A0A087WRE9_MOUSE Loading...

E3 ubiquitin-protein ligase RING2

AlphaFold DB , UniProt , Accession A0A087WRE9, Species MOUSE (Mus musculus, Mouse), Gene Rnf2, Length 264 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	47.4	Very low	244 Å²	244	140.2 Å²	140.2	100%	1.202	80%	0.799	S	S	*	*				0	129.8	0	-62.4	161.3	-175	0	0	106.1
2	S	35.8	Very low	50.7	Low	118 Å²	118	135.3 Å²	135.3	83%	0.825	78%	0.776	S	S	*	*			cis	-131.1	144.8	12.7	-60.1	0	0	0	0	111.3
3	Q	35.5	Very low	53.1	Low	192 Å²	192	134.6 Å²	134.6	90%	0.897	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-78.8	129.3	166	-71.8	176.6	-11.3	0	0	108.2	V5	Q3-V5 PolarHBondContact O-N 3.04Å
4	A	35.7	Very low	55.4	Low	95 Å²	95	132.1 Å²	132.1	79%	0.785	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-74.4	119.1	172.1	0	0	0	0	0	108.9	Q6	A4-Q6 PolarHBondContact O-N 3.24Å
5	V	38.1	Very low	57.7	Low	124 Å²	124	130.9 Å²	130.9	75%	0.752	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-66	119	173.4	176.8	0	0	0	0	108.1	Q3 T7	Q3-V5 PolarHBondContact O-N 3.04Å; V5-T7 HydrophobicContact CG1-CG2 4.35Å; V5-T7 PolarHBondContact O-N 3.12Å
6	Q	39	Very low	59.9	Low	192 Å²	192	127.8 Å²	127.8	90%	0.897	73%	0.73	S	S	*	*			trans	-71.4	94.5	169.4	-71.1	-177.7	-9.6	0	0	108.5	A4	A4-Q6 PolarHBondContact O-N 3.24Å
7	T	42	Very low	61.8	Low	115 Å²	115	131.8 Å²	131.8	71%	0.706	73%	0.73	S	S	*	*			trans	-72.3	131.8	168.7	47.9	0	0	0	0	109.1	V5 G9	V5-T7 HydrophobicContact CG1-CG2 4.35Å; V5-T7 PolarHBondContact O-N 3.12Å; T7-G9 PolarHBondContact O-N 3.41Å
8	N	49.6	Very low	63.7	Low	185 Å²	185	132.2 Å²	132.2	99%	0.989	73%	0.726	S	S	*	*			trans	-77.3	57.6	175.6	-113.3	-19.1	0	0	0	110.5
9	G	51.8	Low	65.4	Low	41 Å²	41	130.4 Å²	130.4	42%	0.423	72%	0.715	S	S	.	*	P	Polyproline II helix	trans	-88.7	127.5	176.8	0	0	0	0	0	111.3	T7 Q11	T7-G9 PolarHBondContact O-N 3.41Å; G9-Q11 PolarHBondContact O-N 3.44Å; G9-Q11 PolarHBondContact O-NE2 2.93Å; G9-Q11 VanDerWaalsContact O-NE2 3.08Å
10	T	71.8	Confident	66.9	Low	145 Å²	145	126.4 Å²	126.4	89%	0.89	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-47.2	123	167.6	-51.9	0	0	0	0	109.4
11	Q	82.6	Confident	68.2	Low	91 Å²	91	127.6 Å²	127.6	43%	0.425	70%	0.701	S	S	.	*	P	Polyproline II helix	trans	-65.5	148.6	-178.9	-62.6	-60.9	-80.4	0	0	110.3	G9 L13 T16	G9-Q11 PolarHBondContact O-N 3.44Å; G9-Q11 PolarHBondContact O-NE2 2.93Å; G9-Q11 VanDerWaalsContact O-NE2 3.08Å; Q11-L13 PolarHBondContact O-N 3.24Å; Q11-T16 PolarHBondContact O-OG1 2.8Å
12	P	86.4	Confident	70.9	Confident	81 Å²	81	122.6 Å²	122.6	53%	0.526	67%	0.67	S	S	.	*	P	Polyproline II helix	trans	-53.8	140.9	173.8	-25.3	34.5	0	0	0	111.2	S14 K15 T16	P12-S14 PolarHBondContact O-N 3.15Å; P12-S14 VanDerWaalsContact O-N 3.1Å; P12-K15 WeakPolarHBondContact O-CA 3.24Å; P12-K15 WeakPolarHBondContact O-CB 3.43Å; P12-K15 PolarHBondContact O-N 3.34Å; P12-T16 PolarHBondContact O-N 3.28Å; P12-T16 PolarHBondContact O-OG1 3.08Å
13	L	81.4	Confident	73.8	Confident	127 Å²	127	120.8 Å²	120.8	67%	0.665	65%	0.648	S	S	*	*	H	α-helix	trans	-52.7	-39.2	-174.2	-175.5	66.2	0	0	0	113	Q11 K15 T16 W17	Q11-L13 PolarHBondContact O-N 3.24Å; L13-K15 VanDerWaalsContact C-N 3.26Å; L13-K15 PolarHBondContact O-N 3.34Å; L13-T16 PolarHBondContact O-N 3.07Å; L13-W17 VanDerWaalsContact O-CD1 3.26Å; L13-W17 PolarHBondContact O-N 2.85Å
14	S	86.1	Confident	76.7	Confident	100 Å²	100	117.2 Å²	117.2	70%	0.699	64%	0.635	S	S	*	*	H	α-helix	trans	-60.9	-30.4	176	49.5	0	0	0	0	114.1	P12 E18	P12-S14 PolarHBondContact O-N 3.15Å; P12-S14 VanDerWaalsContact O-N 3.1Å; S14-E18 PolarHBondContact O-N 2.72Å
15	K	90.3	Very high	79.6	Confident	113 Å²	113	118.6 Å²	118.6	49%	0.491	63%	0.625	S	S	.	*	H	α-helix	trans	-89.1	-30	179.8	-170.3	179.7	175.9	-161.7	0	112.3	P12 L13 W17 E18	P12-K15 WeakPolarHBondContact O-CA 3.24Å; P12-K15 WeakPolarHBondContact O-CB 3.43Å; P12-K15 PolarHBondContact O-N 3.34Å; L13-K15 VanDerWaalsContact C-N 3.26Å; L13-K15 PolarHBondContact O-N 3.34Å; K15-W17 PolarHBondContact O-N 2.97Å; K15-E18 WeakPolarHBondContact O-CB 3.38Å; K15-E18 PolarHBondContact O-N 3.41Å
16	T	91.8	Very high	82.4	Confident	82 Å²	82	119.3 Å²	119.3	50%	0.503	61%	0.614	S	S	.	*	H	α-helix	trans	-64.5	-26.8	173.6	-57.4	0	0	0	0	112.4	Q11 P12 L13	Q11-T16 PolarHBondContact O-OG1 2.8Å; P12-T16 PolarHBondContact O-N 3.28Å; P12-T16 PolarHBondContact O-OG1 3.08Å; L13-T16 PolarHBondContact O-N 3.07Å
17	W	93.1	Very high	85.2	Confident	195 Å²	195	114.9 Å²	114.9	74%	0.739	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	16.5	176.2	-57.8	108.8	0	0	0	113.3	L13 K15 L19	L13-W17 VanDerWaalsContact O-CD1 3.26Å; L13-W17 PolarHBondContact O-N 2.85Å; K15-W17 PolarHBondContact O-N 2.97Å; W17-L19 PolarHBondContact O-N 3.12Å
18	E	95.3	Very high	87.8	Confident	140 Å²	140	114.1 Å²	114.1	65%	0.654	60%	0.598	S	S	*	*			trans	-76.4	112.7	176.2	-176.7	171.8	-156.1	0	0	110	S14 K15	S14-E18 PolarHBondContact O-N 2.72Å; K15-E18 WeakPolarHBondContact O-CB 3.38Å; K15-E18 PolarHBondContact O-N 3.41Å
19	L	95.8	Very high	90	Very high	97 Å²	97	112.2 Å²	112.2	51%	0.508	58%	0.583	S	S	.	*			trans	-74.1	131.2	-178	-60.6	-179.1	0	0	0	111.4	W17 E23 L24	W17-L19 PolarHBondContact O-N 3.12Å; L19-E23 HydrophobicContact CB-CB 4.17Å; L19-E23 HydrophobicContact CD2-CB 4.21Å; L19-L24 HydrophobicContact CB-CD2 4.07Å; L19-L24 HydrophobicContact CB-CG 4Å; L19-L24 HydrophobicContact CD1-CD2 4.01Å
20	S	95.2	Very high	92	Very high	51 Å²	51	118 Å²	118	36%	0.357	60%	0.599	S	S	.	*			trans	-66.6	162	171.2	67.6	0	0	0	0	112.3	Y22 E23 L24	S20-Y22 PolarHBondContact O-N 2.65Å; S20-Y22 VanDerWaalsContact O-N 3.1Å; S20-E23 WeakPolarHBondContact CB-OE2 3.4Å; S20-E23 PolarHBondContact N-OE2 3.37Å; S20-E23 PolarHBondContact O-N 2.91Å; S20-E23 WeakPolarHBondContact OG-CG 3.41Å; S20-E23 PolarHBondContact OG-N 2.88Å; S20-E23 PolarHBondContact OG-OE2 3.21Å; S20-L24 WeakPolarHBondContact O-CG 3.45Å; S20-L24 PolarHBondContact O-N 2.71Å
21	L	95.8	Very high	93	Very high	152 Å²	152	114.7 Å²	114.7	80%	0.796	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-26.5	172.8	-64.4	179.6	0	0	0	113.1	L24 Q25	L21-L24 HydrophobicContact CD2-CD1 4.36Å; L21-Q25 VanDerWaalsContact O-CG 3.31Å; L21-Q25 WeakPolarHBondContact O-CG 3.22Å
22	Y	96.1	Very high	93.3	Very high	138 Å²	138	116.1 Å²	116.1	54%	0.541	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.8	-44	172.5	168.3	-107.3	0	0	0	111.8	S20 L24 Q25 R26	S20-Y22 PolarHBondContact O-N 2.65Å; S20-Y22 VanDerWaalsContact O-N 3.1Å; Y22-L24 VanDerWaalsContact C-N 3.34Å; Y22-L24 PolarHBondContact O-N 3.09Å; Y22-Q25 WeakPolarHBondContact O-CG 3.23Å; Y22-Q25 PolarHBondContact O-N 2.85Å; Y22-Q25 PolarHBondContact O-NE2 2.89Å; Y22-R26 PolarHBondContact O-N 3.18Å
23	E	96.8	Very high	93.6	Very high	80 Å²	80	118.5 Å²	118.5	37%	0.374	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.1	-26.4	-179	-70.5	158.9	119.3	0	0	113.4	L19 S20 Q25 R26	L19-E23 HydrophobicContact CB-CB 4.17Å; L19-E23 HydrophobicContact CD2-CB 4.21Å; S20-E23 WeakPolarHBondContact CB-OE2 3.4Å; S20-E23 PolarHBondContact N-OE2 3.37Å; S20-E23 PolarHBondContact O-N 2.91Å; S20-E23 WeakPolarHBondContact OG-CG 3.41Å; S20-E23 PolarHBondContact OG-N 2.88Å; S20-E23 PolarHBondContact OG-OE2 3.21Å; E23-Q25 PolarHBondContact O-N 2.93Å; E23-R26 WeakPolarHBondContact O-CG 3.21Å
24	L	96.6	Very high	94	Very high	117 Å²	117	118.4 Å²	118.4	61%	0.613	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-19.8	172.6	-71.9	166.1	0	0	0	113.6	L19 S20 L21 Y22	L19-L24 HydrophobicContact CB-CD2 4.07Å; L19-L24 HydrophobicContact CB-CG 4Å; L19-L24 HydrophobicContact CD1-CD2 4.01Å; S20-L24 WeakPolarHBondContact O-CG 3.45Å; S20-L24 PolarHBondContact O-N 2.71Å; L21-L24 HydrophobicContact CD2-CD1 4.36Å; Y22-L24 VanDerWaalsContact C-N 3.34Å; Y22-L24 PolarHBondContact O-N 3.09Å
25	Q	96.7	Very high	94.1	Very high	124 Å²	124	116.8 Å²	116.8	58%	0.579	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.7	-0.4	-178.8	65	78.2	75.4	0	0	114.6	L21 Y22 E23 T27	L21-Q25 VanDerWaalsContact O-CG 3.31Å; L21-Q25 WeakPolarHBondContact O-CG 3.22Å; Y22-Q25 WeakPolarHBondContact O-CG 3.23Å; Y22-Q25 PolarHBondContact O-N 2.85Å; Y22-Q25 PolarHBondContact O-NE2 2.89Å; E23-Q25 PolarHBondContact O-N 2.93Å; Q25-T27 PolarHBondContact O-N 2.73Å
26	R	96.5	Very high	94.1	Very high	139 Å²	139	116.6 Å²	116.6	53%	0.525	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-64.3	133.4	-172.3	67.1	-177.3	-75.9	-156.3	-4	111.6	Y22 E23	Y22-R26 PolarHBondContact O-N 3.18Å; E23-R26 WeakPolarHBondContact O-CG 3.21Å
27	T	97.3	Very high	94	Very high	100 Å²	100	121 Å²	121	61%	0.613	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-78.6	166.3	166.5	57.4	0	0	0	0	110.6	Q25	Q25-T27 PolarHBondContact O-N 2.73Å
28	P	97.4	Very high	93.7	Very high	99 Å²	99	117.5 Å²	117.5	64%	0.643	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-50.6	154.8	158.8	-25.6	36.1	0	0	0	111.8
29	Q	95.1	Very high	93.4	Very high	144 Å²	144	117.6 Å²	117.6	67%	0.673	63%	0.631	S	S	*	*			trans	-96.4	113.3	168.1	-69.5	-68.5	-52	0	0	107
30	E	94.8	Very high	93.1	Very high	164 Å²	164	117 Å²	117	77%	0.766	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-67.1	145.1	179.8	-66.5	-55.7	140.7	0	0	111.5	I32	E30-I32 PolarHBondContact O-N 2.73Å
31	A	91.3	Very high	92.9	Very high	75 Å²	75	117.2 Å²	117.2	62%	0.62	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-74.3	125.6	179.6	0	0	0	0	0	110.9	T33	A31-T33 HydrophobicContact CB-CG2 4.28Å; A31-T33 WeakPolarHBondContact O-CG2 3.36Å; A31-T33 PolarHBondContact O-N 2.99Å; A31-T33 VanDerWaalsContact O-N 3.15Å; A31-T33 PolarHBondContact O-OG1 2.92Å; A31-T33 VanDerWaalsContact O-OG1 3.08Å
32	I	90.4	Very high	92.5	Very high	121 Å²	121	115.2 Å²	115.2	62%	0.621	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-62.8	116.5	171.3	-59.7	176.1	0	0	0	108	E30 D34 L36	E30-I32 PolarHBondContact O-N 2.73Å; I32-D34 WeakPolarHBondContact CG2-OD1 3.42Å; I32-L36 HydrophobicContact CG2-CB 4.31Å; I32-L36 HydrophobicContact CG2-CD2 4.46Å
33	T	91.4	Very high	92.1	Very high	130 Å²	130	119.2 Å²	119.2	80%	0.798	64%	0.643	S	S	*	*			trans	-134.1	12.9	-169.3	39.3	0	0	0	0	112.5	A31 G35	A31-T33 HydrophobicContact CB-CG2 4.28Å; A31-T33 WeakPolarHBondContact O-CG2 3.36Å; A31-T33 PolarHBondContact O-N 2.99Å; A31-T33 VanDerWaalsContact O-N 3.15Å; A31-T33 PolarHBondContact O-OG1 2.92Å; A31-T33 VanDerWaalsContact O-OG1 3.08Å; T33-G35 PolarHBondContact O-N 3Å
34	D	90.9	Very high	91.9	Very high	125 Å²	125	119.3 Å²	119.3	67%	0.668	65%	0.653	S	S	*	*	S	Bend	trans	-77.7	1.4	-179.2	61.7	-3.6	0	0	0	114.6	I32 L36	I32-D34 WeakPolarHBondContact CG2-OD1 3.42Å; D34-L36 WeakPolarHBondContact OD1-CB 3.38Å; D34-L36 PolarHBondContact OD1-N 3.11Å
35	G	87.3	Confident	91.7	Very high	67 Å²	67	117.7 Å²	117.7	69%	0.691	64%	0.644	S	S	*	*			trans	87.6	10.6	-176.6	0	0	0	0	0	114.6	T33 E37	T33-G35 PolarHBondContact O-N 3Å; G35-E37 PolarHBondContact O-N 2.93Å; G35-E37 VanDerWaalsContact O-N 3.09Å
36	L	90.7	Very high	91.3	Very high	108 Å²	108	116.9 Å²	116.9	57%	0.565	64%	0.64	S	S	*	*			trans	-63.9	105.8	174.8	179.8	62.9	0	0	0	112.2	I32 D34 I38	I32-L36 HydrophobicContact CG2-CB 4.31Å; I32-L36 HydrophobicContact CG2-CD2 4.46Å; D34-L36 WeakPolarHBondContact OD1-CB 3.38Å; D34-L36 PolarHBondContact OD1-N 3.11Å; L36-I38 HydrophobicContact CD2-CD1 4.45Å; L36-I38 HydrophobicContact CD2-CG1 4.35Å; L36-I38 HydrophobicContact CG-CG1 4.14Å; L36-I38 PolarHBondContact O-N 2.95Å
37	E	89.4	Confident	91.1	Very high	176 Å²	176	114.6 Å²	114.6	82%	0.822	65%	0.646	S	S	*	*			trans	-76.1	113.5	172.6	-66.1	-166.1	151.1	0	0	111.5	G35	G35-E37 PolarHBondContact O-N 2.93Å; G35-E37 VanDerWaalsContact O-N 3.09Å
38	I	87.3	Confident	91	Very high	121 Å²	121	115.1 Å²	115.1	62%	0.621	64%	0.641	S	S	*	*			trans	-99.8	103.8	175.9	-55.1	178.7	0	0	0	109.4	L36 V40	L36-I38 HydrophobicContact CD2-CD1 4.45Å; L36-I38 HydrophobicContact CD2-CG1 4.35Å; L36-I38 HydrophobicContact CG-CG1 4.14Å; L36-I38 PolarHBondContact O-N 2.95Å; I38-V40 HydrophobicContact CG2-CG2 4.01Å; I38-V40 PolarHBondContact O-N 2.9Å
39	V	89.8	Confident	90.9	Very high	141 Å²	141	114.4 Å²	114.4	86%	0.855	63%	0.631	S	S	*	*			trans	-78.3	103.9	177.3	-177.4	0	0	0	0	110.4
40	V	89.5	Confident	90.9	Very high	85 Å²	85	110 Å²	110	52%	0.515	61%	0.611	S	S	.	*			trans	-101.1	131.2	173.2	-174.6	0	0	0	0	109.9	I38 L45	I38-V40 HydrophobicContact CG2-CG2 4.01Å; I38-V40 PolarHBondContact O-N 2.9Å; V40-L45 HydrophobicContact CG1-CG 4.46Å
41	S	90.9	Very high	91	Very high	56 Å²	56	102.2 Å²	102.2	39%	0.392	58%	0.575	S	S	.	*			trans	-70.9	129.3	173.3	-179.9	0	0	0	0	110.4	R43 S44	S41-R43 PolarHBondContact O-N 3.36Å; S41-R43 PolarHBondContact OG-N 3.1Å; S41-S44 VanDerWaalsContact O-CB 3.3Å; S41-S44 WeakPolarHBondContact O-CB 3.1Å; S41-S44 PolarHBondContact O-N 3.1Å
42	P	86.1	Confident	91.2	Very high	110 Å²	110	102.6 Å²	102.6	71%	0.714	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-57.5	-23.6	174.5	-27	35.7	0	0	0	113.7	S44 L45	P42-S44 PolarHBondContact O-N 2.96Å; P42-L45 PolarHBondContact O-N 3.22Å
43	R	88.8	Confident	91.5	Very high	222 Å²	222	100.4 Å²	100.4	84%	0.838	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-67.6	-24.4	174.4	-60.7	-173.2	-178.5	-148.4	0.4	112.9	S41 L45 H46	S41-R43 PolarHBondContact O-N 3.36Å; S41-R43 PolarHBondContact OG-N 3.1Å; R43-L45 PolarHBondContact O-N 3.37Å; R43-H46 VanDerWaalsContact O-CB 3.32Å; R43-H46 WeakPolarHBondContact O-CB 3.48Å; R43-H46 PolarHBondContact O-N 3.18Å
44	S	92.9	Very high	91.7	Very high	82 Å²	82	97 Å²	97	57%	0.573	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-79.6	-1.8	176.8	-56.8	0	0	0	0	113.7	S41 P42	S41-S44 VanDerWaalsContact O-CB 3.3Å; S41-S44 WeakPolarHBondContact O-CB 3.1Å; S41-S44 PolarHBondContact O-N 3.1Å; P42-S44 PolarHBondContact O-N 2.96Å
45	L	91.3	Very high	91.9	Very high	82 Å²	82	96.8 Å²	96.8	43%	0.429	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-116.4	10.9	174.1	-57.9	176.4	0	0	0	111.8	V40 P42 R43 E48 L49	V40-L45 HydrophobicContact CG1-CG 4.46Å; P42-L45 PolarHBondContact O-N 3.22Å; R43-L45 PolarHBondContact O-N 3.37Å; L45-E48 WeakPolarHBondContact CA-OE2 3.23Å; L45-E48 PolarHBondContact O-N 3.08Å; L45-L49 HydrophobicContact CB-CD1 3.94Å; L45-L49 HydrophobicContact CB-CG 4.42Å; L45-L49 WeakPolarHBondContact O-CB 3.26Å; L45-L49 WeakPolarHBondContact O-CG 3.5Å; L45-L49 PolarHBondContact O-N 2.87Å
46	H	89.6	Confident	92.3	Very high	107 Å²	107	97.2 Å²	97.2	50%	0.495	53%	0.525	S	S	.	.	H	α-helix	trans	-72	-40.3	-168.3	-175.5	40.3	0	0	0	112.4	R43 E48 M50	R43-H46 VanDerWaalsContact O-CB 3.32Å; R43-H46 WeakPolarHBondContact O-CB 3.48Å; R43-H46 PolarHBondContact O-N 3.18Å; H46-E48 VanDerWaalsContact C-N 3.3Å; H46-E48 PolarHBondContact N-OE2 2.8Å; H46-E48 PolarHBondContact O-N 3.4Å; H46-M50 VanDerWaalsContact CE1-CE 3.41Å; H46-M50 WeakPolarHBondContact CE1-CE 3.38Å; H46-M50 VanDerWaalsContact NE2-CE 3.34Å; H46-M50 WeakPolarHBondContact NE2-CE 3.06Å; H46-M50 WeakPolarHBondContact O-CB 3.44Å; H46-M50 PolarHBondContact O-N 2.95Å; H46-M50 VanDerWaalsContact O-N 3.16Å
47	S	90.8	Very high	92.5	Very high	92 Å²	92	97.4 Å²	97.4	64%	0.643	53%	0.525	S	S	*	.	H	α-helix	trans	-69.7	-28.1	177.4	23.7	0	0	0	0	112.8
48	E	94.8	Very high	92.9	Very high	111 Å²	111	90.2 Å²	90.2	52%	0.519	49%	0.492	S	S	.	.	H	α-helix	trans	-85.7	-25	-173.9	-60.2	61.8	-130.6	0	0	111.5	L45 H46	L45-E48 WeakPolarHBondContact CA-OE2 3.23Å; L45-E48 PolarHBondContact O-N 3.08Å; H46-E48 VanDerWaalsContact C-N 3.3Å; H46-E48 PolarHBondContact N-OE2 2.8Å; H46-E48 PolarHBondContact O-N 3.4Å
49	L	95.5	Very high	93.4	Very high	84 Å²	84	89.5 Å²	89.5	44%	0.44	48%	0.484	S	S	.	.	H	α-helix	trans	-112.6	4.1	-177.1	-58.7	178.4	0	0	0	113.7	L45 M57 L58	L45-L49 HydrophobicContact CB-CD1 3.94Å; L45-L49 HydrophobicContact CB-CG 4.42Å; L45-L49 WeakPolarHBondContact O-CB 3.26Å; L45-L49 WeakPolarHBondContact O-CG 3.5Å; L45-L49 PolarHBondContact O-N 2.87Å; L49-M57 CarbonylContact O-C 3.59Å; L49-M57 WeakPolarHBondContact O-CA 3.38Å; L49-L58 WeakPolarHBondContact O-CG 3.48Å; L49-L58 PolarHBondContact O-N 3.37Å
50	M	96	Very high	93.7	Very high	51 Å²	51	89.1 Å²	89.1	25%	0.251	48%	0.477	S	S	.	.	B	Isolated β-bridge	trans	-84.1	141.9	176.1	-179.8	-170.7	-63.2	0	0	112.1	H46 P52 L55	H46-M50 VanDerWaalsContact CE1-CE 3.41Å; H46-M50 WeakPolarHBondContact CE1-CE 3.38Å; H46-M50 VanDerWaalsContact NE2-CE 3.34Å; H46-M50 WeakPolarHBondContact NE2-CE 3.06Å; H46-M50 WeakPolarHBondContact O-CB 3.44Å; H46-M50 PolarHBondContact O-N 2.95Å; H46-M50 VanDerWaalsContact O-N 3.16Å; M50-P52 WeakPolarHBondContact O-CD 3.25Å; M50-L55 HydrophobicContact SD-CB 4.36Å; M50-L55 HydrophobicContact SD-CD2 4.21Å
51	C	96.9	Very high	94.1	Very high	0 Å²	0	88.5 Å²	88.5	0%	0	47%	0.474	C	S	.	.			trans	-81.6	119.9	167.6	-179.7	0	0	0	0	110.8	I53 C54 L55 D56 L58 C72	C51-I53 PolarHBondContact O-N 2.96Å; C51-C54 WeakPolarHBondContact CB-SG 3.3Å; C51-C54 PolarHBondContact O-N 3.5Å; C51-C54 VanDerWaalsContact SG-SG 3.67Å; C51-L55 WeakPolarHBondContact O-CA 3.43Å; C51-L55 PolarHBondContact O-N 2.89Å; C51-D56 WeakPolarHBondContact CB-O 3.47Å; C51-D56 PolarHBondContact N-O 3.01Å; C51-L58 HydrophobicContact CB-CD2 3.79Å; C51-L58 HydrophobicContact CB-CG 4.43Å; C51-C72 WeakPolarHBondContact CB-SG 3.48Å; C51-C72 PolarHBondContact SG-N 2.9Å; C51-C72 VanDerWaalsContact SG-SG 3.65Å
52	P	95.8	Very high	94.4	Very high	83 Å²	83	89.9 Å²	89.9	54%	0.539	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-8.7	-179.4	-23.5	34.1	0	0	0	115.8	M50 R70 F71	M50-P52 WeakPolarHBondContact O-CD 3.25Å; P52-R70 VanDerWaalsContact CD-O 3.25Å; P52-R70 WeakPolarHBondContact CD-O 3.48Å; P52-F71 HydrophobicContact CB-CE1 4.09Å; P52-F71 HydrophobicContact CG-CD1 4.34Å; P52-F71 HydrophobicContact CG-CE1 4.01Å
53	I	95.6	Very high	94.9	Very high	76 Å²	76	87.9 Å²	87.9	39%	0.39	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-40.2	-178.1	-62.6	168	0	0	0	112.2	C51 F71 C75 I76 A79	C51-I53 PolarHBondContact O-N 2.96Å; I53-F71 HydrophobicContact CD1-CB 4.37Å; I53-F71 HydrophobicContact CD1-CD1 3.46Å; I53-F71 VanDerWaalsContact CD1-CD1 3.46Å; I53-F71 HydrophobicContact CD1-CE1 3.99Å; I53-F71 HydrophobicContact CD1-CG 4.11Å; I53-F71 HydrophobicContact CG1-CD1 3.74Å; I53-F71 HydrophobicContact CG1-CE1 4.06Å; I53-C75 HydrophobicContact CB-CB 3.85Å; I53-C75 HydrophobicContact CD1-CB 3.96Å; I53-C75 HydrophobicContact CG2-CB 3.76Å; I53-I76 HydrophobicContact CD1-CB 4.41Å; I53-I76 HydrophobicContact CD1-CD1 4.28Å; I53-A79 HydrophobicContact CD1-CB 4.29Å
54	C	96.3	Very high	95.2	Very high	57 Å²	57	79.4 Å²	79.4	39%	0.385	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-5.1	-179.5	62.6	0	0	0	0	114.5	C51 D56	C51-C54 WeakPolarHBondContact CB-SG 3.3Å; C51-C54 PolarHBondContact O-N 3.5Å; C51-C54 VanDerWaalsContact SG-SG 3.67Å; C54-D56 PolarHBondContact O-N 3.1Å; C54-D56 VanDerWaalsContact O-N 3.09Å
55	L	95.3	Very high	95.3	Very high	121 Å²	121	84.3 Å²	84.3	63%	0.634	45%	0.445	S	S	*	.	S	Bend	trans	60.3	14.2	179.6	-47.7	-179.1	0	0	0	114.9	M50 C51	M50-L55 HydrophobicContact SD-CB 4.36Å; M50-L55 HydrophobicContact SD-CD2 4.21Å; C51-L55 WeakPolarHBondContact O-CA 3.43Å; C51-L55 PolarHBondContact O-N 2.89Å
56	D	95.1	Very high	95.3	Very high	77 Å²	77	88.7 Å²	88.7	41%	0.412	46%	0.463	S	S	.	.	S	Bend	trans	-109.9	168.6	176.1	-177.2	19.9	0	0	0	109.9	C51 C54 K59	C51-D56 WeakPolarHBondContact CB-O 3.47Å; C51-D56 PolarHBondContact N-O 3.01Å; C54-D56 PolarHBondContact O-N 3.1Å; C54-D56 VanDerWaalsContact O-N 3.09Å; D56-K59 IonicContact OD1-NZ 2.69Å; D56-K59 IonicContact OD2-NZ 3.23Å; D56-K59 PolarHBondContact OD2-NZ 2.63Å
57	M	95.2	Very high	95.5	Very high	112 Å²	112	87.1 Å²	87.1	55%	0.552	46%	0.463	S	S	*	.	B	Isolated β-bridge	trans	-59.3	138.5	179.7	-171.2	174.5	68.4	0	0	111.9	L49 K59	L49-M57 CarbonylContact O-C 3.59Å; L49-M57 WeakPolarHBondContact O-CA 3.38Å; M57-K59 WeakPolarHBondContact O-CG 3.49Å; M57-K59 PolarHBondContact O-N 3.35Å
58	L	97.5	Very high	95.7	Very high	24 Å²	24	87.9 Å²	87.9	13%	0.126	46%	0.46	C	S	.	.			trans	-55.4	126.3	179.9	-74	166.1	0	0	0	112	L49 C51 T61 R70 F71	L49-L58 WeakPolarHBondContact O-CG 3.48Å; L49-L58 PolarHBondContact O-N 3.37Å; C51-L58 HydrophobicContact CB-CD2 3.79Å; C51-L58 HydrophobicContact CB-CG 4.43Å; L58-T61 HydrophobicContact CD1-CG2 4.18Å; L58-T61 HydrophobicContact CD2-CG2 4.33Å; L58-R70 HydrophobicContact CD1-CB 3.86Å; L58-R70 HydrophobicContact CD2-CB 4.28Å; L58-F71 VanDerWaalsContact CD2-C 3.44Å
59	K	97.2	Very high	95.7	Very high	106 Å²	106	87.9 Å²	87.9	46%	0.461	46%	0.459	S	S	.	.	S	Bend	trans	-127.2	128	179.3	-69.9	155.3	-172.5	175.9	0	108.4	D56 M57 T61 C72	D56-K59 IonicContact OD1-NZ 2.69Å; D56-K59 IonicContact OD2-NZ 3.23Å; D56-K59 PolarHBondContact OD2-NZ 2.63Å; M57-K59 WeakPolarHBondContact O-CG 3.49Å; M57-K59 PolarHBondContact O-N 3.35Å; K59-T61 PolarHBondContact O-N 3.18Å; K59-C72 PolarHBondContact N-SG 3.39Å; K59-C72 WeakPolarHBondContact O-CA 3.37Å; K59-C72 VanDerWaalsContact O-CB 3.28Å; K59-C72 WeakPolarHBondContact O-CB 3.31Å
60	N	97.7	Very high	95.8	Very high	134 Å²	134	90 Å²	90	72%	0.717	46%	0.462	S	S	*	.	S	Bend	trans	51.4	57.3	-175.6	-59.4	73.2	0	0	0	111.3	M62 A73	N60-M62 PolarHBondContact O-N 3.36Å; N60-M62 VanDerWaalsContact O-N 3.16Å; N60-A73 HydrophobicContact CB-CB 4.05Å; N60-A73 WeakPolarHBondContact O-CB 3.37Å; N60-A73 PolarHBondContact O-N 2.88Å; N60-A73 VanDerWaalsContact O-N 3.14Å
61	T	97.6	Very high	96	Very high	71 Å²	71	89.2 Å²	89.2	44%	0.436	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	113.7	-167.7	-50.3	0	0	0	0	113.5	L58 K59 R70 F71	L58-T61 HydrophobicContact CD1-CG2 4.18Å; L58-T61 HydrophobicContact CD2-CG2 4.33Å; K59-T61 PolarHBondContact O-N 3.18Å; T61-R70 HydrophobicContact CG2-CB 3.89Å; T61-R70 HydrophobicContact CG2-CG 3.97Å; T61-F71 CarbonylContact C-O 3.58Å; T61-F71 WeakPolarHBondContact CA-O 3.22Å
62	M	97.1	Very high	96	Very high	86 Å²	86	89.5 Å²	89.5	42%	0.424	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	148	165	-70.4	-171.4	72.2	0	0	110.3	N60 R70 F71 A73 I76 I77	N60-M62 PolarHBondContact O-N 3.36Å; N60-M62 VanDerWaalsContact O-N 3.16Å; M62-R70 WeakPolarHBondContact O-CA 3.48Å; M62-F71 PolarHBondContact N-O 2.76Å; M62-F71 PolarHBondContact O-N 3.48Å; M62-A73 HydrophobicContact CG-CB 3.92Å; M62-A73 HydrophobicContact SD-CB 3.85Å; M62-I76 HydrophobicContact CB-CG2 3.92Å; M62-I76 HydrophobicContact CE-CG2 4.48Å; M62-I76 HydrophobicContact CG-CG2 4.3Å; M62-I76 HydrophobicContact SD-CG2 3.67Å; M62-I77 HydrophobicContact SD-CD1 4.06Å; M62-I77 HydrophobicContact SD-CG1 4.11Å
63	T	97.1	Very high	96.1	Very high	68 Å²	68	86.4 Å²	86.4	42%	0.417	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	131.5	-178.5	-56.5	0	0	0	0	110	L68 H69 R70	T63-L68 HydrophobicContact CG2-CB 4.26Å; T63-L68 HydrophobicContact CG2-CD2 3.99Å; T63-H69 WeakPolarHBondContact CA-O 3.08Å; T63-R70 HydrophobicContact CG2-CG 4.42Å
64	T	95.1	Very high	96.2	Very high	43 Å²	43	88.5 Å²	88.5	26%	0.264	45%	0.452	S	S	.	.			trans	-72.1	134.6	174.5	52.2	0	0	0	0	110.8	C67 L68 H69 F71	T64-C67 PolarHBondContact OG1-SG 2.99Å; T64-L68 WeakPolarHBondContact O-CA 3.38Å; T64-L68 PolarHBondContact O-N 2.99Å; T64-L68 PolarHBondContact OG1-N 3.1Å; T64-H69 PolarHBondContact N-O 2.69Å; T64-H69 PolarHBondContact OG1-N 2.7Å; T64-H69 PolarHBondContact OG1-O 2.7Å; T64-F71 HydrophobicContact CG2-CD2 4.45Å; T64-F71 HydrophobicContact CG2-CE2 3.92Å
65	K	94.1	Very high	96.2	Very high	186 Å²	186	87 Å²	87	81%	0.809	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-53.6	-177.1	-69.3	-178.4	179.1	-179	0	113.2	C67	K65-C67 PolarHBondContact O-N 3.17Å
66	E	91.9	Very high	96.3	Very high	174 Å²	174	82.6 Å²	82.6	81%	0.813	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-28.9	-170.1	-48.2	-41.2	114.2	0	0	114.8
67	C	93	Very high	96.3	Very high	73 Å²	73	81.6 Å²	81.6	49%	0.493	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.1	5.8	-171.8	56.5	0	0	0	0	115	T64 K65 H69	T64-C67 PolarHBondContact OG1-SG 2.99Å; K65-C67 PolarHBondContact O-N 3.17Å; C67-H69 PolarHBondContact O-N 3.01Å; C67-H69 PolarHBondContact SG-ND1 2.83Å
68	L	95.5	Very high	96.2	Very high	109 Å²	109	80 Å²	80	57%	0.571	41%	0.409	S	S	*	.			trans	51.3	18.8	174	-56.1	180	0	0	0	116.7	T63 T64 R70	T63-L68 HydrophobicContact CG2-CB 4.26Å; T63-L68 HydrophobicContact CG2-CD2 3.99Å; T64-L68 WeakPolarHBondContact O-CA 3.38Å; T64-L68 PolarHBondContact O-N 2.99Å; T64-L68 PolarHBondContact OG1-N 3.1Å; L68-R70 PolarHBondContact O-NH1 2.9Å
69	H	95.2	Very high	95.9	Very high	111 Å²	111	81.1 Å²	81.1	51%	0.514	42%	0.422	S	S	.	.			trans	-65.8	142	170.6	-68.3	113.1	0	0	0	111	T63 T64 C67 F71	T63-H69 WeakPolarHBondContact CA-O 3.08Å; T64-H69 PolarHBondContact N-O 2.69Å; T64-H69 PolarHBondContact OG1-N 2.7Å; T64-H69 PolarHBondContact OG1-O 2.7Å; C67-H69 PolarHBondContact O-N 3.01Å; C67-H69 PolarHBondContact SG-ND1 2.83Å; H69-F71 HydrophobicContact CB-CE2 3.69Å; H69-F71 HydrophobicContact CB-CZ 3.93Å
70	R	97.9	Very high	95.6	Very high	129 Å²	129	81.9 Å²	81.9	49%	0.487	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.2	-171.4	-71.4	169.2	176.3	77.2	-9.3	111.1	P52 L58 T61 M62 T63 L68	P52-R70 VanDerWaalsContact CD-O 3.25Å; P52-R70 WeakPolarHBondContact CD-O 3.48Å; L58-R70 HydrophobicContact CD1-CB 3.86Å; L58-R70 HydrophobicContact CD2-CB 4.28Å; T61-R70 HydrophobicContact CG2-CB 3.89Å; T61-R70 HydrophobicContact CG2-CG 3.97Å; M62-R70 WeakPolarHBondContact O-CA 3.48Å; T63-R70 HydrophobicContact CG2-CG 4.42Å; L68-R70 PolarHBondContact O-NH1 2.9Å
71	F	98.2	Very high	95.2	Very high	33 Å²	33	83.6 Å²	83.6	15%	0.145	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	157.2	-177.8	-55.6	-82.2	0	0	0	110.4	P52 I53 L58 T61 M62 T64 H69 I76	P52-F71 HydrophobicContact CB-CE1 4.09Å; P52-F71 HydrophobicContact CG-CD1 4.34Å; P52-F71 HydrophobicContact CG-CE1 4.01Å; I53-F71 HydrophobicContact CD1-CB 4.37Å; I53-F71 HydrophobicContact CD1-CD1 3.46Å; I53-F71 VanDerWaalsContact CD1-CD1 3.46Å; I53-F71 HydrophobicContact CD1-CE1 3.99Å; I53-F71 HydrophobicContact CD1-CG 4.11Å; I53-F71 HydrophobicContact CG1-CD1 3.74Å; I53-F71 HydrophobicContact CG1-CE1 4.06Å; L58-F71 VanDerWaalsContact CD2-C 3.44Å; T61-F71 CarbonylContact C-O 3.58Å; T61-F71 WeakPolarHBondContact CA-O 3.22Å; M62-F71 PolarHBondContact N-O 2.76Å; M62-F71 PolarHBondContact O-N 3.48Å; T64-F71 HydrophobicContact CG2-CD2 4.45Å; T64-F71 HydrophobicContact CG2-CE2 3.92Å; H69-F71 HydrophobicContact CB-CE2 3.69Å; H69-F71 HydrophobicContact CB-CZ 3.93Å; F71-I76 HydrophobicContact CB-CB 3.84Å; F71-I76 HydrophobicContact CB-CG2 4.24Å; F71-I76 HydrophobicContact CD2-CB 4.45Å; F71-I76 HydrophobicContact CD2-CD1 4.09Å; F71-I76 HydrophobicContact CD2-CG1 4.26Å; F71-I76 HydrophobicContact CE2-CD1 4.32Å; F71-I76 HydrophobicContact CG-CB 4.22Å; F71-I76 HydrophobicContact CG-CD1 4.31Å; F71-I76 HydrophobicContact CG-CG1 4.48Å
72	C	98.4	Very high	94.3	Very high	7 Å²	7	83 Å²	83	5%	0.047	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	142.3	164.4	-54.1	0	0	0	0	110	C51 K59 D74 C75 I76	C51-C72 WeakPolarHBondContact CB-SG 3.48Å; C51-C72 PolarHBondContact SG-N 2.9Å; C51-C72 VanDerWaalsContact SG-SG 3.65Å; K59-C72 PolarHBondContact N-SG 3.39Å; K59-C72 WeakPolarHBondContact O-CA 3.37Å; K59-C72 VanDerWaalsContact O-CB 3.28Å; K59-C72 WeakPolarHBondContact O-CB 3.31Å; C72-D74 PolarHBondContact O-N 2.85Å; C72-C75 HydrophobicContact CB-CB 4.09Å; C72-C75 WeakPolarHBondContact O-CB 3.42Å; C72-C75 PolarHBondContact O-N 2.96Å; C72-C75 VanDerWaalsContact O-N 3.16Å; C72-I76 PolarHBondContact O-N 3.26Å; C72-I76 VanDerWaalsContact O-N 3.08Å
73	A	97.6	Very high	92.5	Very high	17 Å²	17	81 Å²	81	14%	0.14	43%	0.427	C	S	.	.	H	α-helix	trans	-51.7	-55.1	-179.2	0	0	0	0	0	112.7	N60 M62 C75 I76 I77	N60-A73 HydrophobicContact CB-CB 4.05Å; N60-A73 WeakPolarHBondContact O-CB 3.37Å; N60-A73 PolarHBondContact O-N 2.88Å; N60-A73 VanDerWaalsContact O-N 3.14Å; M62-A73 HydrophobicContact CG-CB 3.92Å; M62-A73 HydrophobicContact SD-CB 3.85Å; A73-C75 PolarHBondContact O-N 3.44Å; A73-I76 WeakPolarHBondContact O-CG2 3.38Å; A73-I76 PolarHBondContact O-N 3.42Å; A73-I77 HydrophobicContact CB-CD1 4.33Å; A73-I77 VanDerWaalsContact O-CB 3.29Å; A73-I77 WeakPolarHBondContact O-CB 3.48Å; A73-I77 WeakPolarHBondContact O-CD1 3.38Å; A73-I77 WeakPolarHBondContact O-CG1 3.38Å; A73-I77 PolarHBondContact O-N 2.71Å
74	D	97	Very high	90.4	Very high	121 Å²	121	83.5 Å²	83.5	65%	0.647	44%	0.437	S	S	*	.	H	α-helix	trans	-60.3	-36.3	-178.2	-57.6	-45.7	0	0	0	112.3	C72 T78	C72-D74 PolarHBondContact O-N 2.85Å; D74-T78 WeakPolarHBondContact O-CB 3.25Å; D74-T78 PolarHBondContact O-N 2.81Å; D74-T78 PolarHBondContact O-OG1 2.87Å
75	C	96.8	Very high	88.4	Confident	26 Å²	26	88.6 Å²	88.6	18%	0.176	46%	0.458	C	S	.	.	H	α-helix	trans	-65.9	-50.6	179	-65	0	0	0	0	112	I53 C72 A73 T78 A79	I53-C75 HydrophobicContact CB-CB 3.85Å; I53-C75 HydrophobicContact CD1-CB 3.96Å; I53-C75 HydrophobicContact CG2-CB 3.76Å; C72-C75 HydrophobicContact CB-CB 4.09Å; C72-C75 WeakPolarHBondContact O-CB 3.42Å; C72-C75 PolarHBondContact O-N 2.96Å; C72-C75 VanDerWaalsContact O-N 3.16Å; A73-C75 PolarHBondContact O-N 3.44Å; C75-T78 PolarHBondContact O-N 3.48Å; C75-A79 WeakPolarHBondContact O-CB 3.29Å; C75-A79 PolarHBondContact O-N 3.07Å
76	I	96.3	Very high	86.1	Confident	28 Å²	28	89.3 Å²	89.3	14%	0.144	46%	0.455	C	S	.	.	H	α-helix	trans	-71.9	-38	-178.8	-169.7	61.1	0	0	0	111.7	I53 M62 F71 C72 A73 T78 A79 L80	I53-I76 HydrophobicContact CD1-CB 4.41Å; I53-I76 HydrophobicContact CD1-CD1 4.28Å; M62-I76 HydrophobicContact CB-CG2 3.92Å; M62-I76 HydrophobicContact CE-CG2 4.48Å; M62-I76 HydrophobicContact CG-CG2 4.3Å; M62-I76 HydrophobicContact SD-CG2 3.67Å; F71-I76 HydrophobicContact CB-CB 3.84Å; F71-I76 HydrophobicContact CB-CG2 4.24Å; F71-I76 HydrophobicContact CD2-CB 4.45Å; F71-I76 HydrophobicContact CD2-CD1 4.09Å; F71-I76 HydrophobicContact CD2-CG1 4.26Å; F71-I76 HydrophobicContact CE2-CD1 4.32Å; F71-I76 HydrophobicContact CG-CB 4.22Å; F71-I76 HydrophobicContact CG-CD1 4.31Å; F71-I76 HydrophobicContact CG-CG1 4.48Å; C72-I76 PolarHBondContact O-N 3.26Å; C72-I76 VanDerWaalsContact O-N 3.08Å; A73-I76 WeakPolarHBondContact O-CG2 3.38Å; A73-I76 PolarHBondContact O-N 3.42Å; I76-T78 VanDerWaalsContact C-N 3.33Å; I76-T78 PolarHBondContact O-N 2.94Å; I76-A79 PolarHBondContact O-N 3.46Å; I76-L80 HydrophobicContact CD1-CD1 4.47Å; I76-L80 HydrophobicContact CD1-CG 4.35Å; I76-L80 HydrophobicContact CG1-CD1 4.06Å; I76-L80 HydrophobicContact CG1-CG 4.42Å; I76-L80 WeakPolarHBondContact O-CB 3.2Å; I76-L80 VanDerWaalsContact O-CG 3.27Å; I76-L80 WeakPolarHBondContact O-CG 3.18Å; I76-L80 PolarHBondContact O-N 3.16Å
77	I	94.9	Very high	83.7	Confident	55 Å²	55	83.4 Å²	83.4	28%	0.282	44%	0.442	S	S	.	.	H	α-helix	trans	-61.9	-42.1	175.1	-68.9	168.2	0	0	0	110.5	M62 A73 R81	M62-I77 HydrophobicContact SD-CD1 4.06Å; M62-I77 HydrophobicContact SD-CG1 4.11Å; A73-I77 HydrophobicContact CB-CD1 4.33Å; A73-I77 VanDerWaalsContact O-CB 3.29Å; A73-I77 WeakPolarHBondContact O-CB 3.48Å; A73-I77 WeakPolarHBondContact O-CD1 3.38Å; A73-I77 WeakPolarHBondContact O-CG1 3.38Å; A73-I77 PolarHBondContact O-N 2.71Å; I77-R81 WeakPolarHBondContact O-CB 3.4Å; I77-R81 WeakPolarHBondContact O-CD 3.26Å; I77-R81 WeakPolarHBondContact O-CG 3.42Å; I77-R81 PolarHBondContact O-N 2.95Å; I77-R81 VanDerWaalsContact O-N 3.14Å
78	T	94.4	Very high	81.6	Confident	78 Å²	78	87.4 Å²	87.4	48%	0.479	45%	0.451	S	S	.	.	H	α-helix	trans	-66.9	-47.6	176.5	-59.7	0	0	0	0	111.4	D74 C75 I76 L80 R81 S82	D74-T78 WeakPolarHBondContact O-CB 3.25Å; D74-T78 PolarHBondContact O-N 2.81Å; D74-T78 PolarHBondContact O-OG1 2.87Å; C75-T78 PolarHBondContact O-N 3.48Å; I76-T78 VanDerWaalsContact C-N 3.33Å; I76-T78 PolarHBondContact O-N 2.94Å; T78-L80 PolarHBondContact O-N 3.4Å; T78-R81 PolarHBondContact O-N 2.82Å; T78-S82 WeakPolarHBondContact O-CB 3.46Å; T78-S82 PolarHBondContact O-N 3.31Å; T78-S82 PolarHBondContact O-OG 3.44Å
79	A	91.6	Very high	79.2	Confident	48 Å²	48	90.7 Å²	90.7	40%	0.397	46%	0.461	S	S	.	.	H	α-helix	trans	-57	-46.2	179.4	0	0	0	0	0	112.5	I53 C75 I76 S82 G83	I53-A79 HydrophobicContact CD1-CB 4.29Å; C75-A79 WeakPolarHBondContact O-CB 3.29Å; C75-A79 PolarHBondContact O-N 3.07Å; I76-A79 PolarHBondContact O-N 3.46Å; A79-S82 PolarHBondContact O-N 3.19Å; A79-G83 PolarHBondContact O-N 3.03Å
80	L	91.2	Very high	76.7	Confident	122 Å²	122	93.8 Å²	93.8	64%	0.639	48%	0.475	S	S	*	.	H	α-helix	trans	-63.3	-42.9	177.1	-68.6	170	0	0	0	112.1	I76 T78 G83 L84	I76-L80 HydrophobicContact CD1-CD1 4.47Å; I76-L80 HydrophobicContact CD1-CG 4.35Å; I76-L80 HydrophobicContact CG1-CD1 4.06Å; I76-L80 HydrophobicContact CG1-CG 4.42Å; I76-L80 WeakPolarHBondContact O-CB 3.2Å; I76-L80 VanDerWaalsContact O-CG 3.27Å; I76-L80 WeakPolarHBondContact O-CG 3.18Å; I76-L80 PolarHBondContact O-N 3.16Å; T78-L80 PolarHBondContact O-N 3.4Å; L80-G83 PolarHBondContact O-N 3.38Å; L80-L84 PolarHBondContact O-N 3.32Å
81	R	88.7	Confident	74	Confident	171 Å²	171	96.2 Å²	96.2	65%	0.645	49%	0.492	S	S	*	.	H	α-helix	trans	-64.9	-42.1	176.9	-73.6	170.7	178.5	171.4	1.3	112.5	I77 T78 L84	I77-R81 WeakPolarHBondContact O-CB 3.4Å; I77-R81 WeakPolarHBondContact O-CD 3.26Å; I77-R81 WeakPolarHBondContact O-CG 3.42Å; I77-R81 PolarHBondContact O-N 2.95Å; I77-R81 VanDerWaalsContact O-N 3.14Å; T78-R81 PolarHBondContact O-N 2.82Å; R81-L84 PolarHBondContact O-N 3.2Å
82	S	77.5	Confident	71.6	Confident	58 Å²	58	101.6 Å²	101.6	41%	0.406	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-30.3	179	-65.6	0	0	0	0	113.2	T78 A79	T78-S82 WeakPolarHBondContact O-CB 3.46Å; T78-S82 PolarHBondContact O-N 3.31Å; T78-S82 PolarHBondContact O-OG 3.44Å; A79-S82 PolarHBondContact O-N 3.19Å
83	G	60.1	Low	68.9	Low	44 Å²	44	109.9 Å²	109.9	45%	0.454	56%	0.559	S	S	.	*	H	α-helix	trans	-61.8	-49.8	171.7	0	0	0	0	0	112.2	A79 L80 Q85 R86	A79-G83 PolarHBondContact O-N 3.03Å; L80-G83 PolarHBondContact O-N 3.38Å; G83-Q85 VanDerWaalsContact C-N 3.28Å; G83-Q85 PolarHBondContact O-N 3.03Å; G83-R86 PolarHBondContact O-N 3.43Å; G83-R86 VanDerWaalsContact O-N 3.17Å
84	L	53.9	Low	66.2	Low	121 Å²	121	117.2 Å²	117.2	63%	0.634	60%	0.595	S	S	*	*	H	α-helix	trans	-62.3	-30.5	-175.7	-174.8	61.1	0	0	0	113.9	L80 R81 R86	L80-L84 PolarHBondContact O-N 3.32Å; R81-L84 PolarHBondContact O-N 3.2Å; L84-R86 VanDerWaalsContact C-N 3.31Å; L84-R86 PolarHBondContact O-N 2.97Å
85	Q	52.3	Low	63.2	Low	149 Å²	149	114.9 Å²	114.9	70%	0.696	60%	0.6	S	S	*	*	H	α-helix	trans	-68.9	-27.2	179	-69.4	-174.9	5.2	0	0	113.4	G83	G83-Q85 VanDerWaalsContact C-N 3.28Å; G83-Q85 PolarHBondContact O-N 3.03Å
86	R	46.2	Very low	60.4	Low	201 Å²	201	119.8 Å²	119.8	76%	0.758	64%	0.635	S	S	*	*	H	α-helix	trans	-71.7	-41.3	-179.8	-67.7	178.5	176.6	161	-0.6	111.9	G83 L84 K88 K89	G83-R86 PolarHBondContact O-N 3.43Å; G83-R86 VanDerWaalsContact O-N 3.17Å; L84-R86 VanDerWaalsContact C-N 3.31Å; L84-R86 PolarHBondContact O-N 2.97Å; R86-K88 VanDerWaalsContact C-N 3.29Å; R86-K88 PolarHBondContact O-N 2.88Å; R86-K89 PolarHBondContact O-N 3.49Å
87	G	40	Very low	57.7	Low	51 Å²	51	122.3 Å²	122.3	53%	0.526	67%	0.667	S	S	.	*	H	α-helix	trans	-62.4	-31.7	179.3	0	0	0	0	0	114	K89	G87-K89 VanDerWaalsContact C-N 3.27Å; G87-K89 PolarHBondContact O-N 2.91Å
88	K	49.9	Very low	55	Low	157 Å²	157	124.9 Å²	124.9	68%	0.683	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-9.9	-179.3	-67.3	-166.8	176.4	-170.1	0	114.9	R86	R86-K88 VanDerWaalsContact C-N 3.29Å; R86-K88 PolarHBondContact O-N 2.88Å
89	K	44.9	Very low	52.9	Low	178 Å²	178	130.3 Å²	130.3	77%	0.774	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-6.6	-173.7	-135.3	-178.6	-178	-171.9	0	114.9	R86 G87	R86-K89 PolarHBondContact O-N 3.49Å; G87-K89 VanDerWaalsContact C-N 3.27Å; G87-K89 PolarHBondContact O-N 2.91Å
90	Q	42.7	Very low	50.4	Low	175 Å²	175	135.4 Å²	135.4	82%	0.818	74%	0.738	S	S	*	*	S	Bend	trans	-98.1	9.2	-176.3	-71.6	-178	-30.3	0	0	114.8
91	Q	42.3	Very low	48.5	Very low	181 Å²	181	136.9 Å²	136.9	85%	0.846	75%	0.746	S	S	*	*	S	Bend	trans	-112.3	13.1	-176.4	-78.2	-168	-32.5	0	0	115.5
92	I	46.3	Very low	46	Very low	145 Å²	145	132.3 Å²	132.3	74%	0.744	75%	0.752	S	S	*	*	S	Bend	trans	-113	-30.1	-177.8	-64.4	176.8	0	0	0	113	N94	I92-N94 PolarHBondContact O-N 2.99Å
93	E	41.7	Very low	43.8	Very low	182 Å²	182	136.8 Å²	136.8	85%	0.85	77%	0.771	S	S	*	*	S	Bend	trans	-93	69.1	-179.8	-67.9	-177.8	127.2	0	0	112.4
94	N	41.6	Very low	42.9	Very low	170 Å²	170	138.7 Å²	138.7	91%	0.909	78%	0.777	S	S	*	*			trans	-160	70.2	159.3	-100.1	-47	0	0	0	110	I92	I92-N94 PolarHBondContact O-N 2.99Å
95	G	33.8	Very low	42.6	Very low	72 Å²	72	138 Å²	138	74%	0.742	78%	0.783	S	S	*	*			trans	-132.5	120.3	173.8	0	0	0	0	0	110.1
96	S	38.1	Very low	42	Very low	130 Å²	130	138.8 Å²	138.8	91%	0.909	79%	0.786	S	S	*	*			trans	-62.7	142.5	-175.9	-48.1	0	0	0	0	112.4
97	G	38.9	Very low	41.4	Very low	80 Å²	80	135.1 Å²	135.1	83%	0.825	79%	0.79	S	S	*	*			trans	-73.7	153.3	177.1	0	0	0	0	0	113.9
98	A	38.8	Very low	41.6	Very low	109 Å²	109	136.3 Å²	136.3	90%	0.901	79%	0.79	S	S	*	*			trans	-140.4	144.3	156	0	0	0	0	0	107.3
99	E	50	Low	41	Very low	192 Å²	192	136.7 Å²	136.7	90%	0.897	80%	0.8	S	S	*	*			trans	-113.9	132	-173.1	51.2	-174.4	91.7	0	0	110.8
100	D	38.7	Very low	40.5	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	80%	0.797	S	S	*	*			trans	-154.6	161.3	167.5	-159.6	6.7	0	0	0	110.9
101	N	52.8	Low	40.1	Very low	153 Å²	153	127.7 Å²	127.7	82%	0.818	78%	0.784	S	S	*	*			trans	-126.6	145.5	-172	-67.5	-97.3	0	0	0	112.4
102	G	34.7	Very low	39.7	Very low	74 Å²	74	126 Å²	126	76%	0.763	79%	0.787	S	S	*	*			trans	140.8	114.4	174.9	0	0	0	0	0	109.8
103	D	31.3	Very low	39	Very low	152 Å²	152	127.2 Å²	127.2	81%	0.813	79%	0.789	S	S	*	*			cis	105.1	142.8	42.4	-174.9	48.1	0	0	0	112.2
104	S	41.3	Very low	38.7	Very low	84 Å²	84	123.5 Å²	123.5	59%	0.587	78%	0.783	S	S	*	*			trans	69.5	115.7	161.5	-74.9	0	0	0	0	122.4
105	S	47.6	Very low	38.5	Very low	108 Å²	108	121.4 Å²	121.4	76%	0.755	77%	0.771	S	S	*	*			trans	70.6	98.4	131.2	66.2	0	0	0	0	121.7
106	H	40.1	Very low	38.7	Very low	164 Å²	164	125.8 Å²	125.8	76%	0.759	77%	0.773	S	S	*	*				21	121.5	112.6	174	-79.6	0	0	0	118.9
107	C	33.9	Very low	38.6	Very low	124 Å²	124	128.1 Å²	128.1	84%	0.838	77%	0.769	S	S	*	*			trans	-141.6	147.8	136.6	63.8	0	0	0	0	111.1
108	S	43.2	Very low	38.3	Very low	76 Å²	76	128.5 Å²	128.5	53%	0.531	77%	0.765	S	S	.	*			trans	-132.8	163	177.8	-58.6	0	0	0	0	109.7
109	N	38	Very low	37.9	Very low	165 Å²	165	126.2 Å²	126.2	88%	0.882	75%	0.752	S	S	*	*			trans	72.2	157.6	169.8	-51.1	-20	0	0	0	115.2
110	A	33.6	Very low	37.9	Very low	86 Å²	86	123.3 Å²	123.3	71%	0.711	75%	0.749	S	S	*	*			cis	-150	150.1	3	0	0	0	0	0	114.2
111	S	34.9	Very low	38	Very low	79 Å²	79	120.3 Å²	120.3	55%	0.552	74%	0.741	S	S	*	*			trans	31.9	134.2	131.7	-58.8	0	0	0	0	123.1	H113	S111-H113 WeakPolarHBondContact CB-NE2 3.23Å; S111-H113 PolarHBondContact OG-NE2 3.35Å
112	T	33.8	Very low	37.2	Very low	146 Å²	146	119.4 Å²	119.4	90%	0.896	74%	0.736	S	S	*	*				-144.9	156.8	126.3	9.7	0	0	0	0	110.4
113	H	33	Very low	37.3	Very low	170 Å²	170	124.5 Å²	124.5	79%	0.787	74%	0.737	S	S	*	*			trans	-139.1	168.5	-164.7	-59.6	-97.5	0	0	0	112.5	S111	S111-H113 WeakPolarHBondContact CB-NE2 3.23Å; S111-H113 PolarHBondContact OG-NE2 3.35Å
114	S	35	Very low	37.6	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	74%	0.741	S	S	*	*			trans	75.9	153.2	159.5	-57	0	0	0	0	118.6
115	N	36.7	Very low	37.2	Very low	125 Å²	125	130.6 Å²	130.6	67%	0.668	75%	0.75	S	S	*	*			cis	-167.4	161	-30.7	-105.9	-25.9	0	0	0	110.4
116	Q	39.3	Very low	36.8	Very low	165 Å²	165	134 Å²	134	77%	0.771	75%	0.751	S	S	*	*			trans	21.5	142.6	147.5	-66.8	149.7	-7.8	0	0	121.2
117	E	34.4	Very low	36.4	Very low	179 Å²	179	131.7 Å²	131.7	84%	0.836	75%	0.748	S	S	*	*			cis	-142.5	-142.9	-1.5	-143.1	-159.3	97.3	0	0	109.1
118	A	32.1	Very low	36.6	Very low	88 Å²	88	130.3 Å²	130.3	73%	0.727	74%	0.74	S	S	*	*			cis	-152.6	171.6	7.7	0	0	0	0	0	112.6
119	G	30.7	Very low	36.2	Very low	61 Å²	61	134.3 Å²	134.3	63%	0.629	76%	0.756	S	S	*	*			trans	-102.2	-158.4	172.5	0	0	0	0	0	114.8
120	P	51	Low	36.1	Very low	130 Å²	130	134.4 Å²	134.4	84%	0.844	76%	0.756	S	S	*	*			cis	-137.4	-178.2	-2.7	43.1	-26.8	0	0	0	115.5
121	S	39.5	Very low	36.6	Very low	94 Å²	94	135.4 Å²	135.4	66%	0.657	76%	0.758	S	S	*	*				150.4	125.3	122	-166.9	0	0	0	0	116.7
122	N	37.9	Very low	36.9	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	77%	0.769	S	S	*	*			trans	62.8	146.4	151.8	-73.5	-31.1	0	0	0	121.6
123	K	36.2	Very low	37.2	Very low	182 Å²	182	136.2 Å²	136.2	79%	0.791	77%	0.767	S	S	*	*			cis	-169.7	162.1	-22.4	-146.8	171.9	-167.8	162.9	0	111.1
124	R	37.2	Very low	37.3	Very low	238 Å²	238	136.9 Å²	136.9	90%	0.898	77%	0.771	S	S	*	*			trans	78.9	156.5	173	-69.4	-176.8	168.1	177.1	-2.9	117.7
125	T	33.1	Very low	38	Very low	125 Å²	125	139.8 Å²	139.8	77%	0.767	78%	0.777	S	S	*	*			cis	179.2	140.8	-48.2	-91.9	0	0	0	0	110.6
126	K	38.8	Very low	37.8	Very low	181 Å²	181	141.5 Å²	141.5	79%	0.787	79%	0.787	S	S	*	*			trans	87	98.1	161.3	-94.1	-171.6	173.2	-167.4	0	121.8
127	T	32.5	Very low	38.2	Very low	114 Å²	114	139.8 Å²	139.8	70%	0.699	78%	0.783	S	S	*	*				64.6	121.6	119.1	55.4	0	0	0	0	123.3
128	S	37.7	Very low	38.3	Very low	95 Å²	95	138.8 Å²	138.8	66%	0.664	78%	0.783	S	S	*	*			trans	60.1	115.6	142.9	56.1	0	0	0	0	118.8
129	D	35.5	Very low	38.8	Very low	161 Å²	161	141 Å²	141	86%	0.861	78%	0.783	S	S	*	*				74.6	95.1	57.7	-60.9	-47.4	0	0	0	113.3
130	D	35.1	Very low	38.9	Very low	166 Å²	166	142.3 Å²	142.3	89%	0.888	79%	0.788	S	S	*	*				-157.7	155.2	104.8	-166.2	14.7	0	0	0	110
131	S	43.1	Very low	38.5	Very low	107 Å²	107	140.4 Å²	140.4	75%	0.748	78%	0.783	S	S	*	*			trans	-101.5	88	-168.9	-65.2	0	0	0	0	113.5
132	G	41.8	Very low	38.5	Very low	76 Å²	76	141.4 Å²	141.4	78%	0.784	79%	0.785	S	S	*	*			trans	-76.5	116.6	160.1	0	0	0	0	0	110.9
133	L	40	Very low	38.5	Very low	166 Å²	166	139.7 Å²	139.7	87%	0.869	79%	0.789	S	S	*	*			trans	-126.6	132.3	168.1	-74.3	178	0	0	0	110.4
134	E	36	Very low	38.9	Very low	184 Å²	184	137.8 Å²	137.8	86%	0.86	79%	0.786	S	S	*	*			trans	-77.8	163.2	-169.3	-66.2	-87.7	92.2	0	0	113.1	D136	E134-D136 PolarHBondContact O-N 3.42Å
135	L	48.7	Very low	38.8	Very low	165 Å²	165	132.3 Å²	132.3	86%	0.864	78%	0.775	S	S	*	*			trans	-90.6	79.2	-175.9	-173.7	72.3	0	0	0	112.2	N137	L135-N137 PolarHBondContact O-N 3.16Å
136	D	33.7	Very low	39.4	Very low	162 Å²	162	131.3 Å²	131.3	87%	0.866	77%	0.771	S	S	*	*			trans	-73.4	87.2	175.4	-89.1	-20.2	0	0	0	112.5	E134 N138	E134-D136 PolarHBondContact O-N 3.42Å; D136-N138 PolarHBondContact O-N 3.29Å
137	N	46.9	Very low	39.5	Very low	129 Å²	129	127.5 Å²	127.5	69%	0.69	76%	0.762	S	S	*	*			trans	-70.6	113.5	168.7	162.2	50.5	0	0	0	111.3	L135	L135-N137 PolarHBondContact O-N 3.16Å
138	N	37.8	Very low	40.4	Very low	158 Å²	158	130.2 Å²	130.2	85%	0.845	77%	0.769	S	S	*	*			trans	-143.4	108.1	154	-97.2	-60	0	0	0	113	D136 A140	D136-N138 PolarHBondContact O-N 3.29Å; N138-A140 PolarHBondContact O-N 3.33Å
139	N	42	Very low	40.8	Very low	135 Å²	135	132.8 Å²	132.8	72%	0.722	78%	0.775	S	S	*	*			trans	-37.5	113.6	169.5	171.7	36.1	0	0	0	115.1	A141	N139-A141 PolarHBondContact OD1-N 3.3Å
140	A	32.4	Very low	41.5	Very low	88 Å²	88	128.1 Å²	128.1	73%	0.727	77%	0.765	S	S	*	*			trans	-110.6	105.4	151.8	0	0	0	0	0	108.1	N138 V142	N138-A140 PolarHBondContact O-N 3.33Å; A140-V142 PolarHBondContact O-N 3.26Å
141	A	42.6	Very low	42.5	Very low	90 Å²	90	122.9 Å²	122.9	74%	0.744	75%	0.745	S	S	*	*			trans	-70.2	102.9	-173.5	0	0	0	0	0	111.4	N139	N139-A141 PolarHBondContact OD1-N 3.3Å
142	V	38.9	Very low	44.4	Very low	114 Å²	114	120.4 Å²	120.4	69%	0.691	73%	0.728	S	S	*	*			trans	-112	96.5	160.8	-160.5	0	0	0	0	107.7	A140 I144	A140-V142 PolarHBondContact O-N 3.26Å; V142-I144 HydrophobicContact CB-CG1 4.28Å; V142-I144 HydrophobicContact CG1-CD1 4.01Å; V142-I144 HydrophobicContact CG1-CG1 3.53Å; V142-I144 PolarHBondContact O-N 3.32Å
143	A	37.9	Very low	46.7	Very low	98 Å²	98	122.8 Å²	122.8	81%	0.81	72%	0.718	S	S	*	*			trans	-70.8	77	170.5	0	0	0	0	0	109.3	D145	A143-D145 PolarHBondContact O-N 3.1Å; A143-D145 VanDerWaalsContact O-N 3.16Å
144	I	45.9	Very low	49.2	Very low	141 Å²	141	115.8 Å²	115.8	72%	0.723	68%	0.682	S	S	*	*			trans	-84.9	73.7	164.3	-45.9	-176.1	0	0	0	107	V142 P146	V142-I144 HydrophobicContact CB-CG1 4.28Å; V142-I144 HydrophobicContact CG1-CD1 4.01Å; V142-I144 HydrophobicContact CG1-CG1 3.53Å; V142-I144 PolarHBondContact O-N 3.32Å; I144-P146 VanDerWaalsContact O-CD 3.23Å; I144-P146 WeakPolarHBondContact O-CD 3.24Å
145	D	34.2	Very low	52	Low	123 Å²	123	112 Å²	112	66%	0.658	66%	0.664	S	S	*	*			trans	-62.3	119.9	158.8	-111.5	-41.8	0	0	0	108.3	A143 V147	A143-D145 PolarHBondContact O-N 3.1Å; A143-D145 VanDerWaalsContact O-N 3.16Å; D145-V147 HydrophobicContact CB-CG2 3.66Å; D145-V147 PolarHBondContact O-N 3.05Å
146	P	45.2	Very low	54.2	Low	105 Å²	105	104.2 Å²	104.2	68%	0.682	62%	0.623	S	S	*	*			trans	-83.1	66.2	153.5	36.8	-29.5	0	0	0	107.3	I144 M148	I144-P146 VanDerWaalsContact O-CD 3.23Å; I144-P146 WeakPolarHBondContact O-CD 3.24Å; P146-M148 PolarHBondContact O-N 3.25Å
147	V	41.3	Very low	57.2	Low	101 Å²	101	97.2 Å²	97.2	61%	0.612	59%	0.586	S	S	*	*			trans	-62.4	109.8	160.2	-151.4	0	0	0	0	105.1	D145 D149	D145-V147 HydrophobicContact CB-CG2 3.66Å; D145-V147 PolarHBondContact O-N 3.05Å; V147-D149 HydrophobicContact CB-CB 4.2Å; V147-D149 HydrophobicContact CG1-CB 3.83Å; V147-D149 PolarHBondContact O-N 3.11Å
148	M	51.5	Low	59.6	Low	171 Å²	171	91 Å²	91	84%	0.842	55%	0.553	S	S	*	*			trans	-76.6	51.3	167.6	-77.7	-74.3	-176.8	0	0	109.2	P146	P146-M148 PolarHBondContact O-N 3.25Å
149	D	46.3	Very low	62.3	Low	149 Å²	149	86.9 Å²	86.9	80%	0.797	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	135	172.6	-160.4	9.2	0	0	0	108.4	V147	V147-D149 HydrophobicContact CB-CB 4.2Å; V147-D149 HydrophobicContact CG1-CB 3.83Å; V147-D149 PolarHBondContact O-N 3.11Å
150	G	51.2	Low	64.8	Low	62 Å²	62	81.9 Å²	81.9	64%	0.639	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.9	0.4	-172.5	0	0	0	0	0	116.2	S152	G150-S152 VanDerWaalsContact C-N 3.33Å; G150-S152 PolarHBondContact O-N 2.94Å; G150-S152 VanDerWaalsContact O-N 3.16Å
151	A	55.8	Low	67.6	Low	56 Å²	56	78.1 Å²	78.1	46%	0.463	47%	0.468	S	S	.	.			trans	-82.1	79.6	162.1	0	0	0	0	0	109.9	E153	A151-E153 PolarHBondContact O-N 3.46Å
152	S	81.6	Confident	69.9	Low	56 Å²	56	77.9 Å²	77.9	39%	0.392	46%	0.458	S	S	.	.			trans	-43.4	118.8	-177.8	-54.5	0	0	0	0	112.4	G150 G180 E240	G150-S152 VanDerWaalsContact C-N 3.33Å; G150-S152 PolarHBondContact O-N 2.94Å; G150-S152 VanDerWaalsContact O-N 3.16Å; S152-G180 WeakPolarHBondContact O-CA 3.22Å; S152-G180 PolarHBondContact O-N 3.11Å; S152-E240 WeakPolarHBondContact CB-OE1 3.26Å; S152-E240 PolarHBondContact OG-OE1 3.48Å
153	E	90.1	Very high	72.1	Confident	126 Å²	126	77.9 Å²	77.9	59%	0.589	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	132.1	-178.5	-160.5	-179.2	-167.7	0	0	110.9	A151 K177	A151-E153 PolarHBondContact O-N 3.46Å; E153-K177 HydrophobicContact CG-CG 4.11Å; E153-K177 WeakPolarHBondContact OE1-CE 3.47Å; E153-K177 WeakPolarHBondContact OE1-CG 3.49Å; E153-K177 IonicContact OE1-NZ 3.88Å; E153-K177 PolarHBondContact OE1-NZ 2.93Å; E153-K177 WeakPolarHBondContact OE2-CE 3.18Å; E153-K177 IonicContact OE2-NZ 3.64Å; E153-K177 PolarHBondContact OE2-NZ 3.47Å
154	I	92.6	Very high	74.4	Confident	19 Å²	19	76.3 Å²	76.3	10%	0.097	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122.3	-174.7	-61.3	-169.9	0	0	0	110.5	K177 T178 L239 E240 M253	I154-K177 WeakPolarHBondContact O-CA 3.45Å; I154-T178 PolarHBondContact N-O 3.2Å; I154-T178 PolarHBondContact O-N 2.96Å; I154-L239 VanDerWaalsContact CD1-C 3.46Å; I154-L239 HydrophobicContact CD1-CB 3.94Å; I154-E240 HydrophobicContact CD1-CB 4.34Å; I154-M253 HydrophobicContact CG2-CE 4.26Å
155	E	95.2	Very high	76.1	Confident	103 Å²	103	72 Å²	72	48%	0.481	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	135.1	166.6	-67.7	-176	176.6	0	0	110.3	I176 K177 P252 M253	E155-I176 WeakPolarHBondContact CA-O 3.32Å; E155-K177 HydrophobicContact CG-CB 4.38Å; E155-K177 HydrophobicContact CG-CD 3.76Å; E155-K177 HydrophobicContact CG-CG 3.8Å; E155-K177 WeakPolarHBondContact OE1-CD 3.45Å; E155-K177 WeakPolarHBondContact OE1-CE 3.15Å; E155-P252 HydrophobicContact CB-CB 4.05Å; E155-P252 HydrophobicContact CB-CG 4.18Å; E155-P252 CarbonylContact O-C 3.51Å; E155-P252 VanDerWaalsContact O-CA 3.24Å; E155-P252 WeakPolarHBondContact O-CA 3.21Å; E155-M253 PolarHBondContact O-N 3.08Å
156	L	95.9	Very high	77.8	Confident	3 Å²	3	74 Å²	74	2%	0.016	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	149.7	179.6	67.7	89.6	0	0	0	112.7	F158 I176 T178 L187 L239 M253 L255	L156-F158 HydrophobicContact CD1-CB 3.83Å; L156-F158 HydrophobicContact CD1-CG 4.32Å; L156-I176 HydrophobicContact CD1-CB 3.82Å; L156-I176 HydrophobicContact CD1-CD1 4.12Å; L156-I176 HydrophobicContact CD1-CG1 4.37Å; L156-I176 HydrophobicContact CD1-CG2 4.42Å; L156-I176 HydrophobicContact CG-CB 4.02Å; L156-I176 HydrophobicContact CG-CG2 4.38Å; L156-I176 PolarHBondContact N-O 3.01Å; L156-I176 PolarHBondContact O-N 3.01Å; L156-T178 HydrophobicContact CD2-CG2 4.47Å; L156-L187 HydrophobicContact CD2-CD1 3.94Å; L156-L187 HydrophobicContact CD2-CD2 4.37Å; L156-L239 HydrophobicContact CD2-CD1 3.83Å; L156-M253 CarbonylContact C-O 3.52Å; L156-M253 WeakPolarHBondContact CA-O 3.48Å; L156-M253 HydrophobicContact CB-CB 4.12Å; L156-M253 VanDerWaalsContact CB-O 3.26Å; L156-M253 WeakPolarHBondContact CB-O 3.45Å; L156-L255 HydrophobicContact CD2-CD1 4.34Å
157	V	96.8	Very high	78.8	Confident	14 Å²	14	79.3 Å²	79.3	9%	0.085	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	115	174.6	-173.3	0	0	0	0	107.4	R159 T173 Y175 P252 M253 E254 L255	V157-R159 HydrophobicContact CG1-CG 4.21Å; V157-T173 HydrophobicContact CG1-CG2 3.69Å; V157-Y175 HydrophobicContact CG1-CD1 4.33Å; V157-Y175 HydrophobicContact CG1-CE1 3.98Å; V157-Y175 HydrophobicContact CG2-CD1 3.97Å; V157-Y175 HydrophobicContact CG2-CE1 3.95Å; V157-P252 HydrophobicContact CG2-CB 4.31Å; V157-M253 PolarHBondContact N-O 2.96Å; V157-E254 HydrophobicContact CB-CG 4.45Å; V157-E254 WeakPolarHBondContact O-CA 3.48Å; V157-L255 PolarHBondContact O-N 3.16Å
158	F	96.3	Very high	79.7	Confident	0 Å²	0	80 Å²	80	0%	0	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	110.1	-172.2	-158.7	-163	0	0	0	109.6	L156 T173 R174 I176 L187 L191 I221 L255 Y257	L156-F158 HydrophobicContact CD1-CB 3.83Å; L156-F158 HydrophobicContact CD1-CG 4.32Å; F158-T173 WeakPolarHBondContact O-CA 3.05Å; F158-R174 HydrophobicContact CB-CB 4.33Å; F158-R174 PolarHBondContact N-O 3.5Å; F158-R174 PolarHBondContact O-N 3.46Å; F158-I176 HydrophobicContact CB-CD1 4.08Å; F158-I176 HydrophobicContact CD1-CD1 3.64Å; F158-I176 HydrophobicContact CE1-CD1 4.5Å; F158-I176 HydrophobicContact CG-CD1 4.32Å; F158-L187 HydrophobicContact CE1-CB 4.29Å; F158-L187 HydrophobicContact CZ-CB 4.2Å; F158-L191 HydrophobicContact CE1-CB 4.08Å; F158-L191 HydrophobicContact CE1-CD2 4.15Å; F158-L191 HydrophobicContact CZ-CD2 4.15Å; F158-I221 HydrophobicContact CE2-CD1 4.01Å; F158-I221 HydrophobicContact CE2-CG2 4.08Å; F158-I221 HydrophobicContact CZ-CD1 3.65Å; F158-L255 CarbonylContact C-O 3.54Å; F158-L255 WeakPolarHBondContact CA-O 3.35Å; F158-L255 HydrophobicContact CD2-CB 3.8Å; F158-L255 HydrophobicContact CE2-CB 4.18Å; F158-Y257 HydrophobicContact CD1-CD1 4.28Å; F158-Y257 AromaticContact CD2-CD1 3.75Å; F158-Y257 HydrophobicContact CD2-CD1 3.75Å; F158-Y257 HydrophobicContact CE1-CD1 4.36Å; F158-Y257 AromaticContact CE2-CD1 3.8Å; F158-Y257 HydrophobicContact CE2-CD1 3.8Å; F158-Y257 HydrophobicContact CE2-CG 4.27Å; F158-Y257 HydrophobicContact CG-CD1 4Å; F158-Y257 HydrophobicContact CG-CE1 4.44Å; F158-Y257 HydrophobicContact CZ-CD1 4.13Å; F158-Y257 HydrophobicContact CZ-CG 4.45Å
159	R	94.9	Very high	79.9	Confident	70 Å²	70	80 Å²	80	26%	0.264	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	151.9	-171.5	-64.3	-168.8	-178.5	130.6	12.1	112.7	V157 T173 E254 L255 Y256 Y257	V157-R159 HydrophobicContact CG1-CG 4.21Å; R159-T173 HydrophobicContact CG-CG2 3.87Å; R159-E254 IonicContact CZ-OE1 2.83Å; R159-E254 VanDerWaalsContact CZ-OE1 3.23Å; R159-E254 IonicContact CZ-OE2 3.22Å; R159-E254 IonicContact NH1-OE1 2.99Å; R159-E254 PolarHBondContact NH1-OE1 3.38Å; R159-E254 IonicContact NH1-OE2 2.73Å; R159-E254 PolarHBondContact NH1-OE2 2.89Å; R159-E254 IonicContact NH2-OE1 3.98Å; R159-E254 PolarHBondContact NH2-OE1 3.2Å; R159-E254 IonicContact NH2-OE2 2.7Å; R159-L255 PolarHBondContact N-O 2.78Å; R159-Y256 HydrophobicContact CB-CD1 3.77Å; R159-Y256 HydrophobicContact CB-CE1 3.78Å; R159-Y256 HydrophobicContact CG-CE1 4.31Å; R159-Y256 PolarHBondContact NH1-OH 3.25Å; R159-Y256 CarbonylContact O-C 3.5Å; R159-Y256 VanDerWaalsContact O-CA 3.23Å; R159-Y256 WeakPolarHBondContact O-CA 3.41Å; R159-Y257 WeakPolarHBondContact O-CD1 2.87Å; R159-Y257 WeakPolarHBondContact O-CE1 3.49Å; R159-Y257 PolarHBondContact O-N 2.85Å
160	P	93.9	Very high	80.5	Confident	30 Å²	30	76.8 Å²	76.8	20%	0.195	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	143.7	163	30.8	-39.1	0	0	0	110.5	M165 A171 Y257	P160-M165 HydrophobicContact CB-CB 4.27Å; P160-M165 HydrophobicContact CB-CE 4.08Å; P160-M165 HydrophobicContact CB-CG 4.36Å; P160-M165 HydrophobicContact CB-SD 3.43Å; P160-M165 WeakPolarHBondContact CB-SD 3.19Å; P160-A171 HydrophobicContact CB-CB 4.01Å; P160-A171 HydrophobicContact CG-CB 4.15Å; P160-A171 WeakPolarHBondContact CG-O 3.29Å; P160-Y257 HydrophobicContact CB-CE2 4.46Å
161	H	92.6	Very high	81.5	Confident	10 Å²	10	74.9 Å²	74.9	5%	0.046	40%	0.403	C	S	.	.			trans	-71.6	122.9	178.6	-174.1	-77.3	0	0	0	110.5	T163 L164 M165 Y222 F230 Y257 A258	H161-T163 PolarHBondContact CE1-OG1 2.95Å; H161-T163 VanDerWaalsContact CE1-OG1 3.24Å; H161-T163 PolarHBondContact ND1-OG1 2.82Å; H161-T163 PolarHBondContact O-N 2.97Å; H161-L164 HydrophobicContact CB-CB 4.12Å; H161-L164 WeakPolarHBondContact ND1-CB 3.46Å; H161-L164 WeakPolarHBondContact ND1-CG 3.33Å; H161-L164 PolarHBondContact ND1-N 2.99Å; H161-L164 PolarHBondContact O-N 2.86Å; H161-L164 VanDerWaalsContact O-N 3.12Å; H161-M165 PolarHBondContact O-N 2.92Å; H161-Y222 AromaticContact CD2-CD2 3.84Å; H161-Y222 AromaticContact CD2-CG 3.9Å; H161-F230 AromaticContact CD2-CD1 3.83Å; H161-F230 AromaticContact CD2-CG 3.87Å; H161-F230 WeakPolarHBondContact NE2-CB 3.21Å; H161-F230 AromaticContact NE2-CD1 3.69Å; H161-F230 AromaticContact NE2-CD2 3.52Å; H161-F230 AromaticContact NE2-CG 3.22Å; H161-F230 WeakPolarHBondContact NE2-CG 3.44Å; H161-Y257 VanDerWaalsContact CB-O 3.23Å; H161-Y257 WeakPolarHBondContact CB-O 3.23Å; H161-Y257 PolarHBondContact N-O 3.4Å; H161-A258 HydrophobicContact CB-CB 4.03Å
162	P	89.1	Confident	82.8	Confident	84 Å²	84	77.7 Å²	77.7	55%	0.545	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.6	-160.7	25.6	-36.4	0	0	0	115.8	F230	P162-F230 HydrophobicContact CG-CE1 4.5Å; P162-F230 HydrophobicContact CG-CE2 4Å; P162-F230 HydrophobicContact CG-CZ 3.67Å
163	T	86.6	Confident	83.2	Confident	114 Å²	114	77.4 Å²	77.4	70%	0.699	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	1.5	179.4	58.7	0	0	0	0	114.3	H161	H161-T163 PolarHBondContact CE1-OG1 2.95Å; H161-T163 VanDerWaalsContact CE1-OG1 3.24Å; H161-T163 PolarHBondContact ND1-OG1 2.82Å; H161-T163 PolarHBondContact O-N 2.97Å
164	L	85.1	Confident	83.3	Confident	66 Å²	66	72 Å²	72	35%	0.346	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-3.6	-178.2	-67.5	176.4	0	0	0	113.5	H161 Y222 A258	H161-L164 HydrophobicContact CB-CB 4.12Å; H161-L164 WeakPolarHBondContact ND1-CB 3.46Å; H161-L164 WeakPolarHBondContact ND1-CG 3.33Å; H161-L164 PolarHBondContact ND1-N 2.99Å; H161-L164 PolarHBondContact O-N 2.86Å; H161-L164 VanDerWaalsContact O-N 3.12Å; L164-Y222 HydrophobicContact CD1-CE1 4.46Å; L164-Y222 HydrophobicContact CD1-CE2 4.45Å; L164-A258 HydrophobicContact CB-CB 3.7Å; L164-A258 HydrophobicContact CD1-CB 4.25Å
165	M	81.8	Confident	83.5	Confident	49 Å²	49	79.8 Å²	79.8	24%	0.241	41%	0.406	C	S	.	.	S	Bend	trans	-118.3	143.8	168.3	-68.7	-171.2	62	0	0	109.8	P160 H161 A171 Y257 A258	P160-M165 HydrophobicContact CB-CB 4.27Å; P160-M165 HydrophobicContact CB-CE 4.08Å; P160-M165 HydrophobicContact CB-CG 4.36Å; P160-M165 HydrophobicContact CB-SD 3.43Å; P160-M165 WeakPolarHBondContact CB-SD 3.19Å; H161-M165 PolarHBondContact O-N 2.92Å; M165-A171 HydrophobicContact CE-CB 3.96Å; M165-Y257 HydrophobicContact CE-CD2 4.43Å; M165-Y257 HydrophobicContact CE-CE2 3.78Å; M165-Y257 HydrophobicContact SD-CD2 3.54Å; M165-Y257 VanDerWaalsContact SD-CD2 3.54Å; M165-Y257 HydrophobicContact SD-CE2 3.4Å; M165-Y257 WeakPolarHBondContact SD-CE2 3.34Å; M165-Y257 VanDerWaalsContact SD-O 3.4Å; M165-A258 HydrophobicContact CG-CB 4.46Å
166	E	70.9	Confident	83.5	Confident	166 Å²	166	75.9 Å²	75.9	78%	0.776	39%	0.388	S	S	*	.			trans	-79.2	169	170.5	-55	-143.2	147	0	0	110.8	D168	E166-D168 PolarHBondContact O-N 3.15Å
167	K	64.7	Low	83.4	Confident	217 Å²	217	81 Å²	81	94%	0.943	41%	0.41	S	S	*	.			trans	-85.4	49.8	-175.3	-64.1	-178.8	179.7	176.6	0	112.4
168	D	61.5	Low	83.4	Confident	115 Å²	115	82.3 Å²	82.3	62%	0.615	42%	0.418	S	S	*	.			trans	-76.7	148.2	169.9	-81.5	-47.5	0	0	0	111.2	E166 S170 A171	E166-D168 PolarHBondContact O-N 3.15Å; D168-S170 PolarHBondContact O-N 3.44Å; D168-S170 VanDerWaalsContact O-N 3.07Å; D168-A171 VanDerWaalsContact O-CB 3.24Å; D168-A171 WeakPolarHBondContact O-CB 3.39Å; D168-A171 PolarHBondContact O-N 3.09Å
169	D	54.4	Low	83.3	Confident	170 Å²	170	84.4 Å²	84.4	91%	0.909	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.2	178	-67.8	-52.9	0	0	0	113.3	A171	D169-A171 PolarHBondContact O-N 3.42Å
170	S	60.3	Low	83.2	Confident	82 Å²	82	81.1 Å²	81.1	57%	0.573	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.1	173.8	-57.1	0	0	0	0	114.2	D168 Q172	D168-S170 PolarHBondContact O-N 3.44Å; D168-S170 VanDerWaalsContact O-N 3.07Å; S170-Q172 PolarHBondContact O-N 2.89Å
171	A	71.1	Confident	83.3	Confident	23 Å²	23	84.6 Å²	84.6	19%	0.19	44%	0.438	C	S	.	.			trans	-79.7	47.7	-175.8	0	0	0	0	0	113.3	P160 M165 D168 D169	P160-A171 HydrophobicContact CB-CB 4.01Å; P160-A171 HydrophobicContact CG-CB 4.15Å; P160-A171 WeakPolarHBondContact CG-O 3.29Å; M165-A171 HydrophobicContact CE-CB 3.96Å; D168-A171 VanDerWaalsContact O-CB 3.24Å; D168-A171 WeakPolarHBondContact O-CB 3.39Å; D168-A171 PolarHBondContact O-N 3.09Å; D169-A171 PolarHBondContact O-N 3.42Å
172	Q	82.6	Confident	83.5	Confident	115 Å²	115	84.7 Å²	84.7	54%	0.537	44%	0.44	S	S	.	.			trans	-72.7	139	-175.3	-157.6	-177.5	14.2	0	0	112.6	S170 Y257	S170-Q172 PolarHBondContact O-N 2.89Å; Q172-Y257 PolarHBondContact O-OH 3.16Å
173	T	91.1	Very high	83.9	Confident	49 Å²	49	81.9 Å²	81.9	30%	0.301	42%	0.422	S	S	.	.			trans	-72.8	130.6	165.1	-67.6	0	0	0	0	110	V157 F158 R159 Y175	V157-T173 HydrophobicContact CG1-CG2 3.69Å; F158-T173 WeakPolarHBondContact O-CA 3.05Å; R159-T173 HydrophobicContact CG-CG2 3.87Å; T173-Y175 HydrophobicContact CG2-CE2 4.27Å
174	R	93	Very high	84.4	Confident	13 Å²	13	76.6 Å²	76.6	5%	0.049	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140	-175.5	-52	178.4	-175.6	-81.6	-0.6	110	F158 I176 E198	F158-R174 HydrophobicContact CB-CB 4.33Å; F158-R174 PolarHBondContact N-O 3.5Å; F158-R174 PolarHBondContact O-N 3.46Å; R174-I176 HydrophobicContact CB-CD1 4.33Å; R174-I176 HydrophobicContact CB-CG1 4.35Å; R174-E198 IonicContact CZ-OE1 2.71Å; R174-E198 IonicContact CZ-OE2 2.9Å; R174-E198 VanDerWaalsContact NH1-CD 3.26Å; R174-E198 IonicContact NH1-OE1 2.78Å; R174-E198 PolarHBondContact NH1-OE1 3.09Å; R174-E198 IonicContact NH1-OE2 3.17Å; R174-E198 PolarHBondContact NH1-OE2 3.2Å; R174-E198 IonicContact NH2-OE2 2.76Å; R174-E198 PolarHBondContact NH2-OE2 3.37Å
175	Y	95.6	Very high	84.9	Confident	183 Å²	183	76.5 Å²	76.5	72%	0.718	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.4	173.6	-61.2	-90.2	0	0	0	107.7	V157 T173	V157-Y175 HydrophobicContact CG1-CD1 4.33Å; V157-Y175 HydrophobicContact CG1-CE1 3.98Å; V157-Y175 HydrophobicContact CG2-CD1 3.97Å; V157-Y175 HydrophobicContact CG2-CE1 3.95Å; T173-Y175 HydrophobicContact CG2-CE2 4.27Å
176	I	95.3	Very high	85.6	Confident	21 Å²	21	79.9 Å²	79.9	11%	0.108	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138.2	-169.4	-61.6	172.9	0	0	0	108.7	E155 L156 F158 R174 T178 Y190	E155-I176 WeakPolarHBondContact CA-O 3.32Å; L156-I176 HydrophobicContact CD1-CB 3.82Å; L156-I176 HydrophobicContact CD1-CD1 4.12Å; L156-I176 HydrophobicContact CD1-CG1 4.37Å; L156-I176 HydrophobicContact CD1-CG2 4.42Å; L156-I176 HydrophobicContact CG-CB 4.02Å; L156-I176 HydrophobicContact CG-CG2 4.38Å; L156-I176 PolarHBondContact N-O 3.01Å; L156-I176 PolarHBondContact O-N 3.01Å; F158-I176 HydrophobicContact CB-CD1 4.08Å; F158-I176 HydrophobicContact CD1-CD1 3.64Å; F158-I176 HydrophobicContact CE1-CD1 4.5Å; F158-I176 HydrophobicContact CG-CD1 4.32Å; R174-I176 HydrophobicContact CB-CD1 4.33Å; R174-I176 HydrophobicContact CB-CG1 4.35Å; I176-T178 HydrophobicContact CG2-CG2 4.48Å; I176-Y190 HydrophobicContact CD1-CD1 4.01Å; I176-Y190 HydrophobicContact CD1-CE1 3.45Å; I176-Y190 VanDerWaalsContact CD1-CE1 3.45Å; I176-Y190 HydrophobicContact CG1-CE1 4.29Å
177	K	94.6	Very high	86.8	Confident	110 Å²	110	72.3 Å²	72.3	48%	0.478	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125.5	173.4	-166.2	163.7	-171.7	-97.3	0	107.3	E153 I154 E155	E153-K177 HydrophobicContact CG-CG 4.11Å; E153-K177 WeakPolarHBondContact OE1-CE 3.47Å; E153-K177 WeakPolarHBondContact OE1-CG 3.49Å; E153-K177 IonicContact OE1-NZ 3.88Å; E153-K177 PolarHBondContact OE1-NZ 2.93Å; E153-K177 WeakPolarHBondContact OE2-CE 3.18Å; E153-K177 IonicContact OE2-NZ 3.64Å; E153-K177 PolarHBondContact OE2-NZ 3.47Å; I154-K177 WeakPolarHBondContact O-CA 3.45Å; E155-K177 HydrophobicContact CG-CB 4.38Å; E155-K177 HydrophobicContact CG-CD 3.76Å; E155-K177 HydrophobicContact CG-CG 3.8Å; E155-K177 WeakPolarHBondContact OE1-CD 3.45Å; E155-K177 WeakPolarHBondContact OE1-CE 3.15Å
178	T	95.3	Very high	88.2	Confident	41 Å²	41	62.1 Å²	62.1	25%	0.252	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	172.2	-170.9	-164.5	0	0	0	0	111	I154 L156 I176 A182 L239	I154-T178 PolarHBondContact N-O 3.2Å; I154-T178 PolarHBondContact O-N 2.96Å; L156-T178 HydrophobicContact CD2-CG2 4.47Å; I176-T178 HydrophobicContact CG2-CG2 4.48Å; T178-A182 HydrophobicContact CG2-CB 4.46Å; T178-L239 HydrophobicContact CG2-CD1 3.54Å
179	S	94.9	Very high	89.8	Confident	45 Å²	45	60.9 Å²	60.9	32%	0.315	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	142.2	177.6	55.5	0	0	0	0	111.6	N181 A182	S179-N181 WeakPolarHBondContact CB-OD1 3.06Å; S179-N181 PolarHBondContact O-N 3.37Å; S179-N181 PolarHBondContact OG-OD1 3.07Å; S179-A182 WeakPolarHBondContact O-CB 3.48Å; S179-A182 PolarHBondContact O-N 3.04Å
180	G	93.6	Very high	91.7	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.2	-177.9	0	0	0	0	0	114.2	S152 A182 S238 L239 E240	S152-G180 WeakPolarHBondContact O-CA 3.22Å; S152-G180 PolarHBondContact O-N 3.11Å; G180-A182 VanDerWaalsContact C-N 3.31Å; G180-S238 WeakPolarHBondContact O-CB 3.45Å; G180-L239 PolarHBondContact O-N 2.84Å; G180-E240 WeakPolarHBondContact O-CB 3.42Å; G180-E240 PolarHBondContact O-N 3.26Å
181	N	94.9	Very high	93.3	Very high	103 Å²	103	53.3 Å²	53.3	55%	0.551	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-8.5	171.8	69.2	-1.3	0	0	0	114.3	S179	S179-N181 WeakPolarHBondContact CB-OD1 3.06Å; S179-N181 PolarHBondContact O-N 3.37Å; S179-N181 PolarHBondContact OG-OD1 3.07Å
182	A	96.4	Very high	94.2	Very high	12 Å²	12	52.6 Å²	52.6	10%	0.099	26%	0.255	C	S	.	.			trans	-62.7	151.5	166.1	0	0	0	0	0	109.5	T178 S179 G180 S238 L239	T178-A182 HydrophobicContact CG2-CB 4.46Å; S179-A182 WeakPolarHBondContact O-CB 3.48Å; S179-A182 PolarHBondContact O-N 3.04Å; G180-A182 VanDerWaalsContact C-N 3.31Å; A182-S238 CarbonylContact O-C 3.58Å; A182-S238 VanDerWaalsContact O-CA 3.29Å; A182-S238 WeakPolarHBondContact O-CA 3.42Å; A182-L239 HydrophobicContact CB-CD1 4.22Å; A182-L239 WeakPolarHBondContact O-CG 3.27Å; A182-L239 PolarHBondContact O-N 3.1Å
183	T	97.4	Very high	94.7	Very high	25 Å²	25	49.1 Å²	49.1	15%	0.153	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-110.3	168.8	-178.3	77.7	0	0	0	0	112.9	D185 H186 L187 G235 F237	T183-D185 VanDerWaalsContact C-N 3.27Å; T183-D185 PolarHBondContact O-N 2.94Å; T183-D185 PolarHBondContact OG1-N 2.84Å; T183-H186 PolarHBondContact N-ND1 3.37Å; T183-H186 WeakPolarHBondContact O-CB 3.44Å; T183-H186 PolarHBondContact O-N 2.88Å; T183-H186 PolarHBondContact OG1-ND1 3.49Å; T183-L187 PolarHBondContact O-N 3.25Å; T183-G235 VanDerWaalsContact CB-O 3.26Å; T183-G235 WeakPolarHBondContact CB-O 3.34Å; T183-G235 PolarHBondContact OG1-O 3.46Å; T183-G235 VanDerWaalsContact OG1-O 3.11Å; T183-F237 WeakPolarHBondContact CA-O 3.17Å; T183-F237 WeakPolarHBondContact CB-O 3.4Å
184	V	97.1	Very high	94.7	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.024	24%	0.244	C	C	.	.	H	α-helix	trans	-58.5	-37.6	175.3	174.3	0	0	0	0	112	H186 L187 S188 I221 L233 N234 G235 F237 L239 V242	V184-H186 VanDerWaalsContact C-N 3.31Å; V184-H186 PolarHBondContact O-N 3.18Å; V184-L187 PolarHBondContact O-N 3.31Å; V184-L187 VanDerWaalsContact O-N 3.16Å; V184-S188 PolarHBondContact O-N 3.02Å; V184-I221 HydrophobicContact CG1-CB 3.62Å; V184-I221 HydrophobicContact CG1-CG1 3.68Å; V184-I221 HydrophobicContact CG1-CG2 4.18Å; V184-L233 HydrophobicContact CG1-CB 4.04Å; V184-L233 HydrophobicContact CG2-CB 3.89Å; V184-L233 HydrophobicContact CG2-CD1 4.13Å; V184-N234 WeakPolarHBondContact CB-O 3.4Å; V184-G235 PolarHBondContact N-O 3.05Å; V184-F237 HydrophobicContact CG2-CB 4.4Å; V184-F237 PolarHBondContact N-O 3.38Å; V184-F237 VanDerWaalsContact N-O 3.07Å; V184-L239 HydrophobicContact CG2-CD2 4.47Å; V184-V242 HydrophobicContact CG2-CG2 4.07Å
185	D	96.6	Very high	94.4	Very high	63 Å²	63	52 Å²	52	34%	0.337	25%	0.249	S	C	.	.	H	α-helix	trans	-60.4	-38.7	172.6	-74	-37	0	0	0	112.2	T183 L187 S188 K189 E216 G235	T183-D185 VanDerWaalsContact C-N 3.27Å; T183-D185 PolarHBondContact O-N 2.94Å; T183-D185 PolarHBondContact OG1-N 2.84Å; D185-L187 VanDerWaalsContact C-N 3.33Å; D185-L187 PolarHBondContact O-N 3.41Å; D185-S188 PolarHBondContact O-N 2.81Å; D185-K189 WeakPolarHBondContact O-CB 3.3Å; D185-K189 PolarHBondContact O-N 2.96Å; D185-E216 HydrophobicContact CB-CB 3.82Å; D185-E216 HydrophobicContact CB-CG 4.31Å; D185-E216 WeakPolarHBondContact O-CB 3.36Å; D185-G235 VanDerWaalsContact CG-C 3.41Å; D185-G235 PolarHBondContact N-O 3.14Å; D185-G235 WeakPolarHBondContact OD1-CA 3.21Å; D185-G235 VanDerWaalsContact OD2-CA 3.29Å; D185-G235 WeakPolarHBondContact OD2-CA 3.39Å
186	H	96.3	Very high	94	Very high	121 Å²	121	45.6 Å²	45.6	56%	0.56	23%	0.233	S	C	*	.	H	α-helix	trans	-64.7	-37.1	175.6	-66.3	84.5	0	0	0	111.6	T183 V184 Y190	T183-H186 PolarHBondContact N-ND1 3.37Å; T183-H186 WeakPolarHBondContact O-CB 3.44Å; T183-H186 PolarHBondContact O-N 2.88Å; T183-H186 PolarHBondContact OG1-ND1 3.49Å; V184-H186 VanDerWaalsContact C-N 3.31Å; V184-H186 PolarHBondContact O-N 3.18Å; H186-Y190 WeakPolarHBondContact O-CB 3.37Å; H186-Y190 PolarHBondContact O-N 3.21Å
187	L	96.1	Very high	93.5	Very high	7 Å²	7	48 Å²	48	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-68.9	-40.5	174.6	-68.8	-170.9	0	0	0	112.8	L156 F158 T183 V184 D185 Y190 L191 L239 L255	L156-L187 HydrophobicContact CD2-CD1 3.94Å; L156-L187 HydrophobicContact CD2-CD2 4.37Å; F158-L187 HydrophobicContact CE1-CB 4.29Å; F158-L187 HydrophobicContact CZ-CB 4.2Å; T183-L187 PolarHBondContact O-N 3.25Å; V184-L187 PolarHBondContact O-N 3.31Å; V184-L187 VanDerWaalsContact O-N 3.16Å; D185-L187 VanDerWaalsContact C-N 3.33Å; D185-L187 PolarHBondContact O-N 3.41Å; L187-Y190 PolarHBondContact O-N 2.95Å; L187-L191 WeakPolarHBondContact O-CB 3.11Å; L187-L191 PolarHBondContact O-N 3.26Å; L187-L239 HydrophobicContact CD1-CD1 3.97Å; L187-L239 HydrophobicContact CD1-CD2 3.55Å; L187-L239 HydrophobicContact CD1-CG 4.39Å; L187-L239 HydrophobicContact CD2-CD1 4.18Å; L187-L239 HydrophobicContact CG-CD1 4.13Å; L187-L239 HydrophobicContact CG-CD2 4.18Å; L187-L255 HydrophobicContact CD1-CD1 3.53Å
188	S	95.2	Very high	93	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.014	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-47.1	175	176.9	0	0	0	0	111.4	V184 D185 L191 A192 E216 Y219	V184-S188 PolarHBondContact O-N 3.02Å; D185-S188 PolarHBondContact O-N 2.81Å; S188-L191 WeakPolarHBondContact O-CB 3.32Å; S188-L191 PolarHBondContact O-N 3Å; S188-A192 PolarHBondContact O-N 2.63Å; S188-E216 VanDerWaalsContact CB-O 3.25Å; S188-E216 WeakPolarHBondContact CB-O 3.42Å; S188-E216 VanDerWaalsContact OG-C 3.28Å; S188-E216 PolarHBondContact OG-O 3.3Å; S188-Y219 PolarHBondContact OG-N 2.93Å; S188-Y219 PolarHBondContact OG-O 3.39Å
189	K	93.8	Very high	92.4	Very high	90 Å²	90	48 Å²	48	39%	0.391	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-41.4	177.3	-162.7	175.7	-164.5	115.3	0	112.3	D185 L191 A192 V193 A214 E216	D185-K189 WeakPolarHBondContact O-CB 3.3Å; D185-K189 PolarHBondContact O-N 2.96Å; K189-L191 VanDerWaalsContact C-N 3.3Å; K189-L191 PolarHBondContact O-N 2.83Å; K189-A192 PolarHBondContact O-N 2.7Å; K189-V193 WeakPolarHBondContact O-CG2 3.19Å; K189-V193 PolarHBondContact O-N 3.06Å; K189-A214 WeakPolarHBondContact CE-O 3.39Å; K189-A214 PolarHBondContact NZ-O 3.39Å; K189-E216 HydrophobicContact CB-CB 4.19Å; K189-E216 IonicContact NZ-OE2 3.91Å; K189-E216 PolarHBondContact NZ-OE2 3.49Å
190	Y	94.9	Very high	91.4	Very high	93 Å²	93	48.9 Å²	48.9	37%	0.365	25%	0.246	S	C	.	.	H	α-helix	trans	-54.5	-47.8	171.6	163.4	-88.4	0	0	0	111	I176 H186 L187 V193 R194	I176-Y190 HydrophobicContact CD1-CD1 4.01Å; I176-Y190 HydrophobicContact CD1-CE1 3.45Å; I176-Y190 VanDerWaalsContact CD1-CE1 3.45Å; I176-Y190 HydrophobicContact CG1-CE1 4.29Å; H186-Y190 WeakPolarHBondContact O-CB 3.37Å; H186-Y190 PolarHBondContact O-N 3.21Å; L187-Y190 PolarHBondContact O-N 2.95Å; Y190-V193 PolarHBondContact O-N 2.88Å; Y190-R194 HydrophobicContact CE1-CB 4.26Å; Y190-R194 HydrophobicContact CE1-CG 4.36Å; Y190-R194 WeakPolarHBondContact O-CB 3.18Å; Y190-R194 PolarHBondContact O-N 3.43Å
191	L	93	Very high	90.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-43.5	-178	177.4	62.8	0	0	0	112	F158 L187 S188 K189 R194 L195 Y219 Y257	F158-L191 HydrophobicContact CE1-CB 4.08Å; F158-L191 HydrophobicContact CE1-CD2 4.15Å; F158-L191 HydrophobicContact CZ-CD2 4.15Å; L187-L191 WeakPolarHBondContact O-CB 3.11Å; L187-L191 PolarHBondContact O-N 3.26Å; S188-L191 WeakPolarHBondContact O-CB 3.32Å; S188-L191 PolarHBondContact O-N 3Å; K189-L191 VanDerWaalsContact C-N 3.3Å; K189-L191 PolarHBondContact O-N 2.83Å; L191-R194 PolarHBondContact O-N 3.27Å; L191-L195 HydrophobicContact CD1-CD1 3.77Å; L191-L195 HydrophobicContact CD1-CG 4.18Å; L191-L195 HydrophobicContact CG-CD1 4Å; L191-L195 WeakPolarHBondContact O-CB 3.34Å; L191-L195 PolarHBondContact O-N 3.18Å; L191-Y219 HydrophobicContact CB-CD2 4.43Å; L191-Y219 HydrophobicContact CD2-CD1 3.57Å; L191-Y219 HydrophobicContact CD2-CD2 3.97Å; L191-Y219 HydrophobicContact CD2-CE1 4.11Å; L191-Y219 HydrophobicContact CD2-CE2 4.49Å; L191-Y219 HydrophobicContact CD2-CG 3.51Å; L191-Y219 HydrophobicContact CG-CD1 4.33Å; L191-Y219 HydrophobicContact CG-CD2 4.08Å; L191-Y219 HydrophobicContact CG-CE1 4.49Å; L191-Y219 HydrophobicContact CG-CE2 4.29Å; L191-Y219 HydrophobicContact CG-CG 4.14Å; L191-Y257 HydrophobicContact CD1-CD1 4.46Å; L191-Y257 HydrophobicContact CD1-CD2 4.44Å; L191-Y257 HydrophobicContact CD1-CE1 4.18Å; L191-Y257 HydrophobicContact CD1-CE2 4.1Å; L191-Y257 HydrophobicContact CD2-CD1 3.85Å; L191-Y257 HydrophobicContact CD2-CD2 3.38Å; L191-Y257 HydrophobicContact CD2-CE1 4.34Å; L191-Y257 HydrophobicContact CD2-CE2 3.88Å; L191-Y257 HydrophobicContact CD2-CG 3.35Å; L191-Y257 HydrophobicContact CG-CD2 4.47Å
192	A	91.6	Very high	89.6	Confident	8 Å²	8	59 Å²	59	7%	0.066	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-51.7	175.4	0	0	0	0	0	112.4	S188 K189 R194 A196 A214 Q218 Y219	S188-A192 PolarHBondContact O-N 2.63Å; K189-A192 PolarHBondContact O-N 2.7Å; A192-R194 VanDerWaalsContact C-N 3.29Å; A192-R194 PolarHBondContact O-N 3.4Å; A192-A196 PolarHBondContact O-N 3.16Å; A192-A214 HydrophobicContact CB-CB 4.32Å; A192-Q218 HydrophobicContact CB-CB 4.49Å; A192-Q218 VanDerWaalsContact CB-OE1 3.26Å; A192-Y219 HydrophobicContact CB-CD2 4.21Å; A192-Y219 HydrophobicContact CB-CE2 4.03Å
193	V	91.4	Very high	88.1	Confident	42 Å²	42	64.8 Å²	64.8	26%	0.255	32%	0.316	S	S	.	.	H	α-helix	trans	-59.9	-41.7	175.9	173.2	0	0	0	0	110.8	K189 Y190 A196 L197 L211 A214	K189-V193 WeakPolarHBondContact O-CG2 3.19Å; K189-V193 PolarHBondContact O-N 3.06Å; Y190-V193 PolarHBondContact O-N 2.88Å; V193-A196 PolarHBondContact O-N 3.43Å; V193-L197 HydrophobicContact CG1-CD1 3.86Å; V193-L197 HydrophobicContact CG1-CG 4.43Å; V193-L197 VanDerWaalsContact O-CG 3.31Å; V193-L197 WeakPolarHBondContact O-CG 3.19Å; V193-L197 PolarHBondContact O-N 3.45Å; V193-L197 VanDerWaalsContact O-N 3.07Å; V193-L211 HydrophobicContact CG1-CD1 4.08Å; V193-L211 HydrophobicContact CG2-CD1 4.05Å; V193-A214 HydrophobicContact CG2-CB 3.54Å
194	R	91.1	Very high	86.2	Confident	94 Å²	94	66.9 Å²	66.9	36%	0.355	34%	0.342	S	S	.	.	H	α-helix	trans	-67.9	-41.7	-175.2	-176.1	66.7	-157.5	-170.7	3.1	112.6	Y190 L191 A192 L197 E198	Y190-R194 HydrophobicContact CE1-CB 4.26Å; Y190-R194 HydrophobicContact CE1-CG 4.36Å; Y190-R194 WeakPolarHBondContact O-CB 3.18Å; Y190-R194 PolarHBondContact O-N 3.43Å; L191-R194 PolarHBondContact O-N 3.27Å; A192-R194 VanDerWaalsContact C-N 3.29Å; A192-R194 PolarHBondContact O-N 3.4Å; R194-L197 PolarHBondContact O-N 3.44Å; R194-E198 IonicContact CZ-OE1 2.7Å; R194-E198 IonicContact NE-OE1 2.59Å; R194-E198 PolarHBondContact NE-OE1 2.91Å; R194-E198 IonicContact NH2-OE1 2.63Å; R194-E198 PolarHBondContact NH2-OE1 3.08Å; R194-E198 WeakPolarHBondContact O-CG 3.42Å; R194-E198 PolarHBondContact O-N 3.16Å; R194-E198 VanDerWaalsContact O-N 3.16Å
195	L	88.2	Confident	84	Confident	29 Å²	29	72.6 Å²	72.6	15%	0.152	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-42.9	175.8	-79.3	164	0	0	0	111.7	L191 L197 E198 E199 Y219	L191-L195 HydrophobicContact CD1-CD1 3.77Å; L191-L195 HydrophobicContact CD1-CG 4.18Å; L191-L195 HydrophobicContact CG-CD1 4Å; L191-L195 WeakPolarHBondContact O-CB 3.34Å; L191-L195 PolarHBondContact O-N 3.18Å; L195-L197 VanDerWaalsContact C-N 3.33Å; L195-L197 PolarHBondContact O-N 2.73Å; L195-E198 PolarHBondContact O-N 2.61Å; L195-E198 VanDerWaalsContact O-N 3.08Å; L195-E199 PolarHBondContact O-N 3.23Å; L195-Y219 HydrophobicContact CD1-CE1 4.18Å; L195-Y219 HydrophobicContact CD1-CE2 4.3Å; L195-Y219 VanDerWaalsContact CD1-OH 3.26Å; L195-Y219 WeakPolarHBondContact CD1-OH 3.41Å
196	A	85.7	Confident	81.6	Confident	47 Å²	47	75.7 Å²	75.7	39%	0.388	40%	0.395	S	S	.	.	H	α-helix	trans	-60	-41.2	175.9	0	0	0	0	0	112.5	A192 V193 E198 L200	A192-A196 PolarHBondContact O-N 3.16Å; V193-A196 PolarHBondContact O-N 3.43Å; A196-E198 VanDerWaalsContact C-N 3.29Å; A196-E198 PolarHBondContact O-N 2.69Å; A196-L200 WeakPolarHBondContact O-CG 3.35Å; A196-L200 PolarHBondContact O-N 3.48Å
197	L	85.1	Confident	79.2	Confident	71 Å²	71	74.9 Å²	74.9	37%	0.372	40%	0.395	S	S	.	.	H	α-helix	trans	-68.2	-24.6	175.4	-70.7	171.9	0	0	0	113.7	V193 R194 L195 R201 M209	V193-L197 HydrophobicContact CG1-CD1 3.86Å; V193-L197 HydrophobicContact CG1-CG 4.43Å; V193-L197 VanDerWaalsContact O-CG 3.31Å; V193-L197 WeakPolarHBondContact O-CG 3.19Å; V193-L197 PolarHBondContact O-N 3.45Å; V193-L197 VanDerWaalsContact O-N 3.07Å; R194-L197 PolarHBondContact O-N 3.44Å; L195-L197 VanDerWaalsContact C-N 3.33Å; L195-L197 PolarHBondContact O-N 2.73Å; L197-R201 WeakPolarHBondContact O-CG 3.38Å; L197-M209 HydrophobicContact CD2-SD 4.4Å
198	E	85.4	Confident	76.9	Confident	44 Å²	44	83.8 Å²	83.8	21%	0.206	44%	0.436	C	S	.	.	H	α-helix	trans	-83	-38.2	176.8	-76.4	168	174.3	0	0	111.8	R174 R194 L195 A196 R201 S202	R174-E198 IonicContact CZ-OE1 2.71Å; R174-E198 IonicContact CZ-OE2 2.9Å; R174-E198 VanDerWaalsContact NH1-CD 3.26Å; R174-E198 IonicContact NH1-OE1 2.78Å; R174-E198 PolarHBondContact NH1-OE1 3.09Å; R174-E198 IonicContact NH1-OE2 3.17Å; R174-E198 PolarHBondContact NH1-OE2 3.2Å; R174-E198 IonicContact NH2-OE2 2.76Å; R174-E198 PolarHBondContact NH2-OE2 3.37Å; R194-E198 IonicContact CZ-OE1 2.7Å; R194-E198 IonicContact NE-OE1 2.59Å; R194-E198 PolarHBondContact NE-OE1 2.91Å; R194-E198 IonicContact NH2-OE1 2.63Å; R194-E198 PolarHBondContact NH2-OE1 3.08Å; R194-E198 WeakPolarHBondContact O-CG 3.42Å; R194-E198 PolarHBondContact O-N 3.16Å; R194-E198 VanDerWaalsContact O-N 3.16Å; L195-E198 PolarHBondContact O-N 2.61Å; L195-E198 VanDerWaalsContact O-N 3.08Å; A196-E198 VanDerWaalsContact C-N 3.29Å; A196-E198 PolarHBondContact O-N 2.69Å; E198-R201 PolarHBondContact O-N 3.25Å; E198-S202 WeakPolarHBondContact O-CB 3.45Å; E198-S202 PolarHBondContact O-N 3.18Å
199	E	80.9	Confident	74.8	Confident	109 Å²	109	89.1 Å²	89.1	51%	0.509	46%	0.462	S	S	.	.	H	α-helix	trans	-61.6	-44.2	173.5	-177.1	169.2	-161.6	0	0	112	L195 R201 S202 K203	L195-E199 PolarHBondContact O-N 3.23Å; E199-R201 VanDerWaalsContact C-N 3.3Å; E199-R201 PolarHBondContact O-N 3.49Å; E199-S202 PolarHBondContact O-N 2.81Å; E199-S202 VanDerWaalsContact O-N 3.11Å; E199-K203 HydrophobicContact CG-CD 4.01Å; E199-K203 PolarHBondContact O-N 3.37Å; E199-K203 WeakPolarHBondContact OE1-CE 3.25Å; E199-K203 IonicContact OE1-NZ 2.65Å; E199-K203 PolarHBondContact OE1-NZ 2.82Å
200	L	75.3	Confident	72.7	Confident	63 Å²	63	89.8 Å²	89.8	33%	0.33	47%	0.47	S	S	.	.	H	α-helix	trans	-58.3	-40.5	175.1	-72.5	168.9	0	0	0	112.4	A196 S202 G204 M209	A196-L200 WeakPolarHBondContact O-CG 3.35Å; A196-L200 PolarHBondContact O-N 3.48Å; L200-S202 VanDerWaalsContact C-N 3.34Å; L200-G204 PolarHBondContact O-N 3.43Å; L200-M209 HydrophobicContact CD1-CG 3.93Å; L200-M209 HydrophobicContact CD1-SD 3.62Å
201	R	78.1	Confident	71	Confident	209 Å²	209	89.7 Å²	89.7	79%	0.789	48%	0.475	S	S	*	.	H	α-helix	trans	-71.7	-26.8	176.9	-74.7	177.6	175.9	-154.7	-2.6	113.4	L197 E198 E199	L197-R201 WeakPolarHBondContact O-CG 3.38Å; E198-R201 PolarHBondContact O-N 3.25Å; E199-R201 VanDerWaalsContact C-N 3.3Å; E199-R201 PolarHBondContact O-N 3.49Å
202	S	72.5	Confident	69.4	Low	106 Å²	106	96.9 Å²	96.9	74%	0.741	51%	0.514	S	S	*	.	H	α-helix	trans	-79.9	-44.4	179.1	-171.8	0	0	0	0	112.2	E198 E199 L200	E198-S202 WeakPolarHBondContact O-CB 3.45Å; E198-S202 PolarHBondContact O-N 3.18Å; E199-S202 PolarHBondContact O-N 2.81Å; E199-S202 VanDerWaalsContact O-N 3.11Å; L200-S202 VanDerWaalsContact C-N 3.34Å
203	K	65.3	Low	68.3	Low	134 Å²	134	100.6 Å²	100.6	58%	0.583	54%	0.536	S	S	*	.	H	α-helix	trans	-86.6	-22.4	-174.7	-69	179.9	176.4	174.3	0	114.5	E199 E205	E199-K203 HydrophobicContact CG-CD 4.01Å; E199-K203 PolarHBondContact O-N 3.37Å; E199-K203 WeakPolarHBondContact OE1-CE 3.25Å; E199-K203 IonicContact OE1-NZ 2.65Å; E199-K203 PolarHBondContact OE1-NZ 2.82Å; K203-E205 PolarHBondContact O-N 2.98Å; K203-E205 VanDerWaalsContact O-N 3.1Å
204	G	56.1	Low	67.6	Low	69 Å²	69	99.2 Å²	99.2	71%	0.711	53%	0.529	S	S	*	.			trans	69.9	1.5	175.6	0	0	0	0	0	115.7	L200	L200-G204 PolarHBondContact O-N 3.43Å
205	E	51.5	Low	67.3	Low	124 Å²	124	96.1 Å²	96.1	58%	0.579	52%	0.521	S	S	*	.			trans	-82.3	134	178.9	-64.9	-175.1	147.4	0	0	111.9	K203 N207	K203-E205 PolarHBondContact O-N 2.98Å; K203-E205 VanDerWaalsContact O-N 3.1Å; E205-N207 PolarHBondContact O-N 2.59Å; E205-N207 PolarHBondContact OE2-ND2 3.34Å
206	S	45.4	Very low	67.1	Low	127 Å²	127	97.4 Å²	97.4	89%	0.888	53%	0.527	S	S	*	.			trans	-79.2	52.1	179.4	62.9	0	0	0	0	112.8
207	N	47.1	Very low	67.2	Low	104 Å²	104	102.8 Å²	102.8	56%	0.556	54%	0.541	S	S	*	.			trans	-74.2	136.9	176.4	-80.3	-54	0	0	0	111.1	E205 M209	E205-N207 PolarHBondContact O-N 2.59Å; E205-N207 PolarHBondContact OE2-ND2 3.34Å; N207-M209 PolarHBondContact O-N 3.46Å
208	Q	48.3	Very low	67.3	Low	195 Å²	195	103.1 Å²	103.1	91%	0.911	54%	0.541	S	S	*	.			trans	-65.8	121.1	-173	-148.2	114.7	38.1	0	0	110.3	N210	Q208-N210 PolarHBondContact O-N 3.05Å
209	M	50.2	Low	67.7	Low	114 Å²	114	103.2 Å²	103.2	56%	0.562	54%	0.54	S	S	*	.			trans	-69	115.6	-174.9	-57.8	-157.9	-51.7	0	0	111.6	L197 L200 N207 L211	L197-M209 HydrophobicContact CD2-SD 4.4Å; L200-M209 HydrophobicContact CD1-CG 3.93Å; L200-M209 HydrophobicContact CD1-SD 3.62Å; N207-M209 PolarHBondContact O-N 3.46Å; M209-L211 VanDerWaalsContact C-N 3.3Å; M209-L211 PolarHBondContact O-N 3.44Å
210	N	49.6	Very low	68.4	Low	103 Å²	103	99.5 Å²	99.5	55%	0.551	52%	0.524	S	S	*	.			trans	-89.3	73.8	159.6	-166.3	-47	0	0	0	108.8	Q208 D212 T213	Q208-N210 PolarHBondContact O-N 3.05Å; N210-D212 PolarHBondContact O-N 3.24Å; N210-T213 PolarHBondContact O-N 3.17Å; N210-T213 PolarHBondContact OD1-N 3.22Å; N210-T213 PolarHBondContact OD1-OG1 3.32Å
211	L	60	Low	69.4	Low	91 Å²	91	96.7 Å²	96.7	48%	0.476	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-64.7	-24.3	177.6	-176.3	59.5	0	0	0	111.5	V193 M209 T213 A214	V193-L211 HydrophobicContact CG1-CD1 4.08Å; V193-L211 HydrophobicContact CG2-CD1 4.05Å; M209-L211 VanDerWaalsContact C-N 3.3Å; M209-L211 PolarHBondContact O-N 3.44Å; L211-T213 PolarHBondContact O-N 3.3Å; L211-A214 WeakPolarHBondContact O-CB 3.5Å; L211-A214 PolarHBondContact O-N 3.2Å; L211-A214 VanDerWaalsContact O-N 3.1Å
212	D	58.8	Low	70.2	Confident	152 Å²	152	88.2 Å²	88.2	81%	0.813	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-65.4	-18.4	177.2	-48.1	-73.4	0	0	0	113.4	N210 A214	N210-D212 PolarHBondContact O-N 3.24Å; D212-A214 VanDerWaalsContact C-N 3.3Å
213	T	67.6	Low	71.4	Confident	86 Å²	86	83.2 Å²	83.2	53%	0.528	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-75.9	-16.7	174.2	-59.9	0	0	0	0	112.6	N210 L211 S215 Q218	N210-T213 PolarHBondContact O-N 3.17Å; N210-T213 PolarHBondContact OD1-N 3.22Å; N210-T213 PolarHBondContact OD1-OG1 3.32Å; L211-T213 PolarHBondContact O-N 3.3Å; T213-S215 PolarHBondContact O-N 3.29Å; T213-S215 VanDerWaalsContact O-N 3.17Å; T213-Q218 PolarHBondContact O-OE1 3.02Å
214	A	77.4	Confident	72.7	Confident	12 Å²	12	78.2 Å²	78.2	10%	0.099	43%	0.426	C	S	.	.			trans	-74.9	105.8	-178.5	0	0	0	0	0	111.8	K189 A192 V193 L211 D212	K189-A214 WeakPolarHBondContact CE-O 3.39Å; K189-A214 PolarHBondContact NZ-O 3.39Å; A192-A214 HydrophobicContact CB-CB 4.32Å; V193-A214 HydrophobicContact CG2-CB 3.54Å; L211-A214 WeakPolarHBondContact O-CB 3.5Å; L211-A214 PolarHBondContact O-N 3.2Å; L211-A214 VanDerWaalsContact O-N 3.1Å; D212-A214 VanDerWaalsContact C-N 3.3Å
215	S	86	Confident	74.2	Confident	29 Å²	29	76.9 Å²	76.9	20%	0.203	41%	0.405	C	S	.	.			trans	-122.4	141.2	-174.9	172.1	0	0	0	0	112.6	T213 K217 Q218	T213-S215 PolarHBondContact O-N 3.29Å; T213-S215 VanDerWaalsContact O-N 3.17Å; S215-K217 PolarHBondContact O-N 3.39Å; S215-K217 PolarHBondContact OG-N 3.03Å; S215-K217 VanDerWaalsContact OG-N 3.1Å; S215-Q218 WeakPolarHBondContact O-CB 3.45Å; S215-Q218 WeakPolarHBondContact O-CG 3.5Å; S215-Q218 PolarHBondContact O-N 3.09Å; S215-Q218 PolarHBondContact O-OE1 2.9Å
216	E	83.9	Confident	75.8	Confident	57 Å²	57	76.8 Å²	76.8	27%	0.266	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-19.3	163.9	58.6	-65.7	143.2	0	0	115.2	D185 S188 K189	D185-E216 HydrophobicContact CB-CB 3.82Å; D185-E216 HydrophobicContact CB-CG 4.31Å; D185-E216 WeakPolarHBondContact O-CB 3.36Å; S188-E216 VanDerWaalsContact CB-O 3.25Å; S188-E216 WeakPolarHBondContact CB-O 3.42Å; S188-E216 VanDerWaalsContact OG-C 3.28Å; S188-E216 PolarHBondContact OG-O 3.3Å; K189-E216 HydrophobicContact CB-CB 4.19Å; K189-E216 IonicContact NZ-OE2 3.91Å; K189-E216 PolarHBondContact NZ-OE2 3.49Å
217	K	87.4	Confident	77.6	Confident	159 Å²	159	74.5 Å²	74.5	69%	0.691	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-17.1	176.1	-63.2	-179.5	-177.4	177.4	0	114.4	S215 Y219 T260	S215-K217 PolarHBondContact O-N 3.39Å; S215-K217 PolarHBondContact OG-N 3.03Å; S215-K217 VanDerWaalsContact OG-N 3.1Å; K217-Y219 VanDerWaalsContact C-N 3.33Å; K217-Y219 PolarHBondContact O-N 3.37Å; K217-T260 WeakPolarHBondContact O-CB 2.76Å; K217-T260 PolarHBondContact O-OG1 3.25Å
218	Q	87.3	Confident	79.4	Confident	79 Å²	79	72.3 Å²	72.3	37%	0.369	41%	0.411	S	S	.	.	S	Bend	trans	-71.5	-23.8	-170.8	-67.8	178	-75.5	0	0	114.2	A192 T213 S215 T260	A192-Q218 HydrophobicContact CB-CB 4.49Å; A192-Q218 VanDerWaalsContact CB-OE1 3.26Å; T213-Q218 PolarHBondContact O-OE1 3.02Å; S215-Q218 WeakPolarHBondContact O-CB 3.45Å; S215-Q218 WeakPolarHBondContact O-CG 3.5Å; S215-Q218 PolarHBondContact O-N 3.09Å; S215-Q218 PolarHBondContact O-OE1 2.9Å; Q218-T260 PolarHBondContact O-N 2.96Å
219	Y	93.2	Very high	81.4	Confident	46 Å²	46	69.1 Å²	69.1	18%	0.18	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.5	178.8	-66.6	-87	0	0	0	112.1	S188 L191 A192 L195 K217 Y257 A258 P259 T260	S188-Y219 PolarHBondContact OG-N 2.93Å; S188-Y219 PolarHBondContact OG-O 3.39Å; L191-Y219 HydrophobicContact CB-CD2 4.43Å; L191-Y219 HydrophobicContact CD2-CD1 3.57Å; L191-Y219 HydrophobicContact CD2-CD2 3.97Å; L191-Y219 HydrophobicContact CD2-CE1 4.11Å; L191-Y219 HydrophobicContact CD2-CE2 4.49Å; L191-Y219 HydrophobicContact CD2-CG 3.51Å; L191-Y219 HydrophobicContact CG-CD1 4.33Å; L191-Y219 HydrophobicContact CG-CD2 4.08Å; L191-Y219 HydrophobicContact CG-CE1 4.49Å; L191-Y219 HydrophobicContact CG-CE2 4.29Å; L191-Y219 HydrophobicContact CG-CG 4.14Å; A192-Y219 HydrophobicContact CB-CD2 4.21Å; A192-Y219 HydrophobicContact CB-CE2 4.03Å; L195-Y219 HydrophobicContact CD1-CE1 4.18Å; L195-Y219 HydrophobicContact CD1-CE2 4.3Å; L195-Y219 VanDerWaalsContact CD1-OH 3.26Å; L195-Y219 WeakPolarHBondContact CD1-OH 3.41Å; K217-Y219 VanDerWaalsContact C-N 3.33Å; K217-Y219 PolarHBondContact O-N 3.37Å; Y219-Y257 HydrophobicContact CD1-CD2 4.18Å; Y219-Y257 HydrophobicContact CE1-CD2 4.48Å; Y219-A258 CarbonylContact C-O 3.58Å; Y219-A258 WeakPolarHBondContact CA-O 3.44Å; Y219-P259 HydrophobicContact CE1-CB 4.44Å; Y219-P259 HydrophobicContact CE1-CG 4.05Å; Y219-T260 WeakPolarHBondContact CA-OG1 3.49Å; Y219-T260 PolarHBondContact N-OG1 3.26Å
220	T	94.9	Very high	83.5	Confident	30 Å²	30	67 Å²	67	18%	0.184	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	130.1	170.7	-58.3	0	0	0	0	108.3	Y222 V232 A258 T260	T220-Y222 HydrophobicContact CG2-CD2 4.42Å; T220-Y222 HydrophobicContact CG2-CE1 4.21Å; T220-Y222 HydrophobicContact CG2-CE2 3.7Å; T220-Y222 WeakPolarHBondContact O-CD2 3.38Å; T220-Y222 WeakPolarHBondContact O-CE2 3.48Å; T220-V232 HydrophobicContact CG2-CG1 3.83Å; T220-V232 HydrophobicContact CG2-CG2 4.09Å; T220-A258 PolarHBondContact N-O 2.31Å; T220-A258 PolarHBondContact O-N 2.84Å; T220-A258 VanDerWaalsContact O-N 3.09Å; T220-T260 PolarHBondContact N-OG1 3Å; T220-T260 VanDerWaalsContact N-OG1 3.1Å; T220-T260 PolarHBondContact OG1-OG1 3.32Å
221	I	96.3	Very high	85.6	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.7	-175.9	-47.8	-47.7	0	0	0	109.8	F158 V184 L233 L255 Y256	F158-I221 HydrophobicContact CE2-CD1 4.01Å; F158-I221 HydrophobicContact CE2-CG2 4.08Å; F158-I221 HydrophobicContact CZ-CD1 3.65Å; V184-I221 HydrophobicContact CG1-CB 3.62Å; V184-I221 HydrophobicContact CG1-CG1 3.68Å; V184-I221 HydrophobicContact CG1-CG2 4.18Å; I221-L233 HydrophobicContact CG2-CD1 4.25Å; I221-L233 PolarHBondContact O-N 2.96Å; I221-L255 HydrophobicContact CG2-CD1 4.44Å; I221-Y256 WeakPolarHBondContact CA-O 3.36Å
222	Y	96.5	Very high	87.4	Confident	32 Å²	32	64 Å²	64	13%	0.125	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	153.2	-174.8	-53.6	-103	0	0	0	110.8	H161 L164 T220 F230 T231 V232 Y256 A258	H161-Y222 AromaticContact CD2-CD2 3.84Å; H161-Y222 AromaticContact CD2-CG 3.9Å; L164-Y222 HydrophobicContact CD1-CE1 4.46Å; L164-Y222 HydrophobicContact CD1-CE2 4.45Å; T220-Y222 HydrophobicContact CG2-CD2 4.42Å; T220-Y222 HydrophobicContact CG2-CE1 4.21Å; T220-Y222 HydrophobicContact CG2-CE2 3.7Å; T220-Y222 WeakPolarHBondContact O-CD2 3.38Å; T220-Y222 WeakPolarHBondContact O-CE2 3.48Å; Y222-F230 HydrophobicContact CD1-CB 4.07Å; Y222-F230 HydrophobicContact CG-CB 4.46Å; Y222-T231 CarbonylContact C-O 3.59Å; Y222-T231 VanDerWaalsContact CA-O 3.25Å; Y222-T231 WeakPolarHBondContact CA-O 3.45Å; Y222-V232 HydrophobicContact CD1-CG2 3.76Å; Y222-V232 HydrophobicContact CE1-CG2 3.46Å; Y222-V232 VanDerWaalsContact CE1-CG2 3.46Å; Y222-Y256 PolarHBondContact N-O 3.42Å; Y222-Y256 PolarHBondContact O-N 3.14Å; Y222-A258 HydrophobicContact CE2-CB 3.97Å
223	I	95.9	Very high	89.1	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.5	164.1	-163.9	165.2	0	0	0	110.1	T231 L233 V242 Y246 W247 M253 L255	I223-T231 PolarHBondContact N-O 2.94Å; I223-T231 PolarHBondContact O-N 3.4Å; I223-L233 HydrophobicContact CB-CD1 4.32Å; I223-L233 HydrophobicContact CB-CD2 4.35Å; I223-L233 HydrophobicContact CB-CG 4.45Å; I223-L233 HydrophobicContact CG2-CD2 3.78Å; I223-L233 HydrophobicContact CG2-CG 4.32Å; I223-V242 HydrophobicContact CD1-CG1 4.15Å; I223-Y246 HydrophobicContact CG2-CD1 4.35Å; I223-Y246 HydrophobicContact CG2-CG 4.19Å; I223-W247 HydrophobicContact CD1-CB 4.25Å; I223-W247 HydrophobicContact CD1-CE3 4.13Å; I223-M253 HydrophobicContact CD1-CG 4.22Å; I223-M253 HydrophobicContact CD1-SD 4.1Å; I223-L255 HydrophobicContact CB-CD2 4.03Å; I223-L255 HydrophobicContact CD1-CD2 3.97Å; I223-L255 HydrophobicContact CG1-CD2 4.02Å
224	A	93.8	Very high	90.5	Very high	28 Å²	28	57.2 Å²	57.2	23%	0.231	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	127.3	174.9	0	0	0	0	0	110.2	F230 Y256	A224-F230 HydrophobicContact CB-CD1 4.32Å; A224-F230 HydrophobicContact CB-CE1 3.97Å; A224-Y256 HydrophobicContact CB-CE2 4.07Å
225	T	87.9	Confident	91.2	Very high	42 Å²	42	57.2 Å²	57.2	26%	0.258	33%	0.334	S	S	.	.			trans	-82.6	165.2	175	63.2	0	0	0	0	111.5	S227 G228 Q229 T231	T225-S227 PolarHBondContact O-N 2.89Å; T225-S227 VanDerWaalsContact O-N 3.1Å; T225-S227 PolarHBondContact OG1-N 3.25Å; T225-S227 PolarHBondContact OG1-OG 2.83Å; T225-G228 PolarHBondContact O-N 3.31Å; T225-Q229 PolarHBondContact N-O 3.16Å; T225-Q229 PolarHBondContact OG1-N 3.08Å; T225-Q229 VanDerWaalsContact OG1-N 3.12Å; T225-Q229 PolarHBondContact OG1-O 2.67Å; T225-Q229 VanDerWaalsContact OG1-O 3.08Å; T225-T231 VanDerWaalsContact CG2-OG1 3.3Å; T225-T231 WeakPolarHBondContact CG2-OG1 3.18Å
226	A	83.9	Confident	91.7	Very high	121 Å²	121	59.6 Å²	59.6	100%	1	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-16.2	170.1	0	0	0	0	0	114.1	G228	A226-G228 VanDerWaalsContact C-N 3.32Å
227	S	84.6	Confident	92.3	Very high	80 Å²	80	59 Å²	59	56%	0.559	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	3.7	171.4	54	0	0	0	0	114	T225 Q229	T225-S227 PolarHBondContact O-N 2.89Å; T225-S227 VanDerWaalsContact O-N 3.1Å; T225-S227 PolarHBondContact OG1-N 3.25Å; T225-S227 PolarHBondContact OG1-OG 2.83Å; S227-Q229 PolarHBondContact O-N 3.25Å; S227-Q229 PolarHBondContact OG-OE1 2.94Å
228	G	83.7	Confident	92.8	Very high	57 Å²	57	53 Å²	53	59%	0.588	33%	0.326	S	S	*	.	S	Bend	trans	72.7	14	-176.9	0	0	0	0	0	114.3	T225 A226	T225-G228 PolarHBondContact O-N 3.31Å; A226-G228 VanDerWaalsContact C-N 3.32Å
229	Q	90.8	Very high	93.2	Very high	128 Å²	128	49.2 Å²	49.2	60%	0.598	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-97.2	148.1	-179.9	-63.4	170.3	-59.7	0	0	110.2	T225 S227	T225-Q229 PolarHBondContact N-O 3.16Å; T225-Q229 PolarHBondContact OG1-N 3.08Å; T225-Q229 VanDerWaalsContact OG1-N 3.12Å; T225-Q229 PolarHBondContact OG1-O 2.67Å; T225-Q229 VanDerWaalsContact OG1-O 3.08Å; S227-Q229 PolarHBondContact O-N 3.25Å; S227-Q229 PolarHBondContact OG-OE1 2.94Å
230	F	94.3	Very high	93.2	Very high	69 Å²	69	50.2 Å²	50.2	30%	0.303	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	116.7	178.2	-67.8	-86.9	0	0	0	110.2	H161 P162 Y222 A224 Y256	H161-F230 AromaticContact CD2-CD1 3.83Å; H161-F230 AromaticContact CD2-CG 3.87Å; H161-F230 WeakPolarHBondContact NE2-CB 3.21Å; H161-F230 AromaticContact NE2-CD1 3.69Å; H161-F230 AromaticContact NE2-CD2 3.52Å; H161-F230 AromaticContact NE2-CG 3.22Å; H161-F230 WeakPolarHBondContact NE2-CG 3.44Å; P162-F230 HydrophobicContact CG-CE1 4.5Å; P162-F230 HydrophobicContact CG-CE2 4Å; P162-F230 HydrophobicContact CG-CZ 3.67Å; Y222-F230 HydrophobicContact CD1-CB 4.07Å; Y222-F230 HydrophobicContact CG-CB 4.46Å; A224-F230 HydrophobicContact CB-CD1 4.32Å; A224-F230 HydrophobicContact CB-CE1 3.97Å; F230-Y256 HydrophobicContact CD1-CD2 4.25Å; F230-Y256 HydrophobicContact CD1-CG 4.17Å; F230-Y256 AromaticContact CE1-CD1 3.86Å; F230-Y256 HydrophobicContact CE1-CD1 3.86Å; F230-Y256 AromaticContact CE1-CD2 3.74Å; F230-Y256 HydrophobicContact CE1-CD2 3.74Å; F230-Y256 HydrophobicContact CE1-CE1 4.17Å; F230-Y256 HydrophobicContact CE1-CE2 4.1Å; F230-Y256 AromaticContact CE1-CG 3.65Å; F230-Y256 HydrophobicContact CE1-CG 3.65Å
231	T	94.6	Very high	93.2	Very high	49 Å²	49	52 Å²	52	30%	0.301	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.3	177.8	-64	0	0	0	0	109.5	Y222 I223 T225 L233 Y246	Y222-T231 CarbonylContact C-O 3.59Å; Y222-T231 VanDerWaalsContact CA-O 3.25Å; Y222-T231 WeakPolarHBondContact CA-O 3.45Å; I223-T231 PolarHBondContact N-O 2.94Å; I223-T231 PolarHBondContact O-N 3.4Å; T225-T231 VanDerWaalsContact CG2-OG1 3.3Å; T225-T231 WeakPolarHBondContact CG2-OG1 3.18Å; T231-L233 PolarHBondContact O-N 3.37Å; T231-Y246 HydrophobicContact CG2-CE1 4.29Å
232	V	95.9	Very high	93.2	Very high	82 Å²	82	51.8 Å²	51.8	50%	0.497	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	131.3	173	177.3	0	0	0	0	109.7	T220 Y222	T220-V232 HydrophobicContact CG2-CG1 3.83Å; T220-V232 HydrophobicContact CG2-CG2 4.09Å; Y222-V232 HydrophobicContact CD1-CG2 3.76Å; Y222-V232 HydrophobicContact CE1-CG2 3.46Å; Y222-V232 VanDerWaalsContact CE1-CG2 3.46Å
233	L	96.2	Very high	93	Very high	8 Å²	8	52 Å²	52	4%	0.042	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-90.9	142.9	173.1	-62.6	179.5	0	0	0	110.5	V184 I221 I223 T231 V242 Y246 L255	V184-L233 HydrophobicContact CG1-CB 4.04Å; V184-L233 HydrophobicContact CG2-CB 3.89Å; V184-L233 HydrophobicContact CG2-CD1 4.13Å; I221-L233 HydrophobicContact CG2-CD1 4.25Å; I221-L233 PolarHBondContact O-N 2.96Å; I223-L233 HydrophobicContact CB-CD1 4.32Å; I223-L233 HydrophobicContact CB-CD2 4.35Å; I223-L233 HydrophobicContact CB-CG 4.45Å; I223-L233 HydrophobicContact CG2-CD2 3.78Å; I223-L233 HydrophobicContact CG2-CG 4.32Å; T231-L233 PolarHBondContact O-N 3.37Å; L233-V242 HydrophobicContact CD1-CG1 3.62Å; L233-V242 HydrophobicContact CD1-CG2 4.1Å; L233-V242 HydrophobicContact CD2-CG1 4Å; L233-V242 HydrophobicContact CD2-CG2 4.28Å; L233-V242 HydrophobicContact CG-CG1 4.49Å; L233-Y246 HydrophobicContact CD2-CD2 3.99Å; L233-Y246 HydrophobicContact CD2-CE2 3.98Å; L233-Y246 HydrophobicContact CD2-CG 4.45Å; L233-L255 HydrophobicContact CD1-CD2 3.78Å
234	N	95.3	Very high	92.8	Very high	88 Å²	88	58.2 Å²	58.2	47%	0.471	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-77.1	132.5	174.4	-171.7	-48.3	0	0	0	109.7	V184 S236 F237	V184-N234 WeakPolarHBondContact CB-O 3.4Å; N234-S236 PolarHBondContact O-N 3.19Å; N234-S236 VanDerWaalsContact O-N 3.11Å; N234-S236 PolarHBondContact OD1-N 3.38Å; N234-S236 PolarHBondContact OD1-OG 3.45Å; N234-F237 HydrophobicContact CB-CD1 3.99Å; N234-F237 HydrophobicContact CB-CD2 3.84Å; N234-F237 HydrophobicContact CB-CE1 3.84Å; N234-F237 HydrophobicContact CB-CE2 3.68Å; N234-F237 HydrophobicContact CB-CG 3.99Å; N234-F237 HydrophobicContact CB-CZ 3.68Å; N234-F237 WeakPolarHBondContact O-CB 3.21Å; N234-F237 PolarHBondContact O-N 2.96Å
235	G	93.7	Very high	92.7	Very high	12 Å²	12	61.6 Å²	61.6	12%	0.124	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48	-36.2	178.7	0	0	0	0	0	115.3	T183 V184 D185 F237	T183-G235 VanDerWaalsContact CB-O 3.26Å; T183-G235 WeakPolarHBondContact CB-O 3.34Å; T183-G235 PolarHBondContact OG1-O 3.46Å; T183-G235 VanDerWaalsContact OG1-O 3.11Å; V184-G235 PolarHBondContact N-O 3.05Å; D185-G235 VanDerWaalsContact CG-C 3.41Å; D185-G235 PolarHBondContact N-O 3.14Å; D185-G235 WeakPolarHBondContact OD1-CA 3.21Å; D185-G235 VanDerWaalsContact OD2-CA 3.29Å; D185-G235 WeakPolarHBondContact OD2-CA 3.39Å; G235-F237 PolarHBondContact O-N 3.01Å
236	S	95.7	Very high	92.9	Very high	80 Å²	80	63 Å²	63	56%	0.559	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-12	-178.3	68.9	0	0	0	0	114.9	N234 S238	N234-S236 PolarHBondContact O-N 3.19Å; N234-S236 VanDerWaalsContact O-N 3.11Å; N234-S236 PolarHBondContact OD1-N 3.38Å; N234-S236 PolarHBondContact OD1-OG 3.45Å; S236-S238 PolarHBondContact O-N 3.42Å
237	F	97.2	Very high	93.2	Very high	45 Å²	45	59.4 Å²	59.4	20%	0.197	33%	0.327	C	S	.	.			trans	-70.3	132.5	178.7	-65.1	-16	0	0	0	110.7	T183 V184 N234 G235 L241 V242 Y246	T183-F237 WeakPolarHBondContact CA-O 3.17Å; T183-F237 WeakPolarHBondContact CB-O 3.4Å; V184-F237 HydrophobicContact CG2-CB 4.4Å; V184-F237 PolarHBondContact N-O 3.38Å; V184-F237 VanDerWaalsContact N-O 3.07Å; N234-F237 HydrophobicContact CB-CD1 3.99Å; N234-F237 HydrophobicContact CB-CD2 3.84Å; N234-F237 HydrophobicContact CB-CE1 3.84Å; N234-F237 HydrophobicContact CB-CE2 3.68Å; N234-F237 HydrophobicContact CB-CG 3.99Å; N234-F237 HydrophobicContact CB-CZ 3.68Å; N234-F237 WeakPolarHBondContact O-CB 3.21Å; N234-F237 PolarHBondContact O-N 2.96Å; G235-F237 PolarHBondContact O-N 3.01Å; F237-L241 HydrophobicContact CB-CD2 4.29Å; F237-L241 HydrophobicContact CD1-CD2 3.89Å; F237-L241 HydrophobicContact CE1-CD2 4.5Å; F237-L241 HydrophobicContact CG-CD2 4.15Å; F237-V242 HydrophobicContact CB-CG2 3.87Å; F237-V242 HydrophobicContact CD2-CG2 4.47Å; F237-Y246 HydrophobicContact CD2-CE2 4.34Å; F237-Y246 HydrophobicContact CE2-CE2 4.22Å
238	S	96.8	Very high	93.2	Very high	32 Å²	32	63 Å²	63	22%	0.224	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-69	150.3	168.4	64.2	0	0	0	0	110.7	G180 A182 S236 E240 L241 V242	G180-S238 WeakPolarHBondContact O-CB 3.45Å; A182-S238 CarbonylContact O-C 3.58Å; A182-S238 VanDerWaalsContact O-CA 3.29Å; A182-S238 WeakPolarHBondContact O-CA 3.42Å; S236-S238 PolarHBondContact O-N 3.42Å; S238-E240 PolarHBondContact O-N 3.44Å; S238-L241 PolarHBondContact O-N 2.87Å; S238-L241 WeakPolarHBondContact OG-CB 3.16Å; S238-L241 PolarHBondContact OG-N 3.02Å; S238-V242 WeakPolarHBondContact O-CG2 3.44Å; S238-V242 PolarHBondContact O-N 3.47Å
239	L	95.9	Very high	93.3	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.2	-27.4	179	-61.9	-179.3	0	0	0	112.4	I154 L156 T178 G180 A182 V184 L187 V242 S243 M253 L255	I154-L239 VanDerWaalsContact CD1-C 3.46Å; I154-L239 HydrophobicContact CD1-CB 3.94Å; L156-L239 HydrophobicContact CD2-CD1 3.83Å; T178-L239 HydrophobicContact CG2-CD1 3.54Å; G180-L239 PolarHBondContact O-N 2.84Å; A182-L239 HydrophobicContact CB-CD1 4.22Å; A182-L239 WeakPolarHBondContact O-CG 3.27Å; A182-L239 PolarHBondContact O-N 3.1Å; V184-L239 HydrophobicContact CG2-CD2 4.47Å; L187-L239 HydrophobicContact CD1-CD1 3.97Å; L187-L239 HydrophobicContact CD1-CD2 3.55Å; L187-L239 HydrophobicContact CD1-CG 4.39Å; L187-L239 HydrophobicContact CD2-CD1 4.18Å; L187-L239 HydrophobicContact CG-CD1 4.13Å; L187-L239 HydrophobicContact CG-CD2 4.18Å; L239-V242 PolarHBondContact O-N 2.97Å; L239-S243 WeakPolarHBondContact O-CB 3.18Å; L239-S243 PolarHBondContact O-N 2.59Å; L239-M253 HydrophobicContact CB-CE 4.35Å; L239-M253 HydrophobicContact CD2-CE 4.39Å; L239-L255 HydrophobicContact CD2-CD1 4.31Å
240	E	94.3	Very high	92.9	Very high	67 Å²	67	66.2 Å²	66.2	31%	0.313	34%	0.343	S	S	.	.	H	α-helix	trans	-60.9	-53.5	169.3	-172.3	164.2	-119.3	0	0	111.3	S152 I154 G180 S238 V242 S243 E244	S152-E240 WeakPolarHBondContact CB-OE1 3.26Å; S152-E240 PolarHBondContact OG-OE1 3.48Å; I154-E240 HydrophobicContact CD1-CB 4.34Å; G180-E240 WeakPolarHBondContact O-CB 3.42Å; G180-E240 PolarHBondContact O-N 3.26Å; S238-E240 PolarHBondContact O-N 3.44Å; E240-V242 VanDerWaalsContact C-N 3.28Å; E240-V242 PolarHBondContact O-N 2.96Å; E240-S243 WeakPolarHBondContact O-CB 3.29Å; E240-S243 PolarHBondContact O-N 2.93Å; E240-S243 VanDerWaalsContact O-N 3.09Å; E240-E244 WeakPolarHBondContact O-CG 3.28Å; E240-E244 PolarHBondContact O-N 3.23Å
241	L	94.7	Very high	92.7	Very high	66 Å²	66	70.4 Å²	70.4	35%	0.346	36%	0.361	S	S	.	.	H	α-helix	trans	-60.1	-36.5	174.8	176.4	63.2	0	0	0	112.1	F237 S238 K245	F237-L241 HydrophobicContact CB-CD2 4.29Å; F237-L241 HydrophobicContact CD1-CD2 3.89Å; F237-L241 HydrophobicContact CE1-CD2 4.5Å; F237-L241 HydrophobicContact CG-CD2 4.15Å; S238-L241 PolarHBondContact O-N 2.87Å; S238-L241 WeakPolarHBondContact OG-CB 3.16Å; S238-L241 PolarHBondContact OG-N 3.02Å; L241-K245 WeakPolarHBondContact O-CB 3.45Å; L241-K245 PolarHBondContact O-N 3.37Å
242	V	94.9	Very high	92.6	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-65.6	-44.2	175.4	176.5	0	0	0	0	110.8	V184 I223 L233 F237 S238 L239 E240 K245 Y246 W247 M253 L255	V184-V242 HydrophobicContact CG2-CG2 4.07Å; I223-V242 HydrophobicContact CD1-CG1 4.15Å; L233-V242 HydrophobicContact CD1-CG1 3.62Å; L233-V242 HydrophobicContact CD1-CG2 4.1Å; L233-V242 HydrophobicContact CD2-CG1 4Å; L233-V242 HydrophobicContact CD2-CG2 4.28Å; L233-V242 HydrophobicContact CG-CG1 4.49Å; F237-V242 HydrophobicContact CB-CG2 3.87Å; F237-V242 HydrophobicContact CD2-CG2 4.47Å; S238-V242 WeakPolarHBondContact O-CG2 3.44Å; S238-V242 PolarHBondContact O-N 3.47Å; L239-V242 PolarHBondContact O-N 2.97Å; E240-V242 VanDerWaalsContact C-N 3.28Å; E240-V242 PolarHBondContact O-N 2.96Å; V242-K245 PolarHBondContact O-N 3.29Å; V242-Y246 HydrophobicContact CG1-CD2 4.25Å; V242-Y246 WeakPolarHBondContact O-CB 3.43Å; V242-Y246 PolarHBondContact O-N 2.83Å; V242-W247 PolarHBondContact O-N 3.33Å; V242-M253 HydrophobicContact CB-CE 4.46Å; V242-M253 HydrophobicContact CB-SD 4.35Å; V242-M253 HydrophobicContact CG1-CE 4.19Å; V242-M253 HydrophobicContact CG1-SD 3.67Å; V242-L255 HydrophobicContact CG1-CD2 4.42Å
243	S	92.9	Very high	92.5	Very high	36 Å²	36	67 Å²	67	25%	0.252	34%	0.342	S	S	.	.	I	π-helix	trans	-61.2	-51.5	178.6	-172	0	0	0	0	111.7	L239 E240 K245 W247 K248	L239-S243 WeakPolarHBondContact O-CB 3.18Å; L239-S243 PolarHBondContact O-N 2.59Å; E240-S243 WeakPolarHBondContact O-CB 3.29Å; E240-S243 PolarHBondContact O-N 2.93Å; E240-S243 VanDerWaalsContact O-N 3.09Å; S243-K245 PolarHBondContact O-N 3.45Å; S243-W247 WeakPolarHBondContact O-CB 3.47Å; S243-W247 PolarHBondContact O-N 3.38Å; S243-W247 VanDerWaalsContact O-N 3.15Å; S243-K248 PolarHBondContact O-N 3.36Å
244	E	92	Very high	92.5	Very high	133 Å²	133	69.3 Å²	69.3	62%	0.621	35%	0.352	S	S	*	.	I	π-helix	trans	-61.5	-42.3	178.2	-70.2	-174.2	153.4	0	0	113.1	E240 K248	E240-E244 WeakPolarHBondContact O-CG 3.28Å; E240-E244 PolarHBondContact O-N 3.23Å; E244-K248 WeakPolarHBondContact O-CE 3.48Å; E244-K248 WeakPolarHBondContact O-CG 3.31Å
245	K	91.9	Very high	92.6	Very high	99 Å²	99	65.1 Å²	65.1	43%	0.43	33%	0.33	S	S	.	.	I	π-helix	trans	-84.7	-41.2	-170.4	-173	174.1	173.5	-163.6	0	113.1	L241 V242 S243 K248	L241-K245 WeakPolarHBondContact O-CB 3.45Å; L241-K245 PolarHBondContact O-N 3.37Å; V242-K245 PolarHBondContact O-N 3.29Å; S243-K245 PolarHBondContact O-N 3.45Å; K245-K248 WeakPolarHBondContact O-CE 3.22Å; K245-K248 PolarHBondContact O-NZ 3.36Å
246	Y	91.1	Very high	92.7	Very high	71 Å²	71	65.7 Å²	65.7	28%	0.278	33%	0.329	S	S	.	.	I	π-helix	trans	-115.4	-31.2	-169.1	-58.3	-84.1	0	0	0	114.4	I223 T231 L233 F237 V242	I223-Y246 HydrophobicContact CG2-CD1 4.35Å; I223-Y246 HydrophobicContact CG2-CG 4.19Å; T231-Y246 HydrophobicContact CG2-CE1 4.29Å; L233-Y246 HydrophobicContact CD2-CD2 3.99Å; L233-Y246 HydrophobicContact CD2-CE2 3.98Å; L233-Y246 HydrophobicContact CD2-CG 4.45Å; F237-Y246 HydrophobicContact CD2-CE2 4.34Å; F237-Y246 HydrophobicContact CE2-CE2 4.22Å; V242-Y246 HydrophobicContact CG1-CD2 4.25Å; V242-Y246 WeakPolarHBondContact O-CB 3.43Å; V242-Y246 PolarHBondContact O-N 2.83Å
247	W	90.8	Very high	92.6	Very high	45 Å²	45	61.9 Å²	61.9	17%	0.17	30%	0.302	C	S	.	.	I	π-helix	trans	-91.2	-53.5	-173.5	-170.9	-123.2	0	0	0	113.4	I223 V242 S243 V249 K251 P252 M253 E254	I223-W247 HydrophobicContact CD1-CB 4.25Å; I223-W247 HydrophobicContact CD1-CE3 4.13Å; V242-W247 PolarHBondContact O-N 3.33Å; S243-W247 WeakPolarHBondContact O-CB 3.47Å; S243-W247 PolarHBondContact O-N 3.38Å; S243-W247 VanDerWaalsContact O-N 3.15Å; W247-V249 HydrophobicContact CD2-CG2 3.89Å; W247-V249 HydrophobicContact CG-CG2 4.15Å; W247-V249 HydrophobicContact CZ2-CG2 3.75Å; W247-V249 PolarHBondContact NE1-O 3.1Å; W247-V249 PolarHBondContact O-N 3.06Å; W247-K251 HydrophobicContact CZ2-CB 4.47Å; W247-K251 PolarHBondContact NE1-O 3.15Å; W247-P252 VanDerWaalsContact CZ2-O 3.23Å; W247-P252 WeakPolarHBondContact CZ2-O 3.47Å; W247-M253 HydrophobicContact CB-CG 4.17Å; W247-M253 HydrophobicContact CB-SD 4.01Å; W247-M253 HydrophobicContact CD2-CB 4.33Å; W247-M253 HydrophobicContact CD2-CG 3.98Å; W247-M253 HydrophobicContact CE3-CG 4.39Å; W247-M253 HydrophobicContact CG-CB 4.19Å; W247-M253 HydrophobicContact CG-CG 3.86Å; W247-M253 HydrophobicContact CG-SD 4.31Å; W247-E254 HydrophobicContact CH2-CB 3.71Å; W247-E254 HydrophobicContact CH2-CG 3.72Å; W247-E254 HydrophobicContact CZ2-CG 4.32Å; W247-E254 HydrophobicContact CZ3-CB 3.97Å; W247-E254 HydrophobicContact CZ3-CG 4.47Å
248	K	84.3	Confident	92.4	Very high	157 Å²	157	59.9 Å²	59.9	68%	0.683	29%	0.293	S	S	*	.			trans	54.5	19.6	170.6	-64.8	177.9	175.2	168.5	0	116.8	S243 E244 K245	S243-K248 PolarHBondContact O-N 3.36Å; E244-K248 WeakPolarHBondContact O-CE 3.48Å; E244-K248 WeakPolarHBondContact O-CG 3.31Å; K245-K248 WeakPolarHBondContact O-CE 3.22Å; K245-K248 PolarHBondContact O-NZ 3.36Å
249	V	85.7	Confident	92.2	Very high	77 Å²	77	61.3 Å²	61.3	47%	0.467	30%	0.302	S	S	.	.	S	Bend	trans	-129	142.6	176.3	-61.9	0	0	0	0	111.3	W247 K251	W247-V249 HydrophobicContact CD2-CG2 3.89Å; W247-V249 HydrophobicContact CG-CG2 4.15Å; W247-V249 HydrophobicContact CZ2-CG2 3.75Å; W247-V249 PolarHBondContact NE1-O 3.1Å; W247-V249 PolarHBondContact O-N 3.06Å; V249-K251 HydrophobicContact CG2-CB 4.34Å; V249-K251 PolarHBondContact O-N 3.32Å
250	N	83.4	Confident	91.8	Very high	175 Å²	175	63.7 Å²	63.7	94%	0.936	32%	0.317	S	S	*	.	S	Bend	trans	-79.4	70.8	178.3	-167	2	0	0	0	110.9
251	K	89.8	Confident	91	Very high	156 Å²	156	68.2 Å²	68.2	68%	0.678	34%	0.335	S	S	*	.	S	Bend	trans	-150.5	156	176.8	-67.2	-173.7	178.1	179.1	0	108.9	W247 V249 M253	W247-K251 HydrophobicContact CZ2-CB 4.47Å; W247-K251 PolarHBondContact NE1-O 3.15Å; V249-K251 HydrophobicContact CG2-CB 4.34Å; V249-K251 PolarHBondContact O-N 3.32Å; K251-M253 PolarHBondContact O-N 3.46Å
252	P	91.8	Very high	89.4	Confident	59 Å²	59	73.5 Å²	73.5	38%	0.383	36%	0.358	S	S	.	.			trans	-52.3	133.7	171.9	-27.4	36	0	0	0	111.9	E155 V157 W247	E155-P252 HydrophobicContact CB-CB 4.05Å; E155-P252 HydrophobicContact CB-CG 4.18Å; E155-P252 CarbonylContact O-C 3.51Å; E155-P252 VanDerWaalsContact O-CA 3.24Å; E155-P252 WeakPolarHBondContact O-CA 3.21Å; V157-P252 HydrophobicContact CG2-CB 4.31Å; W247-P252 VanDerWaalsContact CZ2-O 3.23Å; W247-P252 WeakPolarHBondContact CZ2-O 3.47Å
253	M	94.4	Very high	87	Confident	2 Å²	2	83 Å²	83	1%	0.01	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	127.6	-170.6	-177.7	166	52.8	0	0	112.1	I154 E155 L156 V157 I223 L239 V242 W247 K251 L255	I154-M253 HydrophobicContact CG2-CE 4.26Å; E155-M253 PolarHBondContact O-N 3.08Å; L156-M253 CarbonylContact C-O 3.52Å; L156-M253 WeakPolarHBondContact CA-O 3.48Å; L156-M253 HydrophobicContact CB-CB 4.12Å; L156-M253 VanDerWaalsContact CB-O 3.26Å; L156-M253 WeakPolarHBondContact CB-O 3.45Å; V157-M253 PolarHBondContact N-O 2.96Å; I223-M253 HydrophobicContact CD1-CG 4.22Å; I223-M253 HydrophobicContact CD1-SD 4.1Å; L239-M253 HydrophobicContact CB-CE 4.35Å; L239-M253 HydrophobicContact CD2-CE 4.39Å; V242-M253 HydrophobicContact CB-CE 4.46Å; V242-M253 HydrophobicContact CB-SD 4.35Å; V242-M253 HydrophobicContact CG1-CE 4.19Å; V242-M253 HydrophobicContact CG1-SD 3.67Å; W247-M253 HydrophobicContact CB-CG 4.17Å; W247-M253 HydrophobicContact CB-SD 4.01Å; W247-M253 HydrophobicContact CD2-CB 4.33Å; W247-M253 HydrophobicContact CD2-CG 3.98Å; W247-M253 HydrophobicContact CE3-CG 4.39Å; W247-M253 HydrophobicContact CG-CB 4.19Å; W247-M253 HydrophobicContact CG-CG 3.86Å; W247-M253 HydrophobicContact CG-SD 4.31Å; K251-M253 PolarHBondContact O-N 3.46Å; M253-L255 HydrophobicContact CE-CD1 4.14Å; M253-L255 HydrophobicContact CE-CD2 4.41Å; M253-L255 HydrophobicContact CE-CG 4.35Å; M253-L255 HydrophobicContact CG-CD2 4.01Å; M253-L255 HydrophobicContact CG-CG 4.15Å; M253-L255 PolarHBondContact O-N 3.49Å; M253-L255 HydrophobicContact SD-CD2 4.11Å
254	E	95.6	Very high	84.1	Confident	55 Å²	55	94.2 Å²	94.2	26%	0.257	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	105.3	176.6	-65.3	-162.4	164.6	0	0	111.6	V157 R159 W247 Y256	V157-E254 HydrophobicContact CB-CG 4.45Å; V157-E254 WeakPolarHBondContact O-CA 3.48Å; R159-E254 IonicContact CZ-OE1 2.83Å; R159-E254 VanDerWaalsContact CZ-OE1 3.23Å; R159-E254 IonicContact CZ-OE2 3.22Å; R159-E254 IonicContact NH1-OE1 2.99Å; R159-E254 PolarHBondContact NH1-OE1 3.38Å; R159-E254 IonicContact NH1-OE2 2.73Å; R159-E254 PolarHBondContact NH1-OE2 2.89Å; R159-E254 IonicContact NH2-OE1 3.98Å; R159-E254 PolarHBondContact NH2-OE1 3.2Å; R159-E254 IonicContact NH2-OE2 2.7Å; W247-E254 HydrophobicContact CH2-CB 3.71Å; W247-E254 HydrophobicContact CH2-CG 3.72Å; W247-E254 HydrophobicContact CZ2-CG 4.32Å; W247-E254 HydrophobicContact CZ3-CB 3.97Å; W247-E254 HydrophobicContact CZ3-CG 4.47Å; E254-Y256 HydrophobicContact CB-CE2 4Å; E254-Y256 PolarHBondContact OE2-OH 3.37Å
255	L	96.8	Very high	83.7	Confident	0 Å²	0	92.3 Å²	92.3	0%	0	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	151	174.3	-63.2	-174.3	0	0	0	111	L156 V157 F158 R159 L187 I221 I223 L233 L239 V242 M253	L156-L255 HydrophobicContact CD2-CD1 4.34Å; V157-L255 PolarHBondContact O-N 3.16Å; F158-L255 CarbonylContact C-O 3.54Å; F158-L255 WeakPolarHBondContact CA-O 3.35Å; F158-L255 HydrophobicContact CD2-CB 3.8Å; F158-L255 HydrophobicContact CE2-CB 4.18Å; R159-L255 PolarHBondContact N-O 2.78Å; L187-L255 HydrophobicContact CD1-CD1 3.53Å; I221-L255 HydrophobicContact CG2-CD1 4.44Å; I223-L255 HydrophobicContact CB-CD2 4.03Å; I223-L255 HydrophobicContact CD1-CD2 3.97Å; I223-L255 HydrophobicContact CG1-CD2 4.02Å; L233-L255 HydrophobicContact CD1-CD2 3.78Å; L239-L255 HydrophobicContact CD2-CD1 4.31Å; V242-L255 HydrophobicContact CG1-CD2 4.42Å; M253-L255 HydrophobicContact CE-CD1 4.14Å; M253-L255 HydrophobicContact CE-CD2 4.41Å; M253-L255 HydrophobicContact CE-CG 4.35Å; M253-L255 HydrophobicContact CG-CD2 4.01Å; M253-L255 HydrophobicContact CG-CG 4.15Å; M253-L255 PolarHBondContact O-N 3.49Å; M253-L255 HydrophobicContact SD-CD2 4.11Å
256	Y	96.1	Very high	83.3	Confident	24 Å²	24	91.9 Å²	91.9	9%	0.094	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.1	-176.9	-64.6	-98.9	0	0	0	110.1	R159 I221 Y222 A224 F230 E254	R159-Y256 HydrophobicContact CB-CD1 3.77Å; R159-Y256 HydrophobicContact CB-CE1 3.78Å; R159-Y256 HydrophobicContact CG-CE1 4.31Å; R159-Y256 PolarHBondContact NH1-OH 3.25Å; R159-Y256 CarbonylContact O-C 3.5Å; R159-Y256 VanDerWaalsContact O-CA 3.23Å; R159-Y256 WeakPolarHBondContact O-CA 3.41Å; I221-Y256 WeakPolarHBondContact CA-O 3.36Å; Y222-Y256 PolarHBondContact N-O 3.42Å; Y222-Y256 PolarHBondContact O-N 3.14Å; A224-Y256 HydrophobicContact CB-CE2 4.07Å; F230-Y256 HydrophobicContact CD1-CD2 4.25Å; F230-Y256 HydrophobicContact CD1-CG 4.17Å; F230-Y256 AromaticContact CE1-CD1 3.86Å; F230-Y256 HydrophobicContact CE1-CD1 3.86Å; F230-Y256 AromaticContact CE1-CD2 3.74Å; F230-Y256 HydrophobicContact CE1-CD2 3.74Å; F230-Y256 HydrophobicContact CE1-CE1 4.17Å; F230-Y256 HydrophobicContact CE1-CE2 4.1Å; F230-Y256 AromaticContact CE1-CG 3.65Å; F230-Y256 HydrophobicContact CE1-CG 3.65Å; E254-Y256 HydrophobicContact CB-CE2 4Å; E254-Y256 PolarHBondContact OE2-OH 3.37Å
257	Y	94.6	Very high	82.9	Confident	1 Å²	1	93.1 Å²	93.1	0%	0.004	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	148.3	-180	63.9	-98.1	0	0	0	112.7	F158 R159 P160 H161 M165 Q172 L191 Y219	F158-Y257 HydrophobicContact CD1-CD1 4.28Å; F158-Y257 AromaticContact CD2-CD1 3.75Å; F158-Y257 HydrophobicContact CD2-CD1 3.75Å; F158-Y257 HydrophobicContact CE1-CD1 4.36Å; F158-Y257 AromaticContact CE2-CD1 3.8Å; F158-Y257 HydrophobicContact CE2-CD1 3.8Å; F158-Y257 HydrophobicContact CE2-CG 4.27Å; F158-Y257 HydrophobicContact CG-CD1 4Å; F158-Y257 HydrophobicContact CG-CE1 4.44Å; F158-Y257 HydrophobicContact CZ-CD1 4.13Å; F158-Y257 HydrophobicContact CZ-CG 4.45Å; R159-Y257 WeakPolarHBondContact O-CD1 2.87Å; R159-Y257 WeakPolarHBondContact O-CE1 3.49Å; R159-Y257 PolarHBondContact O-N 2.85Å; P160-Y257 HydrophobicContact CB-CE2 4.46Å; H161-Y257 VanDerWaalsContact CB-O 3.23Å; H161-Y257 WeakPolarHBondContact CB-O 3.23Å; H161-Y257 PolarHBondContact N-O 3.4Å; M165-Y257 HydrophobicContact CE-CD2 4.43Å; M165-Y257 HydrophobicContact CE-CE2 3.78Å; M165-Y257 HydrophobicContact SD-CD2 3.54Å; M165-Y257 VanDerWaalsContact SD-CD2 3.54Å; M165-Y257 HydrophobicContact SD-CE2 3.4Å; M165-Y257 WeakPolarHBondContact SD-CE2 3.34Å; M165-Y257 VanDerWaalsContact SD-O 3.4Å; Q172-Y257 PolarHBondContact O-OH 3.16Å; L191-Y257 HydrophobicContact CD1-CD1 4.46Å; L191-Y257 HydrophobicContact CD1-CD2 4.44Å; L191-Y257 HydrophobicContact CD1-CE1 4.18Å; L191-Y257 HydrophobicContact CD1-CE2 4.1Å; L191-Y257 HydrophobicContact CD2-CD1 3.85Å; L191-Y257 HydrophobicContact CD2-CD2 3.38Å; L191-Y257 HydrophobicContact CD2-CE1 4.34Å; L191-Y257 HydrophobicContact CD2-CE2 3.88Å; L191-Y257 HydrophobicContact CD2-CG 3.35Å; L191-Y257 HydrophobicContact CG-CD2 4.47Å; Y219-Y257 HydrophobicContact CD1-CD2 4.18Å; Y219-Y257 HydrophobicContact CE1-CD2 4.48Å
258	A	93	Very high	82.4	Confident	2 Å²	2	95.9 Å²	95.9	2%	0.017	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	153.2	165.6	0	0	0	0	0	109.7	H161 L164 M165 Y219 T220 Y222 T260	H161-A258 HydrophobicContact CB-CB 4.03Å; L164-A258 HydrophobicContact CB-CB 3.7Å; L164-A258 HydrophobicContact CD1-CB 4.25Å; M165-A258 HydrophobicContact CG-CB 4.46Å; Y219-A258 CarbonylContact C-O 3.58Å; Y219-A258 WeakPolarHBondContact CA-O 3.44Å; T220-A258 PolarHBondContact N-O 2.31Å; T220-A258 PolarHBondContact O-N 2.84Å; T220-A258 VanDerWaalsContact O-N 3.09Å; Y222-A258 HydrophobicContact CE2-CB 3.97Å; A258-T260 PolarHBondContact O-N 3.3Å
259	P	91.4	Very high	82.3	Confident	62 Å²	62	92.1 Å²	92.1	40%	0.403	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	132.3	169.6	-23.3	33.3	0	0	0	110.8	Y219 K261	Y219-P259 HydrophobicContact CE1-CB 4.44Å; Y219-P259 HydrophobicContact CE1-CG 4.05Å; P259-K261 PolarHBondContact O-N 3.03Å
260	T	89.1	Confident	82	Confident	51 Å²	51	93.1 Å²	93.1	31%	0.313	45%	0.448	S	S	.	.			trans	-65.9	118.1	177.1	-59.7	0	0	0	0	109.4	K217 Q218 Y219 T220 A258 E262	K217-T260 WeakPolarHBondContact O-CB 2.76Å; K217-T260 PolarHBondContact O-OG1 3.25Å; Q218-T260 PolarHBondContact O-N 2.96Å; Y219-T260 WeakPolarHBondContact CA-OG1 3.49Å; Y219-T260 PolarHBondContact N-OG1 3.26Å; T220-T260 PolarHBondContact N-OG1 3Å; T220-T260 VanDerWaalsContact N-OG1 3.1Å; T220-T260 PolarHBondContact OG1-OG1 3.32Å; A258-T260 PolarHBondContact O-N 3.3Å; T260-E262 PolarHBondContact O-N 2.92Å
261	K	77.6	Confident	81.9	Confident	161 Å²	161	87.2 Å²	87.2	70%	0.7	41%	0.414	S	S	*	.			trans	-80.7	106.8	169.7	-63.8	-177.4	-178.3	-178.5	0	107.6	P259 H263	P259-K261 PolarHBondContact O-N 3.03Å; K261-H263 PolarHBondContact O-N 3.27Å
262	E	60.6	Low	81.3	Confident	178 Å²	178	81.9 Å²	81.9	83%	0.832	39%	0.393	S	S	*	.			trans	-58.6	129.4	175.8	-64.7	-167.6	141.8	0	0	110.4	T260 K264	T260-E262 PolarHBondContact O-N 2.92Å; E262-K264 PolarHBondContact O-N 3.4Å; E262-K264 VanDerWaalsContact O-N 3.15Å
263	H	44	Very low	80.5	Confident	199 Å²	199	83.8 Å²	83.8	92%	0.921	39%	0.394	S	S	*	.			trans	-74.1	101.4	165	-92.4	-88.9	0	0	0	108.3	K261	K261-H263 PolarHBondContact O-N 3.27Å
264	K	32.5	Very low	79.2	Confident	271 Å²	271	91.3 Å²	91.3	100%	1.178	43%	0.429	S	S	*	.			trans	-74.8	0	170.6	-175	-177.6	179.1	-177.5	0	111.8	E262	E262-K264 PolarHBondContact O-N 3.4Å; E262-K264 VanDerWaalsContact O-N 3.15Å

Retrieved 264 of 264 residues in 280.3 ms (Link to these results)

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