516	S	S	*	.	H	α-helix	trans	-63.3	-45.1	175.8	-176.3	0	0	0	0	111.9	D19 R20 T26 G27	D19-S23 VanDerWaalsContact O-CB 3.24Å; D19-S23 WeakPolarHBondContact O-CB 3.19Å; D19-S23 PolarHBondContact O-N 3.45Å; R20-S23 PolarHBondContact O-N 2.83Å; S23-T26 PolarHBondContact O-N 3.28Å; S23-G27 PolarHBondContact O-N 3.22Å
24	Q	70.4	Confident	72.6	Confident	136 Å²	136	102.2 Å²	102.2	64%	0.636	52%	0.518	S	S	*	.	H	α-helix	trans	-63.3	-43.7	173.9	-83.4	-173.2	-14.8	0	0	112.6	R20 N21 T26 G27 M28	R20-Q24 WeakPolarHBondContact O-CB 3.49Å; R20-Q24 PolarHBondContact O-N 3.34Å; N21-Q24 PolarHBondContact O-N 2.95Å; Q24-T26 VanDerWaalsContact C-N 3.32Å; Q24-T26 PolarHBondContact O-N 2.96Å; Q24-G27 PolarHBondContact O-N 2.74Å; Q24-M28 VanDerWaalsContact O-CB 3.29Å; Q24-M28 WeakPolarHBondContact O-CB 3.48Å; Q24-M28 PolarHBondContact O-N 3.1Å
25	Q	72.3	Confident	74.1	Confident	108 Å²	108	102.8 Å²	102.8	51%	0.505	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-36.6	178.7	-167.3	-179.5	11.2	0	0	111.6	N21 I22 K29	N21-Q25 WeakPolarHBondContact O-CB 3.49Å; N21-Q25 PolarHBondContact O-N 2.85Å; I22-Q25 PolarHBondContact O-N 2.9Å; Q25-K29 WeakPolarHBondContact O-CB 3.49Å; Q25-K29 VanDerWaalsContact O-CG 3.23Å; Q25-K29 WeakPolarHBondContact O-CG 3.06Å; Q25-K29 PolarHBondContact O-N 3.48Å
26	T	74.1	Confident	75.7	Confident	71 Å²	71	102.7 Å²	102.7	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-71.7	-41.2	176.5	-54.7	0	0	0	0	111.1	I22 S23 Q24 R30	I22-T26 VanDerWaalsContact O-CB 3.24Å; I22-T26 WeakPolarHBondContact O-CB 3.18Å; I22-T26 PolarHBondContact O-N 3.05Å; I22-T26 PolarHBondContact O-OG1 2.03Å; S23-T26 PolarHBondContact O-N 3.28Å; Q24-T26 VanDerWaalsContact C-N 3.32Å; Q24-T26 PolarHBondContact O-N 2.96Å; T26-R30 VanDerWaalsContact O-CG 3.26Å; T26-R30 WeakPolarHBondContact O-CG 3.4Å; T26-R30 PolarHBondContact O-N 3.04Å
27	G	77.8	Confident	77.2	Confident	30 Å²	30	107.2 Å²	107.2	31%	0.309	53%	0.527	S	S	.	.	H	α-helix	trans	-62.7	-46.6	174.1	0	0	0	0	0	112.6	S23 Q24 K29 R30 I31	S23-G27 PolarHBondContact O-N 3.22Å; Q24-G27 PolarHBondContact O-N 2.74Å; G27-K29 PolarHBondContact O-N 2.92Å; G27-R30 PolarHBondContact O-N 3.09Å; G27-I31 WeakPolarHBondContact O-CG1 3.34Å; G27-I31 PolarHBondContact O-N 3.26Å
28	M	81.5	Confident	78.6	Confident	135 Å²	135	103.5 Å²	103.5	67%	0.665	51%	0.513	S	S	*	.	H	α-helix	trans	-64.1	-40.5	178.5	-167.2	-175	-56.3	0	0	112	Q24 I31 L32	Q24-M28 VanDerWaalsContact O-CB 3.29Å; Q24-M28 WeakPolarHBondContact O-CB 3.48Å; Q24-M28 PolarHBondContact O-N 3.1Å; M28-I31 PolarHBondContact O-N 3.31Å; M28-L32 WeakPolarHBondContact O-CB 3.4Å; M28-L32 PolarHBondContact O-N 2.73Å
29	K	82.9	Confident	80.1	Confident	123 Å²	123	104.7 Å²	104.7	54%	0.535	52%	0.516	S	S	.	.	H	α-helix	trans	-60	-47.8	172.3	-77.2	174.2	-179.3	178.4	0	111	Q25 G27 I31 L32 T33	Q25-K29 WeakPolarHBondContact O-CB 3.49Å; Q25-K29 VanDerWaalsContact O-CG 3.23Å; Q25-K29 WeakPolarHBondContact O-CG 3.06Å; Q25-K29 PolarHBondContact O-N 3.48Å; G27-K29 PolarHBondContact O-N 2.92Å; K29-I31 VanDerWaalsContact C-N 3.34Å; K29-I31 PolarHBondContact O-N 3.36Å; K29-L32 PolarHBondContact O-N 3.34Å; K29-T33 WeakPolarHBondContact O-CB 3.4Å; K29-T33 PolarHBondContact O-N 2.96Å; K29-T33 PolarHBondContact O-OG1 2.91Å
30	R	84.1	Confident	81.7	Confident	190 Å²	190	103.2 Å²	103.2	72%	0.717	51%	0.512	S	S	*	.	H	α-helix	trans	-61.2	-39.8	179.3	-69.9	173	94.7	179.7	7.5	112.9	T26 G27 Y34	T26-R30 VanDerWaalsContact O-CG 3.26Å; T26-R30 WeakPolarHBondContact O-CG 3.4Å; T26-R30 PolarHBondContact O-N 3.04Å; G27-R30 PolarHBondContact O-N 3.09Å; R30-Y34 WeakPolarHBondContact O-CB 3.44Å; R30-Y34 PolarHBondContact O-N 2.7Å
31	I	86.5	Confident	83.2	Confident	107 Å²	107	101.9 Å²	101.9	55%	0.549	51%	0.514	S	S	.	.	H	α-helix	trans	-65.2	-45.2	175.1	-66.8	165.5	0	0	0	110.4	G27 M28 K29 T33 Y34 I35	G27-I31 WeakPolarHBondContact O-CG1 3.34Å; G27-I31 PolarHBondContact O-N 3.26Å; M28-I31 PolarHBondContact O-N 3.31Å; K29-I31 VanDerWaalsContact C-N 3.34Å; K29-I31 PolarHBondContact O-N 3.36Å; I31-T33 PolarHBondContact O-N 3.47Å; I31-Y34 WeakPolarHBondContact O-CB 3.29Å; I31-Y34 PolarHBondContact O-N 3.08Å; I31-I35 HydrophobicContact CG2-CD1 3.86Å; I31-I35 HydrophobicContact CG2-CG1 4.48Å; I31-I35 WeakPolarHBondContact O-CG1 3.3Å; I31-I35 PolarHBondContact O-N 2.78Å
32	L	85.8	Confident	84.7	Confident	103 Å²	103	102.8 Å²	102.8	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-43.5	178.4	-169.6	68.9	0	0	0	111.4	M28 K29 Y34 I35 L36	M28-L32 WeakPolarHBondContact O-CB 3.4Å; M28-L32 PolarHBondContact O-N 2.73Å; K29-L32 PolarHBondContact O-N 3.34Å; L32-Y34 VanDerWaalsContact C-N 3.31Å; L32-Y34 PolarHBondContact O-N 3.48Å; L32-I35 PolarHBondContact O-N 2.99Å; L32-L36 HydrophobicContact CG-CD1 4.01Å; L32-L36 HydrophobicContact CG-CG 4.44Å; L32-L36 VanDerWaalsContact O-CB 3.32Å; L32-L36 WeakPolarHBondContact O-CB 3.33Å; L32-L36 WeakPolarHBondContact O-CG 3.47Å; L32-L36 PolarHBondContact O-N 3.13Å
33	T	88.1	Confident	86.1	Confident	68 Å²	68	103.5 Å²	103.5	42%	0.417	52%	0.522	S	S	.	.	H	α-helix	trans	-59.9	-43.3	174.2	-44.9	0	0	0	0	110.8	K29 I31 L36 Y37	K29-T33 WeakPolarHBondContact O-CB 3.4Å; K29-T33 PolarHBondContact O-N 2.96Å; K29-T33 PolarHBondContact O-OG1 2.91Å; I31-T33 PolarHBondContact O-N 3.47Å; T33-L36 PolarHBondContact O-N 2.9Å; T33-Y37 HydrophobicContact CG2-CD2 3.71Å; T33-Y37 HydrophobicContact CG2-CE2 3.48Å; T33-Y37 VanDerWaalsContact CG2-CE2 3.48Å; T33-Y37 WeakPolarHBondContact O-CD2 3.44Å; T33-Y37 PolarHBondContact O-N 3.01Å; T33-Y37 VanDerWaalsContact O-N 3.16Å
34	Y	90.3	Very high	87.5	Confident	167 Å²	167	103.9 Å²	103.9	66%	0.655	52%	0.517	S	S	*	.	H	α-helix	trans	-62	-48.1	176.5	-174.5	-96.7	0	0	0	111.4	R30 I31 L32 L36 Y37 S38	R30-Y34 WeakPolarHBondContact O-CB 3.44Å; R30-Y34 PolarHBondContact O-N 2.7Å; I31-Y34 WeakPolarHBondContact O-CB 3.29Å; I31-Y34 PolarHBondContact O-N 3.08Å; L32-Y34 VanDerWaalsContact C-N 3.31Å; L32-Y34 PolarHBondContact O-N 3.48Å; Y34-L36 PolarHBondContact O-N 3.37Å; Y34-Y37 PolarHBondContact O-N 2.86Å; Y34-S38 WeakPolarHBondContact CD1-OG 3.39Å; Y34-S38 WeakPolarHBondContact CE1-OG 3.29Å; Y34-S38 WeakPolarHBondContact O-CA 3.38Å; Y34-S38 WeakPolarHBondContact O-CB 3.33Å; Y34-S38 PolarHBondContact O-N 2.78Å; Y34-S38 PolarHBondContact O-OG 3.37Å
35	I	91.4	Very high	88.8	Confident	87 Å²	87	101.7 Å²	101.7	45%	0.446	51%	0.509	S	S	.	.	H	α-helix	trans	-61	-45.2	178	-67.6	169.4	0	0	0	111	I31 L32 Y37 V39	I31-I35 HydrophobicContact CG2-CD1 3.86Å; I31-I35 HydrophobicContact CG2-CG1 4.48Å; I31-I35 WeakPolarHBondContact O-CG1 3.3Å; I31-I35 PolarHBondContact O-N 2.78Å; L32-I35 PolarHBondContact O-N 2.99Å; I35-Y37 VanDerWaalsContact C-N 3.25Å; I35-Y37 PolarHBondContact O-N 3.36Å; I35-V39 HydrophobicContact CG2-CG2 4Å; I35-V39 VanDerWaalsContact O-CB 3.31Å; I35-V39 WeakPolarHBondContact O-CB 3.38Å; I35-V39 WeakPolarHBondContact O-CG2 3.01Å; I35-V39 PolarHBondContact O-N 2.88Å; I35-V39 VanDerWaalsContact O-N 3.12Å
36	L	92.2	Very high	90	Very high	106 Å²	106	100.6 Å²	100.6	56%	0.555	51%	0.506	S	S	*	.	H	α-helix	trans	-62.4	-27.8	-179.1	-75.8	171	0	0	0	113.8	L32 T33 Y34 P40	L32-L36 HydrophobicContact CG-CD1 4.01Å; L32-L36 HydrophobicContact CG-CG 4.44Å; L32-L36 VanDerWaalsContact O-CB 3.32Å; L32-L36 WeakPolarHBondContact O-CB 3.33Å; L32-L36 WeakPolarHBondContact O-CG 3.47Å; L32-L36 PolarHBondContact O-N 3.13Å; T33-L36 PolarHBondContact O-N 2.9Å; Y34-L36 PolarHBondContact O-N 3.37Å; L36-P40 WeakPolarHBondContact O-CD 3.23Å; L36-P40 WeakPolarHBondContact O-CG 3.39Å
37	Y	93.8	Very high	91.1	Very high	174 Å²	174	101.8 Å²	101.8	68%	0.682	51%	0.509	S	S	*	.	H	α-helix	trans	-104.2	-37.3	178.8	-65.1	-62.1	0	0	0	113.5	T33 Y34 I35 L41	T33-Y37 HydrophobicContact CG2-CD2 3.71Å; T33-Y37 HydrophobicContact CG2-CE2 3.48Å; T33-Y37 VanDerWaalsContact CG2-CE2 3.48Å; T33-Y37 WeakPolarHBondContact O-CD2 3.44Å; T33-Y37 PolarHBondContact O-N 3.01Å; T33-Y37 VanDerWaalsContact O-N 3.16Å; Y34-Y37 PolarHBondContact O-N 2.86Å; I35-Y37 VanDerWaalsContact C-N 3.25Å; I35-Y37 PolarHBondContact O-N 3.36Å; Y37-L41 WeakPolarHBondContact O-CB 3.49Å; Y37-L41 PolarHBondContact O-N 3.06Å
38	S	93.3	Very high	92	Very high	30 Å²	30	105.1 Å²	105.1	21%	0.21	52%	0.519	C	S	.	.	H	α-helix	trans	-72.3	-38.8	-178.6	63.9	0	0	0	0	112.8	Y34 L41 L42	Y34-S38 WeakPolarHBondContact CD1-OG 3.39Å; Y34-S38 WeakPolarHBondContact CE1-OG 3.29Å; Y34-S38 WeakPolarHBondContact O-CA 3.38Å; Y34-S38 WeakPolarHBondContact O-CB 3.33Å; Y34-S38 PolarHBondContact O-N 2.78Å; Y34-S38 PolarHBondContact O-OG 3.37Å; S38-L41 PolarHBondContact O-N 3.07Å; S38-L42 VanDerWaalsContact O-CB 3.31Å; S38-L42 WeakPolarHBondContact O-CB 3.49Å; S38-L42 PolarHBondContact O-N 2.8Å
39	V	94	Very high	92.7	Very high	67 Å²	67	104.7 Å²	104.7	41%	0.406	52%	0.519	S	S	.	.	H	α-helix	trans	-69.3	-48.6	-179.1	177.4	0	0	0	0	111	I35 L41 L42 L43	I35-V39 HydrophobicContact CG2-CG2 4Å; I35-V39 VanDerWaalsContact O-CB 3.31Å; I35-V39 WeakPolarHBondContact O-CB 3.38Å; I35-V39 WeakPolarHBondContact O-CG2 3.01Å; I35-V39 PolarHBondContact O-N 2.88Å; I35-V39 VanDerWaalsContact O-N 3.12Å; V39-L41 VanDerWaalsContact C-N 3.31Å; V39-L41 PolarHBondContact O-N 3.47Å; V39-L42 PolarHBondContact O-N 2.9Å; V39-L43 HydrophobicContact CG1-CD1 4.09Å; V39-L43 HydrophobicContact CG1-CG 4.4Å; V39-L43 VanDerWaalsContact O-CG 3.29Å; V39-L43 WeakPolarHBondContact O-CG 3.37Å; V39-L43 PolarHBondContact O-N 2.78Å
40	P	95.2	Very high	93.4	Very high	70 Å²	70	102.3 Å²	102.3	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-35.3	175.3	-26.2	39.1	0	0	0	113.2	L36 L43 L44	L36-P40 WeakPolarHBondContact O-CD 3.23Å; L36-P40 WeakPolarHBondContact O-CG 3.39Å; P40-L43 PolarHBondContact O-N 3.46Å; P40-L44 VanDerWaalsContact O-CB 3.31Å; P40-L44 WeakPolarHBondContact O-CB 3.44Å; P40-L44 PolarHBondContact O-N 3.22Å
41	L	95.7	Very high	93.9	Very high	104 Å²	104	97.6 Å²	97.6	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-43.6	174.8	-178.3	64.9	0	0	0	111.4	Y37 S38 V39 L44 L45	Y37-L41 WeakPolarHBondContact O-CB 3.49Å; Y37-L41 PolarHBondContact O-N 3.06Å; S38-L41 PolarHBondContact O-N 3.07Å; V39-L41 VanDerWaalsContact C-N 3.31Å; V39-L41 PolarHBondContact O-N 3.47Å; L41-L44 PolarHBondContact O-N 3.07Å; L41-L45 HydrophobicContact CG-CD1 4.49Å; L41-L45 VanDerWaalsContact O-CG 3.31Å; L41-L45 WeakPolarHBondContact O-CG 3.3Å; L41-L45 PolarHBondContact O-N 3.16Å
42	L	96.1	Very high	94.4	Very high	105 Å²	105	94.4 Å²	94.4	55%	0.55	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-43.3	176.4	-176.3	64.2	0	0	0	111.4	S38 V39 L44 L45 I46	S38-L42 VanDerWaalsContact O-CB 3.31Å; S38-L42 WeakPolarHBondContact O-CB 3.49Å; S38-L42 PolarHBondContact O-N 2.8Å; V39-L42 PolarHBondContact O-N 2.9Å; L42-L44 VanDerWaalsContact C-N 3.33Å; L42-L44 PolarHBondContact O-N 3.27Å; L42-L45 PolarHBondContact O-N 2.57Å; L42-I46 HydrophobicContact CG-CD1 4.1Å; L42-I46 VanDerWaalsContact O-CG1 3.29Å; L42-I46 WeakPolarHBondContact O-CG1 3.38Å; L42-I46 PolarHBondContact O-N 2.99Å
43	L	95.9	Very high	94.8	Very high	108 Å²	108	93.4 Å²	93.4	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-62.4	-39.9	175.6	-69.3	174.8	0	0	0	111.9	V39 P40 I46 L47	V39-L43 HydrophobicContact CG1-CD1 4.09Å; V39-L43 HydrophobicContact CG1-CG 4.4Å; V39-L43 VanDerWaalsContact O-CG 3.29Å; V39-L43 WeakPolarHBondContact O-CG 3.37Å; V39-L43 PolarHBondContact O-N 2.78Å; P40-L43 PolarHBondContact O-N 3.46Å; L43-I46 PolarHBondContact O-N 3Å; L43-L47 WeakPolarHBondContact O-CB 3.48Å; L43-L47 PolarHBondContact O-N 2.98Å
44	L	96.8	Very high	95	Very high	92 Å²	92	94.1 Å²	94.1	48%	0.482	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-42.4	174.8	-177.8	66	0	0	0	111.5	P40 L41 L42 L47 L48	P40-L44 VanDerWaalsContact O-CB 3.31Å; P40-L44 WeakPolarHBondContact O-CB 3.44Å; P40-L44 PolarHBondContact O-N 3.22Å; L41-L44 PolarHBondContact O-N 3.07Å; L42-L44 VanDerWaalsContact C-N 3.33Å; L42-L44 PolarHBondContact O-N 3.27Å; L44-L47 PolarHBondContact O-N 3.06Å; L44-L48 HydrophobicContact CG-CD1 4.41Å; L44-L48 VanDerWaalsContact O-CG 3.31Å; L44-L48 WeakPolarHBondContact O-CG 3.02Å; L44-L48 PolarHBondContact O-N 3.44Å
45	L	97.1	Very high	95.1	Very high	91 Å²	91	92.8 Å²	92.8	48%	0.476	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-42.9	175.9	-71.7	173.1	0	0	0	111.7	L41 L42 L47 L48 L49	L41-L45 HydrophobicContact CG-CD1 4.49Å; L41-L45 VanDerWaalsContact O-CG 3.31Å; L41-L45 WeakPolarHBondContact O-CG 3.3Å; L41-L45 PolarHBondContact O-N 3.16Å; L42-L45 PolarHBondContact O-N 2.57Å; L45-L47 VanDerWaalsContact C-N 3.34Å; L45-L48 PolarHBondContact O-N 2.88Å; L45-L49 WeakPolarHBondContact O-CG 3.37Å; L45-L49 PolarHBondContact O-N 3.09Å
46	I	96.9	Very high	94.9	Very high	85 Å²	85	92.4 Å²	92.4	44%	0.436	50%	0.498	S	S	.	.	H	α-helix	trans	-61.5	-44.8	174.9	-67.8	165.5	0	0	0	110.3	L42 L43 L48 L49 V50	L42-I46 HydrophobicContact CG-CD1 4.1Å; L42-I46 VanDerWaalsContact O-CG1 3.29Å; L42-I46 WeakPolarHBondContact O-CG1 3.38Å; L42-I46 PolarHBondContact O-N 2.99Å; L43-I46 PolarHBondContact O-N 3Å; I46-L48 VanDerWaalsContact C-N 3.35Å; I46-L48 PolarHBondContact O-N 2.62Å; I46-L49 PolarHBondContact O-N 3.05Å; I46-V50 HydrophobicContact CG2-CG2 4.39Å; I46-V50 WeakPolarHBondContact O-CG2 3.35Å; I46-V50 PolarHBondContact O-N 3.35Å
47	L	97.1	Very high	94.5	Very high	95 Å²	95	92.9 Å²	92.9	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-59.6	-44.8	177.1	-178.4	65.3	0	0	0	111.6	L43 L44 L45 L49 V50 I51	L43-L47 WeakPolarHBondContact O-CB 3.48Å; L43-L47 PolarHBondContact O-N 2.98Å; L44-L47 PolarHBondContact O-N 3.06Å; L45-L47 VanDerWaalsContact C-N 3.34Å; L47-L49 VanDerWaalsContact C-N 3.34Å; L47-L49 PolarHBondContact O-N 2.79Å; L47-V50 PolarHBondContact O-N 3.05Å; L47-I51 HydrophobicContact CD1-CD1 4.07Å; L47-I51 HydrophobicContact CD1-CG1 4.38Å; L47-I51 HydrophobicContact CD2-CD1 4.5Å; L47-I51 HydrophobicContact CG-CD1 3.83Å; L47-I51 WeakPolarHBondContact O-CB 3.34Å; L47-I51 VanDerWaalsContact O-CG1 3.24Å; L47-I51 WeakPolarHBondContact O-CG1 3.41Å; L47-I51 PolarHBondContact O-N 3.32Å
48	L	96.9	Very high	93.8	Very high	100 Å²	100	90.6 Å²	90.6	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-38.3	177	-71	174.3	0	0	0	112.3	L44 L45 I46 G52	L44-L48 HydrophobicContact CG-CD1 4.41Å; L44-L48 VanDerWaalsContact O-CG 3.31Å; L44-L48 WeakPolarHBondContact O-CG 3.02Å; L44-L48 PolarHBondContact O-N 3.44Å; L45-L48 PolarHBondContact O-N 2.88Å; I46-L48 VanDerWaalsContact C-N 3.35Å; I46-L48 PolarHBondContact O-N 2.62Å; L48-G52 PolarHBondContact O-N 2.95Å
49	L	97.1	Very high	93.4	Very high	126 Å²	126	95.6 Å²	95.6	66%	0.66	51%	0.512	S	S	*	.	H	α-helix	trans	-65.1	-45.9	174.8	-70.9	174	0	0	0	111.6	L45 I46 L47 G52 V53	L45-L49 WeakPolarHBondContact O-CG 3.37Å; L45-L49 PolarHBondContact O-N 3.09Å; I46-L49 PolarHBondContact O-N 3.05Å; L47-L49 VanDerWaalsContact C-N 3.34Å; L47-L49 PolarHBondContact O-N 2.79Å; L49-G52 PolarHBondContact O-N 3.08Å; L49-V53 WeakPolarHBondContact O-CG2 3.4Å; L49-V53 PolarHBondContact O-N 2.99Å
50	V	96.8	Very high	92.7	Very high	74 Å²	74	100 Å²	100	45%	0.448	53%	0.526	S	S	.	.	H	α-helix	trans	-61.3	-47.2	177.4	172	0	0	0	0	110.8	I46 L47 G52 V53 I54	I46-V50 HydrophobicContact CG2-CG2 4.39Å; I46-V50 WeakPolarHBondContact O-CG2 3.35Å; I46-V50 PolarHBondContact O-N 3.35Å; L47-V50 PolarHBondContact O-N 3.05Å; V50-G52 VanDerWaalsContact C-N 3.29Å; V50-G52 PolarHBondContact O-N 2.04Å; V50-V53 PolarHBondContact O-N 2.88Å; V50-I54 HydrophobicContact CG1-CD1 3.87Å; V50-I54 WeakPolarHBondContact O-CG1 3.44Å; V50-I54 PolarHBondContact O-N 2.92Å
51	I	95.6	Very high	91.7	Very high	91 Å²	91	102.4 Å²	102.4	47%	0.467	53%	0.531	S	S	.	.	H	α-helix	trans	-59.3	-42	175.5	-68.8	168.4	0	0	0	110.6	L47 V53 I54 F55	L47-I51 HydrophobicContact CD1-CD1 4.07Å; L47-I51 HydrophobicContact CD1-CG1 4.38Å; L47-I51 HydrophobicContact CD2-CD1 4.5Å; L47-I51 HydrophobicContact CG-CD1 3.83Å; L47-I51 WeakPolarHBondContact O-CB 3.34Å; L47-I51 VanDerWaalsContact O-CG1 3.24Å; L47-I51 WeakPolarHBondContact O-CG1 3.41Å; L47-I51 PolarHBondContact O-N 3.32Å; I51-V53 PolarHBondContact O-N 3.04Å; I51-I54 PolarHBondContact O-N 2.91Å; I51-F55 VanDerWaalsContact O-CB 3.31Å; I51-F55 WeakPolarHBondContact O-CB 3.42Å; I51-F55 PolarHBondContact O-N 2.84Å
52	G	95.8	Very high	90.6	Very high	39 Å²	39	104 Å²	104	40%	0.402	54%	0.537	S	S	.	.	H	α-helix	trans	-61.7	-41.4	176.5	0	0	0	0	0	113.3	L48 L49 V50 S56	L48-G52 PolarHBondContact O-N 2.95Å; L49-G52 PolarHBondContact O-N 3.08Å; V50-G52 VanDerWaalsContact C-N 3.29Å; V50-G52 PolarHBondContact O-N 2.04Å; G52-S56 WeakPolarHBondContact O-CB 3.24Å; G52-S56 PolarHBondContact O-N 2.82Å
53	V	94.9	Very high	89.7	Confident	83 Å²	83	103.4 Å²	103.4	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-65.1	-47.4	175.4	172	0	0	0	0	110.9	L49 V50 I51 F55 S56 Q57	L49-V53 WeakPolarHBondContact O-CG2 3.4Å; L49-V53 PolarHBondContact O-N 2.99Å; V50-V53 PolarHBondContact O-N 2.88Å; I51-V53 PolarHBondContact O-N 3.04Å; V53-F55 VanDerWaalsContact C-N 3.34Å; V53-F55 PolarHBondContact O-N 3.49Å; V53-S56 WeakPolarHBondContact O-CB 3.23Å; V53-S56 PolarHBondContact O-N 2.82Å; V53-Q57 HydrophobicContact CG1-CG 4.49Å; V53-Q57 WeakPolarHBondContact O-CG 3.47Å; V53-Q57 PolarHBondContact O-N 2.89Å
54	I	91.4	Very high	88.5	Confident	83 Å²	83	102.1 Å²	102.1	43%	0.426	53%	0.532	S	S	.	.	H	α-helix	trans	-59.9	-46	177.3	-67.3	169.5	0	0	0	110.4	V50 I51 S56 Q57 M58	V50-I54 HydrophobicContact CG1-CD1 3.87Å; V50-I54 WeakPolarHBondContact O-CG1 3.44Å; V50-I54 PolarHBondContact O-N 2.92Å; I51-I54 PolarHBondContact O-N 2.91Å; I54-S56 VanDerWaalsContact C-N 3.31Å; I54-S56 PolarHBondContact O-N 2.76Å; I54-Q57 WeakPolarHBondContact O-CB 3.29Å; I54-Q57 PolarHBondContact O-N 2.91Å; I54-M58 HydrophobicContact CG2-CG 4.4Å; I54-M58 HydrophobicContact CG2-SD 4.24Å; I54-M58 WeakPolarHBondContact O-CG 3.41Å; I54-M58 PolarHBondContact O-N 3.16Å
55	F	92.3	Very high	87.5	Confident	139 Å²	139	101.7 Å²	101.7	61%	0.61	53%	0.532	S	S	*	.	H	α-helix	trans	-61.5	-39.9	177.1	-176.5	-98.1	0	0	0	112.2	I51 V53 M58 K59	I51-F55 VanDerWaalsContact O-CB 3.31Å; I51-F55 WeakPolarHBondContact O-CB 3.42Å; I51-F55 PolarHBondContact O-N 2.84Å; V53-F55 VanDerWaalsContact C-N 3.34Å; V53-F55 PolarHBondContact O-N 3.49Å; F55-M58 PolarHBondContact O-N 3.06Å; F55-K59 WeakPolarHBondContact O-CB 3.41Å; F55-K59 PolarHBondContact O-N 3.42Å
56	S	88.3	Confident	86.4	Confident	79 Å²	79	104.1 Å²	104.1	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-61.7	-44.5	173.8	-172.4	0	0	0	0	111.8	G52 V53 I54 K59 K60	G52-S56 WeakPolarHBondContact O-CB 3.24Å; G52-S56 PolarHBondContact O-N 2.82Å; V53-S56 WeakPolarHBondContact O-CB 3.23Å; V53-S56 PolarHBondContact O-N 2.82Å; I54-S56 VanDerWaalsContact C-N 3.31Å; I54-S56 PolarHBondContact O-N 2.76Å; S56-K59 PolarHBondContact O-N 2.99Å; S56-K60 PolarHBondContact O-N 2.99Å; S56-K60 VanDerWaalsContact O-N 3.09Å
57	Q	83.6	Confident	85.3	Confident	116 Å²	116	104.7 Å²	104.7	54%	0.542	54%	0.543	S	S	.	.	H	α-helix	trans	-61.3	-48.5	175.7	-71.2	173.8	-17.1	0	0	111.3	V53 I54 K59 K60 E61	V53-Q57 HydrophobicContact CG1-CG 4.49Å; V53-Q57 WeakPolarHBondContact O-CG 3.47Å; V53-Q57 PolarHBondContact O-N 2.89Å; I54-Q57 WeakPolarHBondContact O-CB 3.29Å; I54-Q57 PolarHBondContact O-N 2.91Å; Q57-K59 VanDerWaalsContact C-N 3.31Å; Q57-K59 PolarHBondContact O-N 3.38Å; Q57-K60 WeakPolarHBondContact O-CB 3.41Å; Q57-K60 PolarHBondContact O-N 2.8Å; Q57-K60 VanDerWaalsContact O-N 3.14Å; Q57-E61 PolarHBondContact O-N 3.38Å; Q57-E61 VanDerWaalsContact O-N 3.11Å
58	M	80.1	Confident	84	Confident	125 Å²	125	104.5 Å²	104.5	62%	0.616	54%	0.539	S	S	*	.	H	α-helix	trans	-60.1	-38.6	177.4	-70	-175.5	73.4	0	0	112.8	I54 F55 K60 E61 M62	I54-M58 HydrophobicContact CG2-CG 4.4Å; I54-M58 HydrophobicContact CG2-SD 4.24Å; I54-M58 WeakPolarHBondContact O-CG 3.41Å; I54-M58 PolarHBondContact O-N 3.16Å; F55-M58 PolarHBondContact O-N 3.06Å; M58-K60 VanDerWaalsContact C-N 3.34Å; M58-E61 PolarHBondContact O-N 3.24Å; M58-M62 PolarHBondContact O-N 2.85Å; M58-M62 VanDerWaalsContact O-N 3.07Å
59	K	83.8	Confident	82.7	Confident	135 Å²	135	104.9 Å²	104.9	59%	0.587	54%	0.541	S	S	*	.	H	α-helix	trans	-68.5	-33.7	177.9	-170.1	176	-179.6	-179.9	0	112.2	F55 S56 Q57 T63	F55-K59 WeakPolarHBondContact O-CB 3.41Å; F55-K59 PolarHBondContact O-N 3.42Å; S56-K59 PolarHBondContact O-N 2.99Å; Q57-K59 VanDerWaalsContact C-N 3.31Å; Q57-K59 PolarHBondContact O-N 3.38Å; K59-T63 PolarHBondContact O-N 3.25Å; K59-T63 VanDerWaalsContact O-N 3.11Å; K59-T63 PolarHBondContact O-OG1 3.27Å
60	K	78.7	Confident	81.4	Confident	160 Å²	160	104.2 Å²	104.2	70%	0.696	54%	0.535	S	S	*	.	H	α-helix	trans	-66.5	-47.1	175.3	-169.6	-176.6	177	-171.6	0	110.8	S56 Q57 M58 M62 T63 D64	S56-K60 PolarHBondContact O-N 2.99Å; S56-K60 VanDerWaalsContact O-N 3.09Å; Q57-K60 WeakPolarHBondContact O-CB 3.41Å; Q57-K60 PolarHBondContact O-N 2.8Å; Q57-K60 VanDerWaalsContact O-N 3.14Å; M58-K60 VanDerWaalsContact C-N 3.34Å; K60-M62 VanDerWaalsContact C-N 3.33Å; K60-M62 PolarHBondContact O-N 3.41Å; K60-T63 PolarHBondContact O-N 3.01Å; K60-T63 VanDerWaalsContact O-N 3.12Å; K60-D64 PolarHBondContact O-N 2.83Å
61	E	75.3	Confident	80	Confident	120 Å²	120	104.2 Å²	104.2	56%	0.561	53%	0.532	S	S	*	.	H	α-helix	trans	-57.8	-44.4	175.8	-66.4	-57.6	138.7	0	0	111.7	Q57 M58 T63 D64 V65	Q57-E61 PolarHBondContact O-N 3.38Å; Q57-E61 VanDerWaalsContact O-N 3.11Å; M58-E61 PolarHBondContact O-N 3.24Å; E61-T63 VanDerWaalsContact C-N 3.31Å; E61-T63 PolarHBondContact O-N 3.36Å; E61-D64 PolarHBondContact O-N 3.37Å; E61-V65 VanDerWaalsContact O-CG2 3.3Å; E61-V65 WeakPolarHBondContact O-CG2 3.37Å; E61-V65 PolarHBondContact O-N 3.21Å
62	M	73.4	Confident	78.4	Confident	138 Å²	138	105.1 Å²	105.1	68%	0.68	54%	0.536	S	S	*	.	H	α-helix	trans	-63.6	-35.4	177.2	-171.9	-176	-63.9	0	0	113	M58 K60 K66	M58-M62 PolarHBondContact O-N 2.85Å; M58-M62 VanDerWaalsContact O-N 3.07Å; K60-M62 VanDerWaalsContact C-N 3.33Å; K60-M62 PolarHBondContact O-N 3.41Å; M62-K66 WeakPolarHBondContact O-CB 3.4Å; M62-K66 PolarHBondContact O-N 2.85Å
63	T	75.9	Confident	76.8	Confident	92 Å²	92	110.1 Å²	110.1	56%	0.564	55%	0.554	S	S	*	*	H	α-helix	trans	-68.9	-39.6	178.2	-53.9	0	0	0	0	111	K59 K60 E61 K66 L67	K59-T63 PolarHBondContact O-N 3.25Å; K59-T63 VanDerWaalsContact O-N 3.11Å; K59-T63 PolarHBondContact O-OG1 3.27Å; K60-T63 PolarHBondContact O-N 3.01Å; K60-T63 VanDerWaalsContact O-N 3.12Å; E61-T63 VanDerWaalsContact C-N 3.31Å; E61-T63 PolarHBondContact O-N 3.36Å; T63-K66 PolarHBondContact O-N 2.87Å; T63-L67 PolarHBondContact O-N 3.45Å; T63-L67 VanDerWaalsContact O-N 3.09Å
64	D	70.4	Confident	75.4	Confident	82 Å²	82	114.6 Å²	114.6	44%	0.439	57%	0.566	S	S	.	*	H	α-helix	trans	-66.6	-45.6	175.5	-167.5	73.6	0	0	0	111.7	K60 E61 K66 L67 Q68	K60-D64 PolarHBondContact O-N 2.83Å; E61-D64 PolarHBondContact O-N 3.37Å; D64-K66 VanDerWaalsContact C-N 3.3Å; D64-K66 PolarHBondContact O-N 2.73Å; D64-L67 WeakPolarHBondContact O-CA 3.47Å; D64-L67 WeakPolarHBondContact O-CB 3.19Å; D64-L67 PolarHBondContact O-N 3.21Å; D64-Q68 WeakPolarHBondContact O-CG 3.46Å; D64-Q68 PolarHBondContact O-N 3.18Å
65	V	75.3	Confident	73.9	Confident	82 Å²	82	120.5 Å²	120.5	50%	0.497	58%	0.583	S	S	.	*	H	α-helix	trans	-58.7	-41.8	175.4	171.6	0	0	0	0	111.7	E61 L67 Q68 L69	E61-V65 VanDerWaalsContact O-CG2 3.3Å; E61-V65 WeakPolarHBondContact O-CG2 3.37Å; E61-V65 PolarHBondContact O-N 3.21Å; V65-L67 VanDerWaalsContact C-N 3.3Å; V65-L67 PolarHBondContact O-N 3.25Å; V65-Q68 PolarHBondContact O-N 3.09Å; V65-L69 HydrophobicContact CG1-CD1 4.27Å; V65-L69 WeakPolarHBondContact O-CG 3.04Å; V65-L69 PolarHBondContact O-N 3.28Å
66	K	74.1	Confident	72.4	Confident	142 Å²	142	116.4 Å²	116.4	62%	0.617	58%	0.58	S	S	*	*	H	α-helix	trans	-64.9	-35.3	176.7	-168.8	173.2	-177.8	177.4	0	111.8	M62 T63 D64 Q70	M62-K66 WeakPolarHBondContact O-CB 3.4Å; M62-K66 PolarHBondContact O-N 2.85Å; T63-K66 PolarHBondContact O-N 2.87Å; D64-K66 VanDerWaalsContact C-N 3.3Å; D64-K66 PolarHBondContact O-N 2.73Å; K66-Q70 WeakPolarHBondContact O-CG 3.47Å; K66-Q70 PolarHBondContact O-N 3.46Å
67	L	74.3	Confident	70.9	Confident	97 Å²	97	119 Å²	119	51%	0.508	60%	0.596	S	S	.	*	H	α-helix	trans	-67.6	-42.4	174.9	-172.9	65	0	0	0	111.3	T63 D64 V65 Q70 I71	T63-L67 PolarHBondContact O-N 3.45Å; T63-L67 VanDerWaalsContact O-N 3.09Å; D64-L67 WeakPolarHBondContact O-CA 3.47Å; D64-L67 WeakPolarHBondContact O-CB 3.19Å; D64-L67 PolarHBondContact O-N 3.21Å; V65-L67 VanDerWaalsContact C-N 3.3Å; V65-L67 PolarHBondContact O-N 3.25Å; L67-Q70 PolarHBondContact O-N 2.87Å; L67-I71 HydrophobicContact CG-CD1 4.47Å; L67-I71 WeakPolarHBondContact O-CG1 3.02Å; L67-I71 PolarHBondContact O-N 2.86Å; L67-I71 VanDerWaalsContact O-N 3.13Å
68	Q	70.6	Confident	69.5	Low	91 Å²	91	122.3 Å²	122.3	43%	0.425	61%	0.613	S	S	.	*	H	α-helix	trans	-63.6	-42.9	176.1	-65.2	-59.9	-29.6	0	0	112.3	D64 V65 Q70 I71 I72	D64-Q68 WeakPolarHBondContact O-CG 3.46Å; D64-Q68 PolarHBondContact O-N 3.18Å; V65-Q68 PolarHBondContact O-N 3.09Å; Q68-Q70 VanDerWaalsContact C-N 3.28Å; Q68-Q70 PolarHBondContact O-N 2.03Å; Q68-I71 PolarHBondContact O-N 3.04Å; Q68-I71 VanDerWaalsContact O-N 3.11Å; Q68-I72 WeakPolarHBondContact O-CG1 3.24Å; Q68-I72 PolarHBondContact O-N 3.13Å
69	L	68.4	Low	68.1	Low	108 Å²	108	121.2 Å²	121.2	57%	0.565	62%	0.618	S	S	*	*	H	α-helix	trans	-61.8	-35.8	175.7	-74.1	172.9	0	0	0	112.3	V65 N73	V65-L69 HydrophobicContact CG1-CD1 4.27Å; V65-L69 WeakPolarHBondContact O-CG 3.04Å; V65-L69 PolarHBondContact O-N 3.28Å; L69-N73 WeakPolarHBondContact O-CB 3.43Å; L69-N73 PolarHBondContact O-N 2.74Å
70	Q	70.8	Confident	66.5	Low	113 Å²	113	121.9 Å²	121.9	53%	0.528	63%	0.627	S	S	.	*	H	α-helix	trans	-68.9	-32.7	174.3	-73.1	-161.3	-8.9	0	0	113.1	K66 L67 Q68 K74	K66-Q70 WeakPolarHBondContact O-CG 3.47Å; K66-Q70 PolarHBondContact O-N 3.46Å; L67-Q70 PolarHBondContact O-N 2.87Å; Q68-Q70 VanDerWaalsContact C-N 3.28Å; Q68-Q70 PolarHBondContact O-N 2.03Å; Q70-K74 WeakPolarHBondContact O-CG 3.22Å; Q70-K74 PolarHBondContact O-N 3.48Å
71	I	66.3	Low	64.8	Low	74 Å²	74	120 Å²	120	38%	0.379	63%	0.633	S	S	.	*	H	α-helix	trans	-70.9	-42	175.4	-65.9	166.8	0	0	0	110.8	L67 Q68 K74 R75	L67-I71 HydrophobicContact CG-CD1 4.47Å; L67-I71 WeakPolarHBondContact O-CG1 3.02Å; L67-I71 PolarHBondContact O-N 2.86Å; L67-I71 VanDerWaalsContact O-N 3.13Å; Q68-I71 PolarHBondContact O-N 3.04Å; Q68-I71 VanDerWaalsContact O-N 3.11Å; I71-K74 PolarHBondContact O-N 3.11Å; I71-R75 PolarHBondContact O-N 2.72Å
72	I	62.8	Low	63.2	Low	110 Å²	110	120.2 Å²	120.2	56%	0.564	64%	0.642	S	S	*	*	H	α-helix	trans	-65.5	-44	177.7	-64.7	165.8	0	0	0	110.7	Q68 K74 R75	Q68-I72 WeakPolarHBondContact O-CG1 3.24Å; Q68-I72 PolarHBondContact O-N 3.13Å; I72-K74 PolarHBondContact O-N 3.47Å; I72-R75 PolarHBondContact O-N 2.84Å; I72-R75 VanDerWaalsContact O-N 3.13Å
73	N	62.4	Low	62.2	Low	144 Å²	144	119.3 Å²	119.3	77%	0.77	65%	0.65	S	S	*	*	H	α-helix	trans	-67.5	-18.3	178.1	-166.3	54	0	0	0	113.5	L69	L69-N73 WeakPolarHBondContact O-CB 3.43Å; L69-N73 PolarHBondContact O-N 2.74Å
74	K	65.3	Low	61	Low	177 Å²	177	118 Å²	118	77%	0.77	65%	0.654	S	S	*	*	H	α-helix	trans	-87.6	-18.6	173.9	-78.5	-176.2	179	-174.8	0	113.6	Q70 I71 I72 G76	Q70-K74 WeakPolarHBondContact O-CG 3.22Å; Q70-K74 PolarHBondContact O-N 3.48Å; I71-K74 PolarHBondContact O-N 3.11Å; I72-K74 PolarHBondContact O-N 3.47Å; K74-G76 PolarHBondContact O-N 3.1Å
75	R	59.9	Low	60	Low	206 Å²	206	120.4 Å²	120.4	78%	0.777	67%	0.674	S	S	*	*	S	Bend	trans	-82.5	91.9	167.8	-77.2	179.3	178.6	163.2	-0	107.3	I71 I72	I71-R75 PolarHBondContact O-N 2.72Å; I72-R75 PolarHBondContact O-N 2.84Å; I72-R75 VanDerWaalsContact O-N 3.13Å
76	G	60.8	Low	58.4	Low	53 Å²	53	123.1 Å²	123.1	55%	0.546	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-52.9	164.9	172.4	0	0	0	0	0	112.4	K74 M78	K74-G76 PolarHBondContact O-N 3.1Å; G76-M78 PolarHBondContact O-N 2.78Å; G76-M78 VanDerWaalsContact O-N 3.14Å
77	P	56.5	Low	56.8	Low	135 Å²	135	122.9 Å²	122.9	88%	0.877	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-55.6	122.4	-173.8	21.8	-31.7	0	0	0	110.8	S79	P77-S79 PolarHBondContact O-N 3.05Å
78	M	54	Low	55.5	Low	184 Å²	184	123.1 Å²	123.1	91%	0.906	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-56	122.3	171.6	-171.3	169.9	-76.5	0	0	108.1	G76 L80	G76-M78 PolarHBondContact O-N 2.78Å; G76-M78 VanDerWaalsContact O-N 3.14Å; M78-L80 PolarHBondContact O-N 2.87Å; M78-L80 VanDerWaalsContact O-N 3.14Å
79	S	51.8	Low	54.5	Low	102 Å²	102	126.8 Å²	126.8	71%	0.713	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-62.8	116.2	-177.4	61	0	0	0	0	109.9	P77 C81	P77-S79 PolarHBondContact O-N 3.05Å; S79-C81 PolarHBondContact O-N 2.86Å
80	L	48.8	Very low	53.6	Low	150 Å²	150	131.4 Å²	131.4	79%	0.785	75%	0.746	S	S	*	*			trans	-68.2	110.8	169.3	-169.6	72.1	0	0	0	108.1	M78 T82	M78-L80 PolarHBondContact O-N 2.87Å; M78-L80 VanDerWaalsContact O-N 3.14Å; L80-T82 HydrophobicContact CD2-CG2 4.24Å; L80-T82 PolarHBondContact O-N 2.81Å
81	C	43.4	Very low	52.5	Low	121 Å²	121	132.1 Å²	132.1	82%	0.818	76%	0.758	S	S	*	*			trans	-71.2	100.1	169.2	-65.4	0	0	0	0	108.6	S79	S79-C81 PolarHBondContact O-N 2.86Å
82	T	42.6	Very low	51.8	Low	124 Å²	124	135.3 Å²	135.3	76%	0.761	78%	0.775	S	S	*	*			trans	-84.8	106.3	166.8	36.2	0	0	0	0	109.2	L80	L80-T82 HydrophobicContact CD2-CG2 4.24Å; L80-T82 PolarHBondContact O-N 2.81Å
83	S	51.3	Low	51.1	Low	119 Å²	119	136.2 Å²	136.2	83%	0.832	79%	0.785	S	S	*	*			trans	-80.4	135.2	160.4	45.5	0	0	0	0	109.4
84	G	50.3	Low	50.6	Low	63 Å²	63	137 Å²	137	65%	0.649	78%	0.784	S	S	*	*			trans	-71.4	-176.4	-170.4	0	0	0	0	0	116.3
85	P	49.4	Very low	50.2	Low	134 Å²	134	139.5 Å²	139.5	87%	0.87	79%	0.789	S	S	*	*			trans	-81.9	125.4	-164.9	32.4	-31.5	0	0	0	111.4
86	T	42.4	Very low	50	Low	139 Å²	139	137 Å²	137	85%	0.853	79%	0.789	S	S	*	*			trans	-108.6	108.1	164.3	33.9	0	0	0	0	109.3
87	D	41.2	Very low	49.9	Very low	136 Å²	136	139.8 Å²	139.8	73%	0.727	80%	0.795	S	S	*	*			trans	28.8	93.8	145.2	-152.3	20.3	0	0	0	116.4	K89	D87-K89 VanDerWaalsContact C-N 3.29Å; D87-K89 PolarHBondContact O-N 3.02Å
88	A	45.7	Very low	49.9	Very low	103 Å²	103	137 Å²	137	85%	0.851	78%	0.777	S	S	*	*			trans	-70.8	83.8	171.2	0	0	0	0	0	110.3
89	K	49.6	Very low	50.2	Low	167 Å²	167	133.2 Å²	133.2	73%	0.726	76%	0.764	S	S	*	*			trans	-75.2	119.8	155.3	-79.8	-174	178.6	180	0	108.3	D87 V91	D87-K89 VanDerWaalsContact C-N 3.29Å; D87-K89 PolarHBondContact O-N 3.02Å; K89-V91 PolarHBondContact O-N 2.84Å
90	Q	50.4	Low	50.5	Low	206 Å²	206	140.1 Å²	140.1	96%	0.963	78%	0.775	S	S	*	*			trans	-51.3	104.4	171.4	-110.4	168.3	-5	0	0	109.7
91	V	46.7	Very low	51.2	Low	127 Å²	127	135.3 Å²	135.3	77%	0.77	76%	0.761	S	S	*	*			trans	-83.1	118.4	170	178.5	0	0	0	0	107	K89 V93	K89-V91 PolarHBondContact O-N 2.84Å; V91-V93 PolarHBondContact O-N 3.39Å
92	L	52.1	Low	53.1	Low	142 Å²	142	132.8 Å²	132.8	74%	0.743	74%	0.742	S	S	*	*			trans	-54.9	122	170.5	-175.2	70.3	0	0	0	108.4	E94	L92-E94 HydrophobicContact CD2-CG 4.49Å; L92-E94 PolarHBondContact O-N 3.05Å
93	V	48.8	Very low	55.4	Low	128 Å²	128	128.2 Å²	128.2	78%	0.776	72%	0.715	S	S	*	*			trans	-70.8	78.8	179.7	-176.6	0	0	0	0	108.9	V91	V91-V93 PolarHBondContact O-N 3.39Å
94	E	52.1	Low	57.4	Low	161 Å²	161	128 Å²	128	75%	0.752	70%	0.699	S	S	*	*			trans	-77.3	124.5	160	-76.5	-169.6	162	0	0	108.1	L92 I96	L92-E94 HydrophobicContact CD2-CG 4.49Å; L92-E94 PolarHBondContact O-N 3.05Å; E94-I96 PolarHBondContact O-N 3.16Å
95	R	56.2	Low	59.3	Low	229 Å²	229	134.5 Å²	134.5	86%	0.864	71%	0.712	S	S	*	*			trans	-3.6	107.2	169.3	-147.8	-177.5	-61.2	-141.3	2.2	113.5	V97	R95-V97 VanDerWaalsContact C-N 3.28Å; R95-V97 PolarHBondContact O-N 3.39Å
96	I	56.2	Low	61.2	Low	154 Å²	154	131.3 Å²	131.3	79%	0.79	70%	0.704	S	S	*	*			trans	-63.3	89.6	177	-55.8	168.6	0	0	0	108.3	E94	E94-I96 PolarHBondContact O-N 3.16Å
97	V	59	Low	63.8	Low	111 Å²	111	126.3 Å²	126.3	67%	0.673	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-77.7	122.5	161.3	-176.3	0	0	0	0	104.9	R95 V99	R95-V97 VanDerWaalsContact C-N 3.28Å; R95-V97 PolarHBondContact O-N 3.39Å; V97-V99 PolarHBondContact O-N 3.24Å; V97-V99 VanDerWaalsContact O-N 3.12Å
98	P	56.8	Low	66.4	Low	76 Å²	76	121.3 Å²	121.3	49%	0.494	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-51.5	124.7	173.3	-23.4	32.3	0	0	0	108.6	R100	P98-R100 PolarHBondContact O-N 2.88Å
99	V	59.8	Low	68.7	Low	106 Å²	106	119.7 Å²	119.7	64%	0.642	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-59	129.1	172.6	179.3	0	0	0	0	106	V97 G101 T102	V97-V99 PolarHBondContact O-N 3.24Å; V97-V99 VanDerWaalsContact O-N 3.12Å; V99-G101 PolarHBondContact O-N 2.75Å; V99-G101 VanDerWaalsContact O-N 3.13Å; V99-T102 HydrophobicContact CB-CG2 4.03Å; V99-T102 PolarHBondContact N-OG1 2.98Å; V99-T102 WeakPolarHBondContact O-CB 3.38Å; V99-T102 PolarHBondContact O-N 3.09Å; V99-T102 PolarHBondContact O-OG1 2.89Å
100	R	58.4	Low	70.9	Confident	247 Å²	247	113.9 Å²	113.9	93%	0.932	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.3	124.2	175.5	-74.5	-176	178.3	172.9	-0.8	108.9	P98	P98-R100 PolarHBondContact O-N 2.88Å
101	G	64	Low	73	Confident	48 Å²	48	110.4 Å²	110.4	50%	0.495	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	95.1	9.2	-173.7	0	0	0	0	0	115.2	V99 A236	V99-G101 PolarHBondContact O-N 2.75Å; V99-G101 VanDerWaalsContact O-N 3.13Å; G101-A236 WeakPolarHBondContact CA-OXT 3.44Å; G101-A236 PolarHBondContact N-OXT 3.36Å
102	T	82.5	Confident	75.2	Confident	68 Å²	68	106.5 Å²	106.5	42%	0.417	57%	0.573	S	S	.	*			trans	-118.2	134.6	174.1	59.8	0	0	0	0	111.2	V99 A236	V99-T102 HydrophobicContact CB-CG2 4.03Å; V99-T102 PolarHBondContact N-OG1 2.98Å; V99-T102 WeakPolarHBondContact O-CB 3.38Å; V99-T102 PolarHBondContact O-N 3.09Å; V99-T102 PolarHBondContact O-OG1 2.89Å; T102-A236 PolarHBondContact N-OXT 3.49Å
103	C	91.6	Very high	77.3	Confident	28 Å²	28	100 Å²	100	19%	0.189	54%	0.54	C	S	.	.	P	Polyproline II helix	trans	-68.7	149.7	179.2	-61.2	0	0	0	0	112	W107 S109 C114	C103-W107 HydrophobicContact CB-CB 3.88Å; C103-S109 WeakPolarHBondContact SG-CB 3.28Å; C103-C114 WeakPolarHBondContact CA-SG 3.19Å; C103-C114 HydrophobicContact CB-CB 3.78Å; C103-C114 WeakPolarHBondContact CB-SG 3.29Å; C103-C114 WeakPolarHBondContact SG-CA 3.33Å; C103-C114 WeakPolarHBondContact SG-CB 3.34Å; C103-C114 CovalentContact SG-SG 2.03Å; C103-C114 PolarHBondContact SG-SG 3.37Å
104	K	91.6	Very high	79.6	Confident	116 Å²	116	94.2 Å²	94.2	50%	0.504	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-59.4	155.3	173	-61.6	174.6	-172.5	172.4	0	110.3	G106 W107 S134	K104-G106 PolarHBondContact O-N 3.5Å; K104-W107 HydrophobicContact CB-CG 4.29Å; K104-W107 WeakPolarHBondContact O-CB 3.32Å; K104-W107 PolarHBondContact O-N 3.07Å; K104-S134 PolarHBondContact NZ-O 2.78Å
105	E	90.4	Very high	81.8	Confident	199 Å²	199	86.7 Å²	86.7	93%	0.93	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	135.7	173.3	-171.6	178.1	178.4	0	0	110.9	W107	E105-W107 VanDerWaalsContact C-N 3.29Å; E105-W107 PolarHBondContact O-N 3.27Å
106	G	90.6	Very high	83.8	Confident	67 Å²	67	78.1 Å²	78.1	69%	0.691	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-6.4	-175.7	0	0	0	0	0	115.2	K104 L116	K104-G106 PolarHBondContact O-N 3.5Å; G106-L116 WeakPolarHBondContact O-CD1 3.45Å
107	W	95.8	Very high	85.8	Confident	34 Å²	34	73.1 Å²	73.1	13%	0.129	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-97.5	135.2	174.6	-67.4	62.7	0	0	0	111	C103 K104 E105 C114 Y115 L116 C232 A234	C103-W107 HydrophobicContact CB-CB 3.88Å; K104-W107 HydrophobicContact CB-CG 4.29Å; K104-W107 WeakPolarHBondContact O-CB 3.32Å; K104-W107 PolarHBondContact O-N 3.07Å; E105-W107 VanDerWaalsContact C-N 3.29Å; E105-W107 PolarHBondContact O-N 3.27Å; W107-C114 HydrophobicContact CB-CB 4.21Å; W107-C114 HydrophobicContact CD2-CB 4.36Å; W107-C114 VanDerWaalsContact CE3-C 3.47Å; W107-C114 HydrophobicContact CE3-CB 3.67Å; W107-C114 HydrophobicContact CZ3-CB 4.45Å; W107-C114 WeakPolarHBondContact CZ3-O 3.49Å; W107-Y115 CarbonylContact C-O 3.53Å; W107-Y115 WeakPolarHBondContact CA-O 3.39Å; W107-L116 HydrophobicContact CD2-CB 3.67Å; W107-L116 HydrophobicContact CE3-CB 3.81Å; W107-L116 HydrophobicContact CG-CB 4.28Å; W107-L116 HydrophobicContact CH2-CB 3.88Å; W107-L116 HydrophobicContact CZ2-CB 3.72Å; W107-L116 HydrophobicContact CZ2-CD2 3.77Å; W107-L116 HydrophobicContact CZ2-CG 4.34Å; W107-L116 HydrophobicContact CZ3-CB 3.92Å; W107-C232 HydrophobicContact CH2-CB 3.66Å; W107-C232 HydrophobicContact CZ3-CB 4.08Å; W107-A234 HydrophobicContact CE3-CB 4.49Å; W107-A234 HydrophobicContact CH2-CB 4.17Å; W107-A234 HydrophobicContact CZ3-CB 3.8Å
108	A	95.8	Very high	87.6	Confident	31 Å²	31	68.3 Å²	68.3	26%	0.256	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	136.2	175.5	0	0	0	0	0	109.8	C114 Y115 Y149 I153	A108-C114 CarbonylContact O-C 3.48Å; A108-C114 VanDerWaalsContact O-CA 3.3Å; A108-C114 WeakPolarHBondContact O-CA 3.44Å; A108-Y115 PolarHBondContact N-O 3.41Å; A108-Y115 WeakPolarHBondContact O-CD2 3.24Å; A108-Y115 PolarHBondContact O-N 2.58Å; A108-Y149 VanDerWaalsContact CB-OH 3.23Å; A108-Y149 WeakPolarHBondContact CB-OH 3.18Å; A108-I153 HydrophobicContact CB-CD1 4.18Å
109	S	95.6	Very high	89.5	Confident	69 Å²	69	70.1 Å²	70.1	48%	0.483	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.6	-178.4	-171.8	0	0	0	0	111.8	C103 Y149	C103-S109 WeakPolarHBondContact SG-CB 3.28Å; S109-Y149 PolarHBondContact N-OH 3.14Å; S109-Y149 PolarHBondContact O-OH 2.67Å
110	F	95.5	Very high	91.3	Very high	45 Å²	45	68.8 Å²	68.8	20%	0.197	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	129.2	169.5	178.5	-99.6	0	0	0	111.1	G112 S113 Y115 E145 E146 Y149	F110-G112 PolarHBondContact O-N 3.29Å; F110-S113 PolarHBondContact N-O 3.37Å; F110-S113 PolarHBondContact O-N 2.7Å; F110-S113 VanDerWaalsContact O-O 3.13Å; F110-Y115 HydrophobicContact CB-CD2 4.41Å; F110-Y115 HydrophobicContact CB-CE2 3.8Å; F110-E145 HydrophobicContact CE1-CB 4.5Å; F110-E145 HydrophobicContact CZ-CB 4.12Å; F110-E145 WeakPolarHBondContact CZ-O 3.28Å; F110-E146 HydrophobicContact CE1-CB 4.3Å; F110-Y149 HydrophobicContact CB-CD1 3.54Å; F110-Y149 HydrophobicContact CB-CD2 3.87Å; F110-Y149 HydrophobicContact CB-CE1 3.45Å; F110-Y149 VanDerWaalsContact CB-CE1 3.45Å; F110-Y149 HydrophobicContact CB-CE2 3.76Å; F110-Y149 HydrophobicContact CB-CG 3.74Å; F110-Y149 HydrophobicContact CD1-CD1 4.09Å; F110-Y149 AromaticContact CD1-CG 3.95Å; F110-Y149 HydrophobicContact CD1-CG 3.95Å; F110-Y149 HydrophobicContact CD2-CD1 4.25Å; F110-Y149 AromaticContact CD2-CD2 3.36Å; F110-Y149 HydrophobicContact CD2-CD2 3.36Å; F110-Y149 AromaticContact CD2-CE2 3.89Å; F110-Y149 HydrophobicContact CD2-CE2 3.89Å; F110-Y149 AromaticContact CD2-CG 3.55Å; F110-Y149 HydrophobicContact CD2-CG 3.55Å; F110-Y149 HydrophobicContact CE1-CG 4.41Å; F110-Y149 AromaticContact CE2-CD2 3.96Å; F110-Y149 HydrophobicContact CE2-CD2 3.96Å; F110-Y149 HydrophobicContact CE2-CG 4.05Å; F110-Y149 AromaticContact CG-CD1 3.73Å; F110-Y149 HydrophobicContact CG-CD1 3.73Å; F110-Y149 AromaticContact CG-CD2 3.72Å; F110-Y149 HydrophobicContact CG-CD2 3.72Å; F110-Y149 HydrophobicContact CG-CE1 4.15Å; F110-Y149 HydrophobicContact CG-CE2 4.11Å; F110-Y149 AromaticContact CG-CG 3.48Å; F110-Y149 HydrophobicContact CG-CG 3.48Å; F110-Y149 VanDerWaalsContact CG-CG 3.48Å; F110-Y149 HydrophobicContact CZ-CG 4.44Å
111	Q	93.4	Very high	93.2	Very high	133 Å²	133	61 Å²	61	62%	0.621	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	36.9	174.6	-62.1	-172	7.5	0	0	116.3	S113	Q111-S113 VanDerWaalsContact C-N 3.3Å
112	G	92.6	Very high	94.9	Very high	45 Å²	45	60.5 Å²	60.5	46%	0.464	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	5.7	179	0	0	0	0	0	114.7	F110 A236	F110-G112 PolarHBondContact O-N 3.29Å; G112-A236 WeakPolarHBondContact O-CB 3.21Å; G112-A236 PolarHBondContact O-N 3.4Å
113	S	96.2	Very high	95.6	Very high	6 Å²	6	59.5 Å²	59.5	4%	0.042	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	159.3	164.9	-77.8	0	0	0	0	110.5	F110 Q111 Y115 E233 A234	F110-S113 PolarHBondContact N-O 3.37Å; F110-S113 PolarHBondContact O-N 2.7Å; F110-S113 VanDerWaalsContact O-O 3.13Å; Q111-S113 VanDerWaalsContact C-N 3.3Å; S113-Y115 VanDerWaalsContact CB-OH 3.29Å; S113-Y115 WeakPolarHBondContact CB-OH 3.4Å; S113-E233 PolarHBondContact OG-OE1 2.86Å; S113-A234 CarbonylContact C-O 3.42Å; S113-A234 WeakPolarHBondContact CA-O 3.49Å
114	C	97.3	Very high	96	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.034	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137	177.9	-61.2	0	0	0	0	108.9	C103 W107 A108 E233 A234	C103-C114 WeakPolarHBondContact CA-SG 3.19Å; C103-C114 HydrophobicContact CB-CB 3.78Å; C103-C114 WeakPolarHBondContact CB-SG 3.29Å; C103-C114 WeakPolarHBondContact SG-CA 3.33Å; C103-C114 WeakPolarHBondContact SG-CB 3.34Å; C103-C114 CovalentContact SG-SG 2.03Å; C103-C114 PolarHBondContact SG-SG 3.37Å; W107-C114 HydrophobicContact CB-CB 4.21Å; W107-C114 HydrophobicContact CD2-CB 4.36Å; W107-C114 VanDerWaalsContact CE3-C 3.47Å; W107-C114 HydrophobicContact CE3-CB 3.67Å; W107-C114 HydrophobicContact CZ3-CB 4.45Å; W107-C114 WeakPolarHBondContact CZ3-O 3.49Å; A108-C114 CarbonylContact O-C 3.48Å; A108-C114 VanDerWaalsContact O-CA 3.3Å; A108-C114 WeakPolarHBondContact O-CA 3.44Å; C114-E233 CarbonylContact O-C 3.45Å; C114-E233 VanDerWaalsContact O-CA 3.29Å; C114-E233 WeakPolarHBondContact O-CA 3.4Å; C114-A234 PolarHBondContact N-O 3.07Å; C114-A234 PolarHBondContact O-N 3.36Å
115	Y	98.3	Very high	96.3	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.016	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134	-175.6	-52.7	-87.4	0	0	0	112	W107 A108 F110 S113 L139 E146 Y149 I150 C232 E233	W107-Y115 CarbonylContact C-O 3.53Å; W107-Y115 WeakPolarHBondContact CA-O 3.39Å; A108-Y115 PolarHBondContact N-O 3.41Å; A108-Y115 WeakPolarHBondContact O-CD2 3.24Å; A108-Y115 PolarHBondContact O-N 2.58Å; F110-Y115 HydrophobicContact CB-CD2 4.41Å; F110-Y115 HydrophobicContact CB-CE2 3.8Å; S113-Y115 VanDerWaalsContact CB-OH 3.29Å; S113-Y115 WeakPolarHBondContact CB-OH 3.4Å; Y115-L139 HydrophobicContact CD1-CD1 3.83Å; Y115-L139 HydrophobicContact CE1-CD1 3.58Å; Y115-E146 HydrophobicContact CE1-CG 4.47Å; Y115-E146 WeakPolarHBondContact CE1-OE1 3.35Å; Y115-E146 PolarHBondContact OH-OE1 3.28Å; Y115-Y149 HydrophobicContact CD2-CD1 4.28Å; Y115-Y149 AromaticContact CD2-CE1 3.71Å; Y115-Y149 HydrophobicContact CD2-CE1 3.71Å; Y115-Y149 HydrophobicContact CE2-CD1 4.29Å; Y115-Y149 HydrophobicContact CE2-CE1 4.07Å; Y115-Y149 HydrophobicContact CG-CE1 4.44Å; Y115-I150 HydrophobicContact CD1-CD1 3.54Å; Y115-I150 HydrophobicContact CE1-CD1 3.86Å; Y115-I150 HydrophobicContact CG-CD1 3.88Å; Y115-C232 CarbonylContact C-O 3.5Å; Y115-C232 VanDerWaalsContact CA-O 3.24Å; Y115-C232 WeakPolarHBondContact CA-O 3.38Å; Y115-E233 HydrophobicContact CD1-CB 4.22Å; Y115-E233 HydrophobicContact CD1-CG 4.1Å; Y115-E233 HydrophobicContact CE1-CB 4.25Å; Y115-E233 HydrophobicContact CE1-CG 3.74Å
116	L	98	Very high	96.7	Very high	48 Å²	48	56.3 Å²	56.3	25%	0.251	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.3	174.7	180	70.6	0	0	0	109.9	G106 W107 I231 C232	G106-L116 WeakPolarHBondContact O-CD1 3.45Å; W107-L116 HydrophobicContact CD2-CB 3.67Å; W107-L116 HydrophobicContact CE3-CB 3.81Å; W107-L116 HydrophobicContact CG-CB 4.28Å; W107-L116 HydrophobicContact CH2-CB 3.88Å; W107-L116 HydrophobicContact CZ2-CB 3.72Å; W107-L116 HydrophobicContact CZ2-CD2 3.77Å; W107-L116 HydrophobicContact CZ2-CG 4.34Å; W107-L116 HydrophobicContact CZ3-CB 3.92Å; L116-I231 WeakPolarHBondContact O-CA 3.1Å; L116-C232 HydrophobicContact CB-CB 4.2Å; L116-C232 PolarHBondContact N-O 3.37Å; L116-C232 PolarHBondContact O-N 3.15Å
117	L	98.2	Very high	97.1	Very high	49 Å²	49	53.1 Å²	53.1	26%	0.257	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	123.3	175.1	-79.1	65.7	0	0	0	109	I153 V154 I231	L117-I153 HydrophobicContact CD1-CD1 3.63Å; L117-I153 HydrophobicContact CD1-CG1 4.12Å; L117-I153 HydrophobicContact CD2-CG1 4.39Å; L117-I153 WeakPolarHBondContact CD2-O 3.38Å; L117-V154 HydrophobicContact CD2-CB 4.37Å; L117-V154 HydrophobicContact CD2-CG1 3.97Å; L117-I231 HydrophobicContact CD1-CG2 4.4Å; L117-I231 HydrophobicContact CG-CG1 4.37Å
118	S	98.3	Very high	97.2	Very high	10 Å²	10	51.6 Å²	51.6	7%	0.07	29%	0.286	C	S	.	.			trans	-69	146	175.8	86.1	0	0	0	0	111.3	T120 R229 Y230	S118-T120 PolarHBondContact OG-O 3.22Å; S118-R229 WeakPolarHBondContact O-CD 3.41Å; S118-R229 VanDerWaalsContact OG-CA 3.28Å; S118-R229 WeakPolarHBondContact OG-CA 3.44Å; S118-R229 WeakPolarHBondContact OG-CB 3.46Å; S118-Y230 VanDerWaalsContact CB-CZ 3.47Å; S118-Y230 WeakPolarHBondContact CB-O 3.24Å; S118-Y230 PolarHBondContact N-O 3.28Å; S118-Y230 VanDerWaalsContact OG-CD1 3.24Å; S118-Y230 WeakPolarHBondContact OG-CD1 3.23Å; S118-Y230 WeakPolarHBondContact OG-CE1 3.38Å; S118-Y230 PolarHBondContact OG-N 2.89Å; S118-Y230 PolarHBondContact OG-O 3.09Å
119	T	96.7	Very high	97.4	Very high	114 Å²	114	53.6 Å²	53.6	70%	0.699	29%	0.292	S	S	*	.	S	Bend	trans	-95.1	-21.7	170.6	55.2	0	0	0	0	112	R229	T119-R229 PolarHBondContact O-NE 3.26Å; T119-R229 PolarHBondContact O-NH2 2.85Å
120	T	97.3	Very high	97.5	Very high	78 Å²	78	54.5 Å²	54.5	48%	0.479	29%	0.289	S	S	.	.	S	Bend	trans	-103.1	159.4	178.5	56.2	0	0	0	0	111.5	S118	S118-T120 PolarHBondContact OG-O 3.22Å
121	T	98.5	Very high	97.7	Very high	83 Å²	83	52.4 Å²	52.4	51%	0.509	28%	0.28	S	S	.	.			trans	-97.4	149.3	175.6	59.7	0	0	0	0	111.7	Y228 R229	T121-Y228 CarbonylContact C-O 3.48Å; T121-Y228 WeakPolarHBondContact CA-O 3.25Å; T121-R229 HydrophobicContact CG2-CG 4.14Å
122	N	98.6	Very high	97.9	Very high	39 Å²	39	52.4 Å²	52.4	21%	0.209	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-147.6	161.6	173.6	-86.8	-55.1	0	0	0	110.3	R126 A127 W161 G227 Y228 Y230	N122-R126 HydrophobicContact CB-CB 4.23Å; N122-A127 HydrophobicContact CB-CB 4.25Å; N122-W161 PolarHBondContact O-NE1 2.85Å; N122-G227 WeakPolarHBondContact O-CA 3.23Å; N122-Y228 PolarHBondContact N-O 3.21Å; N122-Y228 PolarHBondContact O-N 2.98Å; N122-Y228 VanDerWaalsContact O-N 3.09Å; N122-Y230 HydrophobicContact CB-CD1 4.35Å; N122-Y230 HydrophobicContact CB-CE1 4.12Å
123	V	98.5	Very high	98.1	Very high	47 Å²	47	54.5 Å²	54.5	29%	0.285	28%	0.282	S	S	.	.			trans	-69.1	153.5	164.9	-56	0	0	0	0	110	Q125 R126 A127 S225 L226	V123-Q125 PolarHBondContact O-N 2.94Å; V123-R126 HydrophobicContact CG2-CB 3.91Å; V123-R126 HydrophobicContact CG2-CG 3.77Å; V123-R126 PolarHBondContact O-N 3.16Å; V123-A127 PolarHBondContact O-N 3.16Å; V123-S225 WeakPolarHBondContact CG1-O 3.45Å; V123-L226 WeakPolarHBondContact CA-O 3.13Å
124	W	98.6	Very high	98.1	Very high	14 Å²	14	56 Å²	56	5%	0.053	29%	0.292	C	S	.	.	H	α-helix	trans	-54.2	-48.4	-168.4	-174.3	96	0	0	0	113	R126 A127 E128 L138 W161 I162 L164 V165 V176 C205 C224	W124-R126 VanDerWaalsContact C-N 3.33Å; W124-R126 PolarHBondContact O-N 2.86Å; W124-A127 WeakPolarHBondContact O-CB 3.32Å; W124-A127 PolarHBondContact O-N 3.29Å; W124-A127 VanDerWaalsContact O-N 3.08Å; W124-E128 HydrophobicContact CZ3-CB 4.49Å; W124-E128 PolarHBondContact O-N 2.99Å; W124-L138 HydrophobicContact CD2-CD1 4.15Å; W124-L138 HydrophobicContact CG-CD1 4.38Å; W124-L138 HydrophobicContact CZ2-CD1 4.02Å; W124-W161 HydrophobicContact CB-CD2 4.07Å; W124-W161 HydrophobicContact CB-CE3 4.46Å; W124-W161 HydrophobicContact CB-CG 4.44Å; W124-W161 HydrophobicContact CB-CZ2 4.11Å; W124-W161 AromaticContact CD1-CD2 3.7Å; W124-W161 AromaticContact CD1-CE3 3.6Å; W124-W161 AromaticContact CD1-CG 3.95Å; W124-W161 HydrophobicContact CG-CD2 4.3Å; W124-W161 HydrophobicContact CG-CE3 4.44Å; W124-I162 PolarHBondContact NE1-O 3.21Å; W124-L164 PolarHBondContact NE1-O 3.26Å; W124-V165 HydrophobicContact CH2-CB 3.8Å; W124-V165 HydrophobicContact CH2-CG1 3.72Å; W124-V165 HydrophobicContact CH2-CG2 4.18Å; W124-V165 HydrophobicContact CZ2-CB 3.65Å; W124-V165 HydrophobicContact CZ2-CG1 3.9Å; W124-V165 HydrophobicContact CZ2-CG2 4.35Å; W124-V165 HydrophobicContact CZ3-CB 4.47Å; W124-V165 HydrophobicContact CZ3-CG2 4.39Å; W124-V176 HydrophobicContact CH2-CG1 3.38Å; W124-V176 HydrophobicContact CZ2-CG1 3.42Å; W124-V176 VanDerWaalsContact CZ2-CG1 3.42Å; W124-C205 HydrophobicContact CB-CB 4.1Å; W124-C205 VanDerWaalsContact CB-SG 3.58Å; W124-C205 HydrophobicContact CD2-CB 4.47Å; W124-C205 HydrophobicContact CG-CB 3.81Å; W124-C224 HydrophobicContact CB-CB 4.32Å; W124-C224 PolarHBondContact N-O 3.46Å; W124-C224 VanDerWaalsContact N-O 3.13Å
125	Q	98.4	Very high	98	Very high	101 Å²	101	58.3 Å²	58.3	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-41.6	-179.9	-177.4	59.7	43	0	0	112.4	V123 A127 E128 D129	V123-Q125 PolarHBondContact O-N 2.94Å; Q125-A127 VanDerWaalsContact C-N 3.35Å; Q125-E128 PolarHBondContact O-N 2.94Å; Q125-D129 PolarHBondContact NE2-OD1 3.42Å; Q125-D129 VanDerWaalsContact O-CG 3.23Å; Q125-D129 PolarHBondContact O-N 2.79Å
126	R	98.8	Very high	97.9	Very high	161 Å²	161	58.9 Å²	58.9	61%	0.608	32%	0.324	S	S	*	.	H	α-helix	trans	-70	-35	177.5	-73.6	-170.1	-178.9	166.5	2.5	111.6	N122 V123 W124 E128 D129 Q130	N122-R126 HydrophobicContact CB-CB 4.23Å; V123-R126 HydrophobicContact CG2-CB 3.91Å; V123-R126 HydrophobicContact CG2-CG 3.77Å; V123-R126 PolarHBondContact O-N 3.16Å; W124-R126 VanDerWaalsContact C-N 3.33Å; W124-R126 PolarHBondContact O-N 2.86Å; R126-E128 VanDerWaalsContact C-N 3.35Å; R126-D129 PolarHBondContact O-N 3.14Å; R126-Q130 VanDerWaalsContact O-CG 3.23Å; R126-Q130 WeakPolarHBondContact O-CG 3.39Å; R126-Q130 PolarHBondContact O-N 2.96Å
127	A	98.8	Very high	98	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-43.6	175.8	0	0	0	0	0	111.2	N122 V123 W124 Q125 Q130 C131 L138 Y230	N122-A127 HydrophobicContact CB-CB 4.25Å; V123-A127 PolarHBondContact O-N 3.16Å; W124-A127 WeakPolarHBondContact O-CB 3.32Å; W124-A127 PolarHBondContact O-N 3.29Å; W124-A127 VanDerWaalsContact O-N 3.08Å; Q125-A127 VanDerWaalsContact C-N 3.35Å; A127-Q130 WeakPolarHBondContact O-CB 3.24Å; A127-Q130 PolarHBondContact O-N 2.85Å; A127-C131 PolarHBondContact O-N 3.11Å; A127-C131 PolarHBondContact O-SG 3.09Å; A127-C131 VanDerWaalsContact O-SG 3.35Å; A127-L138 HydrophobicContact CB-CD1 4.43Å; A127-L138 HydrophobicContact CB-CD2 4.02Å; A127-Y230 HydrophobicContact CB-CD1 3.73Å; A127-Y230 HydrophobicContact CB-CD2 4.11Å; A127-Y230 HydrophobicContact CB-CE1 4.37Å; A127-Y230 HydrophobicContact CB-CG 3.6Å
128	E	98.8	Very high	98	Very high	2 Å²	2	56 Å²	56	1%	0.009	31%	0.308	C	S	.	.	H	α-helix	trans	-59.9	-46.8	172.2	174.6	60.7	-177.4	0	0	112.2	W124 Q125 R126 Q130 C131 R132 L138	W124-E128 HydrophobicContact CZ3-CB 4.49Å; W124-E128 PolarHBondContact O-N 2.99Å; Q125-E128 PolarHBondContact O-N 2.94Å; R126-E128 VanDerWaalsContact C-N 3.35Å; E128-Q130 VanDerWaalsContact C-N 3.26Å; E128-Q130 PolarHBondContact O-N 3.19Å; E128-C131 PolarHBondContact O-N 2.87Å; E128-C131 VanDerWaalsContact O-N 3.13Å; E128-R132 WeakPolarHBondContact O-CG 3.23Å; E128-R132 PolarHBondContact O-N 3.38Å; E128-R132 IonicContact OE1-CZ 3.21Å; E128-R132 IonicContact OE1-NE 2.7Å; E128-R132 PolarHBondContact OE1-NE 3.29Å; E128-R132 IonicContact OE1-NH2 2.91Å; E128-R132 PolarHBondContact OE1-NH2 3.39Å; E128-L138 HydrophobicContact CB-CD1 3.79Å; E128-L138 HydrophobicContact CB-CG 4.13Å; E128-L138 WeakPolarHBondContact OE2-CB 3.37Å; E128-L138 WeakPolarHBondContact OE2-CG 3.45Å; E128-L138 PolarHBondContact OE2-N 3.02Å
129	D	98.7	Very high	98	Very high	72 Å²	72	55.6 Å²	55.6	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-60	-37.7	177.2	-65.4	-25.1	0	0	0	111.9	Q125 R126 R132 S133	Q125-D129 PolarHBondContact NE2-OD1 3.42Å; Q125-D129 VanDerWaalsContact O-CG 3.23Å; Q125-D129 PolarHBondContact O-N 2.79Å; R126-D129 PolarHBondContact O-N 3.14Å; D129-R132 PolarHBondContact O-N 3.2Å; D129-S133 WeakPolarHBondContact O-CB 3.2Å; D129-S133 PolarHBondContact O-N 2.81Å
130	Q	98.6	Very high	98.1	Very high	89 Å²	89	50.1 Å²	50.1	42%	0.416	27%	0.271	S	S	.	.	H	α-helix	trans	-65.8	-43.1	175	-69.5	-64	-35	0	0	111.7	R126 A127 E128 S133 S134 Y230	R126-Q130 VanDerWaalsContact O-CG 3.23Å; R126-Q130 WeakPolarHBondContact O-CG 3.39Å; R126-Q130 PolarHBondContact O-N 2.96Å; A127-Q130 WeakPolarHBondContact O-CB 3.24Å; A127-Q130 PolarHBondContact O-N 2.85Å; E128-Q130 VanDerWaalsContact C-N 3.26Å; E128-Q130 PolarHBondContact O-N 3.19Å; Q130-S133 PolarHBondContact O-N 3.14Å; Q130-S133 PolarHBondContact O-OG 3.02Å; Q130-S134 PolarHBondContact O-N 3.49Å; Q130-S134 VanDerWaalsContact O-N 3.09Å; Q130-S134 PolarHBondContact O-OG 2.99Å; Q130-Y230 HydrophobicContact CB-CE2 4.04Å
131	C	98.6	Very high	98.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.9	-42.3	176	-64	0	0	0	0	112	A127 E128 S133 S134 G135 G136 C232	A127-C131 PolarHBondContact O-N 3.11Å; A127-C131 PolarHBondContact O-SG 3.09Å; A127-C131 VanDerWaalsContact O-SG 3.35Å; E128-C131 PolarHBondContact O-N 2.87Å; E128-C131 VanDerWaalsContact O-N 3.13Å; C131-S133 PolarHBondContact O-N 3.27Å; C131-S134 CarbonylContact O-C 3.54Å; C131-S134 WeakPolarHBondContact O-CA 3.33Å; C131-S134 WeakPolarHBondContact O-CB 3.36Å; C131-S134 PolarHBondContact O-N 2.84Å; C131-S134 VanDerWaalsContact O-N 3.08Å; C131-G135 PolarHBondContact O-N 2.95Å; C131-G136 CarbonylContact C-O 3.56Å; C131-G136 CarbonylContact O-C 3.43Å; C131-G136 PolarHBondContact O-N 3.39Å; C131-C232 WeakPolarHBondContact CA-SG 3.45Å; C131-C232 HydrophobicContact CB-CB 3.62Å; C131-C232 WeakPolarHBondContact CB-SG 3.13Å; C131-C232 WeakPolarHBondContact SG-CA 3.42Å; C131-C232 WeakPolarHBondContact SG-CB 3.26Å; C131-C232 CovalentContact SG-SG 2.04Å; C131-C232 PolarHBondContact SG-SG 3.07Å
132	R	98.5	Very high	97.9	Very high	134 Å²	134	45.1 Å²	45.1	51%	0.506	24%	0.238	S	C	.	.	H	α-helix	trans	-58.4	-46.7	172.7	-72	-180	-178.2	-177.4	4.1	112.6	E128 D129 S134 G135 G136	E128-R132 WeakPolarHBondContact O-CG 3.23Å; E128-R132 PolarHBondContact O-N 3.38Å; E128-R132 IonicContact OE1-CZ 3.21Å; E128-R132 IonicContact OE1-NE 2.7Å; E128-R132 PolarHBondContact OE1-NE 3.29Å; E128-R132 IonicContact OE1-NH2 2.91Å; E128-R132 PolarHBondContact OE1-NH2 3.39Å; D129-R132 PolarHBondContact O-N 3.2Å; R132-S134 PolarHBondContact O-N 3.02Å; R132-G135 PolarHBondContact O-N 3.24Å; R132-G136 WeakPolarHBondContact CA-O 3.39Å; R132-G136 PolarHBondContact N-O 3.15Å
133	S	97.7	Very high	97.7	Very high	88 Å²	88	45.5 Å²	45.5	62%	0.615	24%	0.241	S	C	*	.	H	α-helix	trans	-61.7	-26.5	177.3	78	0	0	0	0	112.8	D129 Q130 C131 G135	D129-S133 WeakPolarHBondContact O-CB 3.2Å; D129-S133 PolarHBondContact O-N 2.81Å; Q130-S133 PolarHBondContact O-N 3.14Å; Q130-S133 PolarHBondContact O-OG 3.02Å; C131-S133 PolarHBondContact O-N 3.27Å; S133-G135 VanDerWaalsContact C-N 3.31Å
134	S	95.1	Very high	97.5	Very high	37 Å²	37	45.4 Å²	45.4	26%	0.259	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.1	177.3	-55	0	0	0	0	113.7	K104 Q130 C131 R132	K104-S134 PolarHBondContact NZ-O 2.78Å; Q130-S134 PolarHBondContact O-N 3.49Å; Q130-S134 VanDerWaalsContact O-N 3.09Å; Q130-S134 PolarHBondContact O-OG 2.99Å; C131-S134 CarbonylContact O-C 3.54Å; C131-S134 WeakPolarHBondContact O-CA 3.33Å; C131-S134 WeakPolarHBondContact O-CB 3.36Å; C131-S134 PolarHBondContact O-N 2.84Å; C131-S134 VanDerWaalsContact O-N 3.08Å; R132-S134 PolarHBondContact O-N 3.02Å
135	G	95.2	Very high	97.4	Very high	55 Å²	55	49.3 Å²	49.3	57%	0.567	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	24.2	178.9	0	0	0	0	0	114.5	C131 R132 S133	C131-G135 PolarHBondContact O-N 2.95Å; R132-G135 PolarHBondContact O-N 3.24Å; S133-G135 VanDerWaalsContact C-N 3.31Å
136	G	97.1	Very high	97.3	Very high	15 Å²	15	44.7 Å²	44.7	16%	0.155	24%	0.237	C	C	.	.	S	Bend	trans	-140.3	-153.5	179.6	0	0	0	0	0	112.4	C131 R132 E233	C131-G136 CarbonylContact C-O 3.56Å; C131-G136 CarbonylContact O-C 3.43Å; C131-G136 PolarHBondContact O-N 3.39Å; R132-G136 WeakPolarHBondContact CA-O 3.39Å; R132-G136 PolarHBondContact N-O 3.15Å; G136-E233 CarbonylContact C-O 3.5Å; G136-E233 WeakPolarHBondContact CA-O 3.46Å
137	H	98.8	Very high	97.1	Very high	38 Å²	38	37 Å²	37	18%	0.176	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	172	172	52	79.6	0	0	0	108.8	V176 C232 E233	H137-V176 HydrophobicContact CB-CG2 3.88Å; H137-C232 CarbonylContact O-C 3.54Å; H137-C232 VanDerWaalsContact O-CA 3.3Å; H137-C232 WeakPolarHBondContact O-CA 3.24Å; H137-E233 IonicContact CE1-OE2 3.58Å; H137-E233 PolarHBondContact N-O 3.45Å; H137-E233 PolarHBondContact O-N 3.2Å
138	L	98.8	Very high	96.9	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	145.4	168	-77	171.8	0	0	0	110.6	W124 A127 E128 V140 W161 G163 V176 Y230 I231	W124-L138 HydrophobicContact CD2-CD1 4.15Å; W124-L138 HydrophobicContact CG-CD1 4.38Å; W124-L138 HydrophobicContact CZ2-CD1 4.02Å; A127-L138 HydrophobicContact CB-CD1 4.43Å; A127-L138 HydrophobicContact CB-CD2 4.02Å; E128-L138 HydrophobicContact CB-CD1 3.79Å; E128-L138 HydrophobicContact CB-CG 4.13Å; E128-L138 WeakPolarHBondContact OE2-CB 3.37Å; E128-L138 WeakPolarHBondContact OE2-CG 3.45Å; E128-L138 PolarHBondContact OE2-N 3.02Å; L138-V140 PolarHBondContact O-N 3.09Å; L138-W161 HydrophobicContact CD1-CB 4.49Å; L138-W161 HydrophobicContact CD2-CB 4.24Å; L138-G163 VanDerWaalsContact CB-CA 3.41Å; L138-V176 HydrophobicContact CB-CG2 4.34Å; L138-V176 WeakPolarHBondContact O-CG2 3.36Å; L138-Y230 HydrophobicContact CD2-CD2 4.35Å; L138-Y230 HydrophobicContact CD2-CG 4.41Å; L138-I231 CarbonylContact C-O 3.45Å; L138-I231 WeakPolarHBondContact CA-O 3.28Å
139	L	98.6	Very high	96.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.234	C	C	.	.			trans	-45.3	127.9	-175.6	173	66.4	0	0	0	113.4	Y115 L141 I150 I162 G163 I231 E233	Y115-L139 HydrophobicContact CD1-CD1 3.83Å; Y115-L139 HydrophobicContact CE1-CD1 3.58Å; L139-L141 HydrophobicContact CD1-CD2 4.37Å; L139-L141 HydrophobicContact CD2-CD1 4.39Å; L139-L141 HydrophobicContact CD2-CD2 4.09Å; L139-L141 HydrophobicContact CD2-CG 4.03Å; L139-L141 HydrophobicContact CG-CD2 4.37Å; L139-L141 HydrophobicContact CG-CG 4.12Å; L139-I150 HydrophobicContact CD1-CD1 4.05Å; L139-I150 HydrophobicContact CD1-CG1 4.18Å; L139-I150 HydrophobicContact CD2-CD1 4.13Å; L139-I150 HydrophobicContact CD2-CG1 3.95Å; L139-I150 HydrophobicContact CD2-CG2 3.9Å; L139-I162 HydrophobicContact CB-CB 4.48Å; L139-I162 HydrophobicContact CB-CG2 4.31Å; L139-I162 HydrophobicContact CD2-CG2 3.94Å; L139-I162 HydrophobicContact CG-CG2 4.45Å; L139-G163 WeakPolarHBondContact O-CA 3.44Å; L139-G163 PolarHBondContact O-N 3.03Å; L139-I231 HydrophobicContact CB-CB 3.93Å; L139-I231 HydrophobicContact CB-CG2 3.95Å; L139-I231 HydrophobicContact CD2-CB 4.26Å; L139-I231 HydrophobicContact CD2-CD1 3.9Å; L139-I231 HydrophobicContact CD2-CG2 4.14Å; L139-I231 HydrophobicContact CG-CG2 4.45Å; L139-I231 PolarHBondContact N-O 3.22Å; L139-E233 HydrophobicContact CD1-CB 4.46Å
140	V	98.1	Very high	96.7	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.			trans	-111.6	118.8	171	172.6	0	0	0	0	108.1	L138 N142 W175 V176 D177 T179 E233	L138-V140 PolarHBondContact O-N 3.09Å; V140-N142 PolarHBondContact O-N 2.85Å; V140-N142 PolarHBondContact O-ND2 3.33Å; V140-W175 HydrophobicContact CB-CD2 4.37Å; V140-W175 HydrophobicContact CB-CE3 4.13Å; V140-W175 HydrophobicContact CG1-CB 4.1Å; V140-W175 HydrophobicContact CG1-CD2 3.74Å; V140-W175 HydrophobicContact CG1-CE3 4.01Å; V140-W175 HydrophobicContact CG1-CG 3.79Å; V140-W175 HydrophobicContact CG2-CB 4.1Å; V140-W175 HydrophobicContact CG2-CD2 4.28Å; V140-W175 HydrophobicContact CG2-CE3 3.87Å; V140-W175 HydrophobicContact CG2-CG 4.42Å; V140-V176 HydrophobicContact CG2-CG2 4Å; V140-D177 HydrophobicContact CG2-CB 4.13Å; V140-T179 HydrophobicContact CG1-CG2 4.48Å; V140-E233 PolarHBondContact N-OE2 3.35Å
141	L	96.7	Very high	96.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.2	C	C	.	.			trans	-91.3	108	-176.5	-77.8	167.7	0	0	0	110.3	L139 E146 L147 I150 W175 L208 W219	L139-L141 HydrophobicContact CD1-CD2 4.37Å; L139-L141 HydrophobicContact CD2-CD1 4.39Å; L139-L141 HydrophobicContact CD2-CD2 4.09Å; L139-L141 HydrophobicContact CD2-CG 4.03Å; L139-L141 HydrophobicContact CG-CD2 4.37Å; L139-L141 HydrophobicContact CG-CG 4.12Å; L141-E146 HydrophobicContact CD2-CB 4.49Å; L141-E146 HydrophobicContact CD2-CG 3.96Å; L141-L147 HydrophobicContact CD1-CD1 4.01Å; L141-L147 HydrophobicContact CD2-CB 4.2Å; L141-L147 HydrophobicContact CD2-CD1 4.43Å; L141-I150 HydrophobicContact CD2-CG1 4.26Å; L141-W175 HydrophobicContact CB-CH2 4Å; L141-W175 HydrophobicContact CB-CZ2 4.28Å; L141-L208 HydrophobicContact CD1-CD2 4.32Å; L141-W219 HydrophobicContact CB-CZ2 3.86Å; L141-W219 HydrophobicContact CD1-CZ2 3.58Å; L141-W219 HydrophobicContact CG-CZ2 4.35Å
142	N	95.4	Very high	96.2	Very high	55 Å²	55	37.4 Å²	37.4	29%	0.294	22%	0.221	S	C	.	.			trans	-91.4	-30	-173.1	-61.5	-78.2	0	0	0	113	V140 E146 P185	V140-N142 PolarHBondContact O-N 2.85Å; V140-N142 PolarHBondContact O-ND2 3.33Å; N142-E146 WeakPolarHBondContact CB-OE2 3.47Å; N142-E146 PolarHBondContact N-OE2 2.7Å; N142-E146 PolarHBondContact ND2-OE2 3.49Å; N142-P185 WeakPolarHBondContact O-CD 3.48Å
143	N	94.7	Very high	96	Very high	48 Å²	48	33.8 Å²	33.8	26%	0.257	21%	0.211	S	C	.	.	S	Bend	trans	-156	175.7	-175	59.6	60.8	0	0	0	112.5	E145 E146 L147	N143-E145 WeakPolarHBondContact OD1-CB 3.15Å; N143-E145 PolarHBondContact OD1-N 3.45Å; N143-E145 PolarHBondContact OD1-OE2 2.86Å; N143-E146 WeakPolarHBondContact OD1-CB 3.46Å; N143-E146 PolarHBondContact OD1-N 3.1Å; N143-L147 PolarHBondContact O-N 3.14Å
144	V	94.6	Very high	95.9	Very high	45 Å²	45	30 Å²	30	27%	0.273	18%	0.184	S	C	.	.	H	α-helix	trans	-74	-30.3	-176.3	67.6	0	0	0	0	112.4	L147 D148 F187	V144-L147 PolarHBondContact O-N 2.69Å; V144-D148 WeakPolarHBondContact O-CB 3.04Å; V144-D148 PolarHBondContact O-N 3.21Å; V144-F187 HydrophobicContact CB-CZ 4.37Å
145	E	95.9	Very high	95.8	Very high	95 Å²	95	31.3 Å²	31.3	44%	0.444	19%	0.188	S	C	.	.	H	α-helix	trans	-66.7	-40.8	178.4	-64	71.5	-159.9	0	0	111	F110 N143 D148 Y149	F110-E145 HydrophobicContact CE1-CB 4.5Å; F110-E145 HydrophobicContact CZ-CB 4.12Å; F110-E145 WeakPolarHBondContact CZ-O 3.28Å; N143-E145 WeakPolarHBondContact OD1-CB 3.15Å; N143-E145 PolarHBondContact OD1-N 3.45Å; N143-E145 PolarHBondContact OD1-OE2 2.86Å; E145-D148 PolarHBondContact O-N 3.27Å; E145-Y149 PolarHBondContact O-N 3.22Å
146	E	96.3	Very high	95.7	Very high	5 Å²	5	30.5 Å²	30.5	2%	0.023	17%	0.17	C	C	.	.	H	α-helix	trans	-63.2	-46.9	172.6	-174.7	172.5	-146.7	0	0	111.3	F110 Y115 L141 N142 N143 D148 Y149 I150	F110-E146 HydrophobicContact CE1-CB 4.3Å; Y115-E146 HydrophobicContact CE1-CG 4.47Å; Y115-E146 WeakPolarHBondContact CE1-OE1 3.35Å; Y115-E146 PolarHBondContact OH-OE1 3.28Å; L141-E146 HydrophobicContact CD2-CB 4.49Å; L141-E146 HydrophobicContact CD2-CG 3.96Å; N142-E146 WeakPolarHBondContact CB-OE2 3.47Å; N142-E146 PolarHBondContact N-OE2 2.7Å; N142-E146 PolarHBondContact ND2-OE2 3.49Å; N143-E146 WeakPolarHBondContact OD1-CB 3.46Å; N143-E146 PolarHBondContact OD1-N 3.1Å; E146-D148 VanDerWaalsContact C-N 3.31Å; E146-D148 PolarHBondContact O-N 2.86Å; E146-Y149 WeakPolarHBondContact O-CB 3.22Å; E146-Y149 PolarHBondContact O-N 3.13Å; E146-I150 HydrophobicContact CG-CG1 4.45Å; E146-I150 VanDerWaalsContact O-CG1 3.29Å; E146-I150 WeakPolarHBondContact O-CG1 3.41Å; E146-I150 PolarHBondContact O-N 2.97Å
147	L	94.5	Very high	95.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.7	-44	174.9	175.7	70.2	0	0	0	112.3	L141 N143 V144 Y149 I150 S151 F187 R216	L141-L147 HydrophobicContact CD1-CD1 4.01Å; L141-L147 HydrophobicContact CD2-CB 4.2Å; L141-L147 HydrophobicContact CD2-CD1 4.43Å; N143-L147 PolarHBondContact O-N 3.14Å; V144-L147 PolarHBondContact O-N 2.69Å; L147-Y149 VanDerWaalsContact C-N 3.32Å; L147-Y149 PolarHBondContact O-N 2.8Å; L147-I150 PolarHBondContact O-N 3.36Å; L147-S151 VanDerWaalsContact O-CB 3.25Å; L147-S151 WeakPolarHBondContact O-CB 3.36Å; L147-S151 PolarHBondContact O-N 3.13Å; L147-S151 PolarHBondContact O-OG 3.37Å; L147-F187 HydrophobicContact CB-CE2 4.22Å; L147-F187 HydrophobicContact CB-CZ 4.33Å; L147-F187 HydrophobicContact CD1-CD2 4.43Å; L147-F187 HydrophobicContact CD2-CB 4.17Å; L147-F187 HydrophobicContact CD2-CD1 3.35Å; L147-F187 HydrophobicContact CD2-CD2 3.76Å; L147-F187 HydrophobicContact CD2-CE1 3.46Å; L147-F187 VanDerWaalsContact CD2-CE1 3.46Å; L147-F187 HydrophobicContact CD2-CE2 3.86Å; L147-F187 HydrophobicContact CD2-CG 3.49Å; L147-F187 VanDerWaalsContact CD2-CG 3.49Å; L147-F187 HydrophobicContact CD2-CZ 3.71Å; L147-R216 HydrophobicContact CD2-CB 3.69Å; L147-R216 HydrophobicContact CD2-CG 3.92Å
148	D	94.6	Very high	95.5	Very high	63 Å²	63	40.4 Å²	40.4	34%	0.337	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-41.2	178.9	-81.4	-17.1	0	0	0	111.4	V144 E145 E146 G152 R216	V144-D148 WeakPolarHBondContact O-CB 3.04Å; V144-D148 PolarHBondContact O-N 3.21Å; E145-D148 PolarHBondContact O-N 3.27Å; E146-D148 VanDerWaalsContact C-N 3.31Å; E146-D148 PolarHBondContact O-N 2.86Å; D148-G152 PolarHBondContact O-N 3.23Å; D148-G152 VanDerWaalsContact O-N 3.09Å; D148-R216 IonicContact OD1-CZ 3.4Å; D148-R216 IonicContact OD1-NE 2.7Å; D148-R216 PolarHBondContact OD1-NE 3.03Å; D148-R216 IonicContact OD1-NH2 3.29Å; D148-R216 PolarHBondContact OD1-NH2 3.48Å; D148-R216 IonicContact OD2-CZ 3.48Å; D148-R216 IonicContact OD2-NE 3.59Å; D148-R216 IonicContact OD2-NH2 2.67Å; D148-R216 PolarHBondContact OD2-NH2 3.42Å
149	Y	95.9	Very high	95.4	Very high	52 Å²	52	41.5 Å²	41.5	20%	0.204	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-51.3	174.4	177.8	-100.4	0	0	0	111.6	A108 S109 F110 Y115 E145 E146 L147 S151 G152 I153	A108-Y149 VanDerWaalsContact CB-OH 3.23Å; A108-Y149 WeakPolarHBondContact CB-OH 3.18Å; S109-Y149 PolarHBondContact N-OH 3.14Å; S109-Y149 PolarHBondContact O-OH 2.67Å; F110-Y149 HydrophobicContact CB-CD1 3.54Å; F110-Y149 HydrophobicContact CB-CD2 3.87Å; F110-Y149 HydrophobicContact CB-CE1 3.45Å; F110-Y149 VanDerWaalsContact CB-CE1 3.45Å; F110-Y149 HydrophobicContact CB-CE2 3.76Å; F110-Y149 HydrophobicContact CB-CG 3.74Å; F110-Y149 HydrophobicContact CD1-CD1 4.09Å; F110-Y149 AromaticContact CD1-CG 3.95Å; F110-Y149 HydrophobicContact CD1-CG 3.95Å; F110-Y149 HydrophobicContact CD2-CD1 4.25Å; F110-Y149 AromaticContact CD2-CD2 3.36Å; F110-Y149 HydrophobicContact CD2-CD2 3.36Å; F110-Y149 AromaticContact CD2-CE2 3.89Å; F110-Y149 HydrophobicContact CD2-CE2 3.89Å; F110-Y149 AromaticContact CD2-CG 3.55Å; F110-Y149 HydrophobicContact CD2-CG 3.55Å; F110-Y149 HydrophobicContact CE1-CG 4.41Å; F110-Y149 AromaticContact CE2-CD2 3.96Å; F110-Y149 HydrophobicContact CE2-CD2 3.96Å; F110-Y149 HydrophobicContact CE2-CG 4.05Å; F110-Y149 AromaticContact CG-CD1 3.73Å; F110-Y149 HydrophobicContact CG-CD1 3.73Å; F110-Y149 AromaticContact CG-CD2 3.72Å; F110-Y149 HydrophobicContact CG-CD2 3.72Å; F110-Y149 HydrophobicContact CG-CE1 4.15Å; F110-Y149 HydrophobicContact CG-CE2 4.11Å; F110-Y149 AromaticContact CG-CG 3.48Å; F110-Y149 HydrophobicContact CG-CG 3.48Å; F110-Y149 VanDerWaalsContact CG-CG 3.48Å; F110-Y149 HydrophobicContact CZ-CG 4.44Å; Y115-Y149 HydrophobicContact CD2-CD1 4.28Å; Y115-Y149 AromaticContact CD2-CE1 3.71Å; Y115-Y149 HydrophobicContact CD2-CE1 3.71Å; Y115-Y149 HydrophobicContact CE2-CD1 4.29Å; Y115-Y149 HydrophobicContact CE2-CE1 4.07Å; Y115-Y149 HydrophobicContact CG-CE1 4.44Å; E145-Y149 PolarHBondContact O-N 3.22Å; E146-Y149 WeakPolarHBondContact O-CB 3.22Å; E146-Y149 PolarHBondContact O-N 3.13Å; L147-Y149 VanDerWaalsContact C-N 3.32Å; L147-Y149 PolarHBondContact O-N 2.8Å; Y149-S151 VanDerWaalsContact C-N 3.32Å; Y149-S151 PolarHBondContact O-N 3.24Å; Y149-G152 WeakPolarHBondContact O-CA 3.32Å; Y149-G152 PolarHBondContact O-N 3.27Å; Y149-I153 HydrophobicContact CD1-CD1 4.24Å; Y149-I153 HydrophobicContact CE1-CD1 3.67Å; Y149-I153 HydrophobicContact CE1-CG2 4.46Å; Y149-I153 HydrophobicContact CE2-CG2 4.34Å; Y149-I153 PolarHBondContact O-N 3.28Å
150	I	96.4	Very high	95.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.6	-46.8	178.3	-66.2	-61.8	0	0	0	110.7	Y115 L139 L141 E146 L147 G152 I153 V154 L208 I231	Y115-I150 HydrophobicContact CD1-CD1 3.54Å; Y115-I150 HydrophobicContact CE1-CD1 3.86Å; Y115-I150 HydrophobicContact CG-CD1 3.88Å; L139-I150 HydrophobicContact CD1-CD1 4.05Å; L139-I150 HydrophobicContact CD1-CG1 4.18Å; L139-I150 HydrophobicContact CD2-CD1 4.13Å; L139-I150 HydrophobicContact CD2-CG1 3.95Å; L139-I150 HydrophobicContact CD2-CG2 3.9Å; L141-I150 HydrophobicContact CD2-CG1 4.26Å; E146-I150 HydrophobicContact CG-CG1 4.45Å; E146-I150 VanDerWaalsContact O-CG1 3.29Å; E146-I150 WeakPolarHBondContact O-CG1 3.41Å; E146-I150 PolarHBondContact O-N 2.97Å; L147-I150 PolarHBondContact O-N 3.36Å; I150-G152 PolarHBondContact O-N 3.11Å; I150-G152 VanDerWaalsContact O-N 3.16Å; I150-I153 HydrophobicContact CD1-CD1 4.21Å; I150-I153 WeakPolarHBondContact O-CG1 3.31Å; I150-I153 PolarHBondContact O-N 2.95Å; I150-V154 HydrophobicContact CG2-CG1 3.95Å; I150-V154 WeakPolarHBondContact O-CG1 3.27Å; I150-V154 WeakPolarHBondContact O-CG2 3.3Å; I150-V154 PolarHBondContact O-N 2.98Å; I150-L208 HydrophobicContact CG2-CD1 3.72Å; I150-I231 HydrophobicContact CD1-CG2 4.44Å; I150-I231 HydrophobicContact CG2-CD1 3.86Å
151	S	93.4	Very high	95.4	Very high	13 Å²	13	41.7 Å²	41.7	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-25.5	176.6	-60.2	0	0	0	0	113.2	L147 Y149	L147-S151 VanDerWaalsContact O-CB 3.25Å; L147-S151 WeakPolarHBondContact O-CB 3.36Å; L147-S151 PolarHBondContact O-N 3.13Å; L147-S151 PolarHBondContact O-OG 3.37Å; Y149-S151 VanDerWaalsContact C-N 3.32Å; Y149-S151 PolarHBondContact O-N 3.24Å
152	G	93.1	Very high	95.5	Very high	42 Å²	42	41.7 Å²	41.7	43%	0.433	22%	0.215	S	C	.	.	H	α-helix	trans	-76.4	-31.9	175.7	0	0	0	0	0	114	D148 Y149 I150	D148-G152 PolarHBondContact O-N 3.23Å; D148-G152 VanDerWaalsContact O-N 3.09Å; Y149-G152 WeakPolarHBondContact O-CA 3.32Å; Y149-G152 PolarHBondContact O-N 3.27Å; I150-G152 PolarHBondContact O-N 3.11Å; I150-G152 VanDerWaalsContact O-N 3.16Å
153	I	94.4	Very high	95.7	Very high	58 Å²	58	39.1 Å²	39.1	30%	0.297	20%	0.201	S	C	.	.	H	α-helix	trans	-101.7	-21.6	-172.9	66.3	172.2	0	0	0	114.2	A108 L117 Y149 I150	A108-I153 HydrophobicContact CB-CD1 4.18Å; L117-I153 HydrophobicContact CD1-CD1 3.63Å; L117-I153 HydrophobicContact CD1-CG1 4.12Å; L117-I153 HydrophobicContact CD2-CG1 4.39Å; L117-I153 WeakPolarHBondContact CD2-O 3.38Å; Y149-I153 HydrophobicContact CD1-CD1 4.24Å; Y149-I153 HydrophobicContact CE1-CD1 3.67Å; Y149-I153 HydrophobicContact CE1-CG2 4.46Å; Y149-I153 HydrophobicContact CE2-CG2 4.34Å; Y149-I153 PolarHBondContact O-N 3.28Å; I150-I153 HydrophobicContact CD1-CD1 4.21Å; I150-I153 WeakPolarHBondContact O-CG1 3.31Å; I150-I153 PolarHBondContact O-N 2.95Å
154	V	95.4	Very high	95.8	Very high	8 Å²	8	36.8 Å²	36.8	5%	0.048	19%	0.189	C	C	.	.	S	Bend	trans	-72.7	146.1	176	-62.9	0	0	0	0	112.4	L117 I150 I156 Y160 I231	L117-V154 HydrophobicContact CD2-CB 4.37Å; L117-V154 HydrophobicContact CD2-CG1 3.97Å; I150-V154 HydrophobicContact CG2-CG1 3.95Å; I150-V154 WeakPolarHBondContact O-CG1 3.27Å; I150-V154 WeakPolarHBondContact O-CG2 3.3Å; I150-V154 PolarHBondContact O-N 2.98Å; V154-I156 PolarHBondContact O-N 3.13Å; V154-Y160 HydrophobicContact CB-CD2 4.35Å; V154-Y160 HydrophobicContact CB-CE2 3.89Å; V154-Y160 HydrophobicContact CG1-CD2 4.32Å; V154-Y160 HydrophobicContact CG1-CE2 4.25Å; V154-I231 HydrophobicContact CG1-CD1 3.7Å
155	D	94.6	Very high	95.9	Very high	65 Å²	65	35.5 Å²	35.5	35%	0.348	18%	0.181	S	C	.	.			trans	-81.9	106.1	163.4	-176.9	-12.7	0	0	0	108.9	K157 Y158 Y160	D155-K157 PolarHBondContact O-N 3.36Å; D155-K157 WeakPolarHBondContact OD1-CB 3.48Å; D155-K157 WeakPolarHBondContact OD1-CG 3.44Å; D155-K157 PolarHBondContact OD1-N 3.32Å; D155-K157 VanDerWaalsContact OD1-N 3.09Å; D155-Y158 HydrophobicContact CB-CD2 3.88Å; D155-Y158 HydrophobicContact CB-CE2 4.23Å; D155-Y158 PolarHBondContact O-N 3.27Å; D155-Y158 VanDerWaalsContact O-N 3.09Å; D155-Y158 VanDerWaalsContact OD2-CE2 3.3Å; D155-Y158 WeakPolarHBondContact OD2-CE2 3.29Å; D155-Y160 PolarHBondContact N-OH 3.44Å; D155-Y160 WeakPolarHBondContact O-CE2 3.35Å; D155-Y160 PolarHBondContact O-OH 2.93Å
156	I	92.8	Very high	95.8	Very high	39 Å²	39	31.9 Å²	31.9	20%	0.2	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-12.3	-175.7	63.6	173.8	0	0	0	114.6	V154 Y158 A210 S211 R214	V154-I156 PolarHBondContact O-N 3.13Å; I156-Y158 PolarHBondContact O-N 3Å; I156-A210 CarbonylContact O-C 3.55Å; I156-A210 VanDerWaalsContact O-CA 3.29Å; I156-A210 WeakPolarHBondContact O-CA 3.15Å; I156-S211 PolarHBondContact O-N 2.95Å; I156-R214 HydrophobicContact CD1-CG 4.36Å; I156-R214 HydrophobicContact CG2-CG 3.83Å
157	K	94.1	Very high	95.2	Very high	162 Å²	162	36.7 Å²	36.7	70%	0.704	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.1	176.3	-63.1	174.5	-175.7	174.3	0	113.2	D155 A210	D155-K157 PolarHBondContact O-N 3.36Å; D155-K157 WeakPolarHBondContact OD1-CB 3.48Å; D155-K157 WeakPolarHBondContact OD1-CG 3.44Å; D155-K157 PolarHBondContact OD1-N 3.32Å; D155-K157 VanDerWaalsContact OD1-N 3.09Å; K157-A210 WeakPolarHBondContact O-CB 3.31Å
158	Y	96.6	Very high	94.3	Very high	99 Å²	99	45.6 Å²	45.6	39%	0.388	22%	0.224	S	C	.	.	S	Bend	trans	-113.7	151.5	-179	-57.3	-78	0	0	0	110.6	D155 I156 Y160 R229	D155-Y158 HydrophobicContact CB-CD2 3.88Å; D155-Y158 HydrophobicContact CB-CE2 4.23Å; D155-Y158 PolarHBondContact O-N 3.27Å; D155-Y158 VanDerWaalsContact O-N 3.09Å; D155-Y158 VanDerWaalsContact OD2-CE2 3.3Å; D155-Y158 WeakPolarHBondContact OD2-CE2 3.29Å; I156-Y158 PolarHBondContact O-N 3Å; Y158-Y160 WeakPolarHBondContact O-CD2 3.47Å; Y158-Y160 VanDerWaalsContact O-CE2 3.23Å; Y158-Y160 WeakPolarHBondContact O-CE2 3.5Å; Y158-R229 VanDerWaalsContact CE2-NH1 3.27Å
159	S	97.6	Very high	93.3	Very high	23 Å²	23	47.5 Å²	47.5	16%	0.161	23%	0.23	C	C	.	.			trans	-87.5	148.1	165.3	-51.6	0	0	0	0	111.1	L208 A210 R229	S159-L208 CarbonylContact C-O 3.58Å; S159-L208 WeakPolarHBondContact CA-O 3.15Å; S159-L208 WeakPolarHBondContact CB-O 3.38Å; S159-A210 PolarHBondContact OG-N 3.46Å; S159-A210 VanDerWaalsContact OG-N 3.15Å; S159-R229 PolarHBondContact O-N 2.94Å
160	Y	98.4	Very high	92.5	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	126	-179.5	-60.1	-98.5	0	0	0	111.1	V154 D155 Y158 Q207 L208 R229 I231	V154-Y160 HydrophobicContact CB-CD2 4.35Å; V154-Y160 HydrophobicContact CB-CE2 3.89Å; V154-Y160 HydrophobicContact CG1-CD2 4.32Å; V154-Y160 HydrophobicContact CG1-CE2 4.25Å; D155-Y160 PolarHBondContact N-OH 3.44Å; D155-Y160 WeakPolarHBondContact O-CE2 3.35Å; D155-Y160 PolarHBondContact O-OH 2.93Å; Y158-Y160 WeakPolarHBondContact O-CD2 3.47Å; Y158-Y160 VanDerWaalsContact O-CE2 3.23Å; Y158-Y160 WeakPolarHBondContact O-CE2 3.5Å; Y160-Q207 CarbonylContact O-C 3.51Å; Y160-Q207 WeakPolarHBondContact O-CA 3.33Å; Y160-Q207 WeakPolarHBondContact O-CB 3.4Å; Y160-L208 PolarHBondContact N-O 3.33Å; Y160-L208 PolarHBondContact O-N 3.3Å; Y160-R229 CarbonylContact C-O 3.49Å; Y160-R229 VanDerWaalsContact CA-O 3.22Å; Y160-R229 WeakPolarHBondContact CA-O 3.21Å; Y160-R229 HydrophobicContact CD1-CB 3.52Å; Y160-R229 HydrophobicContact CE1-CB 3.65Å; Y160-R229 HydrophobicContact CE1-CG 4.41Å; Y160-R229 HydrophobicContact CG-CB 4.24Å; Y160-I231 HydrophobicContact CD1-CD1 4.33Å; Y160-I231 HydrophobicContact CD1-CG1 3.87Å; Y160-I231 HydrophobicContact CG-CD1 4.11Å; Y160-I231 HydrophobicContact CG-CG1 4.1Å
161	W	98.8	Very high	91.8	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	138	165.4	-67.4	130.8	0	0	0	111.2	N122 W124 L138 C205 Q207 A222 D223 L226 Y228 R229 I231	N122-W161 PolarHBondContact O-NE1 2.85Å; W124-W161 HydrophobicContact CB-CD2 4.07Å; W124-W161 HydrophobicContact CB-CE3 4.46Å; W124-W161 HydrophobicContact CB-CG 4.44Å; W124-W161 HydrophobicContact CB-CZ2 4.11Å; W124-W161 AromaticContact CD1-CD2 3.7Å; W124-W161 AromaticContact CD1-CE3 3.6Å; W124-W161 AromaticContact CD1-CG 3.95Å; W124-W161 HydrophobicContact CG-CD2 4.3Å; W124-W161 HydrophobicContact CG-CE3 4.44Å; L138-W161 HydrophobicContact CD1-CB 4.49Å; L138-W161 HydrophobicContact CD2-CB 4.24Å; W161-C205 HydrophobicContact CE3-CB 4.24Å; W161-C205 HydrophobicContact CH2-CB 3.96Å; W161-C205 HydrophobicContact CZ3-CB 3.61Å; W161-Q207 HydrophobicContact CE3-CB 3.75Å; W161-Q207 HydrophobicContact CZ3-CB 4Å; W161-Q207 HydrophobicContact CZ3-CG 4.43Å; W161-A222 HydrophobicContact CH2-CB 3.8Å; W161-A222 HydrophobicContact CZ3-CB 3.83Å; W161-D223 WeakPolarHBondContact CH2-O 3.47Å; W161-L226 VanDerWaalsContact CZ2-O 3.32Å; W161-L226 WeakPolarHBondContact CZ2-O 3.34Å; W161-Y228 AromaticContact CD2-CD2 3.77Å; W161-Y228 HydrophobicContact CD2-CD2 3.77Å; W161-Y228 AromaticContact CE2-CD2 3.36Å; W161-Y228 AromaticContact CE3-CD2 3.97Å; W161-Y228 HydrophobicContact CE3-CD2 3.97Å; W161-Y228 AromaticContact CH2-CD2 3.45Å; W161-Y228 HydrophobicContact CH2-CD2 3.45Å; W161-Y228 VanDerWaalsContact CH2-CD2 3.45Å; W161-Y228 AromaticContact CH2-CE2 3.5Å; W161-Y228 HydrophobicContact CH2-CE2 3.5Å; W161-Y228 VanDerWaalsContact CH2-CE2 3.5Å; W161-Y228 AromaticContact CZ2-CD2 3.21Å; W161-Y228 HydrophobicContact CZ2-CD2 3.21Å; W161-Y228 AromaticContact CZ2-CE2 3.61Å; W161-Y228 HydrophobicContact CZ2-CE2 3.61Å; W161-Y228 HydrophobicContact CZ2-CG 4.31Å; W161-Y228 AromaticContact CZ3-CD2 3.82Å; W161-Y228 HydrophobicContact CZ3-CD2 3.82Å; W161-Y228 HydrophobicContact CZ3-CE2 4.04Å; W161-Y228 AromaticContact NE1-CD2 3.94Å; W161-R229 PolarHBondContact N-O 3.48Å; W161-I231 PolarHBondContact O-N 3.15Å
162	I	98.7	Very high	91.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	169.2	168.6	61	170.9	0	0	0	109	W124 L139 L164 W175 G206 L208 W219	W124-I162 PolarHBondContact NE1-O 3.21Å; L139-I162 HydrophobicContact CB-CB 4.48Å; L139-I162 HydrophobicContact CB-CG2 4.31Å; L139-I162 HydrophobicContact CD2-CG2 3.94Å; L139-I162 HydrophobicContact CG-CG2 4.45Å; I162-L164 HydrophobicContact CD1-CB 3.93Å; I162-L164 HydrophobicContact CD1-CD2 4.46Å; I162-L164 HydrophobicContact CG1-CB 3.92Å; I162-L164 PolarHBondContact O-N 3.19Å; I162-W175 HydrophobicContact CD1-CH2 4.13Å; I162-W175 HydrophobicContact CD1-CZ3 4.17Å; I162-G206 VanDerWaalsContact CG1-O 3.24Å; I162-G206 WeakPolarHBondContact CG1-O 3.29Å; I162-G206 PolarHBondContact N-O 2.93Å; I162-G206 VanDerWaalsContact N-O 3.1Å; I162-L208 HydrophobicContact CG2-CD1 4.34Å; I162-L208 HydrophobicContact CG2-CD2 4.14Å; I162-L208 HydrophobicContact CG2-CG 3.73Å; I162-W219 HydrophobicContact CD1-CD2 4.13Å; I162-W219 HydrophobicContact CD1-CG 4.28Å; I162-W219 HydrophobicContact CD1-CZ2 4.43Å
163	G	98.4	Very high	91.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	24.3	-175.5	0	0	0	0	0	114.4	L138 L139 W175 V176	L138-G163 VanDerWaalsContact CB-CA 3.41Å; L139-G163 WeakPolarHBondContact O-CA 3.44Å; L139-G163 PolarHBondContact O-N 3.03Å; G163-W175 CarbonylContact O-C 3.45Å; G163-W175 WeakPolarHBondContact O-CA 3.37Å; G163-V176 WeakPolarHBondContact O-CG1 3.36Å; G163-V176 PolarHBondContact O-N 3.12Å
164	L	97.8	Very high	91.9	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	130.3	-177.8	-164	70.8	0	0	0	109.3	W124 I162 W173 W175 F181 W188 G206 W219	W124-L164 PolarHBondContact NE1-O 3.26Å; I162-L164 HydrophobicContact CD1-CB 3.93Å; I162-L164 HydrophobicContact CD1-CD2 4.46Å; I162-L164 HydrophobicContact CG1-CB 3.92Å; I162-L164 PolarHBondContact O-N 3.19Å; L164-W173 HydrophobicContact CD1-CB 4.21Å; L164-W173 HydrophobicContact CD1-CE3 4.37Å; L164-W173 HydrophobicContact CD2-CD2 4.14Å; L164-W173 HydrophobicContact CD2-CE3 3.74Å; L164-W173 HydrophobicContact CD2-CZ3 4.16Å; L164-W173 HydrophobicContact CG-CD2 4.25Å; L164-W173 HydrophobicContact CG-CE3 3.52Å; L164-W173 HydrophobicContact CG-CZ3 4.09Å; L164-W175 HydrophobicContact CB-CE3 3.98Å; L164-W175 HydrophobicContact CB-CH2 4.17Å; L164-W175 HydrophobicContact CB-CZ3 3.63Å; L164-W175 HydrophobicContact CD1-CD2 3.73Å; L164-W175 HydrophobicContact CD1-CE3 3.77Å; L164-W175 HydrophobicContact CD1-CG 4.44Å; L164-W175 HydrophobicContact CD1-CH2 3.94Å; L164-W175 HydrophobicContact CD1-CZ2 3.92Å; L164-W175 HydrophobicContact CD1-CZ3 3.87Å; L164-W175 HydrophobicContact CG-CH2 4.46Å; L164-W175 HydrophobicContact CG-CZ3 4.29Å; L164-F181 HydrophobicContact CD1-CD2 3.53Å; L164-F181 HydrophobicContact CD1-CE2 3.54Å; L164-F181 HydrophobicContact CD2-CE2 4.16Å; L164-F181 HydrophobicContact CG-CE2 4.47Å; L164-W188 HydrophobicContact CD2-CH2 3.58Å; L164-W188 HydrophobicContact CD2-CZ2 3.76Å; L164-G206 PolarHBondContact O-N 3.09Å; L164-W219 HydrophobicContact CD2-CE3 3.79Å; L164-W219 HydrophobicContact CD2-CZ3 3.85Å
165	V	96.8	Very high	92	Very high	17 Å²	17	53.7 Å²	53.7	10%	0.103	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	143.3	-178.7	61.7	0	0	0	0	110.3	W124 R167 S174 D204	W124-V165 HydrophobicContact CH2-CB 3.8Å; W124-V165 HydrophobicContact CH2-CG1 3.72Å; W124-V165 HydrophobicContact CH2-CG2 4.18Å; W124-V165 HydrophobicContact CZ2-CB 3.65Å; W124-V165 HydrophobicContact CZ2-CG1 3.9Å; W124-V165 HydrophobicContact CZ2-CG2 4.35Å; W124-V165 HydrophobicContact CZ3-CB 4.47Å; W124-V165 HydrophobicContact CZ3-CG2 4.39Å; V165-R167 HydrophobicContact CG1-CG 4.14Å; V165-S174 PolarHBondContact N-O 3.07Å; V165-S174 PolarHBondContact O-N 2.8Å; V165-D204 CarbonylContact C-O 3.54Å; V165-D204 WeakPolarHBondContact CA-O 3.33Å
166	E	93.7	Very high	92.1	Very high	19 Å²	19	51.3 Å²	51.3	9%	0.089	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	131.3	170	-61.2	-150.9	142.9	0	0	110.4	E170 G171 H172 W173 D204	E166-E170 VanDerWaalsContact OE2-CA 3.29Å; E166-E170 WeakPolarHBondContact OE2-CA 3.32Å; E166-G171 VanDerWaalsContact CD-N 3.27Å; E166-G171 WeakPolarHBondContact OE1-CA 3.42Å; E166-G171 PolarHBondContact OE1-N 3.4Å; E166-G171 PolarHBondContact OE2-N 3.07Å; E166-H172 WeakPolarHBondContact CA-O 3.35Å; E166-W173 HydrophobicContact CG-CD2 3.69Å; E166-W173 HydrophobicContact CG-CE3 3.68Å; E166-W173 HydrophobicContact CG-CG 4.39Å; E166-W173 HydrophobicContact CG-CH2 3.69Å; E166-W173 HydrophobicContact CG-CZ2 3.61Å; E166-W173 HydrophobicContact CG-CZ3 3.72Å; E166-W173 WeakPolarHBondContact OE1-CZ2 3.45Å; E166-W173 PolarHBondContact OE1-NE1 3.09Å; E166-D204 HydrophobicContact CB-CB 4.18Å; E166-D204 PolarHBondContact N-O 3.45Å
167	R	84.1	Confident	92.3	Very high	107 Å²	107	52.6 Å²	52.6	40%	0.404	26%	0.256	S	S	.	.			trans	-123.4	146.5	176.3	-64.8	-172.4	-178.1	178.8	4.9	109.6	V165 H169 H172	V165-R167 HydrophobicContact CG1-CG 4.14Å; R167-H169 PolarHBondContact O-N 2.89Å; R167-H172 PolarHBondContact N-O 3.19Å
168	Q	74	Confident	92.4	Very high	187 Å²	187	48 Å²	48	87%	0.874	25%	0.254	S	S	*	.	S	Bend	trans	74.3	-58.7	176.4	-46.3	175.5	16.8	0	0	114.2
169	H	74.6	Confident	92.4	Very high	103 Å²	103	45.1 Å²	45.1	48%	0.477	25%	0.247	S	C	.	.	S	Bend	trans	-158.6	162.8	178.1	47.4	68.2	0	0	0	111.6	R167 H172	R167-H169 PolarHBondContact O-N 2.89Å; H169-H172 AromaticContact CE1-CD2 3.42Å; H169-H172 PolarHBondContact CE1-CD2 2.97Å; H169-H172 VanDerWaalsContact CE1-CD2 3.42Å; H169-H172 AromaticContact CE1-CE1 3.16Å; H169-H172 PolarHBondContact CE1-CE1 2.88Å; H169-H172 AromaticContact CE1-CG 3.22Å; H169-H172 AromaticContact CE1-ND1 3.06Å; H169-H172 PolarHBondContact CE1-ND1 3.35Å; H169-H172 AromaticContact CE1-NE2 3.38Å; H169-H172 PolarHBondContact CE1-NE2 3.45Å; H169-H172 AromaticContact ND1-CE1 3.5Å; H169-H172 AromaticContact ND1-CG 3.39Å; H169-H172 AromaticContact ND1-ND1 2.99Å; H169-H172 PolarHBondContact ND1-ND1 3.34Å; H169-H172 WeakPolarHBondContact O-CB 3.3Å; H169-H172 PolarHBondContact O-N 3.4Å
170	E	79.6	Confident	92.3	Very high	101 Å²	101	49.1 Å²	49.1	47%	0.472	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.8	135.6	178.4	-169.8	68.7	-159.6	0	0	113.4	E166 H172 N195	E166-E170 VanDerWaalsContact OE2-CA 3.29Å; E166-E170 WeakPolarHBondContact OE2-CA 3.32Å; E170-H172 VanDerWaalsContact C-N 3.28Å; E170-H172 PolarHBondContact O-N 3.48Å; E170-H172 PolarHBondContact O-ND1 3.11Å; E170-N195 WeakPolarHBondContact OE1-CB 3.45Å; E170-N195 VanDerWaalsContact OE1-CG 3.28Å; E170-N195 PolarHBondContact OE1-ND2 3.14Å; E170-N195 PolarHBondContact OE2-ND2 3.18Å
171	G	81.1	Confident	92.2	Very high	45 Å²	45	50.8 Å²	50.8	46%	0.464	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	1.9	175.6	0	0	0	0	0	114.9	E166	E166-G171 VanDerWaalsContact CD-N 3.27Å; E166-G171 WeakPolarHBondContact OE1-CA 3.42Å; E166-G171 PolarHBondContact OE1-N 3.4Å; E166-G171 PolarHBondContact OE2-N 3.07Å
172	H	89.4	Confident	92	Very high	101 Å²	101	53.9 Å²	53.9	47%	0.468	31%	0.307	S	S	.	.			trans	-104.8	83.7	-179.7	-72.4	59.7	0	0	0	111.9	E166 R167 H169 E170	E166-H172 WeakPolarHBondContact CA-O 3.35Å; R167-H172 PolarHBondContact N-O 3.19Å; H169-H172 AromaticContact CE1-CD2 3.42Å; H169-H172 PolarHBondContact CE1-CD2 2.97Å; H169-H172 VanDerWaalsContact CE1-CD2 3.42Å; H169-H172 AromaticContact CE1-CE1 3.16Å; H169-H172 PolarHBondContact CE1-CE1 2.88Å; H169-H172 AromaticContact CE1-CG 3.22Å; H169-H172 AromaticContact CE1-ND1 3.06Å; H169-H172 PolarHBondContact CE1-ND1 3.35Å; H169-H172 AromaticContact CE1-NE2 3.38Å; H169-H172 PolarHBondContact CE1-NE2 3.45Å; H169-H172 AromaticContact ND1-CE1 3.5Å; H169-H172 AromaticContact ND1-CG 3.39Å; H169-H172 AromaticContact ND1-ND1 2.99Å; H169-H172 PolarHBondContact ND1-ND1 3.34Å; H169-H172 WeakPolarHBondContact O-CB 3.3Å; H169-H172 PolarHBondContact O-N 3.4Å; E170-H172 VanDerWaalsContact C-N 3.28Å; E170-H172 PolarHBondContact O-N 3.48Å; E170-H172 PolarHBondContact O-ND1 3.11Å
173	W	95.8	Very high	91.8	Very high	20 Å²	20	57.8 Å²	57.8	8%	0.076	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	140.8	179.5	-66.2	93.2	0	0	0	112.9	L164 E166 F181 W188 P193 D221	L164-W173 HydrophobicContact CD1-CB 4.21Å; L164-W173 HydrophobicContact CD1-CE3 4.37Å; L164-W173 HydrophobicContact CD2-CD2 4.14Å; L164-W173 HydrophobicContact CD2-CE3 3.74Å; L164-W173 HydrophobicContact CD2-CZ3 4.16Å; L164-W173 HydrophobicContact CG-CD2 4.25Å; L164-W173 HydrophobicContact CG-CE3 3.52Å; L164-W173 HydrophobicContact CG-CZ3 4.09Å; E166-W173 HydrophobicContact CG-CD2 3.69Å; E166-W173 HydrophobicContact CG-CE3 3.68Å; E166-W173 HydrophobicContact CG-CG 4.39Å; E166-W173 HydrophobicContact CG-CH2 3.69Å; E166-W173 HydrophobicContact CG-CZ2 3.61Å; E166-W173 HydrophobicContact CG-CZ3 3.72Å; E166-W173 WeakPolarHBondContact OE1-CZ2 3.45Å; E166-W173 PolarHBondContact OE1-NE1 3.09Å; W173-F181 HydrophobicContact CB-CD1 3.86Å; W173-F181 HydrophobicContact CB-CD2 3.95Å; W173-F181 HydrophobicContact CB-CE1 3.81Å; W173-F181 HydrophobicContact CB-CE2 3.88Å; W173-F181 HydrophobicContact CB-CG 3.92Å; W173-F181 HydrophobicContact CB-CZ 3.8Å; W173-F181 HydrophobicContact CG-CE1 4.37Å; W173-F181 HydrophobicContact CG-CZ 4.19Å; W173-F181 WeakPolarHBondContact O-CB 3.47Å; W173-W188 AromaticContact CD2-CH2 3.81Å; W173-W188 HydrophobicContact CD2-CH2 3.81Å; W173-W188 AromaticContact CD2-CZ2 3.78Å; W173-W188 HydrophobicContact CD2-CZ2 3.78Å; W173-W188 AromaticContact CE2-CH2 3.43Å; W173-W188 VanDerWaalsContact CE2-CH2 3.43Å; W173-W188 AromaticContact CE2-CZ2 3.53Å; W173-W188 HydrophobicContact CE3-CH2 4.14Å; W173-W188 HydrophobicContact CE3-CZ2 4.48Å; W173-W188 HydrophobicContact CG-CZ2 4.05Å; W173-W188 AromaticContact CH2-CH2 3.72Å; W173-W188 HydrophobicContact CH2-CH2 3.72Å; W173-W188 HydrophobicContact CH2-CZ3 4.47Å; W173-W188 AromaticContact CZ2-CH2 3.4Å; W173-W188 HydrophobicContact CZ2-CH2 3.4Å; W173-W188 VanDerWaalsContact CZ2-CH2 3.4Å; W173-W188 AromaticContact CZ2-CZ2 3.99Å; W173-W188 HydrophobicContact CZ2-CZ2 3.99Å; W173-W188 HydrophobicContact CZ2-CZ3 4.24Å; W173-W188 HydrophobicContact CZ3-CH2 4.08Å; W173-W188 AromaticContact NE1-CZ2 3.72Å; W173-P193 HydrophobicContact CZ2-CB 3.87Å; W173-P193 HydrophobicContact CZ2-CG 4.34Å; W173-D221 HydrophobicContact CH2-CB 3.46Å; W173-D221 VanDerWaalsContact CH2-CB 3.46Å; W173-D221 HydrophobicContact CZ2-CB 3.57Å
174	S	96.9	Very high	91.7	Very high	34 Å²	34	58.5 Å²	58.5	24%	0.238	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	143	178.3	-65.4	0	0	0	0	111.1	V165	V165-S174 PolarHBondContact N-O 3.07Å; V165-S174 PolarHBondContact O-N 2.8Å
175	W	98	Very high	91.5	Very high	2 Å²	2	61 Å²	61	1%	0.008	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	144.8	169.8	-66.9	116.8	0	0	0	111.7	V140 L141 I162 G163 L164 D177 G178 F181 T184 W219	V140-W175 HydrophobicContact CB-CD2 4.37Å; V140-W175 HydrophobicContact CB-CE3 4.13Å; V140-W175 HydrophobicContact CG1-CB 4.1Å; V140-W175 HydrophobicContact CG1-CD2 3.74Å; V140-W175 HydrophobicContact CG1-CE3 4.01Å; V140-W175 HydrophobicContact CG1-CG 3.79Å; V140-W175 HydrophobicContact CG2-CB 4.1Å; V140-W175 HydrophobicContact CG2-CD2 4.28Å; V140-W175 HydrophobicContact CG2-CE3 3.87Å; V140-W175 HydrophobicContact CG2-CG 4.42Å; L141-W175 HydrophobicContact CB-CH2 4Å; L141-W175 HydrophobicContact CB-CZ2 4.28Å; I162-W175 HydrophobicContact CD1-CH2 4.13Å; I162-W175 HydrophobicContact CD1-CZ3 4.17Å; G163-W175 CarbonylContact O-C 3.45Å; G163-W175 WeakPolarHBondContact O-CA 3.37Å; L164-W175 HydrophobicContact CB-CE3 3.98Å; L164-W175 HydrophobicContact CB-CH2 4.17Å; L164-W175 HydrophobicContact CB-CZ3 3.63Å; L164-W175 HydrophobicContact CD1-CD2 3.73Å; L164-W175 HydrophobicContact CD1-CE3 3.77Å; L164-W175 HydrophobicContact CD1-CG 4.44Å; L164-W175 HydrophobicContact CD1-CH2 3.94Å; L164-W175 HydrophobicContact CD1-CZ2 3.92Å; L164-W175 HydrophobicContact CD1-CZ3 3.87Å; L164-W175 HydrophobicContact CG-CH2 4.46Å; L164-W175 HydrophobicContact CG-CZ3 4.29Å; W175-D177 VanDerWaalsContact C-N 3.28Å; W175-D177 WeakPolarHBondContact CB-OD1 3.36Å; W175-D177 PolarHBondContact O-N 3.39Å; W175-G178 PolarHBondContact O-N 2.95Å; W175-F181 AromaticContact NE1-CD2 3.85Å; W175-T184 PolarHBondContact NE1-OG1 3.11Å; W175-W219 AromaticContact CH2-CH2 3.65Å; W175-W219 HydrophobicContact CH2-CH2 3.65Å; W175-W219 AromaticContact CH2-CZ2 3.7Å; W175-W219 HydrophobicContact CH2-CZ2 3.7Å; W175-W219 HydrophobicContact CH2-CZ3 4.43Å; W175-W219 AromaticContact CZ2-CH2 3.47Å; W175-W219 HydrophobicContact CZ2-CH2 3.47Å; W175-W219 VanDerWaalsContact CZ2-CH2 3.47Å; W175-W219 AromaticContact CZ2-CZ2 3.93Å; W175-W219 HydrophobicContact CZ2-CZ2 3.93Å; W175-W219 HydrophobicContact CZ2-CZ3 4.3Å
176	V	97.9	Very high	91.4	Very high	14 Å²	14	63.8 Å²	63.8	9%	0.085	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.6	-179.2	-74.5	0	0	0	0	114.1	W124 H137 L138 V140 G163 G178	W124-V176 HydrophobicContact CH2-CG1 3.38Å; W124-V176 HydrophobicContact CZ2-CG1 3.42Å; W124-V176 VanDerWaalsContact CZ2-CG1 3.42Å; H137-V176 HydrophobicContact CB-CG2 3.88Å; L138-V176 HydrophobicContact CB-CG2 4.34Å; L138-V176 WeakPolarHBondContact O-CG2 3.36Å; V140-V176 HydrophobicContact CG2-CG2 4Å; G163-V176 WeakPolarHBondContact O-CG1 3.36Å; G163-V176 PolarHBondContact O-N 3.12Å; V176-G178 VanDerWaalsContact C-N 3.28Å
177	D	96.9	Very high	91.4	Very high	67 Å²	67	64 Å²	64	36%	0.358	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.7	179.7	73.6	-22.3	0	0	0	113.1	V140 W175 T179	V140-D177 HydrophobicContact CG2-CB 4.13Å; W175-D177 VanDerWaalsContact C-N 3.28Å; W175-D177 WeakPolarHBondContact CB-OD1 3.36Å; W175-D177 PolarHBondContact O-N 3.39Å; D177-T179 VanDerWaalsContact CG-OG1 3.23Å; D177-T179 WeakPolarHBondContact OD1-CB 3.46Å; D177-T179 PolarHBondContact OD1-N 2.92Å; D177-T179 PolarHBondContact OD1-OG1 2.92Å; D177-T179 VanDerWaalsContact OD1-OG1 3.1Å; D177-T179 PolarHBondContact OD2-OG1 2.85Å
178	G	96.1	Very high	91.9	Very high	64 Å²	64	60.7 Å²	60.7	66%	0.66	36%	0.36	S	S	*	.			trans	85.8	5.7	-176.7	0	0	0	0	0	114.7	W175 V176 D180	W175-G178 PolarHBondContact O-N 2.95Å; V176-G178 VanDerWaalsContact C-N 3.28Å; G178-D180 PolarHBondContact O-N 3.21Å
179	T	96.6	Very high	92.9	Very high	39 Å²	39	53.1 Å²	53.1	24%	0.239	33%	0.325	C	S	.	.			trans	-57.5	134.1	169.5	-68.7	0	0	0	0	109.7	V140 D177 F181 T184	V140-T179 HydrophobicContact CG1-CG2 4.48Å; D177-T179 VanDerWaalsContact CG-OG1 3.23Å; D177-T179 WeakPolarHBondContact OD1-CB 3.46Å; D177-T179 PolarHBondContact OD1-N 2.92Å; D177-T179 PolarHBondContact OD1-OG1 2.92Å; D177-T179 VanDerWaalsContact OD1-OG1 3.1Å; D177-T179 PolarHBondContact OD2-OG1 2.85Å; T179-F181 PolarHBondContact O-N 3.2Å; T179-T184 HydrophobicContact CG2-CG2 3.82Å
180	D	95.3	Very high	93.8	Very high	108 Å²	108	57 Å²	57	58%	0.578	34%	0.343	S	S	*	.			trans	-66	118.9	178	175.2	21	0	0	0	109.7	G178 G182 S183	G178-D180 PolarHBondContact O-N 3.21Å; D180-G182 PolarHBondContact O-N 3.47Å; D180-G182 PolarHBondContact OD1-N 2.9Å; D180-G182 VanDerWaalsContact OD1-N 3.07Å; D180-S183 WeakPolarHBondContact O-CB 3.38Å; D180-S183 PolarHBondContact O-N 3.39Å; D180-S183 PolarHBondContact O-OG 3.5Å
181	F	95.4	Very high	94.3	Very high	38 Å²	38	55 Å²	55	17%	0.167	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-56.9	-39.2	179.1	-179.7	-107.9	0	0	0	111.7	L164 W173 W175 T179 S183 T184 T186 W188 W219	L164-F181 HydrophobicContact CD1-CD2 3.53Å; L164-F181 HydrophobicContact CD1-CE2 3.54Å; L164-F181 HydrophobicContact CD2-CE2 4.16Å; L164-F181 HydrophobicContact CG-CE2 4.47Å; W173-F181 HydrophobicContact CB-CD1 3.86Å; W173-F181 HydrophobicContact CB-CD2 3.95Å; W173-F181 HydrophobicContact CB-CE1 3.81Å; W173-F181 HydrophobicContact CB-CE2 3.88Å; W173-F181 HydrophobicContact CB-CG 3.92Å; W173-F181 HydrophobicContact CB-CZ 3.8Å; W173-F181 HydrophobicContact CG-CE1 4.37Å; W173-F181 HydrophobicContact CG-CZ 4.19Å; W173-F181 WeakPolarHBondContact O-CB 3.47Å; W175-F181 AromaticContact NE1-CD2 3.85Å; T179-F181 PolarHBondContact O-N 3.2Å; F181-S183 PolarHBondContact O-N 2.93Å; F181-S183 VanDerWaalsContact O-N 3.16Å; F181-T184 PolarHBondContact O-N 2.89Å; F181-T184 VanDerWaalsContact O-N 3.09Å; F181-T184 PolarHBondContact O-OG1 3.4Å; F181-T186 HydrophobicContact CE1-CG2 4.02Å; F181-T186 HydrophobicContact CE2-CG2 4.18Å; F181-T186 HydrophobicContact CZ-CG2 3.53Å; F181-W188 HydrophobicContact CZ-CZ2 4.38Å; F181-W219 AromaticContact CE2-CZ3 3.96Å; F181-W219 HydrophobicContact CE2-CZ3 3.96Å; F181-W219 HydrophobicContact CZ-CZ3 4.49Å
182	G	95.3	Very high	94.9	Very high	66 Å²	66	54.7 Å²	54.7	68%	0.68	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-66.1	-15.1	178.6	0	0	0	0	0	114.3	D180	D180-G182 PolarHBondContact O-N 3.47Å; D180-G182 PolarHBondContact OD1-N 2.9Å; D180-G182 VanDerWaalsContact OD1-N 3.07Å
183	S	94.9	Very high	95.1	Very high	82 Å²	82	52.5 Å²	52.5	57%	0.573	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-87.7	-11.1	176.4	77.8	0	0	0	0	113.7	D180 F181	D180-S183 WeakPolarHBondContact O-CB 3.38Å; D180-S183 PolarHBondContact O-N 3.39Å; D180-S183 PolarHBondContact O-OG 3.5Å; F181-S183 PolarHBondContact O-N 2.93Å; F181-S183 VanDerWaalsContact O-N 3.16Å
184	T	95.4	Very high	95	Very high	14 Å²	14	55.1 Å²	55.1	9%	0.086	35%	0.347	C	S	.	.	S	Bend	trans	-106.6	148.7	-176.7	61	0	0	0	0	112.3	W175 T179 F181	W175-T184 PolarHBondContact NE1-OG1 3.11Å; T179-T184 HydrophobicContact CG2-CG2 3.82Å; F181-T184 PolarHBondContact O-N 2.89Å; F181-T184 VanDerWaalsContact O-N 3.09Å; F181-T184 PolarHBondContact O-OG1 3.4Å
185	P	93.8	Very high	94.6	Very high	54 Å²	54	55.4 Å²	55.4	35%	0.351	35%	0.346	S	S	.	.			trans	-67.7	140.4	168.7	28.5	-32.7	0	0	0	110.9	N142 F187	N142-P185 WeakPolarHBondContact O-CD 3.48Å; P185-F187 HydrophobicContact CB-CE1 4.18Å; P185-F187 HydrophobicContact CB-CE2 4.08Å; P185-F187 HydrophobicContact CB-CZ 3.66Å; P185-F187 HydrophobicContact CG-CE1 4.43Å; P185-F187 HydrophobicContact CG-CE2 3.71Å; P185-F187 HydrophobicContact CG-CZ 3.46Å; P185-F187 VanDerWaalsContact CG-CZ 3.46Å; P185-F187 WeakPolarHBondContact O-CE2 3.45Å
186	T	94.3	Very high	94	Very high	75 Å²	75	61.2 Å²	61.2	46%	0.46	37%	0.368	S	S	.	.			trans	-94.7	140.6	177	60.9	0	0	0	0	111.6	F181	F181-T186 HydrophobicContact CE1-CG2 4.02Å; F181-T186 HydrophobicContact CE2-CG2 4.18Å; F181-T186 HydrophobicContact CZ-CG2 3.53Å
187	F	94.6	Very high	93.2	Very high	23 Å²	23	68.2 Å²	68.2	10%	0.101	41%	0.405	C	S	.	.			trans	-125.9	36	-176.8	-53.6	-73.5	0	0	0	114.3	V144 L147 P185 K217 L218 W219	V144-F187 HydrophobicContact CB-CZ 4.37Å; L147-F187 HydrophobicContact CB-CE2 4.22Å; L147-F187 HydrophobicContact CB-CZ 4.33Å; L147-F187 HydrophobicContact CD1-CD2 4.43Å; L147-F187 HydrophobicContact CD2-CB 4.17Å; L147-F187 HydrophobicContact CD2-CD1 3.35Å; L147-F187 HydrophobicContact CD2-CD2 3.76Å; L147-F187 HydrophobicContact CD2-CE1 3.46Å; L147-F187 VanDerWaalsContact CD2-CE1 3.46Å; L147-F187 HydrophobicContact CD2-CE2 3.86Å; L147-F187 HydrophobicContact CD2-CG 3.49Å; L147-F187 VanDerWaalsContact CD2-CG 3.49Å; L147-F187 HydrophobicContact CD2-CZ 3.71Å; P185-F187 HydrophobicContact CB-CE1 4.18Å; P185-F187 HydrophobicContact CB-CE2 4.08Å; P185-F187 HydrophobicContact CB-CZ 3.66Å; P185-F187 HydrophobicContact CG-CE1 4.43Å; P185-F187 HydrophobicContact CG-CE2 3.71Å; P185-F187 HydrophobicContact CG-CZ 3.46Å; P185-F187 VanDerWaalsContact CG-CZ 3.46Å; P185-F187 WeakPolarHBondContact O-CE2 3.45Å; F187-K217 WeakPolarHBondContact O-CA 3.35Å; F187-L218 PolarHBondContact O-N 3.34Å; F187-W219 HydrophobicContact CB-CD2 4.02Å; F187-W219 HydrophobicContact CB-CG 4.14Å; F187-W219 HydrophobicContact CB-CZ2 4.25Å; F187-W219 AromaticContact CD2-CE2 3.88Å; F187-W219 HydrophobicContact CD2-CH2 4.12Å; F187-W219 AromaticContact CD2-CZ2 3.53Å; F187-W219 HydrophobicContact CD2-CZ2 3.53Å; F187-W219 HydrophobicContact CE2-CZ2 4.4Å; F187-W219 HydrophobicContact CG-CZ2 4.36Å; F187-W219 WeakPolarHBondContact O-CB 3.16Å; F187-W219 PolarHBondContact O-N 3.21Å
188	W	95.2	Very high	92.6	Very high	37 Å²	37	73.3 Å²	73.3	14%	0.14	42%	0.424	C	S	.	.	B	Isolated β-bridge	trans	-49.5	135.1	171.5	-59.9	118.6	0	0	0	113	L164 W173 F181 Q192 P193 W219 D221	L164-W188 HydrophobicContact CD2-CH2 3.58Å; L164-W188 HydrophobicContact CD2-CZ2 3.76Å; W173-W188 AromaticContact CD2-CH2 3.81Å; W173-W188 HydrophobicContact CD2-CH2 3.81Å; W173-W188 AromaticContact CD2-CZ2 3.78Å; W173-W188 HydrophobicContact CD2-CZ2 3.78Å; W173-W188 AromaticContact CE2-CH2 3.43Å; W173-W188 VanDerWaalsContact CE2-CH2 3.43Å; W173-W188 AromaticContact CE2-CZ2 3.53Å; W173-W188 HydrophobicContact CE3-CH2 4.14Å; W173-W188 HydrophobicContact CE3-CZ2 4.48Å; W173-W188 HydrophobicContact CG-CZ2 4.05Å; W173-W188 AromaticContact CH2-CH2 3.72Å; W173-W188 HydrophobicContact CH2-CH2 3.72Å; W173-W188 HydrophobicContact CH2-CZ3 4.47Å; W173-W188 AromaticContact CZ2-CH2 3.4Å; W173-W188 HydrophobicContact CZ2-CH2 3.4Å; W173-W188 VanDerWaalsContact CZ2-CH2 3.4Å; W173-W188 AromaticContact CZ2-CZ2 3.99Å; W173-W188 HydrophobicContact CZ2-CZ2 3.99Å; W173-W188 HydrophobicContact CZ2-CZ3 4.24Å; W173-W188 HydrophobicContact CZ3-CH2 4.08Å; W173-W188 AromaticContact NE1-CZ2 3.72Å; F181-W188 HydrophobicContact CZ-CZ2 4.38Å; W188-Q192 HydrophobicContact CB-CB 4.37Å; W188-Q192 WeakPolarHBondContact CB-O 3.35Å; W188-Q192 HydrophobicContact CE3-CB 4.05Å; W188-P193 HydrophobicContact CD2-CG 4.4Å; W188-P193 HydrophobicContact CE3-CB 4.27Å; W188-P193 HydrophobicContact CH2-CB 4.17Å; W188-P193 HydrophobicContact CH2-CG 4.41Å; W188-P193 HydrophobicContact CZ2-CB 4.47Å; W188-P193 HydrophobicContact CZ2-CG 4.21Å; W188-P193 HydrophobicContact CZ3-CB 4.06Å; W188-W219 HydrophobicContact CD2-CB 4.11Å; W188-W219 HydrophobicContact CD2-CE3 4.1Å; W188-W219 AromaticContact CE2-CE3 3.98Å; W188-W219 HydrophobicContact CE3-CB 3.53Å; W188-W219 HydrophobicContact CE3-CE3 4.39Å; W188-W219 HydrophobicContact CH2-CE3 4.43Å; W188-W219 HydrophobicContact CZ2-CE3 4.17Å; W188-W219 HydrophobicContact CZ3-CB 3.93Å; W188-D221 HydrophobicContact CZ3-CB 4.26Å
189	D	94.1	Very high	92	Very high	28 Å²	28	74.3 Å²	74.3	15%	0.15	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-69.1	164.8	167.4	-159.4	20	0	0	0	111.2	G191 Q192 H209 K215 W219	D189-G191 PolarHBondContact O-N 3.31Å; D189-G191 VanDerWaalsContact O-N 3.11Å; D189-Q192 HydrophobicContact CB-CG 4.31Å; D189-Q192 PolarHBondContact O-N 3.22Å; D189-H209 IonicContact OD2-CE1 3.1Å; D189-H209 PolarHBondContact OD2-CE1 3.43Å; D189-H209 IonicContact OD2-NE2 3.81Å; D189-H209 PolarHBondContact OD2-NE2 3.46Å; D189-H209 VanDerWaalsContact OD2-NE2 3.1Å; D189-K215 IonicContact OD1-NZ 2.8Å; D189-K215 PolarHBondContact OD1-NZ 3.44Å; D189-K215 IonicContact OD2-NZ 2.69Å; D189-K215 PolarHBondContact OD2-NZ 2.92Å; D189-W219 PolarHBondContact N-O 3.39Å
190	Q	92.6	Very high	91.3	Very high	184 Å²	184	79.1 Å²	79.1	86%	0.86	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	119.3	178.8	-178.3	176.9	-9.1	0	0	110.7
191	G	91.8	Very high	90.6	Very high	60 Å²	60	78.8 Å²	78.8	62%	0.619	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.9	-13.6	-179.1	0	0	0	0	0	113.7	D189 D194	D189-G191 PolarHBondContact O-N 3.31Å; D189-G191 VanDerWaalsContact O-N 3.11Å; G191-D194 WeakPolarHBondContact O-CB 3.4Å
192	Q	93.8	Very high	90.2	Very high	38 Å²	38	77.7 Å²	77.7	18%	0.178	43%	0.434	C	S	.	.			trans	-97.5	155.3	-174.9	-56.8	-55.3	-2.3	0	0	113.9	W188 D189 D194 N220 D221	W188-Q192 HydrophobicContact CB-CB 4.37Å; W188-Q192 WeakPolarHBondContact CB-O 3.35Å; W188-Q192 HydrophobicContact CE3-CB 4.05Å; D189-Q192 HydrophobicContact CB-CG 4.31Å; D189-Q192 PolarHBondContact O-N 3.22Å; Q192-D194 PolarHBondContact NE2-OD2 2.9Å; Q192-D194 VanDerWaalsContact OE1-CB 3.3Å; Q192-D194 PolarHBondContact OE1-OD1 3.26Å; Q192-D194 PolarHBondContact OE1-OD2 2.92Å; Q192-N220 HydrophobicContact CG-CB 4.41Å; Q192-N220 PolarHBondContact NE2-OD1 2.98Å; Q192-D221 PolarHBondContact OE1-OD1 2.93Å
193	P	93.6	Very high	90	Very high	55 Å²	55	74.7 Å²	74.7	36%	0.357	40%	0.403	S	S	.	.	S	Bend	cis	-72.3	140.3	-10.4	32	-33.2	0	0	0	111.8	W173 W188 D221	W173-P193 HydrophobicContact CZ2-CB 3.87Å; W173-P193 HydrophobicContact CZ2-CG 4.34Å; W188-P193 HydrophobicContact CD2-CG 4.4Å; W188-P193 HydrophobicContact CE3-CB 4.27Å; W188-P193 HydrophobicContact CH2-CB 4.17Å; W188-P193 HydrophobicContact CH2-CG 4.41Å; W188-P193 HydrophobicContact CZ2-CB 4.47Å; W188-P193 HydrophobicContact CZ2-CG 4.21Å; W188-P193 HydrophobicContact CZ3-CB 4.06Å; P193-D221 WeakPolarHBondContact CA-OD1 3.36Å; P193-D221 HydrophobicContact CB-CB 3.74Å; P193-D221 WeakPolarHBondContact CB-OD1 3.48Å; P193-D221 WeakPolarHBondContact CB-OD2 3.42Å
194	D	92	Very high	90	Very high	75 Å²	75	73.4 Å²	73.4	40%	0.401	39%	0.39	S	S	.	.			trans	-114.1	-8.5	-173.8	72.4	7.1	0	0	0	114.9	G191 Q192 W196 D221	G191-D194 WeakPolarHBondContact O-CB 3.4Å; Q192-D194 PolarHBondContact NE2-OD2 2.9Å; Q192-D194 VanDerWaalsContact OE1-CB 3.3Å; Q192-D194 PolarHBondContact OE1-OD1 3.26Å; Q192-D194 PolarHBondContact OE1-OD2 2.92Å; D194-W196 VanDerWaalsContact C-N 3.3Å; D194-W196 PolarHBondContact O-N 3.33Å; D194-W196 WeakPolarHBondContact OD1-CB 3.35Å; D194-W196 PolarHBondContact OD1-N 3.18Å; D194-W196 VanDerWaalsContact OD1-N 3.14Å; D194-D221 PolarHBondContact N-OD1 2.98Å; D194-D221 PolarHBondContact N-OD2 3.28Å; D194-D221 VanDerWaalsContact N-OD2 3.14Å
195	N	88.3	Confident	90.1	Very high	40 Å²	40	72.8 Å²	72.8	21%	0.214	39%	0.386	C	S	.	.			trans	38.1	60.5	-173.4	-171.5	15	0	0	0	111.9	E170 D197 G202 E203 D221	E170-N195 WeakPolarHBondContact OE1-CB 3.45Å; E170-N195 VanDerWaalsContact OE1-CG 3.28Å; E170-N195 PolarHBondContact OE1-ND2 3.14Å; E170-N195 PolarHBondContact OE2-ND2 3.18Å; N195-D197 PolarHBondContact O-N 3.48Å; N195-G202 WeakPolarHBondContact OD1-CA 3.4Å; N195-E203 PolarHBondContact OD1-N 3.39Å; N195-D221 WeakPolarHBondContact CA-OD2 3.45Å; N195-D221 PolarHBondContact N-OD2 3.08Å
196	W	86.1	Confident	90.3	Very high	125 Å²	125	70.2 Å²	70.2	47%	0.473	37%	0.369	S	S	.	.			trans	-52.3	111.9	-164.4	-169.5	10.5	0	0	0	113.2	D194 F198 R199 E203	D194-W196 VanDerWaalsContact C-N 3.3Å; D194-W196 PolarHBondContact O-N 3.33Å; D194-W196 WeakPolarHBondContact OD1-CB 3.35Å; D194-W196 PolarHBondContact OD1-N 3.18Å; D194-W196 VanDerWaalsContact OD1-N 3.14Å; W196-F198 AromaticContact CD1-CD2 3.63Å; W196-F198 AromaticContact CE2-CD2 3.91Å; W196-F198 HydrophobicContact CZ2-CD2 4.49Å; W196-F198 AromaticContact NE1-CD2 3.12Å; W196-F198 AromaticContact NE1-CE2 3.77Å; W196-F198 PolarHBondContact O-N 3.41Å; W196-R199 WeakPolarHBondContact O-CB 3.31Å; W196-R199 PolarHBondContact O-N 2.85Å; W196-E203 VanDerWaalsContact CB-OE2 3.27Å; W196-E203 WeakPolarHBondContact CB-OE2 3.24Å; W196-E203 PolarHBondContact N-OE2 2.94Å
197	D	82.5	Confident	90.4	Very high	160 Å²	160	67 Å²	67	86%	0.856	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-19	-175.1	-74.7	-26.9	0	0	0	116.1	N195 R199	N195-D197 PolarHBondContact O-N 3.48Å; D197-R199 VanDerWaalsContact C-N 3.26Å; D197-R199 PolarHBondContact O-N 2.91Å
198	F	83.3	Confident	90.6	Very high	175 Å²	175	66 Å²	66	77%	0.768	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-5.7	176.7	-70	-93.9	0	0	0	113.4	W196	W196-F198 AromaticContact CD1-CD2 3.63Å; W196-F198 AromaticContact CE2-CD2 3.91Å; W196-F198 HydrophobicContact CZ2-CD2 4.49Å; W196-F198 AromaticContact NE1-CD2 3.12Å; W196-F198 AromaticContact NE1-CE2 3.77Å; W196-F198 PolarHBondContact O-N 3.41Å
199	R	84.3	Confident	90.5	Very high	84 Å²	84	66 Å²	66	32%	0.317	35%	0.346	S	S	.	.			trans	-88.3	118.8	173.4	-63.2	-64.5	-171.6	-133.3	-6.9	110.2	W196 D197 N201 G202 E203 D223	W196-R199 WeakPolarHBondContact O-CB 3.31Å; W196-R199 PolarHBondContact O-N 2.85Å; D197-R199 VanDerWaalsContact C-N 3.26Å; D197-R199 PolarHBondContact O-N 2.91Å; R199-N201 PolarHBondContact O-N 3.35Å; R199-G202 PolarHBondContact O-N 2.89Å; R199-E203 HydrophobicContact CB-CG 4.12Å; R199-E203 HydrophobicContact CG-CG 3.57Å; R199-E203 WeakPolarHBondContact CG-OE1 3.37Å; R199-E203 IonicContact CZ-OE1 3.87Å; R199-E203 IonicContact NE-OE1 3.02Å; R199-E203 PolarHBondContact NE-OE1 3.24Å; R199-E203 IonicContact NH2-OE1 2.86Å; R199-D223 HydrophobicContact CG-CB 4.38Å
200	V	80.8	Confident	90.4	Very high	141 Å²	141	66.7 Å²	66.7	86%	0.855	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-30.5	-179.4	-179	0	0	0	0	111.9
201	N	80.3	Confident	90.3	Very high	101 Å²	101	58.9 Å²	58.9	54%	0.54	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	6.7	-177.2	-53.1	-49.4	0	0	0	113.5	R199 D223	R199-N201 PolarHBondContact O-N 3.35Å; N201-D223 PolarHBondContact ND2-OD2 3.47Å
202	G	88.3	Confident	90.2	Very high	14 Å²	14	60 Å²	60	14%	0.144	33%	0.333	C	S	.	.			trans	69.5	-176.2	-168.7	0	0	0	0	0	113.4	N195 R199 D223	N195-G202 WeakPolarHBondContact OD1-CA 3.4Å; R199-G202 PolarHBondContact O-N 2.89Å; G202-D223 WeakPolarHBondContact O-CA 3.42Å; G202-D223 WeakPolarHBondContact O-CB 3.12Å
203	E	90.6	Very high	89.9	Confident	3 Å²	3	62.8 Å²	62.8	1%	0.014	35%	0.349	C	S	.	.			trans	-121.1	72.5	179.2	-63.6	-155.2	127.3	0	0	111.7	N195 W196 R199 C205 D221 A222	N195-E203 PolarHBondContact OD1-N 3.39Å; W196-E203 VanDerWaalsContact CB-OE2 3.27Å; W196-E203 WeakPolarHBondContact CB-OE2 3.24Å; W196-E203 PolarHBondContact N-OE2 2.94Å; R199-E203 HydrophobicContact CB-CG 4.12Å; R199-E203 HydrophobicContact CG-CG 3.57Å; R199-E203 WeakPolarHBondContact CG-OE1 3.37Å; R199-E203 IonicContact CZ-OE1 3.87Å; R199-E203 IonicContact NE-OE1 3.02Å; R199-E203 PolarHBondContact NE-OE1 3.24Å; R199-E203 IonicContact NH2-OE1 2.86Å; E203-C205 PolarHBondContact O-N 3.31Å; E203-D221 HydrophobicContact CB-CB 4.17Å; E203-D221 VanDerWaalsContact O-CB 3.32Å; E203-D221 WeakPolarHBondContact O-CB 3.29Å; E203-A222 CarbonylContact C-O 3.54Å
204	D	95.3	Very high	89.5	Confident	56 Å²	56	68.4 Å²	68.4	30%	0.299	36%	0.363	S	S	.	.			trans	-91.2	2.6	-169.9	-55.4	-24.4	0	0	0	114.7	V165 E166 A222	V165-D204 CarbonylContact C-O 3.54Å; V165-D204 WeakPolarHBondContact CA-O 3.33Å; E166-D204 HydrophobicContact CB-CB 4.18Å; E166-D204 PolarHBondContact N-O 3.45Å; D204-A222 PolarHBondContact N-O 3.45Å
205	C	97.6	Very high	89.2	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.007	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.3	-173.8	-73.3	0	0	0	0	112.9	W124 W161 E203 D221 A222 C224	W124-C205 HydrophobicContact CB-CB 4.1Å; W124-C205 VanDerWaalsContact CB-SG 3.58Å; W124-C205 HydrophobicContact CD2-CB 4.47Å; W124-C205 HydrophobicContact CG-CB 3.81Å; W161-C205 HydrophobicContact CE3-CB 4.24Å; W161-C205 HydrophobicContact CH2-CB 3.96Å; W161-C205 HydrophobicContact CZ3-CB 3.61Å; E203-C205 PolarHBondContact O-N 3.31Å; C205-D221 CarbonylContact O-C 3.56Å; C205-D221 WeakPolarHBondContact O-CA 3.44Å; C205-A222 PolarHBondContact N-O 2.87Å; C205-A222 VanDerWaalsContact N-O 3.11Å; C205-A222 PolarHBondContact O-N 3.18Å; C205-C224 HydrophobicContact CB-CB 3.96Å; C205-C224 WeakPolarHBondContact CB-SG 3.49Å; C205-C224 PolarHBondContact N-SG 2.85Å; C205-C224 WeakPolarHBondContact SG-CB 3.29Å; C205-C224 CovalentContact SG-SG 2.03Å; C205-C224 PolarHBondContact SG-SG 3.39Å
206	G	97.4	Very high	88.9	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	137.7	-179.5	0	0	0	0	0	113.3	I162 L164	I162-G206 VanDerWaalsContact CG1-O 3.24Å; I162-G206 WeakPolarHBondContact CG1-O 3.29Å; I162-G206 PolarHBondContact N-O 2.93Å; I162-G206 VanDerWaalsContact N-O 3.1Å; L164-G206 PolarHBondContact O-N 3.09Å
207	Q	97.3	Very high	88.9	Confident	6 Å²	6	72.3 Å²	72.3	3%	0.028	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	156	171.7	59.7	170.5	-3.2	0	0	111.9	Y160 W161 W219 N220 A222 Y228	Y160-Q207 CarbonylContact O-C 3.51Å; Y160-Q207 WeakPolarHBondContact O-CA 3.33Å; Y160-Q207 WeakPolarHBondContact O-CB 3.4Å; W161-Q207 HydrophobicContact CE3-CB 3.75Å; W161-Q207 HydrophobicContact CZ3-CB 4Å; W161-Q207 HydrophobicContact CZ3-CG 4.43Å; Q207-W219 VanDerWaalsContact O-CA 3.28Å; Q207-W219 WeakPolarHBondContact O-CA 3.38Å; Q207-N220 HydrophobicContact CG-CB 3.96Å; Q207-N220 VanDerWaalsContact CG-O 3.24Å; Q207-N220 WeakPolarHBondContact CG-O 3.31Å; Q207-N220 PolarHBondContact N-O 3.26Å; Q207-N220 PolarHBondContact NE2-ND2 3.16Å; Q207-N220 VanDerWaalsContact NE2-ND2 3.16Å; Q207-N220 PolarHBondContact O-N 3.37Å; Q207-A222 HydrophobicContact CG-CB 4.04Å; Q207-Y228 VanDerWaalsContact OE1-CZ 3.27Å
208	L	96.9	Very high	89.1	Confident	3 Å²	3	65 Å²	65	2%	0.016	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	111.1	154.2	-53.8	-176.7	0	0	0	107.4	L141 I150 S159 Y160 I162 L218 I231	L141-L208 HydrophobicContact CD1-CD2 4.32Å; I150-L208 HydrophobicContact CG2-CD1 3.72Å; S159-L208 CarbonylContact C-O 3.58Å; S159-L208 WeakPolarHBondContact CA-O 3.15Å; S159-L208 WeakPolarHBondContact CB-O 3.38Å; Y160-L208 PolarHBondContact N-O 3.33Å; Y160-L208 PolarHBondContact O-N 3.3Å; I162-L208 HydrophobicContact CG2-CD1 4.34Å; I162-L208 HydrophobicContact CG2-CD2 4.14Å; I162-L208 HydrophobicContact CG2-CG 3.73Å; L208-L218 WeakPolarHBondContact CA-O 3.21Å; L208-L218 HydrophobicContact CB-CB 4.46Å; L208-L218 HydrophobicContact CD2-CB 4.38Å; L208-I231 HydrophobicContact CD1-CD1 3.85Å
209	H	93.4	Very high	89.7	Confident	36 Å²	36	56.7 Å²	56.7	17%	0.167	30%	0.299	C	S	.	.			trans	-77.4	156.9	-179.4	79.4	161.8	0	0	0	112.5	D189 L218 N220	D189-H209 IonicContact OD2-CE1 3.1Å; D189-H209 PolarHBondContact OD2-CE1 3.43Å; D189-H209 IonicContact OD2-NE2 3.81Å; D189-H209 PolarHBondContact OD2-NE2 3.46Å; D189-H209 VanDerWaalsContact OD2-NE2 3.1Å; H209-L218 PolarHBondContact CD2-O 3.03Å; H209-L218 PolarHBondContact N-O 3.49Å; H209-N220 HydrophobicContact CB-CB 3.86Å
210	A	93.1	Very high	90.2	Very high	44 Å²	44	53.7 Å²	53.7	36%	0.364	29%	0.289	S	S	.	.			trans	-62.8	144.3	174.5	0	0	0	0	0	111.7	I156 K157 S159	I156-A210 CarbonylContact O-C 3.55Å; I156-A210 VanDerWaalsContact O-CA 3.29Å; I156-A210 WeakPolarHBondContact O-CA 3.15Å; K157-A210 WeakPolarHBondContact O-CB 3.31Å; S159-A210 PolarHBondContact OG-N 3.46Å; S159-A210 VanDerWaalsContact OG-N 3.15Å
211	S	90.5	Very high	90.9	Very high	19 Å²	19	47 Å²	47	13%	0.133	25%	0.249	C	C	.	.			trans	-141.9	148.5	-178.6	-179.6	0	0	0	0	112.1	I156 N213	I156-S211 PolarHBondContact O-N 2.95Å; S211-N213 VanDerWaalsContact C-N 3.26Å; S211-N213 WeakPolarHBondContact CB-O 3.31Å; S211-N213 PolarHBondContact O-N 3.12Å; S211-N213 PolarHBondContact OG-N 2.89Å; S211-N213 PolarHBondContact OG-O 3.2Å; S211-N213 PolarHBondContact OG-OD1 2.59Å; S211-N213 VanDerWaalsContact OG-OD1 3.13Å
212	G	89.1	Confident	91.7	Very high	84 Å²	84	42.2 Å²	42.2	87%	0.866	22%	0.223	S	C	*	.	S	Bend	trans	-73.8	-17.6	174	0	0	0	0	0	113.7
213	N	87.9	Confident	92	Very high	97 Å²	97	42.2 Å²	42.2	52%	0.519	22%	0.22	S	C	.	.	S	Bend	trans	-140.1	152	178.8	59.8	-21	0	0	0	111.2	S211 K215	S211-N213 VanDerWaalsContact C-N 3.26Å; S211-N213 WeakPolarHBondContact CB-O 3.31Å; S211-N213 PolarHBondContact O-N 3.12Å; S211-N213 PolarHBondContact OG-N 2.89Å; S211-N213 PolarHBondContact OG-O 3.2Å; S211-N213 PolarHBondContact OG-OD1 2.59Å; S211-N213 VanDerWaalsContact OG-OD1 3.13Å; N213-K215 PolarHBondContact O-N 2.76Å
214	R	84.9	Confident	92.3	Very high	173 Å²	173	43.9 Å²	43.9	65%	0.653	23%	0.231	S	C	*	.			trans	-69.2	123.4	172.8	-73.7	-175.2	175.9	132.2	-2.4	109.6	I156	I156-R214 HydrophobicContact CD1-CG 4.36Å; I156-R214 HydrophobicContact CG2-CG 3.83Å
215	K	85.4	Confident	92.3	Very high	62 Å²	62	44.4 Å²	44.4	27%	0.27	24%	0.239	S	C	.	.			trans	-147	158.3	176.8	58.9	176.7	-178.9	164.2	0	109.4	D189 N213 K217 L218	D189-K215 IonicContact OD1-NZ 2.8Å; D189-K215 PolarHBondContact OD1-NZ 3.44Å; D189-K215 IonicContact OD2-NZ 2.69Å; D189-K215 PolarHBondContact OD2-NZ 2.92Å; N213-K215 PolarHBondContact O-N 2.76Å; K215-K217 WeakPolarHBondContact CD-O 3.31Å; K215-K217 WeakPolarHBondContact CE-O 3.31Å; K215-K217 PolarHBondContact NZ-O 2.73Å; K215-L218 HydrophobicContact CD-CD2 4.24Å; K215-L218 HydrophobicContact CG-CD2 3.66Å; K215-L218 HydrophobicContact CG-CG 4.02Å; K215-L218 VanDerWaalsContact O-CD1 3.22Å; K215-L218 WeakPolarHBondContact O-CD1 3.36Å; K215-L218 WeakPolarHBondContact O-CG 3.32Å
216	R	83	Confident	92.3	Very high	129 Å²	129	46.8 Å²	46.8	49%	0.487	25%	0.252	S	S	.	.	S	Bend	trans	-77.9	-28.2	177.5	-72.3	178.5	-179.5	162.6	-3.8	113	L147 D148 L218	L147-R216 HydrophobicContact CD2-CB 3.69Å; L147-R216 HydrophobicContact CD2-CG 3.92Å; D148-R216 IonicContact OD1-CZ 3.4Å; D148-R216 IonicContact OD1-NE 2.7Å; D148-R216 PolarHBondContact OD1-NE 3.03Å; D148-R216 IonicContact OD1-NH2 3.29Å; D148-R216 PolarHBondContact OD1-NH2 3.48Å; D148-R216 IonicContact OD2-CZ 3.48Å; D148-R216 IonicContact OD2-NE 3.59Å; D148-R216 IonicContact OD2-NH2 2.67Å; D148-R216 PolarHBondContact OD2-NH2 3.42Å; R216-L218 PolarHBondContact O-N 2.83Å
217	K	84.2	Confident	92.3	Very high	130 Å²	130	48.8 Å²	48.8	57%	0.565	27%	0.272	S	S	*	.			trans	-89.1	90.3	-179.3	-67.4	-168.8	175.7	-166.7	0	109.8	F187 K215	F187-K217 WeakPolarHBondContact O-CA 3.35Å; K215-K217 WeakPolarHBondContact CD-O 3.31Å; K215-K217 WeakPolarHBondContact CE-O 3.31Å; K215-K217 PolarHBondContact NZ-O 2.73Å
218	L	87.8	Confident	92.4	Very high	7 Å²	7	50.6 Å²	50.6	4%	0.037	28%	0.279	C	S	.	.			trans	-129.3	-4.4	-176.7	-69.8	172.1	0	0	0	112.7	F187 L208 H209 K215 R216 N220	F187-L218 PolarHBondContact O-N 3.34Å; L208-L218 WeakPolarHBondContact CA-O 3.21Å; L208-L218 HydrophobicContact CB-CB 4.46Å; L208-L218 HydrophobicContact CD2-CB 4.38Å; H209-L218 PolarHBondContact CD2-O 3.03Å; H209-L218 PolarHBondContact N-O 3.49Å; K215-L218 HydrophobicContact CD-CD2 4.24Å; K215-L218 HydrophobicContact CG-CD2 3.66Å; K215-L218 HydrophobicContact CG-CG 4.02Å; K215-L218 VanDerWaalsContact O-CD1 3.22Å; K215-L218 WeakPolarHBondContact O-CD1 3.36Å; K215-L218 WeakPolarHBondContact O-CG 3.32Å; R216-L218 PolarHBondContact O-N 2.83Å; L218-N220 PolarHBondContact O-N 2.86Å
219	W	95.4	Very high	92.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	133.9	-177.5	-61.5	6.2	0	0	0	110.5	L141 I162 L164 W175 F181 F187 W188 D189 Q207	L141-W219 HydrophobicContact CB-CZ2 3.86Å; L141-W219 HydrophobicContact CD1-CZ2 3.58Å; L141-W219 HydrophobicContact CG-CZ2 4.35Å; I162-W219 HydrophobicContact CD1-CD2 4.13Å; I162-W219 HydrophobicContact CD1-CG 4.28Å; I162-W219 HydrophobicContact CD1-CZ2 4.43Å; L164-W219 HydrophobicContact CD2-CE3 3.79Å; L164-W219 HydrophobicContact CD2-CZ3 3.85Å; W175-W219 AromaticContact CH2-CH2 3.65Å; W175-W219 HydrophobicContact CH2-CH2 3.65Å; W175-W219 AromaticContact CH2-CZ2 3.7Å; W175-W219 HydrophobicContact CH2-CZ2 3.7Å; W175-W219 HydrophobicContact CH2-CZ3 4.43Å; W175-W219 AromaticContact CZ2-CH2 3.47Å; W175-W219 HydrophobicContact CZ2-CH2 3.47Å; W175-W219 VanDerWaalsContact CZ2-CH2 3.47Å; W175-W219 AromaticContact CZ2-CZ2 3.93Å; W175-W219 HydrophobicContact CZ2-CZ2 3.93Å; W175-W219 HydrophobicContact CZ2-CZ3 4.3Å; F181-W219 AromaticContact CE2-CZ3 3.96Å; F181-W219 HydrophobicContact CE2-CZ3 3.96Å; F181-W219 HydrophobicContact CZ-CZ3 4.49Å; F187-W219 HydrophobicContact CB-CD2 4.02Å; F187-W219 HydrophobicContact CB-CG 4.14Å; F187-W219 HydrophobicContact CB-CZ2 4.25Å; F187-W219 AromaticContact CD2-CE2 3.88Å; F187-W219 HydrophobicContact CD2-CH2 4.12Å; F187-W219 AromaticContact CD2-CZ2 3.53Å; F187-W219 HydrophobicContact CD2-CZ2 3.53Å; F187-W219 HydrophobicContact CE2-CZ2 4.4Å; F187-W219 HydrophobicContact CG-CZ2 4.36Å; F187-W219 WeakPolarHBondContact O-CB 3.16Å; F187-W219 PolarHBondContact O-N 3.21Å; W188-W219 HydrophobicContact CD2-CB 4.11Å; W188-W219 HydrophobicContact CD2-CE3 4.1Å; W188-W219 AromaticContact CE2-CE3 3.98Å; W188-W219 HydrophobicContact CE3-CB 3.53Å; W188-W219 HydrophobicContact CE3-CE3 4.39Å; W188-W219 HydrophobicContact CH2-CE3 4.43Å; W188-W219 HydrophobicContact CZ2-CE3 4.17Å; W188-W219 HydrophobicContact CZ3-CB 3.93Å; D189-W219 PolarHBondContact N-O 3.39Å; Q207-W219 VanDerWaalsContact O-CA 3.28Å; Q207-W219 WeakPolarHBondContact O-CA 3.38Å
220	N	95.9	Very high	92.7	Very high	21 Å²	21	52.1 Å²	52.1	11%	0.112	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	133	175.1	-171.9	97.7	0	0	0	106	Q192 Q207 H209 L218	Q192-N220 HydrophobicContact CG-CB 4.41Å; Q192-N220 PolarHBondContact NE2-OD1 2.98Å; Q207-N220 HydrophobicContact CG-CB 3.96Å; Q207-N220 VanDerWaalsContact CG-O 3.24Å; Q207-N220 WeakPolarHBondContact CG-O 3.31Å; Q207-N220 PolarHBondContact N-O 3.26Å; Q207-N220 PolarHBondContact NE2-ND2 3.16Å; Q207-N220 VanDerWaalsContact NE2-ND2 3.16Å; Q207-N220 PolarHBondContact O-N 3.37Å; H209-N220 HydrophobicContact CB-CB 3.86Å; L218-N220 PolarHBondContact O-N 2.86Å
221	D	95.7	Very high	93	Very high	1 Å²	1	50 Å²	50	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	136	163.6	60.9	-46.9	0	0	0	108	W173 W188 Q192 P193 D194 N195 E203 C205	W173-D221 HydrophobicContact CH2-CB 3.46Å; W173-D221 VanDerWaalsContact CH2-CB 3.46Å; W173-D221 HydrophobicContact CZ2-CB 3.57Å; W188-D221 HydrophobicContact CZ3-CB 4.26Å; Q192-D221 PolarHBondContact OE1-OD1 2.93Å; P193-D221 WeakPolarHBondContact CA-OD1 3.36Å; P193-D221 HydrophobicContact CB-CB 3.74Å; P193-D221 WeakPolarHBondContact CB-OD1 3.48Å; P193-D221 WeakPolarHBondContact CB-OD2 3.42Å; D194-D221 PolarHBondContact N-OD1 2.98Å; D194-D221 PolarHBondContact N-OD2 3.28Å; D194-D221 VanDerWaalsContact N-OD2 3.14Å; N195-D221 WeakPolarHBondContact CA-OD2 3.45Å; N195-D221 PolarHBondContact N-OD2 3.08Å; E203-D221 HydrophobicContact CB-CB 4.17Å; E203-D221 VanDerWaalsContact O-CB 3.32Å; E203-D221 WeakPolarHBondContact O-CB 3.29Å; C205-D221 CarbonylContact O-C 3.56Å; C205-D221 WeakPolarHBondContact O-CA 3.44Å
222	A	95.6	Very high	93.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	154	-176	0	0	0	0	0	111.3	W161 E203 D204 C205 Q207 C224 Y228	W161-A222 HydrophobicContact CH2-CB 3.8Å; W161-A222 HydrophobicContact CZ3-CB 3.83Å; E203-A222 CarbonylContact C-O 3.54Å; D204-A222 PolarHBondContact N-O 3.45Å; C205-A222 PolarHBondContact N-O 2.87Å; C205-A222 VanDerWaalsContact N-O 3.11Å; C205-A222 PolarHBondContact O-N 3.18Å; Q207-A222 HydrophobicContact CG-CB 4.04Å; A222-C224 PolarHBondContact O-N 2.83Å; A222-Y228 HydrophobicContact CB-CE2 3.9Å
223	D	95.6	Very high	93.8	Very high	14 Å²	14	45.3 Å²	45.3	8%	0.075	22%	0.219	C	C	.	.			trans	-57.1	114.2	174.5	179.6	-24.8	0	0	0	109.7	W161 R199 N201 G202 S225 L226	W161-D223 WeakPolarHBondContact CH2-O 3.47Å; R199-D223 HydrophobicContact CG-CB 4.38Å; N201-D223 PolarHBondContact ND2-OD2 3.47Å; G202-D223 WeakPolarHBondContact O-CA 3.42Å; G202-D223 WeakPolarHBondContact O-CB 3.12Å; D223-S225 VanDerWaalsContact CG-OG 3.27Å; D223-S225 PolarHBondContact O-N 3.46Å; D223-S225 VanDerWaalsContact OD1-CB 3.23Å; D223-S225 WeakPolarHBondContact OD1-CB 3.09Å; D223-S225 PolarHBondContact OD1-N 3.41Å; D223-S225 PolarHBondContact OD1-OG 2.85Å; D223-S225 PolarHBondContact OD2-OG 2.68Å; D223-L226 HydrophobicContact CB-CD1 4.01Å; D223-L226 HydrophobicContact CB-CG 3.99Å; D223-L226 WeakPolarHBondContact O-CB 3.46Å; D223-L226 PolarHBondContact O-N 3.48Å
224	C	96.8	Very high	94.3	Very high	38 Å²	38	41.3 Å²	41.3	26%	0.257	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-21.1	-176.7	-61	0	0	0	0	113.9	W124 C205 A222 L226	W124-C224 HydrophobicContact CB-CB 4.32Å; W124-C224 PolarHBondContact N-O 3.46Å; W124-C224 VanDerWaalsContact N-O 3.13Å; C205-C224 HydrophobicContact CB-CB 3.96Å; C205-C224 WeakPolarHBondContact CB-SG 3.49Å; C205-C224 PolarHBondContact N-SG 2.85Å; C205-C224 WeakPolarHBondContact SG-CB 3.29Å; C205-C224 CovalentContact SG-SG 2.03Å; C205-C224 PolarHBondContact SG-SG 3.39Å; A222-C224 PolarHBondContact O-N 2.83Å; C224-L226 VanDerWaalsContact C-N 3.33Å
225	S	95.9	Very high	94.7	Very high	67 Å²	67	40.5 Å²	40.5	47%	0.469	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-7.5	179	75.5	0	0	0	0	113.9	V123 D223	V123-S225 WeakPolarHBondContact CG1-O 3.45Å; D223-S225 VanDerWaalsContact CG-OG 3.27Å; D223-S225 PolarHBondContact O-N 3.46Å; D223-S225 VanDerWaalsContact OD1-CB 3.23Å; D223-S225 WeakPolarHBondContact OD1-CB 3.09Å; D223-S225 PolarHBondContact OD1-N 3.41Å; D223-S225 PolarHBondContact OD1-OG 2.85Å; D223-S225 PolarHBondContact OD2-OG 2.68Å
226	L	96.2	Very high	94.7	Very high	52 Å²	52	40 Å²	40	27%	0.272	21%	0.208	S	C	.	.	S	Bend	trans	-78.1	152.1	175.9	-63.2	178.7	0	0	0	112.2	V123 W161 D223 C224 Y228	V123-L226 WeakPolarHBondContact CA-O 3.13Å; W161-L226 VanDerWaalsContact CZ2-O 3.32Å; W161-L226 WeakPolarHBondContact CZ2-O 3.34Å; D223-L226 HydrophobicContact CB-CD1 4.01Å; D223-L226 HydrophobicContact CB-CG 3.99Å; D223-L226 WeakPolarHBondContact O-CB 3.46Å; D223-L226 PolarHBondContact O-N 3.48Å; C224-L226 VanDerWaalsContact C-N 3.33Å; L226-Y228 HydrophobicContact CB-CE2 3.85Å; L226-Y228 HydrophobicContact CD1-CE2 4.44Å; L226-Y228 VanDerWaalsContact CD1-OH 3.31Å; L226-Y228 WeakPolarHBondContact CD1-OH 3.41Å
227	G	97.9	Very high	95.2	Very high	41 Å²	41	35.5 Å²	35.5	42%	0.423	19%	0.194	S	C	.	.			trans	-92.9	111.3	179.3	0	0	0	0	0	112.1	N122	N122-G227 WeakPolarHBondContact O-CA 3.23Å
228	Y	98.6	Very high	95.8	Very high	44 Å²	44	30.5 Å²	30.5	17%	0.173	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-123.5	163.9	171	-59.4	-55.4	0	0	0	111.5	T121 N122 W161 Q207 A222 L226	T121-Y228 CarbonylContact C-O 3.48Å; T121-Y228 WeakPolarHBondContact CA-O 3.25Å; N122-Y228 PolarHBondContact N-O 3.21Å; N122-Y228 PolarHBondContact O-N 2.98Å; N122-Y228 VanDerWaalsContact O-N 3.09Å; W161-Y228 AromaticContact CD2-CD2 3.77Å; W161-Y228 HydrophobicContact CD2-CD2 3.77Å; W161-Y228 AromaticContact CE2-CD2 3.36Å; W161-Y228 AromaticContact CE3-CD2 3.97Å; W161-Y228 HydrophobicContact CE3-CD2 3.97Å; W161-Y228 AromaticContact CH2-CD2 3.45Å; W161-Y228 HydrophobicContact CH2-CD2 3.45Å; W161-Y228 VanDerWaalsContact CH2-CD2 3.45Å; W161-Y228 AromaticContact CH2-CE2 3.5Å; W161-Y228 HydrophobicContact CH2-CE2 3.5Å; W161-Y228 VanDerWaalsContact CH2-CE2 3.5Å; W161-Y228 AromaticContact CZ2-CD2 3.21Å; W161-Y228 HydrophobicContact CZ2-CD2 3.21Å; W161-Y228 AromaticContact CZ2-CE2 3.61Å; W161-Y228 HydrophobicContact CZ2-CE2 3.61Å; W161-Y228 HydrophobicContact CZ2-CG 4.31Å; W161-Y228 AromaticContact CZ3-CD2 3.82Å; W161-Y228 HydrophobicContact CZ3-CD2 3.82Å; W161-Y228 HydrophobicContact CZ3-CE2 4.04Å; W161-Y228 AromaticContact NE1-CD2 3.94Å; Q207-Y228 VanDerWaalsContact OE1-CZ 3.27Å; A222-Y228 HydrophobicContact CB-CE2 3.9Å; L226-Y228 HydrophobicContact CB-CE2 3.85Å; L226-Y228 HydrophobicContact CD1-CE2 4.44Å; L226-Y228 VanDerWaalsContact CD1-OH 3.31Å; L226-Y228 WeakPolarHBondContact CD1-OH 3.41Å
229	R	98.7	Very high	96.3	Very high	51 Å²	51	31.8 Å²	31.8	19%	0.192	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	174	164.2	-70.5	-175.5	172.4	179.2	2.7	108.5	S118 T119 T121 Y158 S159 Y160 W161	S118-R229 WeakPolarHBondContact O-CD 3.41Å; S118-R229 VanDerWaalsContact OG-CA 3.28Å; S118-R229 WeakPolarHBondContact OG-CA 3.44Å; S118-R229 WeakPolarHBondContact OG-CB 3.46Å; T119-R229 PolarHBondContact O-NE 3.26Å; T119-R229 PolarHBondContact O-NH2 2.85Å; T121-R229 HydrophobicContact CG2-CG 4.14Å; Y158-R229 VanDerWaalsContact CE2-NH1 3.27Å; S159-R229 PolarHBondContact O-N 2.94Å; Y160-R229 CarbonylContact C-O 3.49Å; Y160-R229 VanDerWaalsContact CA-O 3.22Å; Y160-R229 WeakPolarHBondContact CA-O 3.21Å; Y160-R229 HydrophobicContact CD1-CB 3.52Å; Y160-R229 HydrophobicContact CE1-CB 3.65Å; Y160-R229 HydrophobicContact CE1-CG 4.41Å; Y160-R229 HydrophobicContact CG-CB 4.24Å; W161-R229 PolarHBondContact N-O 3.48Å
230	Y	98.8	Very high	96.3	Very high	21 Å²	21	33.7 Å²	33.7	8%	0.082	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	156.9	-176.9	54.6	-87.2	0	0	0	110.7	S118 N122 A127 Q130 L138	S118-Y230 VanDerWaalsContact CB-CZ 3.47Å; S118-Y230 WeakPolarHBondContact CB-O 3.24Å; S118-Y230 PolarHBondContact N-O 3.28Å; S118-Y230 VanDerWaalsContact OG-CD1 3.24Å; S118-Y230 WeakPolarHBondContact OG-CD1 3.23Å; S118-Y230 WeakPolarHBondContact OG-CE1 3.38Å; S118-Y230 PolarHBondContact OG-N 2.89Å; S118-Y230 PolarHBondContact OG-O 3.09Å; N122-Y230 HydrophobicContact CB-CD1 4.35Å; N122-Y230 HydrophobicContact CB-CE1 4.12Å; A127-Y230 HydrophobicContact CB-CD1 3.73Å; A127-Y230 HydrophobicContact CB-CD2 4.11Å; A127-Y230 HydrophobicContact CB-CE1 4.37Å; A127-Y230 HydrophobicContact CB-CG 3.6Å; Q130-Y230 HydrophobicContact CB-CE2 4.04Å; L138-Y230 HydrophobicContact CD2-CD2 4.35Å; L138-Y230 HydrophobicContact CD2-CG 4.41Å
231	I	98.8	Very high	96.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122	178	-56.1	163.1	0	0	0	107	L116 L117 L138 L139 I150 V154 Y160 W161 L208	L116-I231 WeakPolarHBondContact O-CA 3.1Å; L117-I231 HydrophobicContact CD1-CG2 4.4Å; L117-I231 HydrophobicContact CG-CG1 4.37Å; L138-I231 CarbonylContact C-O 3.45Å; L138-I231 WeakPolarHBondContact CA-O 3.28Å; L139-I231 HydrophobicContact CB-CB 3.93Å; L139-I231 HydrophobicContact CB-CG2 3.95Å; L139-I231 HydrophobicContact CD2-CB 4.26Å; L139-I231 HydrophobicContact CD2-CD1 3.9Å; L139-I231 HydrophobicContact CD2-CG2 4.14Å; L139-I231 HydrophobicContact CG-CG2 4.45Å; L139-I231 PolarHBondContact N-O 3.22Å; I150-I231 HydrophobicContact CD1-CG2 4.44Å; I150-I231 HydrophobicContact CG2-CD1 3.86Å; V154-I231 HydrophobicContact CG1-CD1 3.7Å; Y160-I231 HydrophobicContact CD1-CD1 4.33Å; Y160-I231 HydrophobicContact CD1-CG1 3.87Å; Y160-I231 HydrophobicContact CG-CD1 4.11Å; Y160-I231 HydrophobicContact CG-CG1 4.1Å; W161-I231 PolarHBondContact O-N 3.15Å; L208-I231 HydrophobicContact CD1-CD1 3.85Å
232	C	98.7	Very high	96.4	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.007	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	145.2	170.1	-53.5	0	0	0	0	110.2	W107 Y115 L116 C131 H137	W107-C232 HydrophobicContact CH2-CB 3.66Å; W107-C232 HydrophobicContact CZ3-CB 4.08Å; Y115-C232 CarbonylContact C-O 3.5Å; Y115-C232 VanDerWaalsContact CA-O 3.24Å; Y115-C232 WeakPolarHBondContact CA-O 3.38Å; L116-C232 HydrophobicContact CB-CB 4.2Å; L116-C232 PolarHBondContact N-O 3.37Å; L116-C232 PolarHBondContact O-N 3.15Å; C131-C232 WeakPolarHBondContact CA-SG 3.45Å; C131-C232 HydrophobicContact CB-CB 3.62Å; C131-C232 WeakPolarHBondContact CB-SG 3.13Å; C131-C232 WeakPolarHBondContact SG-CA 3.42Å; C131-C232 WeakPolarHBondContact SG-CB 3.26Å; C131-C232 CovalentContact SG-SG 2.04Å; C131-C232 PolarHBondContact SG-SG 3.07Å; H137-C232 CarbonylContact O-C 3.54Å; H137-C232 VanDerWaalsContact O-CA 3.3Å; H137-C232 WeakPolarHBondContact O-CA 3.24Å
233	E	98.5	Very high	96.4	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.009	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140	171	-174.7	-172.5	173.5	0	0	109.8	S113 C114 Y115 G136 H137 L139 V140	S113-E233 PolarHBondContact OG-OE1 2.86Å; C114-E233 CarbonylContact O-C 3.45Å; C114-E233 VanDerWaalsContact O-CA 3.29Å; C114-E233 WeakPolarHBondContact O-CA 3.4Å; Y115-E233 HydrophobicContact CD1-CB 4.22Å; Y115-E233 HydrophobicContact CD1-CG 4.1Å; Y115-E233 HydrophobicContact CE1-CB 4.25Å; Y115-E233 HydrophobicContact CE1-CG 3.74Å; G136-E233 CarbonylContact C-O 3.5Å; G136-E233 WeakPolarHBondContact CA-O 3.46Å; H137-E233 IonicContact CE1-OE2 3.58Å; H137-E233 PolarHBondContact N-O 3.45Å; H137-E233 PolarHBondContact O-N 3.2Å; L139-E233 HydrophobicContact CD1-CB 4.46Å; V140-E233 PolarHBondContact N-OE2 3.35Å
234	A	97.1	Very high	96.5	Very high	13 Å²	13	41.3 Å²	41.3	11%	0.107	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	157.2	170.9	0	0	0	0	0	110.1	W107 S113 C114	W107-A234 HydrophobicContact CE3-CB 4.49Å; W107-A234 HydrophobicContact CH2-CB 4.17Å; W107-A234 HydrophobicContact CZ3-CB 3.8Å; S113-A234 CarbonylContact C-O 3.42Å; S113-A234 WeakPolarHBondContact CA-O 3.49Å; C114-A234 PolarHBondContact N-O 3.07Å; C114-A234 PolarHBondContact O-N 3.36Å
235	K	93.4	Very high	96.5	Very high	156 Å²	156	41.6 Å²	41.6	68%	0.678	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73	142.3	170.9	-64.1	-61.2	177.6	-161.1	0	110.9
236	A	85.3	Confident	96.5	Very high	51 Å²	51	39.3 Å²	39.3	42%	0.421	22%	0.215	S	C	.	.			trans	-73.2	0	178.5	0	0	0	0	0	113.9	G101 T102 G112	G101-A236 WeakPolarHBondContact CA-OXT 3.44Å; G101-A236 PolarHBondContact N-OXT 3.36Å; T102-A236 PolarHBondContact N-OXT 3.49Å; G112-A236 WeakPolarHBondContact O-CB 3.21Å; G112-A236 PolarHBondContact O-N 3.4Å

Retrieved 236 of 236 residues in 40.9 ms (Link to these results)

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