A0A096MWY8_PAPAN Loading...

NEDD4 binding protein 2 like 1

AlphaFold DB (H9ZF28), UniProt , Accession A0A096MWY8, Species PAPAN (Papio anubis, Olive baboon), Gene N4BP2L1, Length 245 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	54.3	Low	51.8	Low	244 Å²	244	142.1 Å²	142.1	100%	1.202	72%	0.719	S	S	*	*				0	38.5	0	-140.1	177	-143	0	0	110.1
2	E	53	Low	51.7	Low	164 Å²	164	139.5 Å²	139.5	77%	0.766	71%	0.708	S	S	*	*			trans	-139.9	3.1	-165.9	-72.3	-173.8	161.8	0	0	116.4
3	D	53.1	Low	52.1	Low	155 Å²	155	134.1 Å²	134.1	83%	0.829	69%	0.69	S	S	*	*	S	Bend	trans	-97.2	-6.5	179.9	-68	-50	0	0	0	114.8
4	S	52.8	Low	52.4	Low	99 Å²	99	132.5 Å²	132.5	69%	0.692	68%	0.683	S	S	*	*	S	Bend	trans	-92.7	-6.8	180	-174	0	0	0	0	114
5	F	50.7	Low	52.9	Low	157 Å²	157	132 Å²	132	69%	0.689	68%	0.676	S	S	*	*	S	Bend	trans	-92.9	-29.3	-174.9	-116.6	-98.4	0	0	0	113.2	F9	F5-F9 HydrophobicContact CD1-CE2 4.2Å; F5-F9 VanDerWaalsContact O-CD2 3.25Å; F5-F9 WeakPolarHBondContact O-CD2 3.49Å
6	L	48.9	Very low	53.3	Low	141 Å²	141	132.1 Å²	132.1	74%	0.738	67%	0.673	S	S	*	*	H	α-helix	trans	-83.4	-19.7	-176	-71.4	169.5	0	0	0	114.3	S8	L6-S8 VanDerWaalsContact C-N 3.35Å
7	Q	54	Low	53.8	Low	153 Å²	153	131.2 Å²	131.2	72%	0.715	67%	0.665	S	S	*	*	H	α-helix	trans	-77.7	-19.8	178.5	-120.1	173.8	31	0	0	113.6
8	S	51.6	Low	54.1	Low	71 Å²	71	131.2 Å²	131.2	50%	0.497	66%	0.662	S	S	.	*	H	α-helix	trans	-79.7	-30.7	-177.9	-52.3	0	0	0	0	113	L6	L6-S8 VanDerWaalsContact C-N 3.35Å
9	F	48.4	Very low	54.5	Low	138 Å²	138	130.4 Å²	130.4	61%	0.605	66%	0.656	S	S	*	*	H	α-helix	trans	-77.7	-29.8	-179	-72.2	-79.1	0	0	0	113.5	F5 R11	F5-F9 HydrophobicContact CD1-CE2 4.2Å; F5-F9 VanDerWaalsContact O-CD2 3.25Å; F5-F9 WeakPolarHBondContact O-CD2 3.49Å; F9-R11 PolarHBondContact O-N 3.37Å
10	G	52.5	Low	54.8	Low	41 Å²	41	130.4 Å²	130.4	42%	0.423	65%	0.654	S	S	.	*	H	α-helix	trans	-70.6	-27	179.1	0	0	0	0	0	114.3
11	R	50.9	Low	55	Low	200 Å²	200	130 Å²	130	76%	0.755	65%	0.65	S	S	*	*	H	α-helix	trans	-83.5	-26.3	180	-69.4	-169.8	177	-160.3	0.5	113.5	F9 Q15	F9-R11 PolarHBondContact O-N 3.37Å; R11-Q15 PolarHBondContact O-N 3.48Å
12	L	50.6	Low	55.2	Low	111 Å²	111	125 Å²	125	58%	0.581	62%	0.623	S	S	*	*	H	α-helix	trans	-71	-37.3	179	-79.3	160.9	0	0	0	112.4	Q16	L12-Q16 WeakPolarHBondContact O-CB 3.48Å; L12-Q16 PolarHBondContact O-N 3.49Å; L12-Q16 VanDerWaalsContact O-N 3.16Å
13	S	56.8	Low	55.5	Low	69 Å²	69	123.5 Å²	123.5	48%	0.483	62%	0.617	S	S	.	*	H	α-helix	trans	-71.7	-39.7	-178.2	78.6	0	0	0	0	112.6	Q16 Q17	S13-Q16 PolarHBondContact O-N 3.49Å; S13-Q17 WeakPolarHBondContact O-CB 3.25Å; S13-Q17 PolarHBondContact O-N 3.08Å
14	L	56.4	Low	55.7	Low	112 Å²	112	127 Å²	127	59%	0.586	62%	0.618	S	S	*	*	H	α-helix	trans	-66.4	-39.1	177.5	-86.3	158.8	0	0	0	112.3	Q17 Q18	L14-Q17 PolarHBondContact O-N 3.48Å; L14-Q18 PolarHBondContact O-N 3.4Å
15	Q	59.7	Low	55.9	Low	125 Å²	125	130.1 Å²	130.1	58%	0.584	62%	0.622	S	S	*	*	H	α-helix	trans	-70	-35.4	178.2	-160.7	167.2	33.3	0	0	111.9	R11 Q19	R11-Q15 PolarHBondContact O-N 3.48Å; Q15-Q19 WeakPolarHBondContact O-CG 3.36Å; Q15-Q19 PolarHBondContact O-N 3.07Å; Q15-Q19 VanDerWaalsContact O-N 3.09Å
16	Q	59.5	Low	56.4	Low	133 Å²	133	131.9 Å²	131.9	62%	0.621	62%	0.624	S	S	*	*	H	α-helix	trans	-71.1	-35.8	175.7	-158	169.9	51.2	0	0	111.9	L12 S13 Q19 Q20	L12-Q16 WeakPolarHBondContact O-CB 3.48Å; L12-Q16 PolarHBondContact O-N 3.49Å; L12-Q16 VanDerWaalsContact O-N 3.16Å; S13-Q16 PolarHBondContact O-N 3.49Å; Q16-Q19 PolarHBondContact O-N 3.14Å; Q16-Q20 PolarHBondContact O-N 3.09Å
17	Q	60.6	Low	57.4	Low	117 Å²	117	130.6 Å²	130.6	55%	0.547	62%	0.624	S	S	.	*	H	α-helix	trans	-71.9	-36.3	176.9	-151.2	170	32.6	0	0	112.1	S13 L14 Q20 Q21	S13-Q17 WeakPolarHBondContact O-CB 3.25Å; S13-Q17 PolarHBondContact O-N 3.08Å; L14-Q17 PolarHBondContact O-N 3.48Å; Q17-Q20 PolarHBondContact O-N 2.98Å; Q17-Q21 PolarHBondContact O-N 3.41Å; Q17-Q21 VanDerWaalsContact O-N 3.1Å
18	Q	60.4	Low	58.3	Low	131 Å²	131	129 Å²	129	61%	0.612	63%	0.627	S	S	*	*	H	α-helix	trans	-67.2	-39	172.4	-109.7	176.1	12.4	0	0	112.8	L14 Q21 Q22	L14-Q18 PolarHBondContact O-N 3.4Å; Q18-Q21 PolarHBondContact O-N 3.48Å; Q18-Q22 PolarHBondContact O-N 3.16Å; Q18-Q22 VanDerWaalsContact O-N 3.08Å
19	Q	61	Low	59	Low	117 Å²	117	136.7 Å²	136.7	55%	0.547	65%	0.645	S	S	.	*	H	α-helix	trans	-67.6	-36.4	175.6	-78.9	-177.8	3.6	0	0	112.7	Q15 Q16 Q22 Q23	Q15-Q19 WeakPolarHBondContact O-CG 3.36Å; Q15-Q19 PolarHBondContact O-N 3.07Å; Q15-Q19 VanDerWaalsContact O-N 3.09Å; Q16-Q19 PolarHBondContact O-N 3.14Å; Q19-Q22 PolarHBondContact O-N 3.4Å; Q19-Q23 WeakPolarHBondContact O-CG 3.41Å; Q19-Q23 PolarHBondContact O-N 3.48Å; Q19-Q23 VanDerWaalsContact O-N 3.14Å
20	Q	60.3	Low	60.1	Low	129 Å²	129	135.5 Å²	135.5	60%	0.603	65%	0.651	S	S	*	*	H	α-helix	trans	-68.3	-35.9	174.4	-87.6	-177.4	6.4	0	0	113	Q16 Q17 Q23 R24	Q16-Q20 PolarHBondContact O-N 3.09Å; Q17-Q20 PolarHBondContact O-N 2.98Å; Q20-Q23 PolarHBondContact O-N 3.34Å; Q20-R24 PolarHBondContact O-N 3.36Å
21	Q	60.4	Low	61.1	Low	122 Å²	122	138.7 Å²	138.7	57%	0.57	67%	0.665	S	S	*	*	H	α-helix	trans	-69.8	-35.7	175.4	-76.6	-177.9	6.1	0	0	112.6	Q17 Q18 R24	Q17-Q21 PolarHBondContact O-N 3.41Å; Q17-Q21 VanDerWaalsContact O-N 3.1Å; Q18-Q21 PolarHBondContact O-N 3.48Å; Q21-R24 PolarHBondContact O-N 2.95Å
22	Q	58.6	Low	62.1	Low	139 Å²	139	135.1 Å²	135.1	65%	0.65	67%	0.667	S	S	*	*	H	α-helix	trans	-70	-30.4	174.7	-78.5	-178.8	8.4	0	0	113.3	Q18 Q19 R24 Q25	Q18-Q22 PolarHBondContact O-N 3.16Å; Q18-Q22 VanDerWaalsContact O-N 3.08Å; Q19-Q22 PolarHBondContact O-N 3.4Å; Q22-R24 VanDerWaalsContact C-N 3.3Å; Q22-R24 PolarHBondContact O-N 3.34Å; Q22-Q25 PolarHBondContact O-N 3.44Å
23	Q	57.8	Low	63	Low	134 Å²	134	141.6 Å²	141.6	63%	0.626	68%	0.684	S	S	*	*	H	α-helix	trans	-71.3	-25.1	174.5	-74.7	-177.8	16.5	0	0	113.1	Q19 Q20 Q25	Q19-Q23 WeakPolarHBondContact O-CG 3.41Å; Q19-Q23 PolarHBondContact O-N 3.48Å; Q19-Q23 VanDerWaalsContact O-N 3.14Å; Q20-Q23 PolarHBondContact O-N 3.34Å; Q23-Q25 VanDerWaalsContact C-N 3.3Å; Q23-Q25 PolarHBondContact O-N 3.47Å
24	R	58	Low	63.3	Low	227 Å²	227	141.2 Å²	141.2	86%	0.857	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-9.8	177.4	-77.1	-174	160.3	-153.9	-4.4	114.9	Q20 Q21 Q22	Q20-R24 PolarHBondContact O-N 3.36Å; Q21-R24 PolarHBondContact O-N 2.95Å; Q22-R24 VanDerWaalsContact C-N 3.3Å; Q22-R24 PolarHBondContact O-N 3.34Å
25	Q	57	Low	63.7	Low	166 Å²	166	142.2 Å²	142.2	78%	0.776	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	7	179.9	-63.9	-172.4	16.6	0	0	114	Q22 Q23	Q22-Q25 PolarHBondContact O-N 3.44Å; Q23-Q25 VanDerWaalsContact C-N 3.3Å; Q23-Q25 PolarHBondContact O-N 3.47Å
26	R	60.6	Low	63.8	Low	194 Å²	194	141.5 Å²	141.5	73%	0.732	71%	0.708	S	S	*	*	S	Bend	trans	-73.4	126.4	175.7	-69.9	-174.4	169.7	-168.8	-3.9	109.5
27	P	69.6	Low	63.7	Low	113 Å²	113	140.8 Å²	140.8	73%	0.734	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-59	143.9	175.1	24.3	-31.9	0	0	0	109.5	R29	P27-R29 PolarHBondContact O-N 3.1Å
28	P	73.6	Confident	63.6	Low	121 Å²	121	146.5 Å²	146.5	79%	0.786	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-56.5	134.8	178.2	22.6	-31.2	0	0	0	109.3
29	R	67.3	Low	63.3	Low	232 Å²	232	151.5 Å²	151.5	88%	0.875	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-55.6	133.4	173.8	-68.5	-177.4	-176.4	-166.9	1.1	107.7	P27	P27-R29 PolarHBondContact O-N 3.1Å
30	P	71.2	Confident	62.8	Low	112 Å²	112	153.8 Å²	153.8	73%	0.727	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-56.7	143.2	174	23.6	-31.3	0	0	0	108.5
31	P	73.3	Confident	62.8	Low	109 Å²	109	151.8 Å²	151.8	71%	0.708	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-53.3	145.6	176.2	23	-32.5	0	0	0	109	R33	P31-R33 PolarHBondContact O-N 3.45Å
32	P	70.7	Confident	62.8	Low	125 Å²	125	156 Å²	156	81%	0.812	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-52	120.7	173.3	21.3	-30	0	0	0	107.1	G34	P32-G34 PolarHBondContact O-N 2.93Å
33	R	69.4	Low	64	Low	246 Å²	246	156.2 Å²	156.2	93%	0.928	77%	0.767	S	S	*	*			trans	-54	109.6	173.2	-74.5	-177.6	-164.2	-173.3	4.1	105.3	P31 T35	P31-R33 PolarHBondContact O-N 3.45Å; R33-T35 PolarHBondContact O-N 2.81Å
34	G	63.4	Low	65.7	Low	62 Å²	62	152.7 Å²	152.7	64%	0.639	75%	0.75	S	S	*	*			trans	-47.4	140.1	171.2	0	0	0	0	0	107.6	P32 P36	P32-G34 PolarHBondContact O-N 2.93Å; G34-P36 VanDerWaalsContact O-N 3.16Å
35	T	64.4	Low	67.6	Low	133 Å²	133	144.4 Å²	144.4	82%	0.816	72%	0.721	S	S	*	*			trans	-45.5	128.7	172.5	38.2	0	0	0	0	107.9	R33	R33-T35 PolarHBondContact O-N 2.81Å
36	P	62.1	Low	69.6	Low	109 Å²	109	136.5 Å²	136.5	71%	0.708	68%	0.684	S	S	*	*			trans	-53.5	138.9	177.7	20.6	-30	0	0	0	107.6	G34 R38	G34-P36 VanDerWaalsContact O-N 3.16Å; P36-R38 PolarHBondContact O-N 3.19Å; P36-R38 VanDerWaalsContact O-N 3.12Å
37	P	58.8	Low	71.4	Confident	118 Å²	118	128 Å²	128	77%	0.766	65%	0.652	S	S	*	*			trans	-50.3	129.6	175.6	21.5	-31.2	0	0	0	107	R39	P37-R39 PolarHBondContact O-N 2.75Å
38	R	57.7	Low	72.7	Confident	237 Å²	237	122.6 Å²	122.6	89%	0.894	62%	0.617	S	S	*	*			trans	-43.4	113.5	178.6	-81.4	175.7	80.1	176.4	4.9	106.6	P36 H40	P36-R38 PolarHBondContact O-N 3.19Å; P36-R38 VanDerWaalsContact O-N 3.12Å; R38-H40 PolarHBondContact O-N 3.12Å; R38-H40 VanDerWaalsContact O-N 3.12Å
39	R	54.1	Low	73.9	Confident	236 Å²	236	116.9 Å²	116.9	89%	0.891	58%	0.58	S	S	*	*			trans	-42.1	126.5	171.5	-71.1	-177.5	175.4	-166.8	-1.7	106.2	P37 S41	P37-R39 PolarHBondContact O-N 2.75Å; R39-S41 PolarHBondContact O-N 2.85Å
40	H	50.3	Low	75.3	Confident	166 Å²	166	106.1 Å²	106.1	77%	0.769	54%	0.539	S	S	*	.			trans	-42.5	104.2	180	-67.4	-78.5	0	0	0	108.2	R38 F42	R38-H40 PolarHBondContact O-N 3.12Å; R38-H40 VanDerWaalsContact O-N 3.12Å; H40-F42 PolarHBondContact O-N 3.39Å
41	S	60.7	Low	76.5	Confident	87 Å²	87	101 Å²	101	61%	0.608	51%	0.506	S	S	*	.			trans	-53.5	129.9	170.8	58.9	0	0	0	0	104.8	R39 R43	R39-S41 PolarHBondContact O-N 2.85Å; S41-R43 PolarHBondContact O-N 2.84Å
42	F	61	Low	77.6	Confident	210 Å²	210	95.8 Å²	95.8	92%	0.921	47%	0.473	S	S	*	.			trans	-38.8	107.4	174.2	-77.9	-85.8	0	0	0	108.4	H40 K44	H40-F42 PolarHBondContact O-N 3.39Å; F42-K44 PolarHBondContact O-N 3.44Å
43	R	82.3	Confident	78.8	Confident	144 Å²	144	90.4 Å²	90.4	54%	0.543	44%	0.438	S	S	.	.			trans	-68.9	126.7	-175.1	-73.4	-167.8	171.6	-168	-1.6	105.9	S41 H45 E141	S41-R43 PolarHBondContact O-N 2.84Å; R43-H45 PolarHBondContact O-CE1 3.22Å; R43-H45 PolarHBondContact O-ND1 3.11Å; R43-H45 PolarHBondContact O-NE2 2.99Å; R43-E141 WeakPolarHBondContact CD-OE2 3.43Å; R43-E141 IonicContact CZ-OE2 2.78Å; R43-E141 IonicContact NE-OE2 3.59Å; R43-E141 IonicContact NH1-OE2 3.86Å; R43-E141 PolarHBondContact NH1-OE2 3.27Å
44	K	95.3	Very high	80	Confident	59 Å²	59	79.7 Å²	79.7	26%	0.257	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	134.9	175.9	-62.7	-179	-63.1	-173.5	0	107.1	F42 S114 N138 Y140 E141	F42-K44 PolarHBondContact O-N 3.44Å; K44-S114 WeakPolarHBondContact CA-OG 3.37Å; K44-N138 WeakPolarHBondContact CE-O 3.36Å; K44-N138 PolarHBondContact NZ-O 3.4Å; K44-Y140 HydrophobicContact CB-CD1 3.5Å; K44-Y140 HydrophobicContact CB-CD2 4.04Å; K44-Y140 HydrophobicContact CB-CE1 3.53Å; K44-Y140 HydrophobicContact CB-CE2 4.06Å; K44-Y140 HydrophobicContact CB-CG 3.74Å; K44-Y140 HydrophobicContact CD-CD2 4.42Å; K44-Y140 HydrophobicContact CD-CE1 4.36Å; K44-Y140 HydrophobicContact CD-CE2 3.81Å; K44-Y140 VanDerWaalsContact CE-CE2 3.46Å; K44-Y140 HydrophobicContact CG-CE1 4.44Å; K44-Y140 CarbonylContact O-C 3.48Å; K44-Y140 WeakPolarHBondContact O-CA 3.08Å; K44-E141 PolarHBondContact O-N 3.38Å
45	H	97.3	Very high	81.6	Confident	53 Å²	53	76.7 Å²	76.7	25%	0.245	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.4	-173.9	-59.2	117.7	0	0	0	111.3	R43 Y47 S114 P115 I116 E141 I143	R43-H45 PolarHBondContact O-CE1 3.22Å; R43-H45 PolarHBondContact O-ND1 3.11Å; R43-H45 PolarHBondContact O-NE2 2.99Å; H45-Y47 HydrophobicContact CB-CD2 4.47Å; H45-Y47 HydrophobicContact CB-CE2 3.9Å; H45-S114 PolarHBondContact N-OG 3.05Å; H45-P115 HydrophobicContact CB-CB 4.12Å; H45-P115 VanDerWaalsContact O-CA 3.27Å; H45-P115 WeakPolarHBondContact O-CA 3.42Å; H45-I116 PolarHBondContact O-N 3.19Å; H45-E141 WeakPolarHBondContact CA-O 3.35Å; H45-I143 HydrophobicContact CB-CD1 4.25Å
46	L	98.2	Very high	83.1	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.1	166.7	173.1	63.7	0	0	0	108.5	L48 M109 I116 I118 A135 Y140 E141 V142 I143	L46-L48 HydrophobicContact CD1-CD2 4.15Å; L46-L48 HydrophobicContact CD2-CD1 4.5Å; L46-L48 HydrophobicContact CD2-CD2 3.92Å; L46-L48 HydrophobicContact CD2-CG 4.19Å; L46-L48 HydrophobicContact CG-CD2 3.96Å; L46-L48 HydrophobicContact CG-CG 4.17Å; L46-M109 HydrophobicContact CB-CE 4.47Å; L46-M109 HydrophobicContact CD1-CE 3.48Å; L46-M109 VanDerWaalsContact CD1-CE 3.48Å; L46-M109 HydrophobicContact CD2-CE 3.51Å; L46-M109 HydrophobicContact CG-CE 3.99Å; L46-I116 CarbonylContact C-O 3.1Å; L46-I116 WeakPolarHBondContact CA-O 3.46Å; L46-I116 HydrophobicContact CD1-CB 3.96Å; L46-I116 HydrophobicContact CD1-CG2 3.74Å; L46-I118 HydrophobicContact CD1-CD1 4.31Å; L46-I118 HydrophobicContact CD1-CG1 3.82Å; L46-A135 HydrophobicContact CB-CB 4.49Å; L46-A135 HydrophobicContact CD2-CB 3.72Å; L46-Y140 HydrophobicContact CB-CD1 4.38Å; L46-E141 PolarHBondContact N-O 2.95Å; L46-V142 HydrophobicContact CD2-CG2 4.22Å; L46-V142 WeakPolarHBondContact O-CA 3.49Å; L46-I143 PolarHBondContact O-N 3.3Å
47	Y	98.2	Very high	84.8	Confident	16 Å²	16	66.9 Å²	66.9	6%	0.063	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.9	170.8	-66	-88.3	0	0	0	109.8	H45 L64 F68 P115 I116 I117 I118 I143 R145	H45-Y47 HydrophobicContact CB-CD2 4.47Å; H45-Y47 HydrophobicContact CB-CE2 3.9Å; Y47-L64 HydrophobicContact CD1-CD1 4.08Å; Y47-L64 HydrophobicContact CD1-CD2 4.5Å; Y47-L64 HydrophobicContact CE1-CD2 4.23Å; Y47-L64 HydrophobicContact CG-CD1 4.09Å; Y47-F68 HydrophobicContact CE2-CE2 4.46Å; Y47-P115 HydrophobicContact CD2-CB 3.85Å; Y47-P115 HydrophobicContact CE2-CB 3.63Å; Y47-P115 HydrophobicContact CE2-CG 4.26Å; Y47-I116 PolarHBondContact N-O 3.39Å; Y47-I117 HydrophobicContact CD2-CG1 4.2Å; Y47-I117 WeakPolarHBondContact O-CA 3.35Å; Y47-I118 PolarHBondContact O-N 3.06Å; Y47-I143 WeakPolarHBondContact CA-O 3.31Å; Y47-I143 HydrophobicContact CD1-CB 3.9Å; Y47-I143 HydrophobicContact CD1-CD1 4.4Å; Y47-I143 HydrophobicContact CD1-CG2 3.94Å; Y47-I143 HydrophobicContact CE1-CB 4.02Å; Y47-I143 HydrophobicContact CE1-CD1 3.74Å; Y47-I143 HydrophobicContact CE1-CG1 4.48Å; Y47-I143 HydrophobicContact CE1-CG2 3.87Å; Y47-R145 HydrophobicContact CD1-CG 3.85Å; Y47-R145 HydrophobicContact CE1-CG 4.39Å
48	L	98.3	Very high	86.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	105.6	170.4	-63	-177.5	0	0	0	108	L46 I118 M128 Y131 V142 I143 F144 R145	L46-L48 HydrophobicContact CD1-CD2 4.15Å; L46-L48 HydrophobicContact CD2-CD1 4.5Å; L46-L48 HydrophobicContact CD2-CD2 3.92Å; L46-L48 HydrophobicContact CD2-CG 4.19Å; L46-L48 HydrophobicContact CG-CD2 3.96Å; L46-L48 HydrophobicContact CG-CG 4.17Å; L48-I118 HydrophobicContact CD2-CB 3.72Å; L48-I118 HydrophobicContact CD2-CG1 3.51Å; L48-I118 HydrophobicContact CD2-CG2 4.43Å; L48-M128 HydrophobicContact CB-SD 4.14Å; L48-M128 HydrophobicContact CD1-CB 3.96Å; L48-M128 HydrophobicContact CD1-CG 4.16Å; L48-M128 HydrophobicContact CD1-SD 4.26Å; L48-Y131 HydrophobicContact CD2-CD2 4.48Å; L48-Y131 HydrophobicContact CD2-CG 4.22Å; L48-V142 HydrophobicContact CD1-CG1 3.62Å; L48-V142 HydrophobicContact CG-CG1 4.04Å; L48-I143 PolarHBondContact N-O 3.36Å; L48-F144 HydrophobicContact CB-CD1 4.02Å; L48-F144 HydrophobicContact CB-CE1 4.32Å; L48-F144 HydrophobicContact CD1-CD1 4.3Å; L48-F144 HydrophobicContact CD1-CE1 3.74Å; L48-F144 HydrophobicContact CD1-CZ 4.44Å; L48-F144 WeakPolarHBondContact O-CA 3.45Å; L48-R145 PolarHBondContact O-N 3.29Å
49	L	97.9	Very high	88.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	145.9	177.3	-54.9	-167.6	0	0	0	110	K57 L60 A61 L64 I117 I118 D119 N122 R145	L49-K57 WeakPolarHBondContact CD1-O 3.4Å; L49-L60 HydrophobicContact CD2-CD2 4.04Å; L49-L60 HydrophobicContact CD2-CG 4.36Å; L49-A61 HydrophobicContact CD1-CB 3.57Å; L49-L64 HydrophobicContact CD2-CD1 4.07Å; L49-I117 HydrophobicContact CD1-CG2 3.92Å; L49-I117 HydrophobicContact CD2-CG2 4.34Å; L49-I117 HydrophobicContact CG-CG2 3.95Å; L49-I118 WeakPolarHBondContact CB-O 3.41Å; L49-I118 PolarHBondContact N-O 3.13Å; L49-D119 HydrophobicContact CD1-CB 4.14Å; L49-N122 WeakPolarHBondContact O-CB 3.37Å; L49-N122 PolarHBondContact O-ND2 3.28Å; L49-R145 CarbonylContact C-O 3.57Å; L49-R145 VanDerWaalsContact CA-O 3.28Å; L49-R145 WeakPolarHBondContact CA-O 3.45Å; L49-R145 HydrophobicContact CD2-CB 3.74Å
50	R	97.3	Very high	90.4	Very high	6 Å²	6	48.6 Å²	48.6	2%	0.023	25%	0.251	C	S	.	.			trans	-136	143.8	177.2	-52.6	-176.8	67	-148.1	0.9	110.3	N122 L123 M128 R145 E146 P147 Y178 E179 V182	R50-N122 HydrophobicContact CB-CB 4.46Å; R50-N122 HydrophobicContact CG-CB 3.96Å; R50-N122 PolarHBondContact NE-O 3Å; R50-N122 VanDerWaalsContact NE-O 3.07Å; R50-N122 PolarHBondContact NH2-O 3.34Å; R50-L123 PolarHBondContact NH2-O 2.93Å; R50-M128 HydrophobicContact CG-CE 4.34Å; R50-M128 HydrophobicContact CG-SD 3.77Å; R50-M128 VanDerWaalsContact NE-CE 3.34Å; R50-R145 PolarHBondContact N-O 3.05Å; R50-E146 HydrophobicContact CB-CG 4.18Å; R50-P147 WeakPolarHBondContact O-CD 3.25Å; R50-Y178 HydrophobicContact CB-CE2 4.48Å; R50-Y178 VanDerWaalsContact CB-OH 3.25Å; R50-Y178 WeakPolarHBondContact CB-OH 3.42Å; R50-E179 VanDerWaalsContact CZ-O 3.31Å; R50-E179 PolarHBondContact NH1-O 3.12Å; R50-E179 VanDerWaalsContact NH1-O 3.08Å; R50-E179 PolarHBondContact NH2-O 3.38Å; R50-V182 VanDerWaalsContact CZ-CG2 3.44Å
51	G	96.6	Very high	92.6	Very high	4 Å²	4	40.7 Å²	40.7	4%	0.041	21%	0.214	C	C	.	.			trans	150.2	160.9	175	0	0	0	0	0	114.8	K57 T121	G51-K57 VanDerWaalsContact O-CD 3.31Å; G51-K57 WeakPolarHBondContact O-CD 3.26Å; G51-K57 WeakPolarHBondContact O-CE 3.36Å; G51-K57 PolarHBondContact O-NZ 3.29Å; G51-T121 PolarHBondContact N-O 3.41Å; G51-T121 WeakPolarHBondContact O-CA 3.19Å
52	L	96.6	Very high	94.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.212	C	C	.	.			trans	-68.2	156.6	-178	-61.5	172.5	0	0	0	112.6	G54 S55 K57 L123 F153 L158 M174 K175 Y178	L52-G54 PolarHBondContact O-N 3.4Å; L52-S55 VanDerWaalsContact O-CB 3.27Å; L52-S55 WeakPolarHBondContact O-CB 3.5Å; L52-S55 PolarHBondContact O-N 2.87Å; L52-S55 VanDerWaalsContact O-N 3.1Å; L52-S55 PolarHBondContact O-OG 3.07Å; L52-K57 PolarHBondContact O-NZ 2.92Å; L52-L123 HydrophobicContact CD2-CD2 3.84Å; L52-F153 HydrophobicContact CD1-CD1 4.04Å; L52-L158 HydrophobicContact CB-CD1 3.78Å; L52-L158 HydrophobicContact CB-CD2 4.46Å; L52-L158 HydrophobicContact CD1-CD1 3.55Å; L52-L158 HydrophobicContact CG-CD1 4.32Å; L52-M174 HydrophobicContact CD2-CB 3.68Å; L52-K175 HydrophobicContact CD1-CB 3.68Å; L52-K175 HydrophobicContact CD1-CG 4.02Å; L52-K175 HydrophobicContact CD2-CB 4.42Å; L52-Y178 HydrophobicContact CD2-CD2 4.44Å
53	P	95.4	Very high	96	Very high	12 Å²	12	39 Å²	39	8%	0.078	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	132.2	170	-26.1	35.7	0	0	0	111	T121 L158 N162 V166 M174	P53-T121 HydrophobicContact CG-CG2 4.25Å; P53-L158 WeakPolarHBondContact O-CB 3.42Å; P53-L158 WeakPolarHBondContact O-CD2 3.39Å; P53-N162 HydrophobicContact CB-CB 4.03Å; P53-V166 HydrophobicContact CB-CB 4.32Å; P53-V166 HydrophobicContact CB-CG2 4.02Å; P53-V166 HydrophobicContact CG-CB 4.49Å; P53-V166 HydrophobicContact CG-CG1 4.37Å; P53-V166 HydrophobicContact CG-CG2 4.12Å; P53-M174 VanDerWaalsContact CD-CE 3.5Å; P53-M174 HydrophobicContact CG-CE 3.6Å; P53-M174 HydrophobicContact CG-SD 3.96Å
54	G	95.1	Very high	96.7	Very high	21 Å²	21	33 Å²	33	22%	0.216	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-0.4	-177	0	0	0	0	0	116	L52 G56 W151	L52-G54 PolarHBondContact O-N 3.4Å; G54-G56 VanDerWaalsContact C-N 3.28Å; G54-G56 PolarHBondContact O-N 3.14Å; G54-W151 PolarHBondContact O-NE1 3.26Å
55	S	96.9	Very high	96.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-75.6	-12.3	-178.7	68.3	0	0	0	0	114.7	L52 P147 T149 L158	L52-S55 VanDerWaalsContact O-CB 3.27Å; L52-S55 WeakPolarHBondContact O-CB 3.5Å; L52-S55 PolarHBondContact O-N 2.87Å; L52-S55 VanDerWaalsContact O-N 3.1Å; L52-S55 PolarHBondContact O-OG 3.07Å; S55-P147 VanDerWaalsContact O-CB 3.23Å; S55-P147 WeakPolarHBondContact O-CB 3.28Å; S55-T149 WeakPolarHBondContact O-CG2 3.46Å; S55-T149 PolarHBondContact O-OG1 3.28Å; S55-L158 VanDerWaalsContact CA-CD2 3.45Å; S55-L158 VanDerWaalsContact N-CD2 3.29Å
56	G	95.9	Very high	96.7	Very high	19 Å²	19	37.5 Å²	37.5	20%	0.196	19%	0.194	C	C	.	.	S	Bend	trans	101.1	18	-179.3	0	0	0	0	0	115	G54 T59 L60	G54-G56 VanDerWaalsContact C-N 3.28Å; G54-G56 PolarHBondContact O-N 3.14Å; G56-T59 WeakPolarHBondContact O-CB 3.39Å; G56-T59 PolarHBondContact O-N 3.42Å; G56-L60 PolarHBondContact O-N 2.94Å
57	K	96.3	Very high	96.5	Very high	17 Å²	17	41.9 Å²	41.9	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-56.9	-49.8	178.4	-60	-174.6	-63.7	-65.8	0	113.3	L49 G51 L52 T59 L60 A61 D119 N120 P147	L49-K57 WeakPolarHBondContact CD1-O 3.4Å; G51-K57 VanDerWaalsContact O-CD 3.31Å; G51-K57 WeakPolarHBondContact O-CD 3.26Å; G51-K57 WeakPolarHBondContact O-CE 3.36Å; G51-K57 PolarHBondContact O-NZ 3.29Å; L52-K57 PolarHBondContact O-NZ 2.92Å; K57-T59 VanDerWaalsContact C-N 3.25Å; K57-T59 PolarHBondContact O-N 2.97Å; K57-L60 CarbonylContact O-C 3.46Å; K57-L60 WeakPolarHBondContact O-CA 3.46Å; K57-L60 WeakPolarHBondContact O-CB 3.05Å; K57-L60 PolarHBondContact O-N 3.16Å; K57-A61 PolarHBondContact O-N 2.77Å; K57-D119 WeakPolarHBondContact CB-OD1 3.23Å; K57-N120 VanDerWaalsContact CD-O 3.28Å; K57-N120 WeakPolarHBondContact CD-O 3.27Å; K57-N120 WeakPolarHBondContact CE-O 3.37Å; K57-P147 HydrophobicContact CB-CG 4.3Å; K57-P147 HydrophobicContact CG-CG 3.78Å
58	T	94.7	Very high	96.4	Very high	72 Å²	72	45 Å²	45	44%	0.442	23%	0.231	S	C	.	.	H	α-helix	trans	-63.2	-35	178.8	-49	0	0	0	0	111.9	A61 R62 D119	T58-A61 WeakPolarHBondContact O-CB 3.47Å; T58-A61 PolarHBondContact O-N 3.12Å; T58-R62 VanDerWaalsContact O-CG 3.26Å; T58-R62 WeakPolarHBondContact O-CG 3.34Å; T58-R62 PolarHBondContact O-N 2.83Å; T58-D119 WeakPolarHBondContact CA-OD2 3.39Å; T58-D119 VanDerWaalsContact CB-OD2 3.23Å; T58-D119 WeakPolarHBondContact CB-OD2 3.24Å; T58-D119 PolarHBondContact OG1-OD2 3.47Å
59	T	96.5	Very high	96.1	Very high	105 Å²	105	50.7 Å²	50.7	64%	0.644	27%	0.268	S	S	*	.	H	α-helix	trans	-61.1	-46.4	171.4	-50.3	0	0	0	0	111.3	G56 K57 A61 R62 Q63	G56-T59 WeakPolarHBondContact O-CB 3.39Å; G56-T59 PolarHBondContact O-N 3.42Å; K57-T59 VanDerWaalsContact C-N 3.25Å; K57-T59 PolarHBondContact O-N 2.97Å; T59-A61 PolarHBondContact O-N 3.34Å; T59-R62 PolarHBondContact O-N 3.22Å; T59-Q63 PolarHBondContact O-N 2.97Å
60	L	97.3	Very high	95.8	Very high	29 Å²	29	59.7 Å²	59.7	15%	0.152	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-40.4	174.8	175.6	62.4	0	0	0	112.3	L49 G56 K57 R62 Q63 L64 R145 P147	L49-L60 HydrophobicContact CD2-CD2 4.04Å; L49-L60 HydrophobicContact CD2-CG 4.36Å; G56-L60 PolarHBondContact O-N 2.94Å; K57-L60 CarbonylContact O-C 3.46Å; K57-L60 WeakPolarHBondContact O-CA 3.46Å; K57-L60 WeakPolarHBondContact O-CB 3.05Å; K57-L60 PolarHBondContact O-N 3.16Å; L60-R62 VanDerWaalsContact C-N 3.33Å; L60-R62 PolarHBondContact O-N 3.29Å; L60-Q63 PolarHBondContact O-N 2.96Å; L60-L64 HydrophobicContact CD1-CG 4.45Å; L60-L64 HydrophobicContact CG-CD1 4.42Å; L60-L64 WeakPolarHBondContact O-CG 3.25Å; L60-L64 PolarHBondContact O-N 3.47Å; L60-R145 HydrophobicContact CD2-CB 4.12Å; L60-P147 HydrophobicContact CD2-CG 4.5Å
61	A	97.3	Very high	95.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.9	-44.8	176.2	0	0	0	0	0	111.3	L49 K57 T58 T59 L64 Q65 I73 I117 D119	L49-A61 HydrophobicContact CD1-CB 3.57Å; K57-A61 PolarHBondContact O-N 2.77Å; T58-A61 WeakPolarHBondContact O-CB 3.47Å; T58-A61 PolarHBondContact O-N 3.12Å; T59-A61 PolarHBondContact O-N 3.34Å; A61-L64 PolarHBondContact O-N 2.92Å; A61-Q65 WeakPolarHBondContact O-CB 3.43Å; A61-Q65 PolarHBondContact O-N 3.21Å; A61-I73 HydrophobicContact CB-CD1 3.92Å; A61-I73 HydrophobicContact CB-CG1 4.39Å; A61-I73 HydrophobicContact CB-CG2 4.22Å; A61-I117 HydrophobicContact CB-CG2 4.05Å; A61-D119 HydrophobicContact CB-CB 4.09Å
62	R	96.7	Very high	95.8	Very high	150 Å²	150	62.6 Å²	62.6	57%	0.566	32%	0.317	S	S	*	.	H	α-helix	trans	-67.6	-37.3	177.6	-66.4	-62.7	179	179	3.7	112.4	T58 T59 L60 Q65 H66	T58-R62 VanDerWaalsContact O-CG 3.26Å; T58-R62 WeakPolarHBondContact O-CG 3.34Å; T58-R62 PolarHBondContact O-N 2.83Å; T59-R62 PolarHBondContact O-N 3.22Å; L60-R62 VanDerWaalsContact C-N 3.33Å; L60-R62 PolarHBondContact O-N 3.29Å; R62-Q65 PolarHBondContact O-N 3.21Å; R62-H66 WeakPolarHBondContact O-CB 3.26Å; R62-H66 PolarHBondContact O-N 2.9Å
63	Q	96.9	Very high	95.9	Very high	113 Å²	113	64 Å²	64	53%	0.528	32%	0.324	S	S	.	.	H	α-helix	trans	-61.2	-48.3	172.5	-175.8	-179.6	-1.8	0	0	111.1	T59 L60 Q65 H66 D67	T59-Q63 PolarHBondContact O-N 2.97Å; L60-Q63 PolarHBondContact O-N 2.96Å; Q63-Q65 VanDerWaalsContact C-N 3.28Å; Q63-Q65 PolarHBondContact O-N 3.27Å; Q63-H66 WeakPolarHBondContact O-CB 3.48Å; Q63-H66 PolarHBondContact O-N 3.27Å; Q63-H66 VanDerWaalsContact O-N 3.14Å; Q63-D67 VanDerWaalsContact O-CG 3.31Å; Q63-D67 PolarHBondContact O-N 3.04Å
64	L	95.8	Very high	96	Very high	18 Å²	18	64.1 Å²	64.1	9%	0.094	32%	0.324	C	S	.	.	H	α-helix	trans	-59.8	-39.1	175.3	-71.4	170.1	0	0	0	112	Y47 L49 L60 A61 D67 F68 I117	Y47-L64 HydrophobicContact CD1-CD1 4.08Å; Y47-L64 HydrophobicContact CD1-CD2 4.5Å; Y47-L64 HydrophobicContact CE1-CD2 4.23Å; Y47-L64 HydrophobicContact CG-CD1 4.09Å; L49-L64 HydrophobicContact CD2-CD1 4.07Å; L60-L64 HydrophobicContact CD1-CG 4.45Å; L60-L64 HydrophobicContact CG-CD1 4.42Å; L60-L64 WeakPolarHBondContact O-CG 3.25Å; L60-L64 PolarHBondContact O-N 3.47Å; A61-L64 PolarHBondContact O-N 2.92Å; L64-D67 PolarHBondContact O-N 2.67Å; L64-F68 HydrophobicContact CD2-CE2 4.23Å; L64-F68 WeakPolarHBondContact O-CB 3.46Å; L64-F68 WeakPolarHBondContact O-CD2 3.42Å; L64-F68 PolarHBondContact O-N 3.47Å; L64-I117 HydrophobicContact CB-CD1 3.6Å; L64-I117 HydrophobicContact CB-CG1 4.44Å; L64-I117 HydrophobicContact CD1-CD1 4.43Å; L64-I117 HydrophobicContact CD1-CG1 4.48Å
65	Q	96.1	Very high	96.1	Very high	55 Å²	55	63.5 Å²	63.5	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-68.3	-34.8	176.2	177.6	173.3	62.9	0	0	113	A61 R62 Q63 F68 A71 I73	A61-Q65 WeakPolarHBondContact O-CB 3.43Å; A61-Q65 PolarHBondContact O-N 3.21Å; R62-Q65 PolarHBondContact O-N 3.21Å; Q63-Q65 VanDerWaalsContact C-N 3.28Å; Q63-Q65 PolarHBondContact O-N 3.27Å; Q65-F68 CarbonylContact O-C 3.55Å; Q65-F68 PolarHBondContact O-N 3.2Å; Q65-A71 HydrophobicContact CB-CB 4.4Å; Q65-A71 PolarHBondContact NE2-O 2.79Å; Q65-I73 HydrophobicContact CB-CD1 3.86Å; Q65-I73 HydrophobicContact CB-CG1 4.31Å; Q65-I73 HydrophobicContact CG-CD1 4.39Å
66	H	96.1	Very high	95.9	Very high	151 Å²	151	63.9 Å²	63.9	70%	0.699	32%	0.318	S	S	*	.	H	α-helix	trans	-64.3	-44.7	173.1	176.3	-84.8	0	0	0	111.1	R62 Q63 F68	R62-H66 WeakPolarHBondContact O-CB 3.26Å; R62-H66 PolarHBondContact O-N 2.9Å; Q63-H66 WeakPolarHBondContact O-CB 3.48Å; Q63-H66 PolarHBondContact O-N 3.27Å; Q63-H66 VanDerWaalsContact O-N 3.14Å; H66-F68 VanDerWaalsContact C-N 3.3Å; H66-F68 PolarHBondContact O-N 3.26Å
67	D	95.3	Very high	95.7	Very high	92 Å²	92	65 Å²	65	49%	0.492	32%	0.32	S	S	.	.	H	α-helix	trans	-69.7	-29.2	179	-62.3	-16	0	0	0	112.3	Q63 L64	Q63-D67 VanDerWaalsContact O-CG 3.31Å; Q63-D67 PolarHBondContact O-N 3.04Å; L64-D67 PolarHBondContact O-N 2.67Å
68	F	94.6	Very high	95.5	Very high	80 Å²	80	67.2 Å²	67.2	35%	0.351	33%	0.333	S	S	.	.	S	Bend	trans	-123.4	87.6	178	-56.1	-68.5	0	0	0	110.7	Y47 L64 Q65 H66 R70 A71 P115	Y47-F68 HydrophobicContact CE2-CE2 4.46Å; L64-F68 HydrophobicContact CD2-CE2 4.23Å; L64-F68 WeakPolarHBondContact O-CB 3.46Å; L64-F68 WeakPolarHBondContact O-CD2 3.42Å; L64-F68 PolarHBondContact O-N 3.47Å; Q65-F68 CarbonylContact O-C 3.55Å; Q65-F68 PolarHBondContact O-N 3.2Å; H66-F68 VanDerWaalsContact C-N 3.3Å; H66-F68 PolarHBondContact O-N 3.26Å; F68-R70 PolarHBondContact O-N 3.06Å; F68-A71 HydrophobicContact CB-CB 4.03Å; F68-A71 WeakPolarHBondContact O-CB 2.99Å; F68-A71 PolarHBondContact O-N 3.25Å; F68-P115 HydrophobicContact CB-CG 3.62Å; F68-P115 HydrophobicContact CD2-CG 3.92Å; F68-P115 HydrophobicContact CG-CG 3.77Å
69	P	92.1	Very high	95.4	Very high	120 Å²	120	66.4 Å²	66.4	78%	0.779	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.1	-173.4	-28.6	35.5	0	0	0	115.7	A71	P69-A71 VanDerWaalsContact C-N 3.34Å
70	R	93.1	Very high	95.2	Very high	189 Å²	189	62 Å²	62	71%	0.713	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	1.3	176.2	-64.1	-177	63.7	-163.9	-1.9	113.6	F68	F68-R70 PolarHBondContact O-N 3.06Å
71	A	96.1	Very high	94.9	Very high	2 Å²	2	65 Å²	65	2%	0.017	31%	0.307	C	S	.	.			trans	-70.6	137.4	-177.3	0	0	0	0	0	111.9	Q65 F68 P69 P115 I117	Q65-A71 HydrophobicContact CB-CB 4.4Å; Q65-A71 PolarHBondContact NE2-O 2.79Å; F68-A71 HydrophobicContact CB-CB 4.03Å; F68-A71 WeakPolarHBondContact O-CB 2.99Å; F68-A71 PolarHBondContact O-N 3.25Å; P69-A71 VanDerWaalsContact C-N 3.34Å; A71-P115 VanDerWaalsContact CA-O 3.26Å; A71-P115 WeakPolarHBondContact CA-O 3.48Å; A71-P115 HydrophobicContact CB-CG 3.66Å; A71-I117 HydrophobicContact CB-CD1 3.84Å
72	L	97.8	Very high	94.5	Very high	70 Å²	70	71.7 Å²	71.7	37%	0.366	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128	170.8	-63.5	-176	0	0	0	110.1	F74 A108 I113 P115 I117	L72-F74 HydrophobicContact CB-CE2 3.97Å; L72-F74 HydrophobicContact CB-CZ 3.99Å; L72-F74 HydrophobicContact CD1-CZ 4.02Å; L72-A108 HydrophobicContact CD1-CB 4.25Å; L72-I113 HydrophobicContact CD1-CB 4.48Å; L72-I113 HydrophobicContact CD1-CG1 4.45Å; L72-I113 HydrophobicContact CD1-CG2 3.76Å; L72-I113 HydrophobicContact CG-CG2 3.86Å; L72-P115 PolarHBondContact N-O 3.48Å; L72-I117 PolarHBondContact O-N 3.47Å
73	I	98.1	Very high	94	Very high	28 Å²	28	72.7 Å²	72.7	14%	0.144	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.3	172.8	-56	171	0	0	0	108.5	A61 Q65 I117 D119	A61-I73 HydrophobicContact CB-CD1 3.92Å; A61-I73 HydrophobicContact CB-CG1 4.39Å; A61-I73 HydrophobicContact CB-CG2 4.22Å; Q65-I73 HydrophobicContact CB-CD1 3.86Å; Q65-I73 HydrophobicContact CB-CG1 4.31Å; Q65-I73 HydrophobicContact CG-CD1 4.39Å; I73-I117 CarbonylContact C-O 3.44Å; I73-I117 WeakPolarHBondContact CA-O 3.47Å; I73-I117 HydrophobicContact CG1-CB 4.2Å; I73-I117 HydrophobicContact CG1-CD1 3.98Å; I73-D119 HydrophobicContact CG2-CB 3.95Å
74	F	97.8	Very high	93.7	Very high	15 Å²	15	72.7 Å²	72.7	7%	0.066	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124.2	175.2	-67.8	-56.9	0	0	0	109.3	L72 N101 R104 A105 A108 I116 I117 I118 D119	L72-F74 HydrophobicContact CB-CE2 3.97Å; L72-F74 HydrophobicContact CB-CZ 3.99Å; L72-F74 HydrophobicContact CD1-CZ 4.02Å; F74-N101 WeakPolarHBondContact CB-OD1 3.35Å; F74-R104 HydrophobicContact CD1-CB 3.88Å; F74-R104 HydrophobicContact CE1-CB 3.78Å; F74-R104 HydrophobicContact CZ-CB 4.4Å; F74-A105 HydrophobicContact CD2-CB 4.11Å; F74-A108 HydrophobicContact CE2-CB 3.69Å; F74-A108 HydrophobicContact CZ-CB 3.79Å; F74-I116 HydrophobicContact CD2-CG2 3.65Å; F74-I116 HydrophobicContact CE2-CG2 3.85Å; F74-I117 PolarHBondContact N-O 3.3Å; F74-I118 HydrophobicContact CB-CD1 3.89Å; F74-I118 HydrophobicContact CD2-CD1 4.17Å; F74-I118 WeakPolarHBondContact O-CA 3.47Å; F74-D119 PolarHBondContact O-N 3.29Å
75	S	96.2	Very high	93.2	Very high	8 Å²	8	74.2 Å²	74.2	6%	0.056	37%	0.367	C	S	.	.			trans	-126.1	144.5	174.5	-172.6	0	0	0	0	110.5	D77 D78 N101 D119	S75-D77 PolarHBondContact OG-N 2.96Å; S75-D78 WeakPolarHBondContact O-CB 3.22Å; S75-D78 PolarHBondContact O-N 3.31Å; S75-N101 PolarHBondContact N-OD1 3.49Å; S75-N101 PolarHBondContact O-OD1 3.46Å; S75-D119 WeakPolarHBondContact CB-O 3.41Å; S75-D119 PolarHBondContact OG-O 3.42Å
76	T	93.9	Very high	92.8	Very high	8 Å²	8	73.8 Å²	73.8	5%	0.049	37%	0.373	C	S	.	.	S	Bend	trans	-67.4	-28.4	169.8	-66.7	0	0	0	0	111.2	D78 F79 L94 A97 H98 N120	T76-D78 PolarHBondContact O-N 2.95Å; T76-F79 WeakPolarHBondContact O-CB 3.5Å; T76-F79 PolarHBondContact O-N 3.05Å; T76-L94 HydrophobicContact CG2-CD1 4.2Å; T76-A97 HydrophobicContact CG2-CB 3.69Å; T76-H98 PolarHBondContact OG1-ND1 2.65Å; T76-N120 PolarHBondContact N-OD1 3.26Å; T76-N120 PolarHBondContact OG1-ND2 2.95Å
77	D	91.3	Very high	92.4	Very high	43 Å²	43	69.8 Å²	69.8	23%	0.23	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-64.6	-26.3	178	-74.5	-57	0	0	0	112.7	S75 F79 F80 F81 Y87	S75-D77 PolarHBondContact OG-N 2.96Å; D77-F79 PolarHBondContact O-N 3.46Å; D77-F79 VanDerWaalsContact O-N 3.07Å; D77-F80 PolarHBondContact O-N 3.24Å; D77-F81 VanDerWaalsContact O-CD2 3.25Å; D77-F81 WeakPolarHBondContact O-CD2 3.11Å; D77-Y87 HydrophobicContact CB-CE2 4.12Å; D77-Y87 PolarHBondContact OD1-OH 3.32Å
78	D	92.6	Very high	92.1	Very high	64 Å²	64	70.7 Å²	70.7	34%	0.342	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-54.4	-28.4	175.1	-69.4	-3.8	0	0	0	112.6	S75 T76 F80 W100 R104	S75-D78 WeakPolarHBondContact O-CB 3.22Å; S75-D78 PolarHBondContact O-N 3.31Å; T76-D78 PolarHBondContact O-N 2.95Å; D78-F80 VanDerWaalsContact C-N 3.27Å; D78-F80 PolarHBondContact O-N 3.46Å; D78-W100 HydrophobicContact CB-CH2 3.71Å; D78-W100 HydrophobicContact CB-CZ3 3.8Å; D78-R104 IonicContact OD2-CZ 3.81Å; D78-R104 IonicContact OD2-NH1 2.65Å; D78-R104 PolarHBondContact OD2-NH1 2.89Å; D78-R104 VanDerWaalsContact OD2-NH1 3.1Å; D78-R104 IonicContact OD2-NH2 3.56Å
79	F	92.5	Very high	91.8	Very high	54 Å²	54	70.3 Å²	70.3	24%	0.237	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-68.3	-27.3	-179.5	-174	-89.5	0	0	0	112.7	T76 D77 F93 E96 A97 W100	T76-F79 WeakPolarHBondContact O-CB 3.5Å; T76-F79 PolarHBondContact O-N 3.05Å; D77-F79 PolarHBondContact O-N 3.46Å; D77-F79 VanDerWaalsContact O-N 3.07Å; F79-F93 HydrophobicContact CE1-CB 3.9Å; F79-E96 HydrophobicContact CE2-CG 4.28Å; F79-E96 HydrophobicContact CZ-CG 4.04Å; F79-A97 HydrophobicContact CB-CB 3.69Å; F79-A97 HydrophobicContact CD1-CB 3.56Å; F79-A97 HydrophobicContact CD2-CB 4.19Å; F79-A97 HydrophobicContact CE1-CB 4.23Å; F79-A97 HydrophobicContact CG-CB 3.54Å; F79-W100 HydrophobicContact CB-CE3 3.97Å; F79-W100 HydrophobicContact CB-CH2 4.48Å; F79-W100 HydrophobicContact CB-CZ3 3.88Å; F79-W100 HydrophobicContact CD2-CB 4.03Å; F79-W100 AromaticContact CD2-CD2 3.83Å; F79-W100 HydrophobicContact CD2-CD2 3.83Å; F79-W100 AromaticContact CD2-CE3 3.96Å; F79-W100 HydrophobicContact CD2-CE3 3.96Å; F79-W100 AromaticContact CD2-CG 3.89Å; F79-W100 HydrophobicContact CD2-CG 3.89Å; F79-W100 HydrophobicContact CD2-CZ3 4.49Å; F79-W100 HydrophobicContact CE2-CB 4.24Å; F79-W100 HydrophobicContact CE2-CG 4.29Å; F79-W100 HydrophobicContact CG-CE3 4.46Å
80	F	91.8	Very high	91.6	Very high	12 Å²	12	67 Å²	67	5%	0.053	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-95.7	3.7	-173.8	-63.9	-71.7	0	0	0	113.3	D77 D78 Y87 E88 F89 N90 F93 L94 A97	D77-F80 PolarHBondContact O-N 3.24Å; D78-F80 VanDerWaalsContact C-N 3.27Å; D78-F80 PolarHBondContact O-N 3.46Å; F80-Y87 HydrophobicContact CB-CD2 4.08Å; F80-Y87 HydrophobicContact CB-CE2 3.75Å; F80-E88 WeakPolarHBondContact CD1-O 3.36Å; F80-E88 PolarHBondContact O-N 2.95Å; F80-F89 HydrophobicContact CD2-CD2 4.15Å; F80-F89 HydrophobicContact CE1-CD2 4.43Å; F80-F89 HydrophobicContact CE2-CD2 4.02Å; F80-F89 HydrophobicContact CE2-CE2 4.12Å; F80-F89 HydrophobicContact CG-CD2 4.4Å; F80-F89 HydrophobicContact CZ-CD2 4.16Å; F80-F89 HydrophobicContact CZ-CE2 4.17Å; F80-N90 WeakPolarHBondContact CE1-O 3.3Å; F80-F93 HydrophobicContact CE1-CB 4.16Å; F80-L94 HydrophobicContact CE2-CD1 4.21Å; F80-L94 HydrophobicContact CZ-CD1 4.32Å; F80-A97 HydrophobicContact CE2-CB 3.74Å; F80-A97 HydrophobicContact CZ-CB 3.8Å
81	F	90.1	Very high	91.4	Very high	94 Å²	94	59.6 Å²	59.6	41%	0.412	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-85.7	128.3	171	-73.8	-85.7	0	0	0	110.5	D77 Y87	D77-F81 VanDerWaalsContact O-CD2 3.25Å; D77-F81 WeakPolarHBondContact O-CD2 3.11Å; F81-Y87 HydrophobicContact CD1-CD2 4.41Å; F81-Y87 HydrophobicContact CD2-CD2 4.09Å; F81-Y87 HydrophobicContact CE1-CD2 4.09Å; F81-Y87 HydrophobicContact CE1-CG 4.48Å; F81-Y87 AromaticContact CE2-CD2 3.75Å; F81-Y87 HydrophobicContact CE2-CD2 3.75Å; F81-Y87 HydrophobicContact CE2-CE2 4.27Å; F81-Y87 HydrophobicContact CG-CD2 4.42Å; F81-Y87 AromaticContact CZ-CD2 3.75Å; F81-Y87 HydrophobicContact CZ-CD2 3.75Å; F81-Y87 HydrophobicContact CZ-CG 4.47Å
82	R	88.9	Confident	91.1	Very high	139 Å²	139	65.8 Å²	65.8	53%	0.525	34%	0.337	S	S	.	.			trans	-79.2	167	173.1	-67.4	-179.2	63.2	162.6	-5.2	111.1	D84 G85 A86 E88	R82-D84 WeakPolarHBondContact CB-OD1 3.4Å; R82-D84 PolarHBondContact O-N 3.02Å; R82-G85 PolarHBondContact O-N 3.49Å; R82-A86 PolarHBondContact N-O 3.38Å; R82-E88 WeakPolarHBondContact CD-OE2 3.25Å; R82-E88 IonicContact NH1-OE2 2.92Å; R82-E88 PolarHBondContact NH1-OE2 2.95Å; R82-E88 VanDerWaalsContact NH1-OE2 3.16Å
83	E	87.6	Confident	90.8	Very high	172 Å²	172	67 Å²	67	80%	0.804	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.9	178.8	-65.7	-177.6	164.1	0	0	113	G85 R237	E83-G85 VanDerWaalsContact C-N 3.28Å; E83-R237 VanDerWaalsContact CD-NH1 3.29Å; E83-R237 IonicContact OE1-CZ 3.2Å; E83-R237 IonicContact OE1-NH1 3.78Å; E83-R237 PolarHBondContact OE1-NH1 3.44Å; E83-R237 IonicContact OE2-NH1 2.86Å; E83-R237 PolarHBondContact OE2-NH1 2.96Å
84	D	89.3	Confident	90.4	Very high	113 Å²	113	66.6 Å²	66.6	60%	0.604	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	0.4	174.7	61.5	6.3	0	0	0	113.6	R82 A86	R82-D84 WeakPolarHBondContact CB-OD1 3.4Å; R82-D84 PolarHBondContact O-N 3.02Å; D84-A86 VanDerWaalsContact C-N 3.34Å; D84-A86 VanDerWaalsContact OD1-CB 3.3Å; D84-A86 WeakPolarHBondContact OD1-CB 3.36Å; D84-A86 PolarHBondContact OD1-N 3.32Å
85	G	85.8	Confident	90.1	Very high	49 Å²	49	71.3 Å²	71.3	51%	0.505	36%	0.359	S	S	.	.	S	Bend	trans	83.4	1.6	-178.7	0	0	0	0	0	114.9	R82 E83	R82-G85 PolarHBondContact O-N 3.49Å; E83-G85 VanDerWaalsContact C-N 3.28Å
86	A	87.9	Confident	90	Very high	46 Å²	46	75.8 Å²	75.8	38%	0.38	38%	0.379	S	S	.	.			trans	-72.8	135	175.8	0	0	0	0	0	111.4	R82 D84	R82-A86 PolarHBondContact N-O 3.38Å; D84-A86 VanDerWaalsContact C-N 3.34Å; D84-A86 VanDerWaalsContact OD1-CB 3.3Å; D84-A86 WeakPolarHBondContact OD1-CB 3.36Å; D84-A86 PolarHBondContact OD1-N 3.32Å
87	Y	87.8	Confident	90.1	Very high	68 Å²	68	75.4 Å²	75.4	27%	0.267	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-89.6	120.2	174.9	-178.9	-96.5	0	0	0	110.5	D77 F80 F81 F89 H164	D77-Y87 HydrophobicContact CB-CE2 4.12Å; D77-Y87 PolarHBondContact OD1-OH 3.32Å; F80-Y87 HydrophobicContact CB-CD2 4.08Å; F80-Y87 HydrophobicContact CB-CE2 3.75Å; F81-Y87 HydrophobicContact CD1-CD2 4.41Å; F81-Y87 HydrophobicContact CD2-CD2 4.09Å; F81-Y87 HydrophobicContact CE1-CD2 4.09Å; F81-Y87 HydrophobicContact CE1-CG 4.48Å; F81-Y87 AromaticContact CE2-CD2 3.75Å; F81-Y87 HydrophobicContact CE2-CD2 3.75Å; F81-Y87 HydrophobicContact CE2-CE2 4.27Å; F81-Y87 HydrophobicContact CG-CD2 4.42Å; F81-Y87 AromaticContact CZ-CD2 3.75Å; F81-Y87 HydrophobicContact CZ-CD2 3.75Å; F81-Y87 HydrophobicContact CZ-CG 4.47Å; Y87-F89 HydrophobicContact CE1-CB 3.71Å; Y87-H164 AromaticContact CD2-ND1 3.94Å; Y87-H164 HydrophobicContact CE1-CB 4.07Å; Y87-H164 AromaticContact CE1-ND1 3.69Å; Y87-H164 AromaticContact CE2-ND1 3.6Å; Y87-H164 AromaticContact CZ-ND1 3.47Å
88	E	89.1	Confident	90.2	Very high	110 Å²	110	76 Å²	76	51%	0.514	38%	0.378	S	S	.	.			trans	-128.9	88.6	-179.1	-169.9	173.6	167.9	0	0	110.2	F80 R82 N90	F80-E88 WeakPolarHBondContact CD1-O 3.36Å; F80-E88 PolarHBondContact O-N 2.95Å; R82-E88 WeakPolarHBondContact CD-OE2 3.25Å; R82-E88 IonicContact NH1-OE2 2.92Å; R82-E88 PolarHBondContact NH1-OE2 2.95Å; R82-E88 VanDerWaalsContact NH1-OE2 3.16Å; E88-N90 PolarHBondContact O-N 3.3Å
89	F	88.4	Confident	90.3	Very high	72 Å²	72	77.3 Å²	77.3	32%	0.316	38%	0.382	S	S	.	.			trans	-70.2	120	177.8	179.2	-97.6	0	0	0	110.9	F80 Y87 P91 L94 Y217	F80-F89 HydrophobicContact CD2-CD2 4.15Å; F80-F89 HydrophobicContact CE1-CD2 4.43Å; F80-F89 HydrophobicContact CE2-CD2 4.02Å; F80-F89 HydrophobicContact CE2-CE2 4.12Å; F80-F89 HydrophobicContact CG-CD2 4.4Å; F80-F89 HydrophobicContact CZ-CD2 4.16Å; F80-F89 HydrophobicContact CZ-CE2 4.17Å; Y87-F89 HydrophobicContact CE1-CB 3.71Å; F89-P91 HydrophobicContact CE1-CB 3.99Å; F89-P91 HydrophobicContact CZ-CB 4.32Å; F89-L94 HydrophobicContact CE2-CD1 4.21Å; F89-Y217 HydrophobicContact CE1-CD1 4.41Å; F89-Y217 AromaticContact CZ-CD1 3.91Å; F89-Y217 HydrophobicContact CZ-CD1 3.91Å; F89-Y217 HydrophobicContact CZ-CG 4.43Å
90	N	88.4	Confident	90.6	Very high	52 Å²	52	78.8 Å²	78.8	28%	0.278	39%	0.386	S	S	.	.			trans	-121.2	116.5	170.1	-175.4	-20.9	0	0	0	110.4	F80 E88 D92 F93	F80-N90 WeakPolarHBondContact CE1-O 3.3Å; E88-N90 PolarHBondContact O-N 3.3Å; N90-D92 VanDerWaalsContact C-N 3.26Å; N90-D92 PolarHBondContact O-N 2.78Å; N90-D92 WeakPolarHBondContact OD1-CB 3.49Å; N90-D92 PolarHBondContact OD1-N 2.84Å; N90-F93 HydrophobicContact CB-CD2 3.81Å; N90-F93 HydrophobicContact CB-CE2 4.49Å; N90-F93 WeakPolarHBondContact ND2-CD2 3.42Å; N90-F93 WeakPolarHBondContact ND2-CE2 3.33Å; N90-F93 PolarHBondContact O-N 2.92Å
91	P	86.9	Confident	90.8	Very high	33 Å²	33	78.2 Å²	78.2	21%	0.214	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-63.4	-28	-177.4	28.9	-38.8	0	0	0	115	F89 F93 L94 Y217 T218	F89-P91 HydrophobicContact CE1-CB 3.99Å; F89-P91 HydrophobicContact CZ-CB 4.32Å; P91-F93 PolarHBondContact O-N 2.85Å; P91-L94 VanDerWaalsContact O-CB 3.27Å; P91-L94 WeakPolarHBondContact O-CB 3.31Å; P91-L94 PolarHBondContact O-N 2.78Å; P91-L94 VanDerWaalsContact O-N 3.1Å; P91-Y217 VanDerWaalsContact CB-CB 3.41Å; P91-Y217 WeakPolarHBondContact CB-O 3.4Å; P91-Y217 WeakPolarHBondContact CG-O 3.31Å; P91-T218 HydrophobicContact CG-CG2 3.88Å
92	D	91	Very high	91.2	Very high	132 Å²	132	75.7 Å²	75.7	71%	0.706	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-65.7	-25.6	-178.6	-63.6	-28.8	0	0	0	111.4	N90	N90-D92 VanDerWaalsContact C-N 3.26Å; N90-D92 PolarHBondContact O-N 2.78Å; N90-D92 WeakPolarHBondContact OD1-CB 3.49Å; N90-D92 PolarHBondContact OD1-N 2.84Å
93	F	91.6	Very high	91.6	Very high	96 Å²	96	74.8 Å²	74.8	42%	0.421	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-95.8	3.9	177.7	-64.2	-80.6	0	0	0	113.6	F79 F80 N90 P91 E95 E96 A97	F79-F93 HydrophobicContact CE1-CB 3.9Å; F80-F93 HydrophobicContact CE1-CB 4.16Å; N90-F93 HydrophobicContact CB-CD2 3.81Å; N90-F93 HydrophobicContact CB-CE2 4.49Å; N90-F93 WeakPolarHBondContact ND2-CD2 3.42Å; N90-F93 WeakPolarHBondContact ND2-CE2 3.33Å; N90-F93 PolarHBondContact O-N 2.92Å; P91-F93 PolarHBondContact O-N 2.85Å; F93-E95 VanDerWaalsContact C-N 3.34Å; F93-E95 PolarHBondContact O-N 2.99Å; F93-E96 WeakPolarHBondContact CD1-OE2 3.46Å; F93-E96 PolarHBondContact O-N 2.89Å; F93-A97 WeakPolarHBondContact O-CB 3.27Å; F93-A97 PolarHBondContact O-N 3.43Å
94	L	90.1	Very high	92.1	Very high	18 Å²	18	70.3 Å²	70.3	9%	0.094	35%	0.349	C	S	.	.	H	α-helix	trans	-65.1	-37.6	-174.4	-176.9	63.1	0	0	0	113.1	T76 F80 F89 P91 A97 H98 Y217	T76-L94 HydrophobicContact CG2-CD1 4.2Å; F80-L94 HydrophobicContact CE2-CD1 4.21Å; F80-L94 HydrophobicContact CZ-CD1 4.32Å; F89-L94 HydrophobicContact CE2-CD1 4.21Å; P91-L94 VanDerWaalsContact O-CB 3.27Å; P91-L94 WeakPolarHBondContact O-CB 3.31Å; P91-L94 PolarHBondContact O-N 2.78Å; P91-L94 VanDerWaalsContact O-N 3.1Å; L94-A97 PolarHBondContact O-N 2.87Å; L94-H98 PolarHBondContact O-CD2 2.76Å; L94-H98 PolarHBondContact O-N 3.44Å; L94-Y217 HydrophobicContact CD2-CD1 4.03Å; L94-Y217 HydrophobicContact CD2-CD2 3.33Å; L94-Y217 HydrophobicContact CD2-CE1 3.76Å; L94-Y217 HydrophobicContact CD2-CE2 3.06Å; L94-Y217 HydrophobicContact CD2-CG 3.85Å
95	E	91	Very high	92.6	Very high	114 Å²	114	64.9 Å²	64.9	53%	0.533	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-45.2	175.7	-176.2	155.7	-144.4	0	0	110.9	F93 A97 H98 E99	F93-E95 VanDerWaalsContact C-N 3.34Å; F93-E95 PolarHBondContact O-N 2.99Å; E95-A97 PolarHBondContact O-N 3.1Å; E95-H98 PolarHBondContact O-N 3.29Å; E95-E99 PolarHBondContact O-N 3.19Å
96	E	94.4	Very high	93.1	Very high	102 Å²	102	67.7 Å²	67.7	48%	0.477	32%	0.315	S	S	.	.	H	α-helix	trans	-61.6	-43.4	174.9	-173.6	179.4	171.3	0	0	112	F79 F93 H98 E99 W100	F79-E96 HydrophobicContact CE2-CG 4.28Å; F79-E96 HydrophobicContact CZ-CG 4.04Å; F93-E96 WeakPolarHBondContact CD1-OE2 3.46Å; F93-E96 PolarHBondContact O-N 2.89Å; E96-H98 VanDerWaalsContact C-N 3.3Å; E96-H98 PolarHBondContact O-N 3.32Å; E96-E99 PolarHBondContact O-N 3.02Å; E96-W100 VanDerWaalsContact O-CB 3.31Å; E96-W100 WeakPolarHBondContact O-CB 3.47Å; E96-W100 PolarHBondContact O-N 3.38Å
97	A	94.6	Very high	93.6	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-60.4	-40.4	177.3	0	0	0	0	0	111.7	T76 F79 F80 F93 L94 E95 N101	T76-A97 HydrophobicContact CG2-CB 3.69Å; F79-A97 HydrophobicContact CB-CB 3.69Å; F79-A97 HydrophobicContact CD1-CB 3.56Å; F79-A97 HydrophobicContact CD2-CB 4.19Å; F79-A97 HydrophobicContact CE1-CB 4.23Å; F79-A97 HydrophobicContact CG-CB 3.54Å; F80-A97 HydrophobicContact CE2-CB 3.74Å; F80-A97 HydrophobicContact CZ-CB 3.8Å; F93-A97 WeakPolarHBondContact O-CB 3.27Å; F93-A97 PolarHBondContact O-N 3.43Å; L94-A97 PolarHBondContact O-N 2.87Å; E95-A97 PolarHBondContact O-N 3.1Å; A97-N101 WeakPolarHBondContact O-CB 3.36Å; A97-N101 PolarHBondContact O-N 3.16Å
98	H	94.2	Very high	94.1	Very high	57 Å²	57	69.4 Å²	69.4	26%	0.264	32%	0.317	S	S	.	.	H	α-helix	trans	-65	-46.8	173.5	-77.6	-52.1	0	0	0	112.1	T76 L94 E95 E96 W100 N101 Q102	T76-H98 PolarHBondContact OG1-ND1 2.65Å; L94-H98 PolarHBondContact O-CD2 2.76Å; L94-H98 PolarHBondContact O-N 3.44Å; E95-H98 PolarHBondContact O-N 3.29Å; E96-H98 VanDerWaalsContact C-N 3.3Å; E96-H98 PolarHBondContact O-N 3.32Å; H98-W100 VanDerWaalsContact C-N 3.32Å; H98-W100 PolarHBondContact O-N 3.48Å; H98-N101 PolarHBondContact O-N 3.32Å; H98-Q102 WeakPolarHBondContact O-CB 3.49Å; H98-Q102 VanDerWaalsContact O-CG 3.23Å; H98-Q102 WeakPolarHBondContact O-CG 3.49Å; H98-Q102 PolarHBondContact O-N 2.82Å
99	E	95.6	Very high	94.5	Very high	90 Å²	90	64.1 Å²	64.1	42%	0.421	29%	0.292	S	S	.	.	H	α-helix	trans	-60.4	-42.7	176.8	-73	-170.2	-175.3	0	0	112.4	E95 E96 Q102 K103	E95-E99 PolarHBondContact O-N 3.19Å; E96-E99 PolarHBondContact O-N 3.02Å; E99-Q102 PolarHBondContact O-N 3.09Å; E99-K103 WeakPolarHBondContact O-CB 3.12Å; E99-K103 VanDerWaalsContact O-CG 3.27Å; E99-K103 WeakPolarHBondContact O-CG 3.15Å; E99-K103 PolarHBondContact O-N 3.29Å; E99-K103 IonicContact OE2-NZ 3.81Å; E99-K103 PolarHBondContact OE2-NZ 3.4Å
100	W	97	Very high	94.9	Very high	85 Å²	85	69.6 Å²	69.6	32%	0.322	31%	0.311	S	S	.	.	H	α-helix	trans	-60.2	-46.3	177.4	173.2	87.9	0	0	0	111.3	D78 F79 E96 H98 Q102 K103 R104	D78-W100 HydrophobicContact CB-CH2 3.71Å; D78-W100 HydrophobicContact CB-CZ3 3.8Å; F79-W100 HydrophobicContact CB-CE3 3.97Å; F79-W100 HydrophobicContact CB-CH2 4.48Å; F79-W100 HydrophobicContact CB-CZ3 3.88Å; F79-W100 HydrophobicContact CD2-CB 4.03Å; F79-W100 AromaticContact CD2-CD2 3.83Å; F79-W100 HydrophobicContact CD2-CD2 3.83Å; F79-W100 AromaticContact CD2-CE3 3.96Å; F79-W100 HydrophobicContact CD2-CE3 3.96Å; F79-W100 AromaticContact CD2-CG 3.89Å; F79-W100 HydrophobicContact CD2-CG 3.89Å; F79-W100 HydrophobicContact CD2-CZ3 4.49Å; F79-W100 HydrophobicContact CE2-CB 4.24Å; F79-W100 HydrophobicContact CE2-CG 4.29Å; F79-W100 HydrophobicContact CG-CE3 4.46Å; E96-W100 VanDerWaalsContact O-CB 3.31Å; E96-W100 WeakPolarHBondContact O-CB 3.47Å; E96-W100 PolarHBondContact O-N 3.38Å; H98-W100 VanDerWaalsContact C-N 3.32Å; H98-W100 PolarHBondContact O-N 3.48Å; W100-Q102 PolarHBondContact O-N 3.28Å; W100-K103 PolarHBondContact O-N 2.88Å; W100-R104 VanDerWaalsContact CZ3-NH1 3.32Å; W100-R104 PolarHBondContact O-N 3.2Å; W100-R104 VanDerWaalsContact O-N 3.09Å
101	N	97.8	Very high	95.3	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-41.5	177.7	-161.2	43	0	0	0	111.9	F74 S75 A97 H98 K103 R104 A105 Y131	F74-N101 WeakPolarHBondContact CB-OD1 3.35Å; S75-N101 PolarHBondContact N-OD1 3.49Å; S75-N101 PolarHBondContact O-OD1 3.46Å; A97-N101 WeakPolarHBondContact O-CB 3.36Å; A97-N101 PolarHBondContact O-N 3.16Å; H98-N101 PolarHBondContact O-N 3.32Å; N101-K103 PolarHBondContact O-N 2.87Å; N101-R104 PolarHBondContact O-N 2.98Å; N101-A105 PolarHBondContact O-N 3.27Å; N101-Y131 PolarHBondContact ND2-OH 3.04Å
102	Q	97.6	Very high	95.7	Very high	42 Å²	42	72.3 Å²	72.3	20%	0.196	33%	0.331	C	S	.	.	H	α-helix	trans	-61.4	-41.5	175.2	-70.9	170.8	31.9	0	0	112	H98 E99 W100 R104 A105 R106 P130 Y131 M134	H98-Q102 WeakPolarHBondContact O-CB 3.49Å; H98-Q102 VanDerWaalsContact O-CG 3.23Å; H98-Q102 WeakPolarHBondContact O-CG 3.49Å; H98-Q102 PolarHBondContact O-N 2.82Å; E99-Q102 PolarHBondContact O-N 3.09Å; W100-Q102 PolarHBondContact O-N 3.28Å; Q102-R104 PolarHBondContact O-N 3.49Å; Q102-A105 PolarHBondContact O-N 2.8Å; Q102-R106 WeakPolarHBondContact O-CB 3.23Å; Q102-R106 PolarHBondContact O-N 3.22Å; Q102-P130 HydrophobicContact CG-CB 4.29Å; Q102-Y131 HydrophobicContact CG-CE1 4.02Å; Q102-Y131 HydrophobicContact CG-CE2 4.34Å; Q102-M134 HydrophobicContact CB-CE 4.28Å; Q102-M134 HydrophobicContact CG-CE 4.5Å
103	K	98	Very high	96	Very high	120 Å²	120	68.1 Å²	68.1	52%	0.522	31%	0.308	S	S	.	.	H	α-helix	trans	-61.1	-43.1	176	-74	165.5	-171.6	161.7	0	111.4	E99 W100 N101 K107	E99-K103 WeakPolarHBondContact O-CB 3.12Å; E99-K103 VanDerWaalsContact O-CG 3.27Å; E99-K103 WeakPolarHBondContact O-CG 3.15Å; E99-K103 PolarHBondContact O-N 3.29Å; E99-K103 IonicContact OE2-NZ 3.81Å; E99-K103 PolarHBondContact OE2-NZ 3.4Å; W100-K103 PolarHBondContact O-N 2.88Å; N101-K103 PolarHBondContact O-N 2.87Å; K103-K107 WeakPolarHBondContact O-CB 3.44Å; K103-K107 PolarHBondContact O-N 3.18Å
104	R	98.3	Very high	96.2	Very high	77 Å²	77	65 Å²	65	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-50.3	175.5	-72	175.5	60.7	-174	-3	111.6	F74 D78 W100 N101 Q102 R106 K107 A108	F74-R104 HydrophobicContact CD1-CB 3.88Å; F74-R104 HydrophobicContact CE1-CB 3.78Å; F74-R104 HydrophobicContact CZ-CB 4.4Å; D78-R104 IonicContact OD2-CZ 3.81Å; D78-R104 IonicContact OD2-NH1 2.65Å; D78-R104 PolarHBondContact OD2-NH1 2.89Å; D78-R104 VanDerWaalsContact OD2-NH1 3.1Å; D78-R104 IonicContact OD2-NH2 3.56Å; W100-R104 VanDerWaalsContact CZ3-NH1 3.32Å; W100-R104 PolarHBondContact O-N 3.2Å; W100-R104 VanDerWaalsContact O-N 3.09Å; N101-R104 PolarHBondContact O-N 2.98Å; Q102-R104 PolarHBondContact O-N 3.49Å; R104-R106 PolarHBondContact O-N 3.27Å; R104-K107 PolarHBondContact O-N 3.45Å; R104-A108 PolarHBondContact O-N 3.41Å
105	A	98.1	Very high	96.5	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-44.9	178.6	0	0	0	0	0	111.9	F74 N101 Q102 K107 A108 M109 I118 Y131	F74-A105 HydrophobicContact CD2-CB 4.11Å; N101-A105 PolarHBondContact O-N 3.27Å; Q102-A105 PolarHBondContact O-N 2.8Å; A105-K107 PolarHBondContact O-N 3.03Å; A105-A108 PolarHBondContact O-N 2.7Å; A105-M109 HydrophobicContact CB-CE 4.49Å; A105-M109 WeakPolarHBondContact O-CG 3.28Å; A105-M109 PolarHBondContact O-N 3.22Å; A105-I118 HydrophobicContact CB-CD1 3.91Å; A105-Y131 HydrophobicContact CB-CD1 3.91Å; A105-Y131 HydrophobicContact CB-CE1 3.77Å
106	R	98.2	Very high	96.9	Very high	107 Å²	107	59 Å²	59	40%	0.404	27%	0.27	S	S	.	.	H	α-helix	trans	-56.6	-48.2	176.2	-167.2	177.3	-63.1	162.1	1.9	111.9	Q102 R104 A108 M109 R110 M134	Q102-R106 WeakPolarHBondContact O-CB 3.23Å; Q102-R106 PolarHBondContact O-N 3.22Å; R104-R106 PolarHBondContact O-N 3.27Å; R106-A108 VanDerWaalsContact C-N 3.34Å; R106-A108 PolarHBondContact O-N 2.99Å; R106-M109 PolarHBondContact O-N 2.9Å; R106-R110 WeakPolarHBondContact O-CG 3.47Å; R106-R110 PolarHBondContact O-N 3.3Å; R106-M134 HydrophobicContact CB-SD 3.49Å; R106-M134 WeakPolarHBondContact CB-SD 3.38Å; R106-M134 HydrophobicContact CG-CG 4.46Å; R106-M134 HydrophobicContact CG-SD 3.78Å; R106-M134 PolarHBondContact NE-SD 3.23Å
107	K	98.3	Very high	97.1	Very high	144 Å²	144	54.2 Å²	54.2	63%	0.626	25%	0.248	S	C	*	.	H	α-helix	trans	-60.5	-45.5	179.8	-175.4	179.4	178.7	-177.8	0	110.7	K103 R104 A105 R110 N111	K103-K107 WeakPolarHBondContact O-CB 3.44Å; K103-K107 PolarHBondContact O-N 3.18Å; R104-K107 PolarHBondContact O-N 3.45Å; A105-K107 PolarHBondContact O-N 3.03Å; K107-R110 PolarHBondContact O-N 2.93Å; K107-N111 WeakPolarHBondContact O-CB 3.33Å; K107-N111 PolarHBondContact O-N 3.02Å; K107-N111 PolarHBondContact O-OD1 2.9Å
108	A	97.9	Very high	97.2	Very high	6 Å²	6	54.2 Å²	54.2	5%	0.05	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-42.3	176.8	0	0	0	0	0	112.2	L72 F74 R104 A105 R106 N111 G112 I113 I116	L72-A108 HydrophobicContact CD1-CB 4.25Å; F74-A108 HydrophobicContact CE2-CB 3.69Å; F74-A108 HydrophobicContact CZ-CB 3.79Å; R104-A108 PolarHBondContact O-N 3.41Å; A105-A108 PolarHBondContact O-N 2.7Å; R106-A108 VanDerWaalsContact C-N 3.34Å; R106-A108 PolarHBondContact O-N 2.99Å; A108-N111 PolarHBondContact O-N 2.91Å; A108-G112 PolarHBondContact O-N 3.01Å; A108-I113 HydrophobicContact CB-CB 4.37Å; A108-I113 HydrophobicContact CB-CG1 4.49Å; A108-I113 PolarHBondContact O-N 3.2Å; A108-I113 VanDerWaalsContact O-N 3.11Å; A108-I116 HydrophobicContact CB-CD1 3.62Å; A108-I116 HydrophobicContact CB-CG1 4.26Å
109	M	97.4	Very high	97.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-46.1	178.2	-73.5	176	-167.9	0	0	112.4	L46 A105 R106 N111 G112 I116 M134 N138 Y140	L46-M109 HydrophobicContact CB-CE 4.47Å; L46-M109 HydrophobicContact CD1-CE 3.48Å; L46-M109 VanDerWaalsContact CD1-CE 3.48Å; L46-M109 HydrophobicContact CD2-CE 3.51Å; L46-M109 HydrophobicContact CG-CE 3.99Å; A105-M109 HydrophobicContact CB-CE 4.49Å; A105-M109 WeakPolarHBondContact O-CG 3.28Å; A105-M109 PolarHBondContact O-N 3.22Å; R106-M109 PolarHBondContact O-N 2.9Å; M109-N111 VanDerWaalsContact C-N 3.26Å; M109-N111 PolarHBondContact O-N 2.82Å; M109-G112 WeakPolarHBondContact O-CA 3.4Å; M109-G112 PolarHBondContact O-N 3.07Å; M109-I116 HydrophobicContact CB-CD1 4.21Å; M109-I116 HydrophobicContact CE-CD1 4.43Å; M109-I116 HydrophobicContact CE-CG2 4.44Å; M109-I116 HydrophobicContact CG-CD1 3.4Å; M109-M134 HydrophobicContact SD-CB 3.65Å; M109-N138 HydrophobicContact CB-CB 4.16Å; M109-Y140 WeakPolarHBondContact CA-OH 3.36Å; M109-Y140 HydrophobicContact CB-CD2 4.47Å; M109-Y140 HydrophobicContact CB-CE2 3.88Å; M109-Y140 HydrophobicContact CG-CD2 4.37Å; M109-Y140 HydrophobicContact CG-CE1 4.36Å; M109-Y140 HydrophobicContact CG-CE2 4.05Å; M109-Y140 WeakPolarHBondContact O-CE2 3.45Å; M109-Y140 PolarHBondContact O-OH 3.14Å; M109-Y140 VanDerWaalsContact O-OH 3.04Å
110	R	97.1	Very high	97.3	Very high	187 Å²	187	48 Å²	48	71%	0.706	22%	0.219	S	C	*	.	H	α-helix	trans	-61.7	-34.8	176.6	-71.7	179.1	78.4	170.9	6.7	112.3	R106 K107 G112 N138	R106-R110 WeakPolarHBondContact O-CG 3.47Å; R106-R110 PolarHBondContact O-N 3.3Å; K107-R110 PolarHBondContact O-N 2.93Å; R110-G112 PolarHBondContact O-N 2.75Å; R110-N138 WeakPolarHBondContact CA-OD1 3.04Å
111	N	96.6	Very high	97.1	Very high	109 Å²	109	45.7 Å²	45.7	58%	0.583	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	0.2	174.6	-68.1	-2	0	0	0	113.3	K107 A108 M109 I113	K107-N111 WeakPolarHBondContact O-CB 3.33Å; K107-N111 PolarHBondContact O-N 3.02Å; K107-N111 PolarHBondContact O-OD1 2.9Å; A108-N111 PolarHBondContact O-N 2.91Å; M109-N111 VanDerWaalsContact C-N 3.26Å; M109-N111 PolarHBondContact O-N 2.82Å; N111-I113 VanDerWaalsContact C-N 3.3Å; N111-I113 HydrophobicContact CB-CG1 4.18Å; N111-I113 PolarHBondContact O-N 2.88Å
112	G	95.6	Very high	96.9	Very high	32 Å²	32	45.9 Å²	45.9	33%	0.33	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	17.5	178	0	0	0	0	0	114.7	A108 M109 R110 S114 Y140	A108-G112 PolarHBondContact O-N 3.01Å; M109-G112 WeakPolarHBondContact O-CA 3.4Å; M109-G112 PolarHBondContact O-N 3.07Å; R110-G112 PolarHBondContact O-N 2.75Å; G112-S114 PolarHBondContact O-N 3.2Å; G112-Y140 WeakPolarHBondContact CA-OH 3.48Å
113	I	96.6	Very high	96.7	Very high	44 Å²	44	44.1 Å²	44.1	23%	0.226	21%	0.208	C	C	.	.			trans	-69.2	126.4	179.2	-56.9	-60.9	0	0	0	110.4	L72 A108 N111 I116 Y140	L72-I113 HydrophobicContact CD1-CB 4.48Å; L72-I113 HydrophobicContact CD1-CG1 4.45Å; L72-I113 HydrophobicContact CD1-CG2 3.76Å; L72-I113 HydrophobicContact CG-CG2 3.86Å; A108-I113 HydrophobicContact CB-CB 4.37Å; A108-I113 HydrophobicContact CB-CG1 4.49Å; A108-I113 PolarHBondContact O-N 3.2Å; A108-I113 VanDerWaalsContact O-N 3.11Å; N111-I113 VanDerWaalsContact C-N 3.3Å; N111-I113 HydrophobicContact CB-CG1 4.18Å; N111-I113 PolarHBondContact O-N 2.88Å; I113-I116 WeakPolarHBondContact O-CD1 3.19Å; I113-I116 WeakPolarHBondContact O-CG1 3.37Å; I113-Y140 PolarHBondContact N-OH 2.99Å; I113-Y140 VanDerWaalsContact O-CE1 3.24Å; I113-Y140 WeakPolarHBondContact O-CE1 3.36Å; I113-Y140 PolarHBondContact O-OH 3.02Å
114	S	96.1	Very high	96.5	Very high	31 Å²	31	39.8 Å²	39.8	22%	0.217	19%	0.189	C	C	.	.	S	Bend	trans	-142.5	139.2	178.3	176.6	0	0	0	0	111.4	K44 H45 G112	K44-S114 WeakPolarHBondContact CA-OG 3.37Å; H45-S114 PolarHBondContact N-OG 3.05Å; G112-S114 PolarHBondContact O-N 3.2Å
115	P	96.7	Very high	96.4	Very high	7 Å²	7	36.4 Å²	36.4	5%	0.045	18%	0.177	C	C	.	.			cis	-81	158.8	-3.7	32.4	-32.7	0	0	0	113	H45 Y47 F68 A71 L72	H45-P115 HydrophobicContact CB-CB 4.12Å; H45-P115 VanDerWaalsContact O-CA 3.27Å; H45-P115 WeakPolarHBondContact O-CA 3.42Å; Y47-P115 HydrophobicContact CD2-CB 3.85Å; Y47-P115 HydrophobicContact CE2-CB 3.63Å; Y47-P115 HydrophobicContact CE2-CG 4.26Å; F68-P115 HydrophobicContact CB-CG 3.62Å; F68-P115 HydrophobicContact CD2-CG 3.92Å; F68-P115 HydrophobicContact CG-CG 3.77Å; A71-P115 VanDerWaalsContact CA-O 3.26Å; A71-P115 WeakPolarHBondContact CA-O 3.48Å; A71-P115 HydrophobicContact CB-CG 3.66Å; L72-P115 PolarHBondContact N-O 3.48Å
116	I	98.3	Very high	96.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	136.9	168.4	-68.5	166.5	0	0	0	108.1	H45 L46 Y47 F74 A108 M109 I113 I118 Y140	H45-I116 PolarHBondContact O-N 3.19Å; L46-I116 CarbonylContact C-O 3.1Å; L46-I116 WeakPolarHBondContact CA-O 3.46Å; L46-I116 HydrophobicContact CD1-CB 3.96Å; L46-I116 HydrophobicContact CD1-CG2 3.74Å; Y47-I116 PolarHBondContact N-O 3.39Å; F74-I116 HydrophobicContact CD2-CG2 3.65Å; F74-I116 HydrophobicContact CE2-CG2 3.85Å; A108-I116 HydrophobicContact CB-CD1 3.62Å; A108-I116 HydrophobicContact CB-CG1 4.26Å; M109-I116 HydrophobicContact CB-CD1 4.21Å; M109-I116 HydrophobicContact CE-CD1 4.43Å; M109-I116 HydrophobicContact CE-CG2 4.44Å; M109-I116 HydrophobicContact CG-CD1 3.4Å; I113-I116 WeakPolarHBondContact O-CD1 3.19Å; I113-I116 WeakPolarHBondContact O-CG1 3.37Å; I116-I118 HydrophobicContact CG2-CD1 3.97Å; I116-Y140 HydrophobicContact CD1-CE1 4.05Å
117	I	98.6	Very high	96.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	123.3	-178	-56.9	159.6	0	0	0	108.4	Y47 L49 A61 L64 A71 L72 I73 F74	Y47-I117 HydrophobicContact CD2-CG1 4.2Å; Y47-I117 WeakPolarHBondContact O-CA 3.35Å; L49-I117 HydrophobicContact CD1-CG2 3.92Å; L49-I117 HydrophobicContact CD2-CG2 4.34Å; L49-I117 HydrophobicContact CG-CG2 3.95Å; A61-I117 HydrophobicContact CB-CG2 4.05Å; L64-I117 HydrophobicContact CB-CD1 3.6Å; L64-I117 HydrophobicContact CB-CG1 4.44Å; L64-I117 HydrophobicContact CD1-CD1 4.43Å; L64-I117 HydrophobicContact CD1-CG1 4.48Å; A71-I117 HydrophobicContact CB-CD1 3.84Å; L72-I117 PolarHBondContact O-N 3.47Å; I73-I117 CarbonylContact C-O 3.44Å; I73-I117 WeakPolarHBondContact CA-O 3.47Å; I73-I117 HydrophobicContact CG1-CB 4.2Å; I73-I117 HydrophobicContact CG1-CD1 3.98Å; F74-I117 PolarHBondContact N-O 3.3Å
118	I	98.4	Very high	96.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	104.6	173.8	-51.1	-55.5	0	0	0	108.4	L46 Y47 L48 L49 F74 A105 I116 N120 Y131	L46-I118 HydrophobicContact CD1-CD1 4.31Å; L46-I118 HydrophobicContact CD1-CG1 3.82Å; Y47-I118 PolarHBondContact O-N 3.06Å; L48-I118 HydrophobicContact CD2-CB 3.72Å; L48-I118 HydrophobicContact CD2-CG1 3.51Å; L48-I118 HydrophobicContact CD2-CG2 4.43Å; L49-I118 WeakPolarHBondContact CB-O 3.41Å; L49-I118 PolarHBondContact N-O 3.13Å; F74-I118 HydrophobicContact CB-CD1 3.89Å; F74-I118 HydrophobicContact CD2-CD1 4.17Å; F74-I118 WeakPolarHBondContact O-CA 3.47Å; A105-I118 HydrophobicContact CB-CD1 3.91Å; I116-I118 HydrophobicContact CG2-CD1 3.97Å; I118-N120 HydrophobicContact CG2-CB 4.23Å; I118-N120 PolarHBondContact O-N 3.45Å; I118-Y131 HydrophobicContact CD1-CD1 3.81Å; I118-Y131 HydrophobicContact CD1-CE1 3.75Å; I118-Y131 HydrophobicContact CG1-CD1 3.86Å; I118-Y131 HydrophobicContact CG1-CE1 4.1Å; I118-Y131 HydrophobicContact CG1-CG 4.17Å; I118-Y131 HydrophobicContact CG2-CD2 4.36Å; I118-Y131 HydrophobicContact CG2-CE1 4.2Å; I118-Y131 HydrophobicContact CG2-CE2 3.99Å
119	D	96.9	Very high	96.1	Very high	7 Å²	7	31.4 Å²	31.4	4%	0.037	16%	0.156	C	C	.	.			trans	-93.3	68.9	179.7	-175	24.6	0	0	0	111	L49 K57 T58 A61 I73 F74 S75	L49-D119 HydrophobicContact CD1-CB 4.14Å; K57-D119 WeakPolarHBondContact CB-OD1 3.23Å; T58-D119 WeakPolarHBondContact CA-OD2 3.39Å; T58-D119 VanDerWaalsContact CB-OD2 3.23Å; T58-D119 WeakPolarHBondContact CB-OD2 3.24Å; T58-D119 PolarHBondContact OG1-OD2 3.47Å; A61-D119 HydrophobicContact CB-CB 4.09Å; I73-D119 HydrophobicContact CG2-CB 3.95Å; F74-D119 PolarHBondContact O-N 3.29Å; S75-D119 WeakPolarHBondContact CB-O 3.41Å; S75-D119 PolarHBondContact OG-O 3.42Å
120	N	94.9	Very high	96.2	Very high	9 Å²	9	33.4 Å²	33.4	5%	0.048	17%	0.169	C	C	.	.	S	Bend	trans	-115	168.7	175.1	-77.7	1.7	0	0	0	110.3	K57 T76 I118	K57-N120 VanDerWaalsContact CD-O 3.28Å; K57-N120 WeakPolarHBondContact CD-O 3.27Å; K57-N120 WeakPolarHBondContact CE-O 3.37Å; T76-N120 PolarHBondContact N-OD1 3.26Å; T76-N120 PolarHBondContact OG1-ND2 2.95Å; I118-N120 HydrophobicContact CG2-CB 4.23Å; I118-N120 PolarHBondContact O-N 3.45Å
121	T	90.9	Very high	96.2	Very high	38 Å²	38	24.6 Å²	24.6	23%	0.233	14%	0.136	C	C	.	.			trans	-66.5	-39.5	176.4	47.3	0	0	0	0	113	G51 P53 L123 M174	G51-T121 PolarHBondContact N-O 3.41Å; G51-T121 WeakPolarHBondContact O-CA 3.19Å; P53-T121 HydrophobicContact CG-CG2 4.25Å; T121-L123 VanDerWaalsContact C-N 3.35Å; T121-L123 PolarHBondContact O-N 3.38Å; T121-M174 HydrophobicContact CG2-CE 4.05Å
122	N	93.8	Very high	96.3	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.016	11%	0.108	C	C	.	.			trans	44	57.3	176.7	-67.4	-28.5	0	0	0	112.6	L49 R50 H124 E127 M128	L49-N122 WeakPolarHBondContact O-CB 3.37Å; L49-N122 PolarHBondContact O-ND2 3.28Å; R50-N122 HydrophobicContact CB-CB 4.46Å; R50-N122 HydrophobicContact CG-CB 3.96Å; R50-N122 PolarHBondContact NE-O 3Å; R50-N122 VanDerWaalsContact NE-O 3.07Å; R50-N122 PolarHBondContact NH2-O 3.34Å; N122-H124 VanDerWaalsContact C-N 3.33Å; N122-E127 WeakPolarHBondContact CA-OE2 3.49Å; N122-M128 HydrophobicContact CB-CE 4.44Å; N122-M128 HydrophobicContact CB-CG 3.65Å; N122-M128 HydrophobicContact CB-SD 3.78Å; N122-M128 VanDerWaalsContact CG-CG 3.48Å
123	L	94.1	Very high	96.4	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.026	11%	0.108	C	C	.	.			trans	-67.1	-39.7	-178.8	-56	-177.7	0	0	0	110.5	R50 L52 T121 E127 M174 Y178 E179	R50-L123 PolarHBondContact NH2-O 2.93Å; L52-L123 HydrophobicContact CD2-CD2 3.84Å; T121-L123 VanDerWaalsContact C-N 3.35Å; T121-L123 PolarHBondContact O-N 3.38Å; L123-E127 PolarHBondContact N-OE2 3.1Å; L123-M174 HydrophobicContact CD1-CB 3.9Å; L123-M174 HydrophobicContact CD1-CE 3.84Å; L123-M174 HydrophobicContact CD1-CG 3.93Å; L123-M174 HydrophobicContact CD2-CE 4.28Å; L123-M174 HydrophobicContact CG-CE 4.45Å; L123-Y178 HydrophobicContact CD2-CD2 3.74Å; L123-Y178 HydrophobicContact CD2-CE2 4.35Å; L123-E179 PolarHBondContact O-N 2.82Å
124	H	94.8	Very high	96.4	Very high	30 Å²	30	18.5 Å²	18.5	14%	0.139	10%	0.098	C	C	.	.	S	Bend	trans	-113.2	148.9	-176.9	-62.7	-74.6	0	0	0	112.2	N122 W126 E127 R177 E179	N122-H124 VanDerWaalsContact C-N 3.33Å; H124-W126 VanDerWaalsContact C-N 3.26Å; H124-W126 HydrophobicContact CB-CG 4.17Å; H124-W126 AromaticContact CD2-NE1 3.77Å; H124-W126 AromaticContact CG-NE1 3.5Å; H124-W126 PolarHBondContact O-N 2.81Å; H124-E127 HydrophobicContact CB-CG 4.23Å; H124-E127 PolarHBondContact N-OE2 3.48Å; H124-E127 VanDerWaalsContact N-OE2 3.15Å; H124-E127 WeakPolarHBondContact O-CB 3.24Å; H124-E127 PolarHBondContact O-N 3.19Å; H124-E127 VanDerWaalsContact O-N 3.16Å; H124-R177 PolarHBondContact CE1-O 3.3Å; H124-E179 IonicContact CE1-OE1 3.07Å; H124-E179 IonicContact CG-OE1 3.55Å; H124-E179 IonicContact ND1-OE1 3.39Å; H124-E179 PolarHBondContact ND1-OE1 2.86Å
125	A	96.3	Very high	96.5	Very high	5 Å²	5	17 Å²	17	4%	0.041	9%	0.088	C	C	.	.	H	α-helix	trans	-57.7	-37.7	176.9	0	0	0	0	0	112.5	E127 M128 K129 E179 V182 V187 A190	A125-E127 VanDerWaalsContact C-N 3.27Å; A125-E127 PolarHBondContact O-N 2.99Å; A125-M128 PolarHBondContact O-N 2.84Å; A125-M128 VanDerWaalsContact O-N 3.14Å; A125-K129 PolarHBondContact O-N 2.79Å; A125-E179 VanDerWaalsContact CB-OE2 3.31Å; A125-E179 WeakPolarHBondContact CB-OE2 3.09Å; A125-E179 PolarHBondContact N-OE2 3.29Å; A125-V182 HydrophobicContact CB-CG1 4.31Å; A125-V182 HydrophobicContact CB-CG2 4.47Å; A125-V187 HydrophobicContact CB-CG2 4.05Å; A125-A190 HydrophobicContact CB-CB 3.7Å
126	W	95.7	Very high	96.4	Very high	63 Å²	63	21.6 Å²	21.6	24%	0.239	11%	0.112	C	C	.	.	H	α-helix	trans	-64.7	-28.2	-179.9	70.3	-99.4	0	0	0	113.1	H124 M128 K129 A190 K192	H124-W126 VanDerWaalsContact C-N 3.26Å; H124-W126 HydrophobicContact CB-CG 4.17Å; H124-W126 AromaticContact CD2-NE1 3.77Å; H124-W126 AromaticContact CG-NE1 3.5Å; H124-W126 PolarHBondContact O-N 2.81Å; W126-M128 PolarHBondContact O-N 2.72Å; W126-K129 WeakPolarHBondContact O-CB 3.4Å; W126-K129 PolarHBondContact O-N 3.39Å; W126-A190 HydrophobicContact CB-CB 3.91Å; W126-K192 HydrophobicContact CD2-CB 3.99Å; W126-K192 HydrophobicContact CD2-CG 3.95Å; W126-K192 HydrophobicContact CE3-CB 3.81Å; W126-K192 HydrophobicContact CE3-CD 3.92Å; W126-K192 HydrophobicContact CE3-CG 3.68Å; W126-K192 HydrophobicContact CG-CB 4.35Å; W126-K192 HydrophobicContact CH2-CD 4.13Å; W126-K192 HydrophobicContact CH2-CG 4.1Å; W126-K192 HydrophobicContact CZ2-CG 4.32Å; W126-K192 HydrophobicContact CZ3-CB 4.38Å; W126-K192 HydrophobicContact CZ3-CD 3.62Å; W126-K192 HydrophobicContact CZ3-CG 3.77Å
127	E	95.4	Very high	96.3	Very high	26 Å²	26	27.6 Å²	27.6	12%	0.121	14%	0.14	C	C	.	.	H	α-helix	trans	-66.9	-29.6	177.7	-64.7	175.7	150.6	0	0	111.3	N122 L123 H124 A125	N122-E127 WeakPolarHBondContact CA-OE2 3.49Å; L123-E127 PolarHBondContact N-OE2 3.1Å; H124-E127 HydrophobicContact CB-CG 4.23Å; H124-E127 PolarHBondContact N-OE2 3.48Å; H124-E127 VanDerWaalsContact N-OE2 3.15Å; H124-E127 WeakPolarHBondContact O-CB 3.24Å; H124-E127 PolarHBondContact O-N 3.19Å; H124-E127 VanDerWaalsContact O-N 3.16Å; A125-E127 VanDerWaalsContact C-N 3.27Å; A125-E127 PolarHBondContact O-N 2.99Å
128	M	97.5	Very high	96.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-87.6	-20.8	180	-72.9	-178.6	-70.7	0	0	113.5	L48 R50 N122 A125 W126 P130 Y131 A132 F144 V182 V187	L48-M128 HydrophobicContact CB-SD 4.14Å; L48-M128 HydrophobicContact CD1-CB 3.96Å; L48-M128 HydrophobicContact CD1-CG 4.16Å; L48-M128 HydrophobicContact CD1-SD 4.26Å; R50-M128 HydrophobicContact CG-CE 4.34Å; R50-M128 HydrophobicContact CG-SD 3.77Å; R50-M128 VanDerWaalsContact NE-CE 3.34Å; N122-M128 HydrophobicContact CB-CE 4.44Å; N122-M128 HydrophobicContact CB-CG 3.65Å; N122-M128 HydrophobicContact CB-SD 3.78Å; N122-M128 VanDerWaalsContact CG-CG 3.48Å; A125-M128 PolarHBondContact O-N 2.84Å; A125-M128 VanDerWaalsContact O-N 3.14Å; W126-M128 PolarHBondContact O-N 2.72Å; M128-P130 VanDerWaalsContact C-CD 3.49Å; M128-Y131 PolarHBondContact O-N 2.67Å; M128-A132 PolarHBondContact O-N 3.03Å; M128-F144 HydrophobicContact CE-CD1 4.35Å; M128-F144 HydrophobicContact CE-CE1 4.16Å; M128-F144 HydrophobicContact SD-CD1 3.67Å; M128-F144 HydrophobicContact SD-CE1 3.62Å; M128-V182 HydrophobicContact CE-CB 4.48Å; M128-V182 HydrophobicContact CE-CG1 3.79Å; M128-V187 HydrophobicContact CB-CG1 3.96Å; M128-V187 HydrophobicContact CB-CG2 4.35Å; M128-V187 HydrophobicContact CE-CG2 4.05Å
129	K	97.4	Very high	96.1	Very high	64 Å²	64	35.2 Å²	35.2	28%	0.278	18%	0.18	S	C	.	.	H	α-helix	trans	-52.2	-45.1	-175	179.9	169.2	172.2	161.3	0	113.9	A125 W126 Y131 A132 V133 V187 L188 A190	A125-K129 PolarHBondContact O-N 2.79Å; W126-K129 WeakPolarHBondContact O-CB 3.4Å; W126-K129 PolarHBondContact O-N 3.39Å; K129-Y131 VanDerWaalsContact C-N 3.28Å; K129-Y131 PolarHBondContact O-N 3.45Å; K129-A132 PolarHBondContact O-N 2.98Å; K129-V133 HydrophobicContact CG-CG2 4.26Å; K129-V133 WeakPolarHBondContact O-CG2 3.45Å; K129-V133 PolarHBondContact O-N 3.36Å; K129-V187 HydrophobicContact CB-CG1 4.21Å; K129-V187 WeakPolarHBondContact CB-O 3.42Å; K129-V187 WeakPolarHBondContact CD-O 3.5Å; K129-V187 WeakPolarHBondContact CG-O 3.41Å; K129-L188 WeakPolarHBondContact CE-O 3.34Å; K129-L188 PolarHBondContact NZ-O 3Å; K129-A190 WeakPolarHBondContact CD-O 3.26Å; K129-A190 PolarHBondContact NZ-O 2.78Å
130	P	97.8	Very high	96.1	Very high	42 Å²	42	35.5 Å²	35.5	27%	0.273	18%	0.181	S	C	.	.	H	α-helix	trans	-57.4	-41.1	178.1	-25.2	35	0	0	0	112.7	Q102 M128 M134	Q102-P130 HydrophobicContact CG-CB 4.29Å; M128-P130 VanDerWaalsContact C-CD 3.49Å; P130-M134 WeakPolarHBondContact O-CE 3.39Å; P130-M134 VanDerWaalsContact O-CG 3.24Å; P130-M134 WeakPolarHBondContact O-CG 3.39Å; P130-M134 PolarHBondContact O-N 3.35Å; P130-M134 VanDerWaalsContact O-N 3.1Å
131	Y	98.2	Very high	96.2	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-71.7	-38.4	178.9	-57.2	-78.7	0	0	0	112.3	L48 N101 Q102 A105 I118 M128 K129 M134 A135	L48-Y131 HydrophobicContact CD2-CD2 4.48Å; L48-Y131 HydrophobicContact CD2-CG 4.22Å; N101-Y131 PolarHBondContact ND2-OH 3.04Å; Q102-Y131 HydrophobicContact CG-CE1 4.02Å; Q102-Y131 HydrophobicContact CG-CE2 4.34Å; A105-Y131 HydrophobicContact CB-CD1 3.91Å; A105-Y131 HydrophobicContact CB-CE1 3.77Å; I118-Y131 HydrophobicContact CD1-CD1 3.81Å; I118-Y131 HydrophobicContact CD1-CE1 3.75Å; I118-Y131 HydrophobicContact CG1-CD1 3.86Å; I118-Y131 HydrophobicContact CG1-CE1 4.1Å; I118-Y131 HydrophobicContact CG1-CG 4.17Å; I118-Y131 HydrophobicContact CG2-CD2 4.36Å; I118-Y131 HydrophobicContact CG2-CE1 4.2Å; I118-Y131 HydrophobicContact CG2-CE2 3.99Å; M128-Y131 PolarHBondContact O-N 2.67Å; K129-Y131 VanDerWaalsContact C-N 3.28Å; K129-Y131 PolarHBondContact O-N 3.45Å; Y131-M134 HydrophobicContact CD1-CE 3.6Å; Y131-M134 HydrophobicContact CE1-CE 4.19Å; Y131-M134 HydrophobicContact CG-CE 4.17Å; Y131-M134 PolarHBondContact O-N 2.74Å; Y131-A135 WeakPolarHBondContact O-CB 3.48Å; Y131-A135 PolarHBondContact O-N 2.97Å
132	A	97.8	Very high	96.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.2	-39.9	176.1	0	0	0	0	0	112.5	M128 K129 A135 L136 F184 V187 L188	M128-A132 PolarHBondContact O-N 3.03Å; K129-A132 PolarHBondContact O-N 2.98Å; A132-A135 WeakPolarHBondContact O-CB 3.31Å; A132-A135 PolarHBondContact O-N 3.38Å; A132-L136 PolarHBondContact O-N 2.9Å; A132-F184 HydrophobicContact CB-CD2 4.36Å; A132-F184 HydrophobicContact CB-CE2 3.93Å; A132-V187 HydrophobicContact CB-CG1 3.59Å; A132-L188 HydrophobicContact CB-CD2 4.07Å
133	V	97.8	Very high	96.7	Very high	53 Å²	53	39.3 Å²	39.3	32%	0.321	20%	0.197	S	C	.	.	H	α-helix	trans	-63.6	-49.1	174	172.1	0	0	0	0	110.5	K129 A135 L136 E137 L188	K129-V133 HydrophobicContact CG-CG2 4.26Å; K129-V133 WeakPolarHBondContact O-CG2 3.45Å; K129-V133 PolarHBondContact O-N 3.36Å; V133-A135 PolarHBondContact O-N 3.1Å; V133-L136 WeakPolarHBondContact O-CB 3.38Å; V133-L136 PolarHBondContact O-N 2.85Å; V133-L136 VanDerWaalsContact O-N 3.13Å; V133-E137 WeakPolarHBondContact O-CG 3.15Å; V133-E137 PolarHBondContact O-N 3.35Å; V133-L188 HydrophobicContact CG2-CD2 3.96Å
134	M	97.6	Very high	96.9	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-35	177.2	-68.3	-177.6	-62.9	0	0	112.3	Q102 R106 M109 P130 Y131 N138	Q102-M134 HydrophobicContact CB-CE 4.28Å; Q102-M134 HydrophobicContact CG-CE 4.5Å; R106-M134 HydrophobicContact CB-SD 3.49Å; R106-M134 WeakPolarHBondContact CB-SD 3.38Å; R106-M134 HydrophobicContact CG-CG 4.46Å; R106-M134 HydrophobicContact CG-SD 3.78Å; R106-M134 PolarHBondContact NE-SD 3.23Å; M109-M134 HydrophobicContact SD-CB 3.65Å; P130-M134 WeakPolarHBondContact O-CE 3.39Å; P130-M134 VanDerWaalsContact O-CG 3.24Å; P130-M134 WeakPolarHBondContact O-CG 3.39Å; P130-M134 PolarHBondContact O-N 3.35Å; P130-M134 VanDerWaalsContact O-N 3.1Å; Y131-M134 HydrophobicContact CD1-CE 3.6Å; Y131-M134 HydrophobicContact CE1-CE 4.19Å; Y131-M134 HydrophobicContact CG-CE 4.17Å; Y131-M134 PolarHBondContact O-N 2.74Å; M134-N138 WeakPolarHBondContact O-CB 3.23Å; M134-N138 PolarHBondContact O-N 2.86Å; M134-N138 PolarHBondContact O-ND2 3.22Å
135	A	97.3	Very high	97	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-47.6	174.6	0	0	0	0	0	111.8	L46 Y131 A132 V133 N138 N139 Y140 V142	L46-A135 HydrophobicContact CB-CB 4.49Å; L46-A135 HydrophobicContact CD2-CB 3.72Å; Y131-A135 WeakPolarHBondContact O-CB 3.48Å; Y131-A135 PolarHBondContact O-N 2.97Å; A132-A135 WeakPolarHBondContact O-CB 3.31Å; A132-A135 PolarHBondContact O-N 3.38Å; V133-A135 PolarHBondContact O-N 3.1Å; A135-N138 CarbonylContact O-C 3.52Å; A135-N138 PolarHBondContact O-N 2.76Å; A135-N139 PolarHBondContact O-N 3.16Å; A135-Y140 PolarHBondContact O-N 2.76Å; A135-V142 HydrophobicContact CB-CG2 3.38Å
136	L	95.8	Very high	97	Very high	104 Å²	104	48.8 Å²	48.8	55%	0.545	24%	0.235	S	C	.	.	H	α-helix	trans	-59.7	-48.8	179	-176	64.5	0	0	0	111.4	A132 V133 N138 N139 F184	A132-L136 PolarHBondContact O-N 2.9Å; V133-L136 WeakPolarHBondContact O-CB 3.38Å; V133-L136 PolarHBondContact O-N 2.85Å; V133-L136 VanDerWaalsContact O-N 3.13Å; L136-N138 PolarHBondContact O-N 2.96Å; L136-N139 PolarHBondContact O-N 3.31Å; L136-F184 HydrophobicContact CB-CZ 4.45Å
137	E	96.5	Very high	97	Very high	126 Å²	126	46 Å²	46	59%	0.589	23%	0.225	S	C	*	.	H	α-helix	trans	-57.8	-29.9	177.8	-70.5	172.5	171.8	0	0	113.2	V133	V133-E137 WeakPolarHBondContact O-CG 3.15Å; V133-E137 PolarHBondContact O-N 3.35Å
138	N	96.5	Very high	97	Very high	27 Å²	27	52.3 Å²	52.3	14%	0.144	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	13.7	-176	-66.4	-92	0	0	0	112.7	K44 M109 R110 M134 A135 L136 Y140	K44-N138 WeakPolarHBondContact CE-O 3.36Å; K44-N138 PolarHBondContact NZ-O 3.4Å; M109-N138 HydrophobicContact CB-CB 4.16Å; R110-N138 WeakPolarHBondContact CA-OD1 3.04Å; M134-N138 WeakPolarHBondContact O-CB 3.23Å; M134-N138 PolarHBondContact O-N 2.86Å; M134-N138 PolarHBondContact O-ND2 3.22Å; A135-N138 CarbonylContact O-C 3.52Å; A135-N138 PolarHBondContact O-N 2.76Å; L136-N138 PolarHBondContact O-N 2.96Å; N138-Y140 HydrophobicContact CB-CD2 3.69Å; N138-Y140 HydrophobicContact CB-CE2 3.71Å; N138-Y140 VanDerWaalsContact O-CD2 3.25Å; N138-Y140 WeakPolarHBondContact O-CD2 3.27Å; N138-Y140 PolarHBondContact O-N 2.85Å
139	N	95.8	Very high	97	Very high	132 Å²	132	53.7 Å²	53.7	71%	0.706	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	46.7	-179.1	-55.2	95.9	0	0	0	114.1	A135 L136	A135-N139 PolarHBondContact O-N 3.16Å; L136-N139 PolarHBondContact O-N 3.31Å
140	Y	97.4	Very high	97	Very high	14 Å²	14	61.9 Å²	61.9	6%	0.055	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	140.9	169.2	-74.1	-113.9	0	0	0	110.4	K44 L46 M109 G112 I113 I116 A135 N138	K44-Y140 HydrophobicContact CB-CD1 3.5Å; K44-Y140 HydrophobicContact CB-CD2 4.04Å; K44-Y140 HydrophobicContact CB-CE1 3.53Å; K44-Y140 HydrophobicContact CB-CE2 4.06Å; K44-Y140 HydrophobicContact CB-CG 3.74Å; K44-Y140 HydrophobicContact CD-CD2 4.42Å; K44-Y140 HydrophobicContact CD-CE1 4.36Å; K44-Y140 HydrophobicContact CD-CE2 3.81Å; K44-Y140 VanDerWaalsContact CE-CE2 3.46Å; K44-Y140 HydrophobicContact CG-CE1 4.44Å; K44-Y140 CarbonylContact O-C 3.48Å; K44-Y140 WeakPolarHBondContact O-CA 3.08Å; L46-Y140 HydrophobicContact CB-CD1 4.38Å; M109-Y140 WeakPolarHBondContact CA-OH 3.36Å; M109-Y140 HydrophobicContact CB-CD2 4.47Å; M109-Y140 HydrophobicContact CB-CE2 3.88Å; M109-Y140 HydrophobicContact CG-CD2 4.37Å; M109-Y140 HydrophobicContact CG-CE1 4.36Å; M109-Y140 HydrophobicContact CG-CE2 4.05Å; M109-Y140 WeakPolarHBondContact O-CE2 3.45Å; M109-Y140 PolarHBondContact O-OH 3.14Å; M109-Y140 VanDerWaalsContact O-OH 3.04Å; G112-Y140 WeakPolarHBondContact CA-OH 3.48Å; I113-Y140 PolarHBondContact N-OH 2.99Å; I113-Y140 VanDerWaalsContact O-CE1 3.24Å; I113-Y140 WeakPolarHBondContact O-CE1 3.36Å; I113-Y140 PolarHBondContact O-OH 3.02Å; I116-Y140 HydrophobicContact CD1-CE1 4.05Å; A135-Y140 PolarHBondContact O-N 2.76Å; N138-Y140 HydrophobicContact CB-CD2 3.69Å; N138-Y140 HydrophobicContact CB-CE2 3.71Å; N138-Y140 VanDerWaalsContact O-CD2 3.25Å; N138-Y140 WeakPolarHBondContact O-CD2 3.27Å; N138-Y140 PolarHBondContact O-N 2.85Å
141	E	96.9	Very high	96.9	Very high	76 Å²	76	62.3 Å²	62.3	36%	0.355	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.9	165.3	179	167.8	162.3	0	0	109.3	R43 K44 H45 L46 I143	R43-E141 WeakPolarHBondContact CD-OE2 3.43Å; R43-E141 IonicContact CZ-OE2 2.78Å; R43-E141 IonicContact NE-OE2 3.59Å; R43-E141 IonicContact NH1-OE2 3.86Å; R43-E141 PolarHBondContact NH1-OE2 3.27Å; K44-E141 PolarHBondContact O-N 3.38Å; H45-E141 WeakPolarHBondContact CA-O 3.35Å; L46-E141 PolarHBondContact N-O 2.95Å; E141-I143 HydrophobicContact CG-CG1 4.4Å
142	V	97.6	Very high	96.8	Very high	21 Å²	21	64.8 Å²	64.8	13%	0.127	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	124.5	-179.4	-177.5	0	0	0	0	109.8	L46 L48 A135 F144 F184	L46-V142 HydrophobicContact CD2-CG2 4.22Å; L46-V142 WeakPolarHBondContact O-CA 3.49Å; L48-V142 HydrophobicContact CD1-CG1 3.62Å; L48-V142 HydrophobicContact CG-CG1 4.04Å; A135-V142 HydrophobicContact CB-CG2 3.38Å; V142-F144 HydrophobicContact CG1-CE1 4.2Å; V142-F144 HydrophobicContact CG1-CE2 4.04Å; V142-F144 HydrophobicContact CG1-CZ 3.8Å; V142-F184 HydrophobicContact CB-CD2 3.86Å; V142-F184 HydrophobicContact CB-CE2 4.09Å; V142-F184 HydrophobicContact CG1-CD2 4.34Å; V142-F184 HydrophobicContact CG2-CD2 3.93Å; V142-F184 HydrophobicContact CG2-CE2 3.62Å
143	I	97.4	Very high	96.7	Very high	32 Å²	32	67.2 Å²	67.2	16%	0.164	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	114.9	-179.7	-54.8	172	0	0	0	108.2	H45 L46 Y47 L48 E141 R145	H45-I143 HydrophobicContact CB-CD1 4.25Å; L46-I143 PolarHBondContact O-N 3.3Å; Y47-I143 WeakPolarHBondContact CA-O 3.31Å; Y47-I143 HydrophobicContact CD1-CB 3.9Å; Y47-I143 HydrophobicContact CD1-CD1 4.4Å; Y47-I143 HydrophobicContact CD1-CG2 3.94Å; Y47-I143 HydrophobicContact CE1-CB 4.02Å; Y47-I143 HydrophobicContact CE1-CD1 3.74Å; Y47-I143 HydrophobicContact CE1-CG1 4.48Å; Y47-I143 HydrophobicContact CE1-CG2 3.87Å; L48-I143 PolarHBondContact N-O 3.36Å; E141-I143 HydrophobicContact CG-CG1 4.4Å; I143-R145 HydrophobicContact CG2-CG 4.1Å
144	F	97.2	Very high	96.7	Very high	49 Å²	49	68.5 Å²	68.5	22%	0.215	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	133.2	172.9	-56.4	-82.2	0	0	0	109.6	L48 M128 V142 V182 F184 V187	L48-F144 HydrophobicContact CB-CD1 4.02Å; L48-F144 HydrophobicContact CB-CE1 4.32Å; L48-F144 HydrophobicContact CD1-CD1 4.3Å; L48-F144 HydrophobicContact CD1-CE1 3.74Å; L48-F144 HydrophobicContact CD1-CZ 4.44Å; L48-F144 WeakPolarHBondContact O-CA 3.45Å; M128-F144 HydrophobicContact CE-CD1 4.35Å; M128-F144 HydrophobicContact CE-CE1 4.16Å; M128-F144 HydrophobicContact SD-CD1 3.67Å; M128-F144 HydrophobicContact SD-CE1 3.62Å; V142-F144 HydrophobicContact CG1-CE1 4.2Å; V142-F144 HydrophobicContact CG1-CE2 4.04Å; V142-F144 HydrophobicContact CG1-CZ 3.8Å; F144-V182 HydrophobicContact CE1-CG1 4.29Å; F144-F184 HydrophobicContact CE2-CB 4.27Å; F144-V187 HydrophobicContact CE1-CG2 3.76Å; F144-V187 HydrophobicContact CZ-CB 4.3Å; F144-V187 HydrophobicContact CZ-CG2 3.69Å
145	R	97.4	Very high	96.7	Very high	129 Å²	129	69.2 Å²	69.2	49%	0.487	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	136.9	178.3	-71.5	-63.9	-172	175.7	-0	111.6	Y47 L48 L49 R50 L60 I143	Y47-R145 HydrophobicContact CD1-CG 3.85Å; Y47-R145 HydrophobicContact CE1-CG 4.39Å; L48-R145 PolarHBondContact O-N 3.29Å; L49-R145 CarbonylContact C-O 3.57Å; L49-R145 VanDerWaalsContact CA-O 3.28Å; L49-R145 WeakPolarHBondContact CA-O 3.45Å; L49-R145 HydrophobicContact CD2-CB 3.74Å; R50-R145 PolarHBondContact N-O 3.05Å; L60-R145 HydrophobicContact CD2-CB 4.12Å; I143-R145 HydrophobicContact CG2-CG 4.1Å
146	E	96.8	Very high	96.6	Very high	61 Å²	61	75.8 Å²	75.8	29%	0.285	36%	0.355	S	S	.	.			trans	-114.3	150.5	170.7	-64.4	-172.1	175.9	0	0	109.7	R50 K152 Y178	R50-E146 HydrophobicContact CB-CG 4.18Å; E146-K152 IonicContact OE2-NZ 2.72Å; E146-K152 PolarHBondContact OE2-NZ 3.25Å; E146-Y178 PolarHBondContact OE1-OH 2.83Å
147	P	95.7	Very high	96.7	Very high	5 Å²	5	72.9 Å²	72.9	3%	0.032	34%	0.338	C	S	.	.			trans	-57.7	139.9	167.1	-25.1	36.3	0	0	0	111.1	R50 S55 K57 L60 T149 K152	R50-P147 WeakPolarHBondContact O-CD 3.25Å; S55-P147 VanDerWaalsContact O-CB 3.23Å; S55-P147 WeakPolarHBondContact O-CB 3.28Å; K57-P147 HydrophobicContact CB-CG 4.3Å; K57-P147 HydrophobicContact CG-CG 3.78Å; L60-P147 HydrophobicContact CD2-CG 4.5Å; P147-T149 VanDerWaalsContact C-N 3.26Å; P147-T149 HydrophobicContact CB-CG2 4.29Å; P147-T149 PolarHBondContact O-N 3.08Å; P147-K152 WeakPolarHBondContact O-CD 3.46Å
148	D	95.3	Very high	96.7	Very high	159 Å²	159	66.9 Å²	66.9	85%	0.85	31%	0.31	S	S	*	.			trans	-95.2	42.3	174.7	-166.3	24	0	0	0	111.8
149	T	96.2	Very high	96.6	Very high	28 Å²	28	67 Å²	67	17%	0.172	32%	0.315	C	S	.	.			trans	-91.5	135	178.8	64.5	0	0	0	0	109.9	S55 P147 W151 K152	S55-T149 WeakPolarHBondContact O-CG2 3.46Å; S55-T149 PolarHBondContact O-OG1 3.28Å; P147-T149 VanDerWaalsContact C-N 3.26Å; P147-T149 HydrophobicContact CB-CG2 4.29Å; P147-T149 PolarHBondContact O-N 3.08Å; T149-W151 HydrophobicContact CG2-CH2 3.89Å; T149-W151 HydrophobicContact CG2-CZ2 3.55Å; T149-W151 PolarHBondContact O-N 3.45Å; T149-K152 WeakPolarHBondContact O-CB 3.43Å; T149-K152 WeakPolarHBondContact O-CG 3.34Å; T149-K152 PolarHBondContact O-N 3.25Å; T149-K152 WeakPolarHBondContact OG1-CB 3.27Å; T149-K152 PolarHBondContact OG1-N 3.42Å
150	R	97.2	Very high	96.6	Very high	237 Å²	237	68.8 Å²	68.8	89%	0.894	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-19.9	177.7	65.6	179.6	-179.2	-173.1	0.1	114.2
151	W	96.8	Very high	96.5	Very high	51 Å²	51	72.8 Å²	72.8	19%	0.193	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	7.4	-179.2	64.9	83.2	0	0	0	113.9	G54 T149 F153 N154 E157	G54-W151 PolarHBondContact O-NE1 3.26Å; T149-W151 HydrophobicContact CG2-CH2 3.89Å; T149-W151 HydrophobicContact CG2-CZ2 3.55Å; T149-W151 PolarHBondContact O-N 3.45Å; W151-F153 PolarHBondContact O-N 3.14Å; W151-N154 HydrophobicContact CB-CB 4.13Å; W151-N154 PolarHBondContact O-N 2.96Å; W151-E157 HydrophobicContact CB-CB 3.97Å; W151-E157 HydrophobicContact CB-CG 3.63Å; W151-E157 HydrophobicContact CD2-CG 4.34Å; W151-E157 HydrophobicContact CG-CB 4.41Å; W151-E157 HydrophobicContact CG-CG 3.66Å
152	K	95.9	Very high	96.2	Very high	52 Å²	52	70.1 Å²	70.1	23%	0.226	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.2	-173.2	69.7	-175.6	-174.2	158.7	0	115.3	E146 P147 T149	E146-K152 IonicContact OE2-NZ 2.72Å; E146-K152 PolarHBondContact OE2-NZ 3.25Å; P147-K152 WeakPolarHBondContact O-CD 3.46Å; T149-K152 WeakPolarHBondContact O-CB 3.43Å; T149-K152 WeakPolarHBondContact O-CG 3.34Å; T149-K152 PolarHBondContact O-N 3.25Å; T149-K152 WeakPolarHBondContact OG1-CB 3.27Å; T149-K152 PolarHBondContact OG1-N 3.42Å
153	F	96.3	Very high	95.7	Very high	52 Å²	52	76.1 Å²	76.1	23%	0.228	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	9.6	174.3	-61.9	-62.6	0	0	0	114.5	L52 W151 V155 K175 Y178 H180	L52-F153 HydrophobicContact CD1-CD1 4.04Å; W151-F153 PolarHBondContact O-N 3.14Å; F153-V155 PolarHBondContact O-N 3.09Å; F153-K175 WeakPolarHBondContact O-CE 3.37Å; F153-K175 PolarHBondContact O-NZ 3.38Å; F153-Y178 AromaticContact CE1-CD1 3.81Å; F153-Y178 HydrophobicContact CE1-CD1 3.81Å; F153-Y178 AromaticContact CE1-CE1 3.88Å; F153-Y178 HydrophobicContact CE1-CE1 3.88Å; F153-Y178 HydrophobicContact CE1-CG 4.25Å; F153-Y178 HydrophobicContact CZ-CD1 4.13Å; F153-Y178 AromaticContact CZ-CE1 3.85Å; F153-Y178 HydrophobicContact CZ-CE1 3.85Å; F153-H180 AromaticContact CZ-NE2 3.96Å
154	N	97.3	Very high	95.1	Very high	79 Å²	79	77.1 Å²	77.1	42%	0.422	35%	0.349	S	S	.	.			trans	-85.6	101.4	174.6	-178.1	-37.6	0	0	0	109.6	W151 Q156 E157 L158	W151-N154 HydrophobicContact CB-CB 4.13Å; W151-N154 PolarHBondContact O-N 2.96Å; N154-Q156 VanDerWaalsContact C-N 3.27Å; N154-Q156 PolarHBondContact O-N 3.1Å; N154-Q156 PolarHBondContact OD1-N 3.37Å; N154-Q156 VanDerWaalsContact OD1-N 3.1Å; N154-E157 HydrophobicContact CB-CB 4.18Å; N154-E157 PolarHBondContact O-N 3.36Å; N154-E157 VanDerWaalsContact O-N 3.17Å; N154-E157 PolarHBondContact OD1-N 3.29Å; N154-E157 VanDerWaalsContact OD1-N 3.12Å; N154-L158 WeakPolarHBondContact O-CB 3.38Å; N154-L158 WeakPolarHBondContact O-CG 3.35Å; N154-L158 PolarHBondContact O-N 3Å
155	V	96.6	Very high	94.6	Very high	19 Å²	19	77.6 Å²	77.6	12%	0.115	37%	0.367	C	S	.	.	H	α-helix	trans	-56.7	-37.3	-174.1	176.6	0	0	0	0	113.1	F153 A159 R168 I171 H172 K175	F153-V155 PolarHBondContact O-N 3.09Å; V155-A159 WeakPolarHBondContact O-CB 3.42Å; V155-A159 PolarHBondContact O-N 2.92Å; V155-R168 HydrophobicContact CG1-CG 3.64Å; V155-R168 WeakPolarHBondContact CG1-O 3.48Å; V155-I171 HydrophobicContact CB-CG2 4.49Å; V155-I171 HydrophobicContact CG1-CB 4.33Å; V155-I171 HydrophobicContact CG1-CG2 4.09Å; V155-I171 HydrophobicContact CG2-CG2 4.44Å; V155-H172 HydrophobicContact CG1-CB 4.16Å; V155-K175 HydrophobicContact CG2-CD 3.67Å
156	Q	96.3	Very high	94.2	Very high	138 Å²	138	72.5 Å²	72.5	65%	0.645	35%	0.351	S	S	*	.	H	α-helix	trans	-67.9	-46.2	179.9	-65	174.9	-4	0	0	111.1	N154 A159 R160	N154-Q156 VanDerWaalsContact C-N 3.27Å; N154-Q156 PolarHBondContact O-N 3.1Å; N154-Q156 PolarHBondContact OD1-N 3.37Å; N154-Q156 VanDerWaalsContact OD1-N 3.1Å; Q156-A159 PolarHBondContact O-N 3.17Å; Q156-R160 PolarHBondContact O-N 2.86Å; Q156-R160 VanDerWaalsContact O-N 3.09Å
157	E	96.9	Very high	94.1	Very high	43 Å²	43	71.4 Å²	71.4	20%	0.201	35%	0.35	C	S	.	.	H	α-helix	trans	-70.6	-35.8	-179.5	-173.7	65.4	171.9	0	0	111.9	W151 N154 R160 R161	W151-E157 HydrophobicContact CB-CB 3.97Å; W151-E157 HydrophobicContact CB-CG 3.63Å; W151-E157 HydrophobicContact CD2-CG 4.34Å; W151-E157 HydrophobicContact CG-CB 4.41Å; W151-E157 HydrophobicContact CG-CG 3.66Å; N154-E157 HydrophobicContact CB-CB 4.18Å; N154-E157 PolarHBondContact O-N 3.36Å; N154-E157 VanDerWaalsContact O-N 3.17Å; N154-E157 PolarHBondContact OD1-N 3.29Å; N154-E157 VanDerWaalsContact OD1-N 3.12Å; E157-R160 PolarHBondContact O-N 2.88Å; E157-R160 IonicContact OE1-CZ 3.1Å; E157-R160 IonicContact OE1-NE 3.41Å; E157-R160 IonicContact OE1-NH2 3.75Å; E157-R160 PolarHBondContact OE1-NH2 3.2Å; E157-R160 IonicContact OE2-CZ 3.85Å; E157-R160 IonicContact OE2-NE 3.16Å; E157-R160 PolarHBondContact OE2-NE 2.87Å; E157-R160 IonicContact OE2-NH2 3.12Å; E157-R160 PolarHBondContact OE2-NH2 2.69Å; E157-R161 VanDerWaalsContact CD-NE 3.33Å; E157-R161 HydrophobicContact CG-CG 4.42Å; E157-R161 WeakPolarHBondContact O-CB 3.15Å; E157-R161 VanDerWaalsContact O-CG 3.31Å; E157-R161 WeakPolarHBondContact O-CG 3.44Å; E157-R161 PolarHBondContact O-N 3.08Å; E157-R161 IonicContact OE1-CZ 3.56Å; E157-R161 IonicContact OE1-NE 2.84Å; E157-R161 PolarHBondContact OE1-NE 3.11Å; E157-R161 IonicContact OE1-NH2 3.7Å; E157-R161 PolarHBondContact OE1-NH2 3.47Å
158	L	96.7	Very high	94.1	Very high	0 Å²	0	77.4 Å²	77.4	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-61.6	-45.4	172.7	-67.7	171.1	0	0	0	111.4	L52 P53 S55 N154 R160 R161 N162 I171	L52-L158 HydrophobicContact CB-CD1 3.78Å; L52-L158 HydrophobicContact CB-CD2 4.46Å; L52-L158 HydrophobicContact CD1-CD1 3.55Å; L52-L158 HydrophobicContact CG-CD1 4.32Å; P53-L158 WeakPolarHBondContact O-CB 3.42Å; P53-L158 WeakPolarHBondContact O-CD2 3.39Å; S55-L158 VanDerWaalsContact CA-CD2 3.45Å; S55-L158 VanDerWaalsContact N-CD2 3.29Å; N154-L158 WeakPolarHBondContact O-CB 3.38Å; N154-L158 WeakPolarHBondContact O-CG 3.35Å; N154-L158 PolarHBondContact O-N 3Å; L158-R160 VanDerWaalsContact C-N 3.27Å; L158-R160 PolarHBondContact O-N 2.86Å; L158-R161 PolarHBondContact O-N 2.63Å; L158-N162 WeakPolarHBondContact O-CB 3.47Å; L158-N162 PolarHBondContact O-N 3.21Å; L158-N162 PolarHBondContact O-ND2 2.94Å; L158-I171 HydrophobicContact CB-CD1 4.15Å; L158-I171 HydrophobicContact CB-CG2 3.94Å; L158-I171 HydrophobicContact CD1-CG2 3.81Å
159	A	95.2	Very high	94.2	Very high	30 Å²	30	74.5 Å²	74.5	25%	0.248	35%	0.353	C	S	.	.	H	α-helix	trans	-60.4	-37.9	176.3	0	0	0	0	0	111.9	V155 Q156 N162 R168 I171	V155-A159 WeakPolarHBondContact O-CB 3.42Å; V155-A159 PolarHBondContact O-N 2.92Å; Q156-A159 PolarHBondContact O-N 3.17Å; A159-N162 WeakPolarHBondContact CA-ND2 3.37Å; A159-N162 PolarHBondContact O-ND2 3.21Å; A159-R168 HydrophobicContact CB-CB 3.88Å; A159-R168 HydrophobicContact CB-CG 4.14Å; A159-I171 HydrophobicContact CB-CD1 4.06Å
160	R	95.8	Very high	94.1	Very high	170 Å²	170	76.4 Å²	76.4	64%	0.642	36%	0.359	S	S	*	.	H	α-helix	trans	-71.2	-34.1	177	-166.2	-175.1	71.2	83.5	-1.2	113.5	Q156 E157 L158	Q156-R160 PolarHBondContact O-N 2.86Å; Q156-R160 VanDerWaalsContact O-N 3.09Å; E157-R160 PolarHBondContact O-N 2.88Å; E157-R160 IonicContact OE1-CZ 3.1Å; E157-R160 IonicContact OE1-NE 3.41Å; E157-R160 IonicContact OE1-NH2 3.75Å; E157-R160 PolarHBondContact OE1-NH2 3.2Å; E157-R160 IonicContact OE2-CZ 3.85Å; E157-R160 IonicContact OE2-NE 3.16Å; E157-R160 PolarHBondContact OE2-NE 2.87Å; E157-R160 IonicContact OE2-NH2 3.12Å; E157-R160 PolarHBondContact OE2-NH2 2.69Å; L158-R160 VanDerWaalsContact C-N 3.27Å; L158-R160 PolarHBondContact O-N 2.86Å
161	R	94.8	Very high	94.1	Very high	98 Å²	98	65.1 Å²	65.1	37%	0.37	32%	0.316	S	S	.	.	H	α-helix	trans	-94	-20.3	-173.1	-71.4	-177.9	-178.1	-112.5	-0.7	114.8	E157 L158	E157-R161 VanDerWaalsContact CD-NE 3.33Å; E157-R161 HydrophobicContact CG-CG 4.42Å; E157-R161 WeakPolarHBondContact O-CB 3.15Å; E157-R161 VanDerWaalsContact O-CG 3.31Å; E157-R161 WeakPolarHBondContact O-CG 3.44Å; E157-R161 PolarHBondContact O-N 3.08Å; E157-R161 IonicContact OE1-CZ 3.56Å; E157-R161 IonicContact OE1-NE 2.84Å; E157-R161 PolarHBondContact OE1-NE 3.11Å; E157-R161 IonicContact OE1-NH2 3.7Å; E157-R161 PolarHBondContact OE1-NH2 3.47Å; L158-R161 PolarHBondContact O-N 2.63Å
162	N	91.4	Very high	94	Very high	19 Å²	19	67 Å²	67	10%	0.102	33%	0.327	C	S	.	.			trans	-72.5	131.7	-176.8	86	95.3	0	0	0	111.1	P53 L158 A159 G165 V166	P53-N162 HydrophobicContact CB-CB 4.03Å; L158-N162 WeakPolarHBondContact O-CB 3.47Å; L158-N162 PolarHBondContact O-N 3.21Å; L158-N162 PolarHBondContact O-ND2 2.94Å; A159-N162 WeakPolarHBondContact CA-ND2 3.37Å; A159-N162 PolarHBondContact O-ND2 3.21Å; N162-G165 PolarHBondContact OD1-N 3.24Å; N162-G165 VanDerWaalsContact OD1-N 3.16Å; N162-V166 PolarHBondContact ND2-O 3.02Å; N162-V166 WeakPolarHBondContact OD1-CB 3.48Å; N162-V166 PolarHBondContact OD1-N 3.15Å
163	I	87.6	Confident	94	Very high	147 Å²	147	70.9 Å²	70.9	75%	0.754	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-9	-175.4	63.1	174	0	0	0	113.3
164	H	84.1	Confident	94	Very high	54 Å²	54	69.1 Å²	69.1	25%	0.25	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	10.3	-176.9	-55.2	-69.4	0	0	0	113	Y87 V166	Y87-H164 AromaticContact CD2-ND1 3.94Å; Y87-H164 HydrophobicContact CE1-CB 4.07Å; Y87-H164 AromaticContact CE1-ND1 3.69Å; Y87-H164 AromaticContact CE2-ND1 3.6Å; Y87-H164 AromaticContact CZ-ND1 3.47Å; H164-V166 HydrophobicContact CB-CG2 4.22Å; H164-V166 PolarHBondContact O-N 3.22Å
165	G	86.4	Confident	94	Very high	58 Å²	58	69.4 Å²	69.4	60%	0.598	33%	0.33	S	S	*	.			trans	64.3	24.2	176.4	0	0	0	0	0	114.6	N162 S167	N162-G165 PolarHBondContact OD1-N 3.24Å; N162-G165 VanDerWaalsContact OD1-N 3.16Å; G165-S167 PolarHBondContact O-N 2.74Å
166	V	89.9	Confident	94	Very high	22 Å²	22	74.8 Å²	74.8	13%	0.133	35%	0.354	C	S	.	.			trans	-66.4	119.4	176.6	-170.2	0	0	0	0	108.7	P53 N162 H164 K170 I171 M174	P53-V166 HydrophobicContact CB-CB 4.32Å; P53-V166 HydrophobicContact CB-CG2 4.02Å; P53-V166 HydrophobicContact CG-CB 4.49Å; P53-V166 HydrophobicContact CG-CG1 4.37Å; P53-V166 HydrophobicContact CG-CG2 4.12Å; N162-V166 PolarHBondContact ND2-O 3.02Å; N162-V166 WeakPolarHBondContact OD1-CB 3.48Å; N162-V166 PolarHBondContact OD1-N 3.15Å; H164-V166 HydrophobicContact CB-CG2 4.22Å; H164-V166 PolarHBondContact O-N 3.22Å; V166-K170 HydrophobicContact CG1-CB 3.96Å; V166-K170 HydrophobicContact CG1-CD 3.76Å; V166-K170 HydrophobicContact CG1-CG 3.74Å; V166-I171 HydrophobicContact CB-CD1 4.32Å; V166-I171 HydrophobicContact CB-CG1 4.17Å; V166-I171 HydrophobicContact CG1-CD1 4.38Å; V166-I171 HydrophobicContact CG1-CG1 3.7Å; V166-M174 HydrophobicContact CG1-SD 4.22Å
167	S	94.6	Very high	93.8	Very high	38 Å²	38	74.1 Å²	74.1	27%	0.266	35%	0.346	S	S	.	.			trans	-62	152.5	-178.7	68	0	0	0	0	112.3	G165 E169 K170 I171	G165-S167 PolarHBondContact O-N 2.74Å; S167-E169 PolarHBondContact O-N 2.99Å; S167-K170 WeakPolarHBondContact O-CB 3.47Å; S167-K170 PolarHBondContact O-N 3.42Å; S167-K170 VanDerWaalsContact O-N 3.08Å; S167-K170 WeakPolarHBondContact OG-CB 3.35Å; S167-K170 PolarHBondContact OG-N 3.07Å; S167-I171 WeakPolarHBondContact O-CG1 3.41Å; S167-I171 PolarHBondContact O-N 3.02Å
168	R	96.1	Very high	93.8	Very high	132 Å²	132	72.5 Å²	72.5	50%	0.498	34%	0.338	S	S	.	.	H	α-helix	trans	-56.2	-41.8	178.3	-173	-175	61.9	176.4	-1.3	111.7	V155 A159 K170 I171 H172	V155-R168 HydrophobicContact CG1-CG 3.64Å; V155-R168 WeakPolarHBondContact CG1-O 3.48Å; A159-R168 HydrophobicContact CB-CB 3.88Å; A159-R168 HydrophobicContact CB-CG 4.14Å; R168-K170 VanDerWaalsContact C-N 3.33Å; R168-K170 PolarHBondContact O-N 3.35Å; R168-I171 PolarHBondContact O-N 3.31Å; R168-H172 PolarHBondContact O-N 3.1Å
169	E	96.4	Very high	93.7	Very high	97 Å²	97	75.8 Å²	75.8	45%	0.453	35%	0.353	S	S	.	.	H	α-helix	trans	-65.3	-38.8	179.5	-64.8	64.4	-137.8	0	0	110.7	S167 H172 R173	S167-E169 PolarHBondContact O-N 2.99Å; E169-H172 WeakPolarHBondContact O-CB 3.45Å; E169-H172 PolarHBondContact O-N 3.3Å; E169-R173 WeakPolarHBondContact O-CG 3.45Å; E169-R173 PolarHBondContact O-N 3.08Å; E169-R173 VanDerWaalsContact O-N 3.13Å
170	K	93.9	Very high	93.7	Very high	68 Å²	68	79.4 Å²	79.4	30%	0.296	37%	0.365	S	S	.	.	H	α-helix	trans	-68.1	-42.6	174.5	-178	168.8	172	-173.7	0	111.3	V166 S167 R168 H172 R173 M174	V166-K170 HydrophobicContact CG1-CB 3.96Å; V166-K170 HydrophobicContact CG1-CD 3.76Å; V166-K170 HydrophobicContact CG1-CG 3.74Å; S167-K170 WeakPolarHBondContact O-CB 3.47Å; S167-K170 PolarHBondContact O-N 3.42Å; S167-K170 VanDerWaalsContact O-N 3.08Å; S167-K170 WeakPolarHBondContact OG-CB 3.35Å; S167-K170 PolarHBondContact OG-N 3.07Å; R168-K170 VanDerWaalsContact C-N 3.33Å; R168-K170 PolarHBondContact O-N 3.35Å; K170-H172 VanDerWaalsContact C-N 3.31Å; K170-H172 PolarHBondContact O-N 3.3Å; K170-R173 PolarHBondContact O-N 3.26Å; K170-M174 HydrophobicContact CG-SD 4.15Å; K170-M174 VanDerWaalsContact O-CG 3.26Å; K170-M174 WeakPolarHBondContact O-CG 3.42Å; K170-M174 PolarHBondContact O-N 3.3Å
171	I	96.3	Very high	93.5	Very high	0 Å²	0	78.7 Å²	78.7	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-61.6	-40.6	175.3	-67	170.6	0	0	0	110.9	V155 L158 A159 V166 S167 R168 M174 K175	V155-I171 HydrophobicContact CB-CG2 4.49Å; V155-I171 HydrophobicContact CG1-CB 4.33Å; V155-I171 HydrophobicContact CG1-CG2 4.09Å; V155-I171 HydrophobicContact CG2-CG2 4.44Å; L158-I171 HydrophobicContact CB-CD1 4.15Å; L158-I171 HydrophobicContact CB-CG2 3.94Å; L158-I171 HydrophobicContact CD1-CG2 3.81Å; A159-I171 HydrophobicContact CB-CD1 4.06Å; V166-I171 HydrophobicContact CB-CD1 4.32Å; V166-I171 HydrophobicContact CB-CG1 4.17Å; V166-I171 HydrophobicContact CG1-CD1 4.38Å; V166-I171 HydrophobicContact CG1-CG1 3.7Å; S167-I171 WeakPolarHBondContact O-CG1 3.41Å; S167-I171 PolarHBondContact O-N 3.02Å; R168-I171 PolarHBondContact O-N 3.31Å; I171-M174 PolarHBondContact O-N 3.16Å; I171-K175 WeakPolarHBondContact O-CB 3.05Å; I171-K175 PolarHBondContact O-N 2.81Å
172	H	96.6	Very high	93.4	Very high	91 Å²	91	75 Å²	75	42%	0.421	36%	0.362	S	S	.	.	H	α-helix	trans	-56.9	-51.1	174.2	-169.1	-82.4	0	0	0	111.5	V155 R168 E169 K170 M174 K175 E176	V155-H172 HydrophobicContact CG1-CB 4.16Å; R168-H172 PolarHBondContact O-N 3.1Å; E169-H172 WeakPolarHBondContact O-CB 3.45Å; E169-H172 PolarHBondContact O-N 3.3Å; K170-H172 VanDerWaalsContact C-N 3.31Å; K170-H172 PolarHBondContact O-N 3.3Å; H172-M174 VanDerWaalsContact C-N 3.27Å; H172-M174 PolarHBondContact O-N 3.3Å; H172-K175 WeakPolarHBondContact O-CB 2.83Å; H172-K175 PolarHBondContact O-N 3.23Å; H172-K175 VanDerWaalsContact O-N 3.09Å; H172-E176 IonicContact CE1-OE1 2.67Å; H172-E176 PolarHBondContact CE1-OE1 3.44Å; H172-E176 IonicContact ND1-OE1 2.79Å; H172-E176 PolarHBondContact ND1-OE1 3.33Å; H172-E176 IonicContact ND1-OE2 3.39Å; H172-E176 PolarHBondContact O-N 3.01Å
173	R	95.9	Very high	93.6	Very high	133 Å²	133	77.5 Å²	77.5	50%	0.502	38%	0.378	S	S	.	.	H	α-helix	trans	-64.2	-29.3	176.9	-66.8	176.7	-171.8	178.6	1.9	113.4	E169 K170 R177	E169-R173 WeakPolarHBondContact O-CG 3.45Å; E169-R173 PolarHBondContact O-N 3.08Å; E169-R173 VanDerWaalsContact O-N 3.13Å; K170-R173 PolarHBondContact O-N 3.26Å; R173-R177 WeakPolarHBondContact O-CG 3.49Å; R173-R177 PolarHBondContact O-NE 3.25Å
174	M	95.7	Very high	93.9	Very high	16 Å²	16	74 Å²	74	8%	0.079	36%	0.358	C	S	.	.	H	α-helix	trans	-72.2	-38.6	173.2	-70.2	171.7	78	0	0	111	L52 P53 T121 L123 V166 K170 I171 H172 R177 Y178	L52-M174 HydrophobicContact CD2-CB 3.68Å; P53-M174 VanDerWaalsContact CD-CE 3.5Å; P53-M174 HydrophobicContact CG-CE 3.6Å; P53-M174 HydrophobicContact CG-SD 3.96Å; T121-M174 HydrophobicContact CG2-CE 4.05Å; L123-M174 HydrophobicContact CD1-CB 3.9Å; L123-M174 HydrophobicContact CD1-CE 3.84Å; L123-M174 HydrophobicContact CD1-CG 3.93Å; L123-M174 HydrophobicContact CD2-CE 4.28Å; L123-M174 HydrophobicContact CG-CE 4.45Å; V166-M174 HydrophobicContact CG1-SD 4.22Å; K170-M174 HydrophobicContact CG-SD 4.15Å; K170-M174 VanDerWaalsContact O-CG 3.26Å; K170-M174 WeakPolarHBondContact O-CG 3.42Å; K170-M174 PolarHBondContact O-N 3.3Å; I171-M174 PolarHBondContact O-N 3.16Å; H172-M174 VanDerWaalsContact C-N 3.27Å; H172-M174 PolarHBondContact O-N 3.3Å; M174-R177 PolarHBondContact O-N 3.38Å; M174-Y178 PolarHBondContact O-N 2.83Å; M174-Y178 VanDerWaalsContact O-N 3.16Å
175	K	96.4	Very high	94.5	Very high	84 Å²	84	77.4 Å²	77.4	37%	0.365	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-45.9	175.7	-178.9	-178.5	170.7	179.1	0	111.7	L52 F153 V155 I171 H172 R177 Y178	L52-K175 HydrophobicContact CD1-CB 3.68Å; L52-K175 HydrophobicContact CD1-CG 4.02Å; L52-K175 HydrophobicContact CD2-CB 4.42Å; F153-K175 WeakPolarHBondContact O-CE 3.37Å; F153-K175 PolarHBondContact O-NZ 3.38Å; V155-K175 HydrophobicContact CG2-CD 3.67Å; I171-K175 WeakPolarHBondContact O-CB 3.05Å; I171-K175 PolarHBondContact O-N 2.81Å; H172-K175 WeakPolarHBondContact O-CB 2.83Å; H172-K175 PolarHBondContact O-N 3.23Å; H172-K175 VanDerWaalsContact O-N 3.09Å; K175-R177 PolarHBondContact O-N 3.4Å; K175-Y178 VanDerWaalsContact O-CB 3.28Å; K175-Y178 WeakPolarHBondContact O-CB 3.08Å; K175-Y178 PolarHBondContact O-N 3.49Å; K175-Y178 VanDerWaalsContact O-N 3.1Å
176	E	96.1	Very high	94.9	Very high	133 Å²	133	76.7 Å²	76.7	62%	0.621	36%	0.359	S	S	*	.	H	α-helix	trans	-60.4	-30.6	178.6	-71.8	173.4	145.9	0	0	112.9	H172	H172-E176 IonicContact CE1-OE1 2.67Å; H172-E176 PolarHBondContact CE1-OE1 3.44Å; H172-E176 IonicContact ND1-OE1 2.79Å; H172-E176 PolarHBondContact ND1-OE1 3.33Å; H172-E176 IonicContact ND1-OE2 3.39Å; H172-E176 PolarHBondContact O-N 3.01Å
177	R	94.1	Very high	95.2	Very high	123 Å²	123	75.7 Å²	75.7	46%	0.464	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-0.2	179.5	-66.6	-176.3	-65.5	147.7	1.6	113.7	H124 R173 M174 K175 E179	H124-R177 PolarHBondContact CE1-O 3.3Å; R173-R177 WeakPolarHBondContact O-CG 3.49Å; R173-R177 PolarHBondContact O-NE 3.25Å; M174-R177 PolarHBondContact O-N 3.38Å; K175-R177 PolarHBondContact O-N 3.4Å; R177-E179 PolarHBondContact O-N 3.1Å
178	Y	96	Very high	95.3	Very high	9 Å²	9	75.9 Å²	75.9	4%	0.035	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-71.2	117	-177.7	-170.1	-92.9	0	0	0	110.1	R50 L52 L123 E146 F153 M174 K175 H180	R50-Y178 HydrophobicContact CB-CE2 4.48Å; R50-Y178 VanDerWaalsContact CB-OH 3.25Å; R50-Y178 WeakPolarHBondContact CB-OH 3.42Å; L52-Y178 HydrophobicContact CD2-CD2 4.44Å; L123-Y178 HydrophobicContact CD2-CD2 3.74Å; L123-Y178 HydrophobicContact CD2-CE2 4.35Å; E146-Y178 PolarHBondContact OE1-OH 2.83Å; F153-Y178 AromaticContact CE1-CD1 3.81Å; F153-Y178 HydrophobicContact CE1-CD1 3.81Å; F153-Y178 AromaticContact CE1-CE1 3.88Å; F153-Y178 HydrophobicContact CE1-CE1 3.88Å; F153-Y178 HydrophobicContact CE1-CG 4.25Å; F153-Y178 HydrophobicContact CZ-CD1 4.13Å; F153-Y178 AromaticContact CZ-CE1 3.85Å; F153-Y178 HydrophobicContact CZ-CE1 3.85Å; M174-Y178 PolarHBondContact O-N 2.83Å; M174-Y178 VanDerWaalsContact O-N 3.16Å; K175-Y178 VanDerWaalsContact O-CB 3.28Å; K175-Y178 WeakPolarHBondContact O-CB 3.08Å; K175-Y178 PolarHBondContact O-N 3.49Å; K175-Y178 VanDerWaalsContact O-N 3.1Å; Y178-H180 AromaticContact CD1-CE1 3.77Å; Y178-H180 AromaticContact CD1-NE2 3.69Å; Y178-H180 PolarHBondContact O-CE1 3.3Å; Y178-H180 VanDerWaalsContact O-CE1 3.29Å; Y178-H180 PolarHBondContact O-ND1 2.92Å; Y178-H180 VanDerWaalsContact O-ND1 3.08Å
179	E	95.5	Very high	95.2	Very high	69 Å²	69	75.4 Å²	75.4	32%	0.322	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-78.8	129.4	178.2	-71	171.2	-165	0	0	110.6	R50 L123 H124 A125 R177 V182	R50-E179 VanDerWaalsContact CZ-O 3.31Å; R50-E179 PolarHBondContact NH1-O 3.12Å; R50-E179 VanDerWaalsContact NH1-O 3.08Å; R50-E179 PolarHBondContact NH2-O 3.38Å; L123-E179 PolarHBondContact O-N 2.82Å; H124-E179 IonicContact CE1-OE1 3.07Å; H124-E179 IonicContact CG-OE1 3.55Å; H124-E179 IonicContact ND1-OE1 3.39Å; H124-E179 PolarHBondContact ND1-OE1 2.86Å; A125-E179 VanDerWaalsContact CB-OE2 3.31Å; A125-E179 WeakPolarHBondContact CB-OE2 3.09Å; A125-E179 PolarHBondContact N-OE2 3.29Å; R177-E179 PolarHBondContact O-N 3.1Å; E179-V182 HydrophobicContact CB-CG2 4.12Å
180	H	93.3	Very high	95.1	Very high	107 Å²	107	71.7 Å²	71.7	50%	0.495	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-95.5	167	177.6	-60.7	79.2	0	0	0	110.5	F153 Y178 V182	F153-H180 AromaticContact CZ-NE2 3.96Å; Y178-H180 AromaticContact CD1-CE1 3.77Å; Y178-H180 AromaticContact CD1-NE2 3.69Å; Y178-H180 PolarHBondContact O-CE1 3.3Å; Y178-H180 VanDerWaalsContact O-CE1 3.29Å; Y178-H180 PolarHBondContact O-ND1 2.92Å; Y178-H180 VanDerWaalsContact O-ND1 3.08Å; H180-V182 PolarHBondContact O-N 2.88Å; H180-V182 VanDerWaalsContact O-N 3.11Å
181	D	91.6	Very high	95.1	Very high	155 Å²	155	76.3 Å²	76.3	83%	0.829	36%	0.362	S	S	*	.	S	Bend	trans	53.5	37.8	171.5	-51.9	-44.1	0	0	0	114.8	T183	D181-T183 PolarHBondContact O-N 3.49Å
182	V	93.5	Very high	94.7	Very high	20 Å²	20	82.3 Å²	82.3	12%	0.121	39%	0.389	C	S	.	.			trans	-70.5	132.1	179.6	174.7	0	0	0	0	110.6	R50 A125 M128 F144 E179 H180 V187	R50-V182 VanDerWaalsContact CZ-CG2 3.44Å; A125-V182 HydrophobicContact CB-CG1 4.31Å; A125-V182 HydrophobicContact CB-CG2 4.47Å; M128-V182 HydrophobicContact CE-CB 4.48Å; M128-V182 HydrophobicContact CE-CG1 3.79Å; F144-V182 HydrophobicContact CE1-CG1 4.29Å; E179-V182 HydrophobicContact CB-CG2 4.12Å; H180-V182 PolarHBondContact O-N 2.88Å; H180-V182 VanDerWaalsContact O-N 3.11Å; V182-V187 HydrophobicContact CG1-CG2 3.2Å
183	T	95.4	Very high	94.2	Very high	71 Å²	71	82.6 Å²	82.6	44%	0.436	40%	0.398	S	S	.	.			trans	-116.6	164.2	177.5	64.8	0	0	0	0	110.1	D181 H185 S186 V187	D181-T183 PolarHBondContact O-N 3.49Å; T183-H185 PolarHBondContact O-N 3.08Å; T183-S186 PolarHBondContact N-OG 3.1Å; T183-S186 PolarHBondContact O-N 3.2Å; T183-S186 PolarHBondContact O-OG 3.29Å; T183-S186 VanDerWaalsContact O-OG 3.1Å; T183-S186 PolarHBondContact OG1-N 3.25Å; T183-S186 VanDerWaalsContact OG1-N 3.08Å; T183-S186 PolarHBondContact OG1-OG 3.08Å; T183-V187 WeakPolarHBondContact O-CG2 3.46Å; T183-V187 PolarHBondContact O-N 2.84Å
184	F	94.6	Very high	93.3	Very high	74 Å²	74	79 Å²	79	33%	0.325	39%	0.394	S	S	.	.	H	α-helix	trans	-57.6	-39.4	173.2	-175.9	-108.4	0	0	0	111.6	A132 L136 V142 F144 V187 L188	A132-F184 HydrophobicContact CB-CD2 4.36Å; A132-F184 HydrophobicContact CB-CE2 3.93Å; L136-F184 HydrophobicContact CB-CZ 4.45Å; V142-F184 HydrophobicContact CB-CD2 3.86Å; V142-F184 HydrophobicContact CB-CE2 4.09Å; V142-F184 HydrophobicContact CG1-CD2 4.34Å; V142-F184 HydrophobicContact CG2-CD2 3.93Å; V142-F184 HydrophobicContact CG2-CE2 3.62Å; F144-F184 HydrophobicContact CE2-CB 4.27Å; F184-V187 PolarHBondContact O-N 3.09Å; F184-L188 HydrophobicContact CD1-CD1 3.97Å; F184-L188 HydrophobicContact CD1-CG 4.47Å; F184-L188 HydrophobicContact CE1-CD1 3.37Å; F184-L188 HydrophobicContact CE1-CG 4.11Å; F184-L188 HydrophobicContact CE2-CD1 4.42Å; F184-L188 HydrophobicContact CE2-CD2 4.43Å; F184-L188 HydrophobicContact CE2-CG 4.37Å; F184-L188 HydrophobicContact CZ-CD1 3.64Å; F184-L188 HydrophobicContact CZ-CD2 4.22Å; F184-L188 HydrophobicContact CZ-CG 4.05Å; F184-L188 WeakPolarHBondContact O-CG 3.28Å; F184-L188 PolarHBondContact O-N 3.44Å; F184-L188 VanDerWaalsContact O-N 3.08Å
185	H	95.4	Very high	91.6	Very high	126 Å²	126	88.9 Å²	88.9	58%	0.583	43%	0.43	S	S	*	.	H	α-helix	trans	-62.8	-48.9	176.5	-177.6	-100.3	0	0	0	112.1	T183 V187 L188 H189	T183-H185 PolarHBondContact O-N 3.08Å; H185-V187 VanDerWaalsContact C-N 3.3Å; H185-V187 PolarHBondContact O-N 3.3Å; H185-L188 PolarHBondContact O-N 2.89Å; H185-H189 AromaticContact CD2-CE1 3.4Å; H185-H189 PolarHBondContact CD2-CE1 3.28Å; H185-H189 VanDerWaalsContact CD2-CE1 3.4Å; H185-H189 AromaticContact CD2-ND1 3.69Å; H185-H189 AromaticContact CE1-CE1 3.96Å; H185-H189 AromaticContact CE1-ND1 3.94Å; H185-H189 AromaticContact NE2-CE1 3.23Å; H185-H189 PolarHBondContact NE2-CE1 3.14Å; H185-H189 AromaticContact NE2-ND1 3.62Å; H185-H189 AromaticContact NE2-NE2 3.75Å; H185-H189 PolarHBondContact O-N 3.26Å; H185-H189 PolarHBondContact O-ND1 3.45Å
186	S	95.8	Very high	89.5	Confident	43 Å²	43	92.6 Å²	92.6	30%	0.301	45%	0.451	S	S	.	.	H	α-helix	trans	-64.2	-35.2	179.8	66.7	0	0	0	0	112.3	T183 H189 A190	T183-S186 PolarHBondContact N-OG 3.1Å; T183-S186 PolarHBondContact O-N 3.2Å; T183-S186 PolarHBondContact O-OG 3.29Å; T183-S186 VanDerWaalsContact O-OG 3.1Å; T183-S186 PolarHBondContact OG1-N 3.25Å; T183-S186 VanDerWaalsContact OG1-N 3.08Å; T183-S186 PolarHBondContact OG1-OG 3.08Å; S186-H189 PolarHBondContact O-N 3.16Å; S186-A190 WeakPolarHBondContact O-CB 3.32Å; S186-A190 PolarHBondContact O-N 2.77Å
187	V	96.2	Very high	87.2	Confident	0 Å²	0	91.3 Å²	91.3	0%	0	45%	0.448	C	S	.	.	H	α-helix	trans	-64.3	-45.5	174.7	169.4	0	0	0	0	112.7	A125 M128 K129 A132 F144 V182 T183 F184 H185 H189 A190	A125-V187 HydrophobicContact CB-CG2 4.05Å; M128-V187 HydrophobicContact CB-CG1 3.96Å; M128-V187 HydrophobicContact CB-CG2 4.35Å; M128-V187 HydrophobicContact CE-CG2 4.05Å; K129-V187 HydrophobicContact CB-CG1 4.21Å; K129-V187 WeakPolarHBondContact CB-O 3.42Å; K129-V187 WeakPolarHBondContact CD-O 3.5Å; K129-V187 WeakPolarHBondContact CG-O 3.41Å; A132-V187 HydrophobicContact CB-CG1 3.59Å; F144-V187 HydrophobicContact CE1-CG2 3.76Å; F144-V187 HydrophobicContact CZ-CB 4.3Å; F144-V187 HydrophobicContact CZ-CG2 3.69Å; V182-V187 HydrophobicContact CG1-CG2 3.2Å; T183-V187 WeakPolarHBondContact O-CG2 3.46Å; T183-V187 PolarHBondContact O-N 2.84Å; F184-V187 PolarHBondContact O-N 3.09Å; H185-V187 VanDerWaalsContact C-N 3.3Å; H185-V187 PolarHBondContact O-N 3.3Å; V187-H189 PolarHBondContact O-N 3.36Å; V187-A190 PolarHBondContact O-N 3.36Å
188	L	95.5	Very high	84.9	Confident	42 Å²	42	92.5 Å²	92.5	22%	0.22	45%	0.453	C	S	.	.	H	α-helix	trans	-64.4	-31.7	-180	-72	-176.1	0	0	0	112.7	K129 A132 V133 F184 H185	K129-L188 WeakPolarHBondContact CE-O 3.34Å; K129-L188 PolarHBondContact NZ-O 3Å; A132-L188 HydrophobicContact CB-CD2 4.07Å; V133-L188 HydrophobicContact CG2-CD2 3.96Å; F184-L188 HydrophobicContact CD1-CD1 3.97Å; F184-L188 HydrophobicContact CD1-CG 4.47Å; F184-L188 HydrophobicContact CE1-CD1 3.37Å; F184-L188 HydrophobicContact CE1-CG 4.11Å; F184-L188 HydrophobicContact CE2-CD1 4.42Å; F184-L188 HydrophobicContact CE2-CD2 4.43Å; F184-L188 HydrophobicContact CE2-CG 4.37Å; F184-L188 HydrophobicContact CZ-CD1 3.64Å; F184-L188 HydrophobicContact CZ-CD2 4.22Å; F184-L188 HydrophobicContact CZ-CG 4.05Å; F184-L188 WeakPolarHBondContact O-CG 3.28Å; F184-L188 PolarHBondContact O-N 3.44Å; F184-L188 VanDerWaalsContact O-N 3.08Å; H185-L188 PolarHBondContact O-N 2.89Å
189	H	95.2	Very high	82.4	Confident	123 Å²	123	95.9 Å²	95.9	57%	0.569	48%	0.478	S	S	*	.	H	α-helix	trans	-93	-5	-178.8	-63.1	74.6	0	0	0	113.3	H185 S186 V187	H185-H189 AromaticContact CD2-CE1 3.4Å; H185-H189 PolarHBondContact CD2-CE1 3.28Å; H185-H189 VanDerWaalsContact CD2-CE1 3.4Å; H185-H189 AromaticContact CD2-ND1 3.69Å; H185-H189 AromaticContact CE1-CE1 3.96Å; H185-H189 AromaticContact CE1-ND1 3.94Å; H185-H189 AromaticContact NE2-CE1 3.23Å; H185-H189 PolarHBondContact NE2-CE1 3.14Å; H185-H189 AromaticContact NE2-ND1 3.62Å; H185-H189 AromaticContact NE2-NE2 3.75Å; H185-H189 PolarHBondContact O-N 3.26Å; H185-H189 PolarHBondContact O-ND1 3.45Å; S186-H189 PolarHBondContact O-N 3.16Å; V187-H189 PolarHBondContact O-N 3.36Å
190	A	94.9	Very high	79.9	Confident	18 Å²	18	99.6 Å²	99.6	15%	0.149	50%	0.495	C	S	.	.			trans	-68	144.1	179.6	0	0	0	0	0	112	A125 W126 K129 S186 V187	A125-A190 HydrophobicContact CB-CB 3.7Å; W126-A190 HydrophobicContact CB-CB 3.91Å; K129-A190 WeakPolarHBondContact CD-O 3.26Å; K129-A190 PolarHBondContact NZ-O 2.78Å; S186-A190 WeakPolarHBondContact O-CB 3.32Å; S186-A190 PolarHBondContact O-N 2.77Å; V187-A190 PolarHBondContact O-N 3.36Å
191	E	92.6	Very high	77.6	Confident	165 Å²	165	101.2 Å²	101.2	77%	0.771	51%	0.507	S	S	*	.			trans	-120.8	140.3	176.4	-65.3	-171.3	169	0	0	110.4
192	K	88.8	Confident	75.5	Confident	127 Å²	127	101.3 Å²	101.3	55%	0.552	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-71.5	126.5	173.5	-174.4	176.9	-177.8	-178	0	107.7	W126 S194	W126-K192 HydrophobicContact CD2-CB 3.99Å; W126-K192 HydrophobicContact CD2-CG 3.95Å; W126-K192 HydrophobicContact CE3-CB 3.81Å; W126-K192 HydrophobicContact CE3-CD 3.92Å; W126-K192 HydrophobicContact CE3-CG 3.68Å; W126-K192 HydrophobicContact CG-CB 4.35Å; W126-K192 HydrophobicContact CH2-CD 4.13Å; W126-K192 HydrophobicContact CH2-CG 4.1Å; W126-K192 HydrophobicContact CZ2-CG 4.32Å; W126-K192 HydrophobicContact CZ3-CB 4.38Å; W126-K192 HydrophobicContact CZ3-CD 3.62Å; W126-K192 HydrophobicContact CZ3-CG 3.77Å; K192-S194 PolarHBondContact O-N 3.17Å
193	P	85.8	Confident	73	Confident	96 Å²	96	107 Å²	107	62%	0.623	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-54.7	128.6	178.5	-24.9	32.6	0	0	0	111.2
194	S	76.1	Confident	70.6	Confident	59 Å²	59	111.4 Å²	111.4	41%	0.413	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-67.7	147.2	177.8	73.8	0	0	0	0	110.4	K192 M196 N197	K192-S194 PolarHBondContact O-N 3.17Å; S194-M196 PolarHBondContact O-N 3.07Å; S194-M196 VanDerWaalsContact O-N 3.13Å; S194-N197 PolarHBondContact O-N 3.39Å; S194-N197 VanDerWaalsContact OG-CG 3.26Å; S194-N197 PolarHBondContact OG-N 3.32Å; S194-N197 PolarHBondContact OG-OD1 3.26Å
195	R	60.8	Low	67.9	Low	223 Å²	223	111.5 Å²	111.5	84%	0.842	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-21	176.4	-70.4	-173.9	175.1	177.4	0.8	112.7
196	M	52.8	Low	64.9	Low	162 Å²	162	113.5 Å²	113.5	80%	0.798	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-27.7	-176.7	-71.5	-174.3	172.7	0	0	114.8	S194 R198 S199	S194-M196 PolarHBondContact O-N 3.07Å; S194-M196 VanDerWaalsContact O-N 3.13Å; M196-R198 PolarHBondContact O-N 2.99Å; M196-S199 PolarHBondContact O-N 3.13Å
197	N	47.3	Very low	62	Low	106 Å²	106	117.2 Å²	117.2	57%	0.567	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-5.6	-177.4	-78.8	-0.3	0	0	0	114.1	S194 S199	S194-N197 PolarHBondContact O-N 3.39Å; S194-N197 VanDerWaalsContact OG-CG 3.26Å; S194-N197 PolarHBondContact OG-N 3.32Å; S194-N197 PolarHBondContact OG-OD1 3.26Å; N197-S199 VanDerWaalsContact C-N 3.35Å
198	R	46.7	Very low	59	Low	147 Å²	147	122.7 Å²	122.7	56%	0.555	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-11.3	-178.3	-137.2	179	-163.3	-179.8	3.7	114.3	M196	M196-R198 PolarHBondContact O-N 2.99Å
199	S	42.6	Very low	56.1	Low	81 Å²	81	128.1 Å²	128.1	57%	0.566	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-22.1	-175.2	-55.9	0	0	0	0	113.5	M196 N197	M196-S199 PolarHBondContact O-N 3.13Å; N197-S199 VanDerWaalsContact C-N 3.35Å
200	Q	44	Very low	53.1	Low	147 Å²	147	129.5 Å²	129.5	69%	0.687	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-30.9	-178	-79.3	176.4	-26.6	0	0	113.2	R202 N203	Q200-R202 PolarHBondContact O-N 3.43Å; Q200-N203 PolarHBondContact O-N 3.34Å
201	D	44.7	Very low	50.1	Low	140 Å²	140	131.9 Å²	131.9	75%	0.749	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-70	-10.7	175.5	-72.5	-26	0	0	0	113.9
202	R	46.5	Very low	47.1	Very low	157 Å²	157	134.1 Å²	134.1	59%	0.592	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-78.4	-17.7	176.9	-81.5	-169.3	174.1	-172.1	-1.6	114.2	Q200 N204	Q200-R202 PolarHBondContact O-N 3.43Å; R202-N204 VanDerWaalsContact C-N 3.32Å; R202-N204 PolarHBondContact O-N 3.13Å
203	N	42.1	Very low	44.3	Very low	140 Å²	140	138.3 Å²	138.3	75%	0.749	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-83	-5.5	-173.9	-70.9	-17.8	0	0	0	114.1	Q200	Q200-N203 PolarHBondContact O-N 3.34Å
204	N	45.1	Very low	41.7	Very low	164 Å²	164	141 Å²	141	88%	0.877	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-111.1	9.1	179.7	-83.3	-2.8	0	0	0	114.7	R202	R202-N204 VanDerWaalsContact C-N 3.32Å; R202-N204 PolarHBondContact O-N 3.13Å
205	A	37.4	Very low	39.5	Very low	75 Å²	75	143.7 Å²	143.7	62%	0.62	72%	0.72	S	S	*	*	S	Bend	trans	-123.9	124.4	177.2	0	0	0	0	0	111.5
206	L	32.3	Very low	38.5	Very low	169 Å²	169	136.9 Å²	136.9	89%	0.885	71%	0.707	S	S	*	*			trans	-55.6	150.7	176.3	-77.7	159.1	0	0	0	112.3	S208	L206-S208 PolarHBondContact O-N 3.44Å
207	P	35.7	Very low	37.8	Very low	120 Å²	120	133.2 Å²	133.2	78%	0.779	69%	0.685	S	S	*	*			trans	-79.7	114.6	-162.2	30.9	-32.4	0	0	0	111.5
208	S	32.9	Very low	37	Very low	116 Å²	116	132.1 Å²	132.1	81%	0.811	68%	0.682	S	S	*	*			trans	-102.5	113.1	157.8	-166.3	0	0	0	0	108.9	L206 N210	L206-S208 PolarHBondContact O-N 3.44Å; S208-N210 PolarHBondContact O-N 3.38Å
209	N	33.6	Very low	36.2	Very low	156 Å²	156	133.5 Å²	133.5	83%	0.834	70%	0.695	S	S	*	*	S	Bend	trans	-63.3	99	178.5	-96.7	-16.3	0	0	0	111.5
210	N	32.8	Very low	35.8	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	70%	0.701	S	S	*	*			trans	178.3	73	130.3	-109.3	-21	0	0	0	109.6	S208 R212	S208-N210 PolarHBondContact O-N 3.38Å; N210-R212 PolarHBondContact O-N 3.47Å
211	A	31.8	Very low	35.2	Very low	68 Å²	68	136.1 Å²	136.1	56%	0.562	71%	0.706	S	S	*	*			trans	-88.5	95.8	176.2	0	0	0	0	0	110.5
212	R	29.9	Very low	34.7	Very low	212 Å²	212	137.5 Å²	137.5	80%	0.8	71%	0.714	S	S	*	*			trans	-100	111.5	159.1	-75.6	-172.2	-172.7	162.9	3.3	110.2	N210	N210-R212 PolarHBondContact O-N 3.47Å
213	Y	29	Very low	34	Very low	215 Å²	215	141.2 Å²	141.2	84%	0.843	73%	0.728	S	S	*	*			trans	13	121.7	153.7	-64.2	-89.9	0	0	0	119.6
214	W	31.4	Very low	33.4	Very low	153 Å²	153	146.4 Å²	146.4	58%	0.58	74%	0.737	S	S	*	*			trans	-103.2	110.8	177.2	-75.5	92.2	0	0	0	112.1
215	N	30.3	Very low	32.6	Very low	114 Å²	114	143 Å²	143	61%	0.61	73%	0.731	S	S	*	*			trans	-96.2	130	143.8	-88.3	-31.4	0	0	0	107.6	Y217	N215-Y217 PolarHBondContact O-N 3.06Å; N215-Y217 VanDerWaalsContact O-N 3.17Å
216	S	40.3	Very low	32.2	Very low	81 Å²	81	149 Å²	149	57%	0.566	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	121	164.2	49.1	0	0	0	0	106.3
217	Y	37.5	Very low	31.9	Very low	85 Å²	85	144.6 Å²	144.6	33%	0.333	74%	0.742	S	S	.	*	T	Hydrogen-bonded Turn	trans	86	48.8	-177.3	-46	-83.5	0	0	0	117.8	F89 P91 L94 N215	F89-Y217 HydrophobicContact CE1-CD1 4.41Å; F89-Y217 AromaticContact CZ-CD1 3.91Å; F89-Y217 HydrophobicContact CZ-CD1 3.91Å; F89-Y217 HydrophobicContact CZ-CG 4.43Å; P91-Y217 VanDerWaalsContact CB-CB 3.41Å; P91-Y217 WeakPolarHBondContact CB-O 3.4Å; P91-Y217 WeakPolarHBondContact CG-O 3.31Å; L94-Y217 HydrophobicContact CD2-CD1 4.03Å; L94-Y217 HydrophobicContact CD2-CD2 3.33Å; L94-Y217 HydrophobicContact CD2-CE1 3.76Å; L94-Y217 HydrophobicContact CD2-CE2 3.06Å; L94-Y217 HydrophobicContact CD2-CG 3.85Å; N215-Y217 PolarHBondContact O-N 3.06Å; N215-Y217 VanDerWaalsContact O-N 3.17Å
218	T	31.4	Very low	31.5	Very low	83 Å²	83	142.7 Å²	142.7	51%	0.509	74%	0.744	S	S	.	*			trans	-149.8	124.5	154.5	43.8	0	0	0	0	110.9	P91	P91-T218 HydrophobicContact CG-CG2 3.88Å
219	E	29.4	Very low	31.3	Very low	176 Å²	176	147 Å²	147	82%	0.822	75%	0.748	S	S	*	*			trans	173.3	101.3	133.5	-96.6	-179.3	-179.8	0	0	109.7
220	F	32.8	Very low	31.1	Very low	160 Å²	160	145.5 Å²	145.5	70%	0.702	75%	0.745	S	S	*	*			trans	-132.1	137.1	148.7	-74.7	-70.4	0	0	0	107.7	N222	F220-N222 PolarHBondContact O-N 3.21Å
221	P	31.9	Very low	30.9	Very low	122 Å²	122	145.4 Å²	145.4	79%	0.792	75%	0.745	S	S	*	*			trans	-80.7	108.9	-178.8	30.8	-30.2	0	0	0	109.9	R223	P221-R223 PolarHBondContact O-N 3.07Å
222	N	33.9	Very low	30.9	Very low	169 Å²	169	150.4 Å²	150.4	90%	0.904	76%	0.757	S	S	*	*			trans	-80.3	105.7	162.3	-97.9	-17.1	0	0	0	108.8	F220 R224	F220-N222 PolarHBondContact O-N 3.21Å; N222-R224 PolarHBondContact O-N 3.38Å
223	R	32.2	Very low	30.8	Very low	235 Å²	235	144.7 Å²	144.7	89%	0.887	75%	0.749	S	S	*	*			trans	-70.1	120.5	155.3	-77.6	-174.7	-173.9	-179.6	2.4	107.6	P221	P221-R223 PolarHBondContact O-N 3.07Å
224	R	29.1	Very low	31	Very low	249 Å²	249	140.1 Å²	140.1	94%	0.94	75%	0.748	S	S	*	*				-178.3	161.4	125.5	-100.7	171.3	-171.8	-173.2	3.4	112.8	N222	N222-R224 PolarHBondContact O-N 3.38Å
225	A	28.3	Very low	31.2	Very low	93 Å²	93	142.4 Å²	142.4	77%	0.769	76%	0.758	S	S	*	*			trans	-78.6	173.1	-160.6	0	0	0	0	0	115.4
226	H	29.1	Very low	31.4	Very low	201 Å²	201	144.4 Å²	144.4	93%	0.931	77%	0.769	S	S	*	*			trans	-39.7	150.1	-178.5	-70.1	-81.8	0	0	0	120.2
227	G	27.1	Very low	31.4	Very low	77 Å²	77	149.3 Å²	149.3	79%	0.794	78%	0.775	S	S	*	*			trans	151	101.4	155.7	0	0	0	0	0	109.1
228	G	26.2	Very low	31.4	Very low	80 Å²	80	157 Å²	157	83%	0.825	80%	0.803	S	S	*	*				108.8	115.9	80.1	0	0	0	0	0	109.3
229	F	29.3	Very low	31.4	Very low	205 Å²	205	157 Å²	157	90%	0.899	82%	0.82	S	S	*	*			trans	-62.3	146.1	-171.5	-78.5	-106.1	0	0	0	115.4
230	T	30.1	Very low	31.3	Very low	126 Å²	126	152.2 Å²	152.2	77%	0.773	82%	0.818	S	S	*	*				160.4	149.1	104.1	43.4	0	0	0	0	113.4
231	N	27.4	Very low	31.4	Very low	150 Å²	150	150.4 Å²	150.4	80%	0.802	82%	0.824	S	S	*	*			trans	95.9	131	150.5	-91.1	6.7	0	0	0	123.6
232	E	31.8	Very low	31.4	Very low	173 Å²	173	153.6 Å²	153.6	81%	0.808	83%	0.828	S	S	*	*			trans	-36.6	138.9	167.8	-71.2	172.4	105.6	0	0	114
233	S	28	Very low	31.5	Very low	92 Å²	92	154.4 Å²	154.4	64%	0.643	83%	0.826	S	S	*	*			trans	-166	131	131.4	-84.8	0	0	0	0	111.3	Y235	S233-Y235 WeakPolarHBondContact O-CD2 3.48Å; S233-Y235 WeakPolarHBondContact O-CE2 3.41Å
234	S	34	Very low	31.4	Very low	118 Å²	118	146.6 Å²	146.6	83%	0.825	82%	0.819	S	S	*	*			trans	-64.2	122	173.1	28.9	0	0	0	0	111.7	N236	S234-N236 PolarHBondContact O-N 3.28Å
235	Y	34.7	Very low	31.7	Very low	201 Å²	201	149.5 Å²	149.5	79%	0.788	83%	0.832	S	S	*	*			trans	-98.3	88.8	174.7	-67.9	-72.9	0	0	0	111.4	S233	S233-Y235 WeakPolarHBondContact O-CD2 3.48Å; S233-Y235 WeakPolarHBondContact O-CE2 3.41Å
236	N	34.4	Very low	31.9	Very low	156 Å²	156	152.3 Å²	152.3	83%	0.834	84%	0.835	S	S	*	*			trans	-77.4	116.7	150.1	-92.4	-39.1	0	0	0	108.3	S234	S234-N236 PolarHBondContact O-N 3.28Å
237	R	40.1	Very low	32	Very low	185 Å²	185	149.7 Å²	149.7	70%	0.698	83%	0.83	S	S	*	*			trans	-128.9	100.7	155.7	-83.9	-165.5	-156.8	-157	4.5	111.2	E83	E83-R237 VanDerWaalsContact CD-NH1 3.29Å; E83-R237 IonicContact OE1-CZ 3.2Å; E83-R237 IonicContact OE1-NH1 3.78Å; E83-R237 PolarHBondContact OE1-NH1 3.44Å; E83-R237 IonicContact OE2-NH1 2.86Å; E83-R237 PolarHBondContact OE2-NH1 2.96Å
238	R	37.8	Very low	32.3	Very low	245 Å²	245	153.8 Å²	153.8	93%	0.925	83%	0.832	S	S	*	*			trans	-74.7	139.5	159.4	-78.3	-179.8	171.9	-168.2	-1.2	109.5
239	G	30.9	Very low	32.7	Very low	84 Å²	84	158.1 Å²	158.1	87%	0.866	83%	0.832	S	S	*	*				77.7	113.8	126.7	0	0	0	0	0	118.6
240	G	28.6	Very low	32.9	Very low	76 Å²	76	155.2 Å²	155.2	78%	0.784	83%	0.828	S	S	*	*			trans	-172.3	86.3	163.3	0	0	0	0	0	111.5
241	C	35.3	Very low	33.1	Very low	122 Å²	122	157.1 Å²	157.1	82%	0.824	83%	0.832	S	S	*	*			trans	-72.8	123.1	164.7	-62.3	0	0	0	0	108.2
242	H	31.8	Very low	33.5	Very low	188 Å²	188	157.6 Å²	157.6	87%	0.87	83%	0.834	S	S	*	*			trans	-115.8	111.9	162.4	-90.1	-34.4	0	0	0	110.3
243	H	35.7	Very low	33.6	Very low	186 Å²	186	156.5 Å²	156.5	86%	0.861	84%	0.836	S	S	*	*			trans	-77.7	131.3	153.1	-79.5	37	0	0	0	107.5
244	G	30.6	Very low	34.1	Very low	71 Å²	71	161.8 Å²	161.8	73%	0.732	85%	0.852	S	S	*	*			trans	-144.3	122.4	166.8	0	0	0	0	0	107.1
245	Y	34.9	Very low	34.1	Very low	310 Å²	310	165.8 Å²	165.8	100%	1.216	85%	0.854	S	S	*	*			trans	-43.2	0	-172.8	-61.7	-92.6	0	0	0	116.6

Retrieved 245 of 245 residues in 46.1 ms (Link to these results)

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