A0A087YJY3_POEFO Loading...

2-oxoglutarate and iron dependent oxygenase domain containing 3

AlphaFold DB , UniProt , Accession A0A087YJY3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 316 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	38	Very low	45.2	Very low	249 Å²	249	165.3 Å²	165.3	100%	1.227	84%	0.836	S	S	*	*				0	130.9	0	-77.4	-169.6	-177.8	0	0	108.7
2	A	40.6	Very low	45.9	Very low	89 Å²	89	162.4 Å²	162.4	74%	0.736	84%	0.837	S	S	*	*			trans	-73.2	132.4	-170.7	0	0	0	0	0	112.8	L4	A2-L4 PolarHBondContact O-N 3.42Å; A2-L4 VanDerWaalsContact O-N 3.15Å
3	L	38.7	Very low	46.8	Very low	181 Å²	181	157.7 Å²	157.7	95%	0.948	81%	0.814	S	S	*	*			trans	-77.2	91.2	167.1	-96.4	152.3	0	0	0	108.9	R5	L3-R5 PolarHBondContact O-N 3.33Å
4	L	39.8	Very low	47.7	Very low	152 Å²	152	149.5 Å²	149.5	80%	0.796	78%	0.781	S	S	*	*			trans	-70.3	118.9	170.4	-88.6	149.8	0	0	0	109.8	A2 L6	A2-L4 PolarHBondContact O-N 3.42Å; A2-L4 VanDerWaalsContact O-N 3.15Å; L4-L6 PolarHBondContact O-N 2.84Å; L4-L6 VanDerWaalsContact O-N 3.1Å
5	R	51	Low	48.7	Very low	248 Å²	248	144.2 Å²	144.2	94%	0.936	77%	0.768	S	S	*	*			trans	-56.8	108.9	168.8	-91.4	-179.9	170.6	179	-2.4	109.9	L3 R7	L3-R5 PolarHBondContact O-N 3.33Å; R5-R7 PolarHBondContact O-N 3.28Å
6	L	39.5	Very low	49.9	Very low	173 Å²	173	141 Å²	141	91%	0.906	75%	0.747	S	S	*	*			trans	-74.5	108.9	167.7	-96.3	140	0	0	0	109.6	L4 N8	L4-L6 PolarHBondContact O-N 2.84Å; L4-L6 VanDerWaalsContact O-N 3.1Å; L6-N8 PolarHBondContact O-N 3.18Å
7	R	50.3	Low	51	Low	238 Å²	238	138.4 Å²	138.4	90%	0.898	73%	0.732	S	S	*	*			trans	-67.3	111.1	169.9	-154	178.2	-169	179.2	2.9	107.2	R5	R5-R7 PolarHBondContact O-N 3.28Å
8	N	46.7	Very low	52.1	Low	153 Å²	153	135.9 Å²	135.9	82%	0.818	72%	0.716	S	S	*	*			trans	-64.5	130.9	178.8	-128.6	-1.3	0	0	0	109.5	L6 K10	L6-N8 PolarHBondContact O-N 3.18Å; N8-K10 PolarHBondContact O-N 2.79Å
9	P	45.5	Very low	53.1	Low	110 Å²	110	139.6 Å²	139.6	71%	0.714	72%	0.719	S	S	*	*			trans	-70.6	130.3	-176.9	26.8	-26.7	0	0	0	108.9	G11	P9-G11 PolarHBondContact O-N 3.07Å
10	K	54.6	Low	54.1	Low	185 Å²	185	139.4 Å²	139.4	80%	0.804	71%	0.713	S	S	*	*			trans	-59	108.6	167.3	-77.8	-175.5	175.2	-174.5	0	107.3	N8 A14	N8-K10 PolarHBondContact O-N 2.79Å; K10-A14 HydrophobicContact CB-CB 4.5Å
11	G	52.1	Low	55	Low	40 Å²	40	137.3 Å²	137.3	41%	0.412	70%	0.702	S	S	.	*			trans	-59	154.9	173.9	0	0	0	0	0	111.2	P9 N13 A14	P9-G11 PolarHBondContact O-N 3.07Å; G11-N13 PolarHBondContact O-N 3.29Å; G11-A14 PolarHBondContact O-N 3.46Å
12	P	54	Low	56.6	Low	131 Å²	131	131.8 Å²	131.8	85%	0.851	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-14.2	-173.5	22.2	-32.7	0	0	0	114.3
13	N	58	Low	58.1	Low	101 Å²	101	136.5 Å²	136.5	54%	0.54	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.5	-11.3	178.6	-81.3	-7.2	0	0	0	115.7	G11 E16 I17	G11-N13 PolarHBondContact O-N 3.29Å; N13-E16 PolarHBondContact O-N 3.43Å; N13-I17 HydrophobicContact CB-CD1 4.32Å; N13-I17 WeakPolarHBondContact O-CD1 3.41Å; N13-I17 VanDerWaalsContact O-CG1 3.23Å; N13-I17 WeakPolarHBondContact O-CG1 3.46Å; N13-I17 PolarHBondContact O-N 2.89Å
14	A	58.5	Low	59.6	Low	43 Å²	43	129.3 Å²	129.3	36%	0.355	64%	0.64	S	S	.	*	H	α-helix	trans	-68.1	-40.3	-174.1	0	0	0	0	0	112.7	K10 G11 E16 E18	K10-A14 HydrophobicContact CB-CB 4.5Å; G11-A14 PolarHBondContact O-N 3.46Å; A14-E16 VanDerWaalsContact C-N 3.34Å; A14-E18 PolarHBondContact O-N 3.33Å; A14-E18 VanDerWaalsContact O-N 3.13Å
15	A	63.4	Low	60.8	Low	70 Å²	70	126.3 Å²	126.3	58%	0.579	63%	0.625	S	S	*	*	H	α-helix	trans	-70.9	-30.6	177.4	0	0	0	0	0	112.6	R19	A15-R19 PolarHBondContact O-N 3.22Å; A15-R19 VanDerWaalsContact O-N 3.1Å
16	E	67.3	Low	61.4	Low	93 Å²	93	117.3 Å²	117.3	44%	0.435	60%	0.604	S	S	.	*	H	α-helix	trans	-73.3	-41.8	177.6	-163.6	-171.4	146.5	0	0	111.6	N13 A14 R19 K20	N13-E16 PolarHBondContact O-N 3.43Å; A14-E16 VanDerWaalsContact C-N 3.34Å; E16-R19 PolarHBondContact O-N 3.04Å; E16-K20 WeakPolarHBondContact O-CG 3.29Å; E16-K20 PolarHBondContact O-N 3.19Å; E16-K20 WeakPolarHBondContact OE1-CE 3.14Å; E16-K20 IonicContact OE1-NZ 3.87Å; E16-K20 PolarHBondContact OE1-NZ 2.85Å
17	I	69.4	Low	62.4	Low	97 Å²	97	114.7 Å²	114.7	50%	0.497	59%	0.59	S	S	.	*	H	α-helix	trans	-62.3	-45	174.7	-67.3	164.8	0	0	0	110.2	N13 R19 K20 I21	N13-I17 HydrophobicContact CB-CD1 4.32Å; N13-I17 WeakPolarHBondContact O-CD1 3.41Å; N13-I17 VanDerWaalsContact O-CG1 3.23Å; N13-I17 WeakPolarHBondContact O-CG1 3.46Å; N13-I17 PolarHBondContact O-N 2.89Å; I17-R19 VanDerWaalsContact C-N 3.35Å; I17-R19 PolarHBondContact O-N 2.92Å; I17-K20 PolarHBondContact O-N 3.02Å; I17-I21 HydrophobicContact CG2-CD1 3.87Å; I17-I21 WeakPolarHBondContact O-CG1 3.28Å; I17-I21 PolarHBondContact O-N 2.94Å
18	E	70.8	Confident	62.9	Low	94 Å²	94	112.7 Å²	112.7	44%	0.439	58%	0.582	S	S	.	*	H	α-helix	trans	-62.7	-39.7	177.8	-161.6	-172.4	149.3	0	0	112.2	A14 I21 K22	A14-E18 PolarHBondContact O-N 3.33Å; A14-E18 VanDerWaalsContact O-N 3.13Å; E18-I21 PolarHBondContact O-N 3.33Å; E18-K22 WeakPolarHBondContact O-CB 3.5Å; E18-K22 WeakPolarHBondContact O-CG 3.38Å; E18-K22 PolarHBondContact O-N 2.75Å; E18-K22 WeakPolarHBondContact OE1-CE 3.48Å; E18-K22 IonicContact OE1-NZ 2.7Å; E18-K22 PolarHBondContact OE1-NZ 3.28Å
19	R	70.7	Confident	63.5	Low	205 Å²	205	112.2 Å²	112.2	77%	0.774	58%	0.575	S	S	*	*	H	α-helix	trans	-64.2	-41.7	173.2	-89.7	-176	174.3	178.9	-0.4	112.5	A15 E16 I17 K22 R23	A15-R19 PolarHBondContact O-N 3.22Å; A15-R19 VanDerWaalsContact O-N 3.1Å; E16-R19 PolarHBondContact O-N 3.04Å; I17-R19 VanDerWaalsContact C-N 3.35Å; I17-R19 PolarHBondContact O-N 2.92Å; R19-K22 PolarHBondContact O-N 3.27Å; R19-R23 VanDerWaalsContact O-CB 3.31Å; R19-R23 WeakPolarHBondContact O-CB 3.42Å; R19-R23 PolarHBondContact O-N 2.99Å
20	K	73.6	Confident	64	Low	135 Å²	135	108.8 Å²	108.8	59%	0.587	56%	0.56	S	S	*	*	H	α-helix	trans	-64.4	-41.3	177.4	-78.7	176.5	178.3	162.8	0	111.6	E16 I17 R23 G24	E16-K20 WeakPolarHBondContact O-CG 3.29Å; E16-K20 PolarHBondContact O-N 3.19Å; E16-K20 WeakPolarHBondContact OE1-CE 3.14Å; E16-K20 IonicContact OE1-NZ 3.87Å; E16-K20 PolarHBondContact OE1-NZ 2.85Å; I17-K20 PolarHBondContact O-N 3.02Å; K20-R23 PolarHBondContact O-N 3.15Å; K20-G24 PolarHBondContact O-N 2.89Å
21	I	72.7	Confident	64.2	Low	97 Å²	97	104 Å²	104	50%	0.497	55%	0.55	S	S	.	.	H	α-helix	trans	-65.6	-47.3	176.3	-66.7	169.1	0	0	0	111.1	I17 E18 R23 G24 N25	I17-I21 HydrophobicContact CG2-CD1 3.87Å; I17-I21 WeakPolarHBondContact O-CG1 3.28Å; I17-I21 PolarHBondContact O-N 2.94Å; E18-I21 PolarHBondContact O-N 3.33Å; I21-R23 VanDerWaalsContact C-N 3.31Å; I21-R23 PolarHBondContact O-N 3.07Å; I21-G24 PolarHBondContact O-N 3.38Å; I21-N25 WeakPolarHBondContact O-CB 3.43Å; I21-N25 PolarHBondContact O-N 3.41Å
22	K	71.6	Confident	64.3	Low	133 Å²	133	106.2 Å²	106.2	58%	0.578	56%	0.559	S	S	*	*	H	α-helix	trans	-59.7	-40.6	176.5	-77.7	175.6	171.8	165.3	0	111.9	E18 R19 A26	E18-K22 WeakPolarHBondContact O-CB 3.5Å; E18-K22 WeakPolarHBondContact O-CG 3.38Å; E18-K22 PolarHBondContact O-N 2.75Å; E18-K22 WeakPolarHBondContact OE1-CE 3.48Å; E18-K22 IonicContact OE1-NZ 2.7Å; E18-K22 PolarHBondContact OE1-NZ 3.28Å; R19-K22 PolarHBondContact O-N 3.27Å; K22-A26 WeakPolarHBondContact O-CB 3.44Å; K22-A26 PolarHBondContact O-N 2.8Å
23	R	70.8	Confident	64.4	Low	187 Å²	187	108.9 Å²	108.9	71%	0.706	55%	0.552	S	S	*	*	H	α-helix	trans	-67.1	-42.1	176.4	-164.9	175.2	-175.7	-178.9	0.5	112.1	R19 K20 I21 A26 L27	R19-R23 VanDerWaalsContact O-CB 3.31Å; R19-R23 WeakPolarHBondContact O-CB 3.42Å; R19-R23 PolarHBondContact O-N 2.99Å; K20-R23 PolarHBondContact O-N 3.15Å; I21-R23 VanDerWaalsContact C-N 3.31Å; I21-R23 PolarHBondContact O-N 3.07Å; R23-A26 PolarHBondContact O-N 2.91Å; R23-L27 HydrophobicContact CG-CD1 4.27Å; R23-L27 WeakPolarHBondContact O-CB 3.43Å; R23-L27 WeakPolarHBondContact O-CD1 3.33Å; R23-L27 VanDerWaalsContact O-CG 3.28Å; R23-L27 WeakPolarHBondContact O-CG 3.43Å; R23-L27 PolarHBondContact O-N 2.83Å
24	G	70.2	Confident	64.3	Low	31 Å²	31	114 Å²	114	32%	0.32	56%	0.564	S	S	.	*	H	α-helix	trans	-63.6	-41.7	175.5	0	0	0	0	0	113.1	K20 I21 L27 R28	K20-G24 PolarHBondContact O-N 2.89Å; I21-G24 PolarHBondContact O-N 3.38Å; G24-L27 PolarHBondContact O-N 3.29Å; G24-R28 PolarHBondContact O-N 3.01Å
25	N	65.8	Low	64.4	Low	88 Å²	88	113.8 Å²	113.8	47%	0.471	57%	0.566	S	S	.	*	H	α-helix	trans	-68.4	-39.4	176.6	-74.1	-12.7	0	0	0	112.4	I21 R28 Q29	I21-N25 WeakPolarHBondContact O-CB 3.43Å; I21-N25 PolarHBondContact O-N 3.41Å; N25-R28 PolarHBondContact O-N 3.1Å; N25-Q29 WeakPolarHBondContact O-CB 3.42Å; N25-Q29 PolarHBondContact O-N 2.95Å
26	A	63.7	Low	64.6	Low	60 Å²	60	114 Å²	114	50%	0.496	56%	0.563	S	S	.	*	H	α-helix	trans	-64.7	-39.4	174.3	0	0	0	0	0	112.4	K22 R23 G30	K22-A26 WeakPolarHBondContact O-CB 3.44Å; K22-A26 PolarHBondContact O-N 2.8Å; R23-A26 PolarHBondContact O-N 2.91Å; A26-G30 PolarHBondContact O-N 2.65Å
27	L	61	Low	64.8	Low	118 Å²	118	118 Å²	118	62%	0.618	57%	0.574	S	S	*	*	H	α-helix	trans	-65.8	-40.8	174.5	-74.3	164.6	0	0	0	111.9	R23 G24 S31	R23-L27 HydrophobicContact CG-CD1 4.27Å; R23-L27 WeakPolarHBondContact O-CB 3.43Å; R23-L27 WeakPolarHBondContact O-CD1 3.33Å; R23-L27 VanDerWaalsContact O-CG 3.28Å; R23-L27 WeakPolarHBondContact O-CG 3.43Å; R23-L27 PolarHBondContact O-N 2.83Å; G24-L27 PolarHBondContact O-N 3.29Å; L27-S31 WeakPolarHBondContact O-CB 3.26Å; L27-S31 PolarHBondContact O-N 3.41Å
28	R	60.5	Low	65	Low	195 Å²	195	115 Å²	115	74%	0.736	57%	0.568	S	S	*	*	H	α-helix	trans	-66.1	-42.2	174.7	-80.9	-178.4	170	-172.9	-3.4	112.7	G24 N25 S31 S32	G24-R28 PolarHBondContact O-N 3.01Å; N25-R28 PolarHBondContact O-N 3.1Å; R28-S31 PolarHBondContact O-N 3.28Å; R28-S32 WeakPolarHBondContact O-CB 3.2Å; R28-S32 PolarHBondContact O-N 2.86Å
29	Q	58.6	Low	65.4	Low	143 Å²	143	115.9 Å²	115.9	67%	0.668	58%	0.575	S	S	*	*	H	α-helix	trans	-65.1	-42.2	175.1	-79.6	-176.3	-18.8	0	0	112.1	N25 S31 S32 W33	N25-Q29 WeakPolarHBondContact O-CB 3.42Å; N25-Q29 PolarHBondContact O-N 2.95Å; Q29-S31 VanDerWaalsContact C-N 3.32Å; Q29-S31 PolarHBondContact O-N 3.12Å; Q29-S32 PolarHBondContact O-N 3.1Å; Q29-W33 VanDerWaalsContact O-CB 3.28Å; Q29-W33 WeakPolarHBondContact O-CB 3.37Å; Q29-W33 PolarHBondContact O-N 3.26Å
30	G	57	Low	65.9	Low	38 Å²	38	111.4 Å²	111.4	39%	0.392	57%	0.565	S	S	.	*	H	α-helix	trans	-64.3	-33.9	175.2	0	0	0	0	0	113.8	A26 R34	A26-G30 PolarHBondContact O-N 2.65Å; G30-R34 WeakPolarHBondContact O-CB 3.43Å; G30-R34 WeakPolarHBondContact O-CG 3.48Å; G30-R34 PolarHBondContact O-N 2.88Å
31	S	57.9	Low	66.3	Low	85 Å²	85	107.4 Å²	107.4	59%	0.594	56%	0.557	S	S	*	*	H	α-helix	trans	-70.4	-48	174.9	170.3	0	0	0	0	112.4	L27 R28 Q29 W33 R34 G35	L27-S31 WeakPolarHBondContact O-CB 3.26Å; L27-S31 PolarHBondContact O-N 3.41Å; R28-S31 PolarHBondContact O-N 3.28Å; Q29-S31 VanDerWaalsContact C-N 3.32Å; Q29-S31 PolarHBondContact O-N 3.12Å; S31-W33 VanDerWaalsContact C-N 3.34Å; S31-W33 PolarHBondContact O-N 3.04Å; S31-R34 PolarHBondContact O-N 2.92Å; S31-G35 PolarHBondContact O-N 3.37Å
32	S	55.6	Low	66.9	Low	87 Å²	87	108.5 Å²	108.5	61%	0.608	56%	0.564	S	S	*	*	H	α-helix	trans	-59.9	-41.9	175.7	177.3	0	0	0	0	112.3	R28 Q29 G35 S36	R28-S32 WeakPolarHBondContact O-CB 3.2Å; R28-S32 PolarHBondContact O-N 2.86Å; Q29-S32 PolarHBondContact O-N 3.1Å; S32-G35 PolarHBondContact O-N 2.77Å; S32-S36 PolarHBondContact O-N 3.28Å; S32-S36 VanDerWaalsContact O-N 3.14Å
33	W	54.3	Low	67.6	Low	187 Å²	187	107.9 Å²	107.9	71%	0.708	57%	0.566	S	S	*	*	H	α-helix	trans	-68.2	-38.6	179.8	-163.4	-57	0	0	0	112.2	Q29 S31 R37	Q29-W33 VanDerWaalsContact O-CB 3.28Å; Q29-W33 WeakPolarHBondContact O-CB 3.37Å; Q29-W33 PolarHBondContact O-N 3.26Å; S31-W33 VanDerWaalsContact C-N 3.34Å; S31-W33 PolarHBondContact O-N 3.04Å; W33-R37 WeakPolarHBondContact O-CG 3Å; W33-R37 PolarHBondContact O-N 3.4Å
34	R	57.3	Low	68.4	Low	209 Å²	209	103.8 Å²	103.8	79%	0.789	56%	0.558	S	S	*	*	H	α-helix	trans	-68.9	-39.7	175.5	-80.6	-178.5	179.5	-132.3	1.1	112.4	G30 S31 G38	G30-R34 WeakPolarHBondContact O-CB 3.43Å; G30-R34 WeakPolarHBondContact O-CG 3.48Å; G30-R34 PolarHBondContact O-N 2.88Å; S31-R34 PolarHBondContact O-N 2.92Å; R34-G38 PolarHBondContact O-N 3.37Å; R34-G38 VanDerWaalsContact O-N 3.12Å
35	G	60.3	Low	69.4	Low	38 Å²	38	107 Å²	107	39%	0.392	57%	0.571	S	S	.	*	H	α-helix	trans	-63.4	-43.6	177	0	0	0	0	0	113	S31 S32 G38 L39	S31-G35 PolarHBondContact O-N 3.37Å; S32-G35 PolarHBondContact O-N 2.77Å; G35-G38 PolarHBondContact O-N 2.85Å; G35-L39 WeakPolarHBondContact O-CG 3.35Å; G35-L39 PolarHBondContact O-N 3.43Å
36	S	67.4	Low	70.5	Confident	75 Å²	75	105.6 Å²	105.6	52%	0.524	57%	0.571	S	S	.	*	H	α-helix	trans	-64.7	-40.8	178.4	-179.4	0	0	0	0	112.9	S32 G38 L39 L40	S32-S36 PolarHBondContact O-N 3.28Å; S32-S36 VanDerWaalsContact O-N 3.14Å; S36-G38 PolarHBondContact O-N 3.08Å; S36-L39 PolarHBondContact O-N 2.82Å; S36-L40 WeakPolarHBondContact O-CB 3.47Å; S36-L40 PolarHBondContact O-N 2.66Å
37	R	70.6	Confident	71.9	Confident	175 Å²	175	107.8 Å²	107.8	66%	0.66	57%	0.574	S	S	*	*	H	α-helix	trans	-65.5	-37.5	174.5	-71.4	179.7	70.4	174	3.2	112.9	W33 A41	W33-R37 WeakPolarHBondContact O-CG 3Å; W33-R37 PolarHBondContact O-N 3.4Å; R37-A41 VanDerWaalsContact O-CB 3.3Å; R37-A41 WeakPolarHBondContact O-CB 3.39Å; R37-A41 PolarHBondContact O-N 2.64Å
38	G	75.1	Confident	73.4	Confident	35 Å²	35	105.7 Å²	105.7	36%	0.361	57%	0.569	S	S	.	*	H	α-helix	trans	-64.5	-44.6	175.2	0	0	0	0	0	112.2	R34 G35 S36 A41 L42	R34-G38 PolarHBondContact O-N 3.37Å; R34-G38 VanDerWaalsContact O-N 3.12Å; G35-G38 PolarHBondContact O-N 2.85Å; S36-G38 PolarHBondContact O-N 3.08Å; G38-A41 PolarHBondContact O-N 3.25Å; G38-L42 WeakPolarHBondContact O-CB 3.19Å; G38-L42 VanDerWaalsContact O-CG 3.3Å; G38-L42 WeakPolarHBondContact O-CG 3.41Å; G38-L42 PolarHBondContact O-N 2.85Å
39	L	78.6	Confident	74.8	Confident	113 Å²	113	99 Å²	99	59%	0.592	56%	0.555	S	S	*	*	H	α-helix	trans	-63.3	-44.4	175.5	-75.6	160.9	0	0	0	112.2	G35 S36 A41 L42 L43	G35-L39 WeakPolarHBondContact O-CG 3.35Å; G35-L39 PolarHBondContact O-N 3.43Å; S36-L39 PolarHBondContact O-N 2.82Å; L39-A41 PolarHBondContact O-N 3.18Å; L39-L42 PolarHBondContact O-N 3.38Å; L39-L43 WeakPolarHBondContact O-CG 3.3Å; L39-L43 PolarHBondContact O-N 2.88Å
40	L	80.9	Confident	76.3	Confident	110 Å²	110	95.2 Å²	95.2	58%	0.576	55%	0.545	S	S	*	.	H	α-helix	trans	-63.9	-40.8	177.6	-154.3	83.1	0	0	0	111.7	S36 L43 L44	S36-L40 WeakPolarHBondContact O-CB 3.47Å; S36-L40 PolarHBondContact O-N 2.66Å; L40-L43 PolarHBondContact O-N 2.99Å; L40-L44 WeakPolarHBondContact O-CG 3.45Å; L40-L44 PolarHBondContact O-N 3.41Å
41	A	82	Confident	77.9	Confident	51 Å²	51	97.2 Å²	97.2	42%	0.421	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-41.7	175.5	0	0	0	0	0	112.1	R37 G38 L39 L44 V45	R37-A41 VanDerWaalsContact O-CB 3.3Å; R37-A41 WeakPolarHBondContact O-CB 3.39Å; R37-A41 PolarHBondContact O-N 2.64Å; G38-A41 PolarHBondContact O-N 3.25Å; L39-A41 PolarHBondContact O-N 3.18Å; A41-L44 PolarHBondContact O-N 2.96Å; A41-V45 VanDerWaalsContact O-CG2 3.31Å; A41-V45 WeakPolarHBondContact O-CG2 3.24Å; A41-V45 PolarHBondContact O-N 3.4Å
42	L	85.1	Confident	79.4	Confident	121 Å²	121	97 Å²	97	63%	0.634	54%	0.544	S	S	*	.	H	α-helix	trans	-63.4	-40.8	175.3	-74.6	166.1	0	0	0	112	G38 L39 V45 A46	G38-L42 WeakPolarHBondContact O-CB 3.19Å; G38-L42 VanDerWaalsContact O-CG 3.3Å; G38-L42 WeakPolarHBondContact O-CG 3.41Å; G38-L42 PolarHBondContact O-N 2.85Å; L39-L42 PolarHBondContact O-N 3.38Å; L42-V45 PolarHBondContact O-N 2.77Å; L42-A46 WeakPolarHBondContact O-CB 3.42Å; L42-A46 PolarHBondContact O-N 3.45Å
43	L	87.1	Confident	80.9	Confident	120 Å²	120	95.5 Å²	95.5	63%	0.628	54%	0.537	S	S	*	.	H	α-helix	trans	-63.8	-41.1	175.6	-74.2	169.5	0	0	0	112	L39 L40 A46 L47	L39-L43 WeakPolarHBondContact O-CG 3.3Å; L39-L43 PolarHBondContact O-N 2.88Å; L40-L43 PolarHBondContact O-N 2.99Å; L43-A46 PolarHBondContact O-N 2.85Å; L43-L47 WeakPolarHBondContact O-CB 3.36Å; L43-L47 PolarHBondContact O-N 3.41Å
44	L	87.6	Confident	82.2	Confident	101 Å²	101	89 Å²	89	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-42.7	175.4	-73	168.9	0	0	0	111.8	L40 A41 L47 C48	L40-L44 WeakPolarHBondContact O-CG 3.45Å; L40-L44 PolarHBondContact O-N 3.41Å; A41-L44 PolarHBondContact O-N 2.96Å; L44-L47 PolarHBondContact O-N 2.96Å; L44-C48 WeakPolarHBondContact O-CB 3.31Å; L44-C48 PolarHBondContact O-N 3.1Å; L44-C48 PolarHBondContact O-SG 2.5Å; L44-C48 VanDerWaalsContact O-SG 3.33Å
45	V	90.8	Very high	83.4	Confident	98 Å²	98	87.4 Å²	87.4	59%	0.594	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-43.2	175.7	171.3	0	0	0	0	111	A41 L42 C48 A49	A41-V45 VanDerWaalsContact O-CG2 3.31Å; A41-V45 WeakPolarHBondContact O-CG2 3.24Å; A41-V45 PolarHBondContact O-N 3.4Å; L42-V45 PolarHBondContact O-N 2.77Å; V45-C48 PolarHBondContact O-N 2.92Å; V45-A49 VanDerWaalsContact O-CB 3.32Å; V45-A49 WeakPolarHBondContact O-CB 3.35Å; V45-A49 PolarHBondContact O-N 3.28Å
46	A	89.9	Confident	84.1	Confident	58 Å²	58	90.2 Å²	90.2	48%	0.479	52%	0.523	S	S	.	.	H	α-helix	trans	-63.5	-41.7	176.5	0	0	0	0	0	111.9	L42 L43 A49 S50	L42-A46 WeakPolarHBondContact O-CB 3.42Å; L42-A46 PolarHBondContact O-N 3.45Å; L43-A46 PolarHBondContact O-N 2.85Å; A46-A49 PolarHBondContact O-N 3.42Å; A46-S50 WeakPolarHBondContact O-CB 3.44Å; A46-S50 PolarHBondContact O-N 3.43Å; A46-S50 PolarHBondContact O-OG 2.9Å
47	L	92.6	Very high	84.4	Confident	107 Å²	107	93.9 Å²	93.9	56%	0.56	53%	0.526	S	S	*	.	H	α-helix	trans	-61.9	-49.6	175	-166.8	79.5	0	0	0	110.7	L43 L44 A49 S50 T51	L43-L47 WeakPolarHBondContact O-CB 3.36Å; L43-L47 PolarHBondContact O-N 3.41Å; L44-L47 PolarHBondContact O-N 2.96Å; L47-A49 VanDerWaalsContact C-N 3.34Å; L47-A49 PolarHBondContact O-N 3.38Å; L47-S50 WeakPolarHBondContact CA-OG 3.42Å; L47-S50 PolarHBondContact O-N 3.19Å; L47-S50 VanDerWaalsContact O-N 3.15Å; L47-S50 PolarHBondContact O-OG 2.78Å; L47-T51 WeakPolarHBondContact O-CG2 3.44Å; L47-T51 PolarHBondContact O-N 3.45Å; L47-T51 PolarHBondContact O-OG1 2.93Å
48	C	91.8	Very high	84.3	Confident	74 Å²	74	90.9 Å²	90.9	50%	0.5	52%	0.523	S	S	.	.	H	α-helix	trans	-60.6	-40.8	176.4	-71.5	0	0	0	0	112.5	L44 V45 S50 T51 V52	L44-C48 WeakPolarHBondContact O-CB 3.31Å; L44-C48 PolarHBondContact O-N 3.1Å; L44-C48 PolarHBondContact O-SG 2.5Å; L44-C48 VanDerWaalsContact O-SG 3.33Å; V45-C48 PolarHBondContact O-N 2.92Å; C48-S50 VanDerWaalsContact C-N 3.33Å; C48-S50 PolarHBondContact O-N 2.85Å; C48-T51 WeakPolarHBondContact CA-OG1 3.49Å; C48-T51 PolarHBondContact O-N 3.49Å; C48-T51 PolarHBondContact O-OG1 3.39Å; C48-V52 WeakPolarHBondContact O-CB 3.33Å; C48-V52 WeakPolarHBondContact O-CG2 3.47Å; C48-V52 PolarHBondContact O-N 3.39Å
49	A	90.6	Very high	83.7	Confident	55 Å²	55	91.3 Å²	91.3	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-40.3	175.6	0	0	0	0	0	111.2	V45 A46 L47 A53	V45-A49 VanDerWaalsContact O-CB 3.32Å; V45-A49 WeakPolarHBondContact O-CB 3.35Å; V45-A49 PolarHBondContact O-N 3.28Å; A46-A49 PolarHBondContact O-N 3.42Å; L47-A49 VanDerWaalsContact C-N 3.34Å; L47-A49 PolarHBondContact O-N 3.38Å; A49-A53 WeakPolarHBondContact O-CB 3.09Å; A49-A53 PolarHBondContact O-N 3.01Å
50	S	89.7	Confident	82.9	Confident	63 Å²	63	89.1 Å²	89.1	44%	0.441	52%	0.517	S	S	.	.	H	α-helix	trans	-66.7	-39.2	177.1	73.6	0	0	0	0	112.7	A46 L47 C48 A54	A46-S50 WeakPolarHBondContact O-CB 3.44Å; A46-S50 PolarHBondContact O-N 3.43Å; A46-S50 PolarHBondContact O-OG 2.9Å; L47-S50 WeakPolarHBondContact CA-OG 3.42Å; L47-S50 PolarHBondContact O-N 3.19Å; L47-S50 VanDerWaalsContact O-N 3.15Å; L47-S50 PolarHBondContact O-OG 2.78Å; C48-S50 VanDerWaalsContact C-N 3.33Å; C48-S50 PolarHBondContact O-N 2.85Å; S50-A54 VanDerWaalsContact O-CB 3.27Å; S50-A54 WeakPolarHBondContact O-CB 3.48Å; S50-A54 PolarHBondContact O-N 3.44Å
51	T	90.3	Very high	81.8	Confident	80 Å²	80	89 Å²	89	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-71	-39.7	176.9	56.1	0	0	0	0	111.6	L47 C48 A54 W55	L47-T51 WeakPolarHBondContact O-CG2 3.44Å; L47-T51 PolarHBondContact O-N 3.45Å; L47-T51 PolarHBondContact O-OG1 2.93Å; C48-T51 WeakPolarHBondContact CA-OG1 3.49Å; C48-T51 PolarHBondContact O-N 3.49Å; C48-T51 PolarHBondContact O-OG1 3.39Å; T51-A54 PolarHBondContact O-N 3.04Å; T51-W55 VanDerWaalsContact O-CB 3.29Å; T51-W55 WeakPolarHBondContact O-CB 3.24Å; T51-W55 PolarHBondContact O-N 3.24Å
52	V	90.8	Very high	80.6	Confident	79 Å²	79	90 Å²	90	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-65.5	-43.2	173.9	170.8	0	0	0	0	110.8	C48 W55 L56	C48-V52 WeakPolarHBondContact O-CB 3.33Å; C48-V52 WeakPolarHBondContact O-CG2 3.47Å; C48-V52 PolarHBondContact O-N 3.39Å; V52-W55 PolarHBondContact O-N 3.29Å; V52-L56 HydrophobicContact CG1-CD1 3.88Å; V52-L56 HydrophobicContact CG1-CG 4.28Å; V52-L56 WeakPolarHBondContact O-CB 3.37Å; V52-L56 VanDerWaalsContact O-CG 3.31Å; V52-L56 WeakPolarHBondContact O-CG 3.41Å; V52-L56 PolarHBondContact O-N 2.94Å
53	A	85.7	Confident	79.3	Confident	56 Å²	56	88.5 Å²	88.5	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-42.5	176.2	0	0	0	0	0	111.8	A49 W55 L56 Y57	A49-A53 WeakPolarHBondContact O-CB 3.09Å; A49-A53 PolarHBondContact O-N 3.01Å; A53-W55 VanDerWaalsContact C-N 3.35Å; A53-L56 PolarHBondContact O-N 2.97Å; A53-Y57 VanDerWaalsContact O-CB 3.25Å; A53-Y57 WeakPolarHBondContact O-CB 3.46Å; A53-Y57 PolarHBondContact O-N 2.8Å
54	A	83.2	Confident	78.7	Confident	50 Å²	50	87.7 Å²	87.7	41%	0.413	51%	0.511	S	S	.	.	H	α-helix	trans	-62.7	-41.5	173.7	0	0	0	0	0	111.6	S50 T51 Y57 L58	S50-A54 VanDerWaalsContact O-CB 3.27Å; S50-A54 WeakPolarHBondContact O-CB 3.48Å; S50-A54 PolarHBondContact O-N 3.44Å; T51-A54 PolarHBondContact O-N 3.04Å; A54-Y57 PolarHBondContact O-N 2.95Å; A54-L58 WeakPolarHBondContact O-CB 3.02Å; A54-L58 WeakPolarHBondContact O-CG 3.43Å; A54-L58 PolarHBondContact O-N 3.47Å
55	W	82.6	Confident	78.4	Confident	176 Å²	176	84.1 Å²	84.1	67%	0.667	49%	0.492	S	S	*	.	H	α-helix	trans	-66.1	-44.9	176.7	-177	76.5	0	0	0	112.3	T51 V52 A53 Y57 L58 A59	T51-W55 VanDerWaalsContact O-CB 3.29Å; T51-W55 WeakPolarHBondContact O-CB 3.24Å; T51-W55 PolarHBondContact O-N 3.24Å; V52-W55 PolarHBondContact O-N 3.29Å; A53-W55 VanDerWaalsContact C-N 3.35Å; W55-Y57 VanDerWaalsContact C-N 3.34Å; W55-Y57 PolarHBondContact O-N 2.92Å; W55-L58 PolarHBondContact O-N 3.5Å; W55-A59 VanDerWaalsContact O-CB 3.24Å; W55-A59 WeakPolarHBondContact O-CB 3.27Å; W55-A59 PolarHBondContact O-N 3.11Å
56	L	74.8	Confident	78.2	Confident	98 Å²	98	83.8 Å²	83.8	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-63.4	-39.7	175.7	-73.6	172.3	0	0	0	111.7	V52 A53 A59 S60	V52-L56 HydrophobicContact CG1-CD1 3.88Å; V52-L56 HydrophobicContact CG1-CG 4.28Å; V52-L56 WeakPolarHBondContact O-CB 3.37Å; V52-L56 VanDerWaalsContact O-CG 3.31Å; V52-L56 WeakPolarHBondContact O-CG 3.41Å; V52-L56 PolarHBondContact O-N 2.94Å; A53-L56 PolarHBondContact O-N 2.97Å; L56-A59 PolarHBondContact O-N 3.4Å; L56-S60 VanDerWaalsContact O-CB 3.3Å; L56-S60 WeakPolarHBondContact O-CB 3.32Å; L56-S60 PolarHBondContact O-N 3.37Å; L56-S60 PolarHBondContact O-OG 3.12Å
57	Y	73.6	Confident	78.4	Confident	152 Å²	152	84.7 Å²	84.7	60%	0.596	48%	0.484	S	S	*	.	H	α-helix	trans	-64	-47.2	174.6	-179.2	-107.4	0	0	0	111.4	A53 A54 W55 A59 S60 L61	A53-Y57 VanDerWaalsContact O-CB 3.25Å; A53-Y57 WeakPolarHBondContact O-CB 3.46Å; A53-Y57 PolarHBondContact O-N 2.8Å; A54-Y57 PolarHBondContact O-N 2.95Å; W55-Y57 VanDerWaalsContact C-N 3.34Å; W55-Y57 PolarHBondContact O-N 2.92Å; Y57-A59 PolarHBondContact O-N 3.23Å; Y57-S60 PolarHBondContact O-N 2.93Å; Y57-S60 PolarHBondContact O-OG 2.7Å; Y57-L61 HydrophobicContact CD1-CD1 4.2Å; Y57-L61 HydrophobicContact CE1-CD1 3.8Å; Y57-L61 WeakPolarHBondContact O-CG 3.45Å; Y57-L61 PolarHBondContact O-N 2.74Å; Y57-L61 VanDerWaalsContact O-N 3.12Å
58	L	68.2	Low	78.6	Confident	112 Å²	112	82.3 Å²	82.3	59%	0.586	47%	0.474	S	S	*	.	H	α-helix	trans	-62.7	-41.1	175.5	-72.1	168.3	0	0	0	112.3	A54 W55 S60 L61 D62	A54-L58 WeakPolarHBondContact O-CB 3.02Å; A54-L58 WeakPolarHBondContact O-CG 3.43Å; A54-L58 PolarHBondContact O-N 3.47Å; W55-L58 PolarHBondContact O-N 3.5Å; L58-S60 VanDerWaalsContact C-N 3.34Å; L58-L61 PolarHBondContact O-N 3.18Å; L58-D62 PolarHBondContact O-N 3.37Å
59	A	61.4	Low	78.8	Confident	44 Å²	44	78.9 Å²	78.9	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-67.3	-34.3	176.2	0	0	0	0	0	112.2	W55 L56 Y57 L61 D62 S63	W55-A59 VanDerWaalsContact O-CB 3.24Å; W55-A59 WeakPolarHBondContact O-CB 3.27Å; W55-A59 PolarHBondContact O-N 3.11Å; L56-A59 PolarHBondContact O-N 3.4Å; Y57-A59 PolarHBondContact O-N 3.23Å; A59-L61 VanDerWaalsContact C-N 3.29Å; A59-L61 PolarHBondContact O-N 2.93Å; A59-D62 PolarHBondContact O-N 2.73Å; A59-S63 PolarHBondContact O-N 2.99Å
60	S	63	Low	79.2	Confident	67 Å²	67	76.3 Å²	76.3	47%	0.469	43%	0.429	S	S	.	.	H	α-helix	trans	-70.5	-23.5	174.6	73.5	0	0	0	0	113.5	L56 Y57 L58 D62 S63	L56-S60 VanDerWaalsContact O-CB 3.3Å; L56-S60 WeakPolarHBondContact O-CB 3.32Å; L56-S60 PolarHBondContact O-N 3.37Å; L56-S60 PolarHBondContact O-OG 3.12Å; Y57-S60 PolarHBondContact O-N 2.93Å; Y57-S60 PolarHBondContact O-OG 2.7Å; L58-S60 VanDerWaalsContact C-N 3.34Å; S60-D62 VanDerWaalsContact C-N 3.32Å; S60-S63 PolarHBondContact O-OG 2.74Å; S60-S63 VanDerWaalsContact O-OG 3.08Å
61	L	58	Low	79.6	Confident	106 Å²	106	74.8 Å²	74.8	56%	0.555	42%	0.419	S	S	*	.	H	α-helix	trans	-75.8	-23.4	171.9	-69.7	168.7	0	0	0	112.2	Y57 L58 A59	Y57-L61 HydrophobicContact CD1-CD1 4.2Å; Y57-L61 HydrophobicContact CE1-CD1 3.8Å; Y57-L61 WeakPolarHBondContact O-CG 3.45Å; Y57-L61 PolarHBondContact O-N 2.74Å; Y57-L61 VanDerWaalsContact O-N 3.12Å; L58-L61 PolarHBondContact O-N 3.18Å; A59-L61 VanDerWaalsContact C-N 3.29Å; A59-L61 PolarHBondContact O-N 2.93Å
62	D	56.5	Low	79.9	Confident	73 Å²	73	74.5 Å²	74.5	39%	0.39	41%	0.409	S	S	.	.	S	Bend	trans	-98.9	0.3	-179.2	-141.8	27.7	0	0	0	112.4	L58 A59 S60 D64 I65 R255	L58-D62 PolarHBondContact O-N 3.37Å; A59-D62 PolarHBondContact O-N 2.73Å; S60-D62 VanDerWaalsContact C-N 3.32Å; D62-D64 PolarHBondContact O-N 3.39Å; D62-D64 VanDerWaalsContact O-N 3.1Å; D62-I65 PolarHBondContact O-N 3.23Å; D62-R255 IonicContact OD1-CZ 2.72Å; D62-R255 IonicContact OD1-NH1 3.7Å; D62-R255 PolarHBondContact OD1-NH1 3.46Å; D62-R255 VanDerWaalsContact OD1-NH1 3.14Å; D62-R255 IonicContact OD1-NH2 3.66Å; D62-R255 PolarHBondContact OD1-NH2 2.87Å
63	S	57.1	Low	80.2	Confident	90 Å²	90	81.8 Å²	81.8	63%	0.629	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.2	-174.4	64.8	0	0	0	0	114.5	A59 S60	A59-S63 PolarHBondContact O-N 2.99Å; S60-S63 PolarHBondContact O-OG 2.74Å; S60-S63 VanDerWaalsContact O-OG 3.08Å
64	D	75.1	Confident	80.7	Confident	103 Å²	103	81.8 Å²	81.8	55%	0.551	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-12.9	176.4	-78.4	-9.8	0	0	0	112.9	D62 N264	D62-D64 PolarHBondContact O-N 3.39Å; D62-D64 VanDerWaalsContact O-N 3.1Å; D64-N264 VanDerWaalsContact O-CB 3.22Å; D64-N264 WeakPolarHBondContact O-CB 3.2Å; D64-N264 PolarHBondContact O-ND2 3.33Å
65	I	81.5	Confident	81.4	Confident	26 Å²	26	84.6 Å²	84.6	13%	0.133	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119.8	-178.5	-56.6	-49.6	0	0	0	110	D62 V257 N264 T266	D62-I65 PolarHBondContact O-N 3.23Å; I65-V257 HydrophobicContact CD1-CG1 4.12Å; I65-N264 HydrophobicContact CD1-CB 3.88Å; I65-T266 HydrophobicContact CB-CG2 4.47Å; I65-T266 HydrophobicContact CD1-CG2 3.51Å; I65-T266 HydrophobicContact CG1-CG2 3.96Å; I65-T266 HydrophobicContact CG2-CG2 3.69Å
66	T	85.8	Confident	82.1	Confident	91 Å²	91	76.6 Å²	76.6	56%	0.558	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	-32.4	-178.5	-50.9	0	0	0	0	111.9	G263 N264	T66-G263 WeakPolarHBondContact OG1-CA 3.1Å; T66-N264 PolarHBondContact N-O 3.05Å; T66-N264 PolarHBondContact OG1-N 3.15Å
67	E	94	Very high	83.1	Confident	76 Å²	76	75 Å²	75	36%	0.355	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	145.9	-175.4	-169	-179.6	174.8	0	0	111.8	L69 N264 R265 T266	E67-L69 HydrophobicContact CG-CD2 4.28Å; E67-N264 PolarHBondContact N-O 3.06Å; E67-R265 HydrophobicContact CB-CG 4.13Å; E67-R265 CarbonylContact O-C 3.56Å; E67-R265 VanDerWaalsContact O-CA 3.3Å; E67-R265 WeakPolarHBondContact O-CA 3.45Å; E67-R265 IonicContact OE2-CZ 3.83Å; E67-R265 IonicContact OE2-NE 3.96Å; E67-R265 PolarHBondContact OE2-NE 3.32Å; E67-R265 IonicContact OE2-NH2 2.72Å; E67-T266 PolarHBondContact O-N 3.39Å
68	T	96.6	Very high	84.1	Confident	58 Å²	58	73.1 Å²	73.1	36%	0.356	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	107.9	166	-58.8	0	0	0	0	108.4	T266 E268	T68-T266 CarbonylContact C-O 3.5Å; T68-T266 PolarHBondContact OG1-OG1 2.66Å; T68-E268 HydrophobicContact CG2-CG 4Å
69	L	97.5	Very high	85.5	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.01	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	-37.7	-179.7	-59.9	-178	0	0	0	111.9	E67 R81 Y83 F258 R265 T266 V267	E67-L69 HydrophobicContact CG-CD2 4.28Å; L69-R81 PolarHBondContact O-NH1 3.36Å; L69-Y83 HydrophobicContact CB-CE2 3.84Å; L69-Y83 HydrophobicContact CD1-CD2 4.32Å; L69-Y83 HydrophobicContact CD1-CE2 4.43Å; L69-Y83 HydrophobicContact CD2-CD1 3.92Å; L69-Y83 HydrophobicContact CD2-CD2 4.42Å; L69-Y83 HydrophobicContact CD2-CE1 3.61Å; L69-Y83 HydrophobicContact CD2-CE2 4.15Å; L69-Y83 HydrophobicContact CD2-CG 4.3Å; L69-Y83 HydrophobicContact CG-CE2 4.35Å; L69-Y83 PolarHBondContact O-OH 2.73Å; L69-F258 HydrophobicContact CD1-CD2 4.03Å; L69-F258 HydrophobicContact CD1-CE2 4.31Å; L69-R265 HydrophobicContact CD1-CB 3.98Å; L69-R265 HydrophobicContact CD2-CB 4.08Å; L69-R265 HydrophobicContact CD2-CG 4.4Å; L69-R265 HydrophobicContact CG-CB 3.87Å; L69-T266 WeakPolarHBondContact CB-O 3.08Å; L69-T266 PolarHBondContact N-O 2.88Å; L69-V267 HydrophobicContact CB-CG2 4.3Å; L69-V267 HydrophobicContact CD1-CG2 4.48Å
70	A	98	Very high	87.2	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	108.8	179.9	0	0	0	0	0	110.4	E74 I76 V109 V267 E268 R273	A70-E74 WeakPolarHBondContact CA-OE1 3.4Å; A70-I76 HydrophobicContact CB-CD1 3.64Å; A70-V109 HydrophobicContact CB-CB 4.11Å; A70-V109 HydrophobicContact CB-CG1 3.76Å; A70-V109 HydrophobicContact CB-CG2 3.99Å; A70-V267 HydrophobicContact CB-CG1 4.24Å; A70-E268 WeakPolarHBondContact O-CB 2.98Å; A70-E268 PolarHBondContact O-N 3.46Å; A70-R273 PolarHBondContact O-NH1 2.8Å
71	S	97.9	Very high	88.9	Confident	31 Å²	31	73.6 Å²	73.6	22%	0.217	38%	0.381	C	S	.	.			trans	-78.3	148.6	174	177.3	0	0	0	0	111.1	R73 E74 E268 R273	S71-R73 PolarHBondContact O-N 2.97Å; S71-R73 PolarHBondContact OG-N 3.14Å; S71-E74 PolarHBondContact N-OE1 2.86Å; S71-E74 WeakPolarHBondContact O-CG 3.35Å; S71-E74 PolarHBondContact O-N 2.89Å; S71-E268 WeakPolarHBondContact CA-OE2 3.32Å; S71-E268 WeakPolarHBondContact CB-OE2 3.2Å; S71-E268 PolarHBondContact OG-OE2 2.88Å; S71-R273 VanDerWaalsContact C-NH1 3.3Å; S71-R273 PolarHBondContact O-NH1 3.27Å; S71-R273 PolarHBondContact O-NH2 3.48Å; S71-R273 VanDerWaalsContact O-NH2 3.16Å
72	R	97.1	Very high	90.9	Very high	74 Å²	74	71.9 Å²	71.9	28%	0.279	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-29.8	174.7	-168.4	-86.8	-89	-157.4	-2.3	111.3	Y247 E268 P269 R270	R72-Y247 PolarHBondContact NE-O 2.68Å; R72-Y247 PolarHBondContact NH2-O 2.9Å; R72-E268 HydrophobicContact CB-CB 4.04Å; R72-E268 PolarHBondContact N-OE2 3.5Å; R72-P269 VanDerWaalsContact CG-O 3.3Å; R72-P269 WeakPolarHBondContact CG-O 3.32Å; R72-R270 HydrophobicContact CG-CB 4.04Å; R72-R270 HydrophobicContact CG-CG 4.41Å; R72-R270 PolarHBondContact O-NH1 2.83Å; R72-R270 VanDerWaalsContact O-NH1 3.1Å
73	R	96.4	Very high	92.8	Very high	233 Å²	233	71.2 Å²	71.2	88%	0.879	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-22.7	-175.8	-64.6	-177.1	-178.4	174.3	2.1	113.9	S71	S71-R73 PolarHBondContact O-N 2.97Å; S71-R73 PolarHBondContact OG-N 3.14Å
74	E	96.3	Very high	94.8	Very high	55 Å²	55	72.1 Å²	72.1	26%	0.257	37%	0.373	S	S	.	.	S	Bend	trans	-89.3	159.4	176.4	58	175.3	155.6	0	0	112.1	A70 S71 I76 R81 R270 R273	A70-E74 WeakPolarHBondContact CA-OE1 3.4Å; S71-E74 PolarHBondContact N-OE1 2.86Å; S71-E74 WeakPolarHBondContact O-CG 3.35Å; S71-E74 PolarHBondContact O-N 2.89Å; E74-I76 HydrophobicContact CG-CG1 4.36Å; E74-R81 VanDerWaalsContact CD-NH1 3.25Å; E74-R81 IonicContact OE1-CZ 3.67Å; E74-R81 IonicContact OE1-NH1 2.72Å; E74-R81 PolarHBondContact OE1-NH1 3.22Å; E74-R81 IonicContact OE2-CZ 3.99Å; E74-R81 VanDerWaalsContact OE2-CZ 3.23Å; E74-R81 IonicContact OE2-NH1 3.62Å; E74-R81 PolarHBondContact OE2-NH1 3.39Å; E74-R81 IonicContact OE2-NH2 2.96Å; E74-R81 PolarHBondContact OE2-NH2 3.33Å; E74-R270 PolarHBondContact O-NH1 2.85Å; E74-R273 PolarHBondContact O-NH2 2.85Å
75	M	97.3	Very high	95.8	Very high	110 Å²	110	69 Å²	69	54%	0.542	36%	0.358	S	S	.	.			trans	-115.8	119.8	173.4	-173.7	72.6	98.2	0	0	108.6	D111	M75-D111 WeakPolarHBondContact CA-OD2 3.48Å; M75-D111 HydrophobicContact CG-CB 4.43Å; M75-D111 HydrophobicContact SD-CB 3.51Å; M75-D111 VanDerWaalsContact SD-CB 3.51Å
76	I	98.3	Very high	96.5	Very high	8 Å²	8	76 Å²	76	4%	0.041	39%	0.39	C	S	.	.			trans	-105.7	84.8	-177	-54.3	176.7	0	0	0	108.8	A70 E74 R81 V109 D111	A70-I76 HydrophobicContact CB-CD1 3.64Å; E74-I76 HydrophobicContact CG-CG1 4.36Å; I76-R81 HydrophobicContact CG2-CB 3.72Å; I76-V109 HydrophobicContact CD1-CB 4.14Å; I76-V109 HydrophobicContact CD1-CG1 3.95Å; I76-V109 VanDerWaalsContact CG2-O 3.31Å; I76-V109 WeakPolarHBondContact CG2-O 3.21Å; I76-D111 PolarHBondContact N-OD2 2.95Å; I76-D111 PolarHBondContact O-N 3.02Å
77	S	96.8	Very high	97.1	Very high	63 Å²	63	73.9 Å²	73.9	44%	0.441	38%	0.378	S	S	.	.			trans	-155.5	153.3	-178.4	64.1	0	0	0	0	109.8
78	P	94.6	Very high	97.2	Very high	114 Å²	114	71.2 Å²	71.2	74%	0.74	37%	0.368	S	S	*	.	S	Bend	cis	-83	-22.1	6	31.4	-34.5	0	0	0	114.4
79	Q	95.9	Very high	97.1	Very high	125 Å²	125	75.5 Å²	75.5	58%	0.584	38%	0.384	S	S	*	.	S	Bend	trans	-95.3	147.2	-176.1	-66.2	-61.4	-27.7	0	0	112
80	P	98.4	Very high	96.9	Very high	24 Å²	24	76.4 Å²	76.4	16%	0.156	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-60.6	142.8	172.6	-21.1	33.1	0	0	0	112.1	V82 A108 V109 T110 V188 F276	P80-V82 HydrophobicContact CB-CG2 4.4Å; P80-A108 HydrophobicContact CB-CB 4.36Å; P80-V109 WeakPolarHBondContact CA-O 3.37Å; P80-T110 HydrophobicContact CG-CG2 4.48Å; P80-V188 HydrophobicContact CG-CG2 3.62Å; P80-F276 HydrophobicContact CB-CE1 4.4Å; P80-F276 HydrophobicContact CB-CZ 4.16Å; P80-F276 HydrophobicContact CG-CZ 4.28Å
81	R	98.6	Very high	96.7	Very high	84 Å²	84	76.9 Å²	76.9	32%	0.317	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	121.5	164.7	-174.7	179.4	-61.5	155.5	-0	108.4	L69 E74 I76 Y83 A108 V109	L69-R81 PolarHBondContact O-NH1 3.36Å; E74-R81 VanDerWaalsContact CD-NH1 3.25Å; E74-R81 IonicContact OE1-CZ 3.67Å; E74-R81 IonicContact OE1-NH1 2.72Å; E74-R81 PolarHBondContact OE1-NH1 3.22Å; E74-R81 IonicContact OE2-CZ 3.99Å; E74-R81 VanDerWaalsContact OE2-CZ 3.23Å; E74-R81 IonicContact OE2-NH1 3.62Å; E74-R81 PolarHBondContact OE2-NH1 3.39Å; E74-R81 IonicContact OE2-NH2 2.96Å; E74-R81 PolarHBondContact OE2-NH2 3.33Å; I76-R81 HydrophobicContact CG2-CB 3.72Å; R81-Y83 WeakPolarHBondContact CD-OH 3.45Å; R81-Y83 HydrophobicContact CG-CE2 3.75Å; R81-A108 WeakPolarHBondContact O-CA 3.34Å; R81-V109 PolarHBondContact N-O 2.98Å; R81-V109 PolarHBondContact O-N 2.88Å
82	V	98.6	Very high	96.4	Very high	70 Å²	70	81.5 Å²	81.5	42%	0.424	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	136	-173.7	-173.7	0	0	0	0	110.7	P80 R107 A108 T192	P80-V82 HydrophobicContact CB-CG2 4.4Å; V82-R107 CarbonylContact C-O 3.59Å; V82-R107 WeakPolarHBondContact CA-O 3.45Å; V82-A108 HydrophobicContact CG2-CB 4.21Å; V82-T192 HydrophobicContact CG1-CG2 4.41Å; V82-T192 HydrophobicContact CG2-CG2 3.62Å
83	Y	98	Very high	95.9	Very high	58 Å²	58	83.7 Å²	83.7	23%	0.227	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	101.5	174.4	-60.1	-89.1	0	0	0	108.2	L69 R81 G106 R107	L69-Y83 HydrophobicContact CB-CE2 3.84Å; L69-Y83 HydrophobicContact CD1-CD2 4.32Å; L69-Y83 HydrophobicContact CD1-CE2 4.43Å; L69-Y83 HydrophobicContact CD2-CD1 3.92Å; L69-Y83 HydrophobicContact CD2-CD2 4.42Å; L69-Y83 HydrophobicContact CD2-CE1 3.61Å; L69-Y83 HydrophobicContact CD2-CE2 4.15Å; L69-Y83 HydrophobicContact CD2-CG 4.3Å; L69-Y83 HydrophobicContact CG-CE2 4.35Å; L69-Y83 PolarHBondContact O-OH 2.73Å; R81-Y83 WeakPolarHBondContact CD-OH 3.45Å; R81-Y83 HydrophobicContact CG-CE2 3.75Å; Y83-G106 CarbonylContact O-C 3.58Å; Y83-G106 WeakPolarHBondContact O-CA 3.39Å; Y83-R107 PolarHBondContact N-O 3.27Å; Y83-R107 PolarHBondContact O-N 2.94Å
84	S	97.6	Very high	95.4	Very high	110 Å²	110	78.2 Å²	78.2	77%	0.769	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.5	178.9	-55.1	0	0	0	0	111
85	V	96.8	Very high	95.3	Very high	37 Å²	37	82.9 Å²	82.9	22%	0.224	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	159.3	171.5	-61.3	0	0	0	0	109.4	C105 E282	V85-C105 HydrophobicContact CG2-CB 4.1Å; V85-C105 PolarHBondContact N-O 3.22Å; V85-C105 CarbonylContact O-C 3.59Å; V85-E282 HydrophobicContact CG2-CB 3.94Å; V85-E282 HydrophobicContact CG2-CG 3.54Å
86	Q	96.9	Very high	95.2	Very high	173 Å²	173	83.2 Å²	83.2	81%	0.808	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-68	134.4	172.9	-65.3	-59	-32.9	0	0	109.2	E282	Q86-E282 WeakPolarHBondContact O-CB 3.21Å
87	C	97.2	Very high	95.1	Very high	46 Å²	46	84.8 Å²	84.8	31%	0.311	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-64	138.7	174	-69.6	0	0	0	0	110.2	Y91 C105	C87-Y91 HydrophobicContact CB-CD2 4.23Å; C87-Y91 HydrophobicContact CB-CE2 4.34Å; C87-C105 WeakPolarHBondContact CA-SG 3.45Å; C87-C105 HydrophobicContact CB-CB 3.89Å; C87-C105 WeakPolarHBondContact CB-SG 3.15Å; C87-C105 WeakPolarHBondContact SG-CB 3.29Å; C87-C105 PolarHBondContact SG-N 2.84Å; C87-C105 CovalentContact SG-SG 2.03Å; C87-C105 PolarHBondContact SG-SG 2.88Å
88	S	96.2	Very high	95.1	Very high	21 Å²	21	87.3 Å²	87.3	15%	0.147	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-70.2	163.4	171.4	59.1	0	0	0	0	112.2	D90 Y91 S281 E282	S88-D90 PolarHBondContact O-N 3.2Å; S88-D90 WeakPolarHBondContact OG-CB 3.41Å; S88-D90 PolarHBondContact OG-OD2 3.49Å; S88-Y91 WeakPolarHBondContact O-CD2 3.26Å; S88-S281 PolarHBondContact OG-N 3.01Å; S88-E282 WeakPolarHBondContact CB-OE2 3.25Å; S88-E282 PolarHBondContact N-OE2 2.83Å; S88-E282 VanDerWaalsContact N-OE2 3.07Å; S88-E282 PolarHBondContact OG-OE2 2.92Å
89	E	95	Very high	95.1	Very high	148 Å²	148	84 Å²	84	69%	0.692	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-8.4	173.9	-64.1	179.8	176.9	0	0	112.7	Y91 E92 N93	E89-Y91 PolarHBondContact O-N 2.9Å; E89-E92 WeakPolarHBondContact O-CB 3.48Å; E89-E92 WeakPolarHBondContact O-CG 3.27Å; E89-E92 PolarHBondContact O-N 2.88Å; E89-N93 PolarHBondContact O-ND2 3.13Å
90	D	93.6	Very high	95.2	Very high	21 Å²	21	78.1 Å²	78.1	11%	0.112	40%	0.401	C	S	.	.	H	α-helix	trans	-52.9	-43	179.4	-63.8	-19	0	0	0	111.3	S88 E92 N93 Y94 K230 G280 S281	S88-D90 PolarHBondContact O-N 3.2Å; S88-D90 WeakPolarHBondContact OG-CB 3.41Å; S88-D90 PolarHBondContact OG-OD2 3.49Å; D90-E92 PolarHBondContact O-N 2.88Å; D90-E92 VanDerWaalsContact O-N 3.14Å; D90-N93 PolarHBondContact O-N 3.06Å; D90-N93 VanDerWaalsContact O-N 3.08Å; D90-Y94 WeakPolarHBondContact O-CD2 2.89Å; D90-Y94 WeakPolarHBondContact O-CE2 3.4Å; D90-K230 HydrophobicContact CB-CG 4.44Å; D90-G280 WeakPolarHBondContact OD2-CA 3.49Å; D90-S281 PolarHBondContact OD1-OG 2.89Å; D90-S281 VanDerWaalsContact OD2-CB 3.3Å; D90-S281 WeakPolarHBondContact OD2-CB 3.27Å; D90-S281 PolarHBondContact OD2-N 3.33Å; D90-S281 PolarHBondContact OD2-OG 3.42Å
91	Y	93.6	Very high	95.2	Very high	9 Å²	9	77.6 Å²	77.6	4%	0.035	40%	0.397	C	S	.	.	H	α-helix	trans	-73.1	-2.7	-178.4	-47.4	-68.2	0	0	0	114.2	C87 S88 E89 R96 P102 S278 S279 G280 E282	C87-Y91 HydrophobicContact CB-CD2 4.23Å; C87-Y91 HydrophobicContact CB-CE2 4.34Å; S88-Y91 WeakPolarHBondContact O-CD2 3.26Å; E89-Y91 PolarHBondContact O-N 2.9Å; Y91-R96 PolarHBondContact O-NE 2.92Å; Y91-R96 VanDerWaalsContact O-NE 3.07Å; Y91-P102 HydrophobicContact CD1-CB 4.14Å; Y91-P102 HydrophobicContact CD1-CG 3.87Å; Y91-P102 HydrophobicContact CD2-CB 4.08Å; Y91-P102 HydrophobicContact CE1-CB 3.89Å; Y91-P102 HydrophobicContact CE1-CG 3.41Å; Y91-P102 VanDerWaalsContact CE1-CG 3.41Å; Y91-P102 HydrophobicContact CE2-CB 3.81Å; Y91-P102 HydrophobicContact CE2-CG 4.24Å; Y91-P102 HydrophobicContact CG-CB 4.22Å; Y91-P102 HydrophobicContact CG-CG 4.45Å; Y91-S278 WeakPolarHBondContact OH-CB 3.41Å; Y91-S279 PolarHBondContact OH-N 3.39Å; Y91-G280 WeakPolarHBondContact OH-CA 3.43Å; Y91-G280 PolarHBondContact OH-N 3.32Å; Y91-E282 WeakPolarHBondContact CE2-OE1 3.29Å; Y91-E282 PolarHBondContact OH-OE1 3.33Å
92	E	90.6	Very high	95.1	Very high	128 Å²	128	73.6 Å²	73.6	60%	0.598	38%	0.382	S	S	*	.	H	α-helix	trans	-92.1	-26.6	170.8	-39.6	-143.5	120	0	0	111.8	E89 D90 Y94 R96	E89-E92 WeakPolarHBondContact O-CB 3.48Å; E89-E92 WeakPolarHBondContact O-CG 3.27Å; E89-E92 PolarHBondContact O-N 2.88Å; D90-E92 PolarHBondContact O-N 2.88Å; D90-E92 VanDerWaalsContact O-N 3.14Å; E92-Y94 VanDerWaalsContact C-N 3.32Å; E92-Y94 PolarHBondContact O-N 3.14Å; E92-R96 IonicContact OE1-NH2 3.79Å; E92-R96 PolarHBondContact OE1-NH2 2.8Å
93	N	88.1	Confident	94.9	Very high	120 Å²	120	76.6 Å²	76.6	64%	0.642	39%	0.391	S	S	*	.	H	α-helix	trans	-81.8	-10.9	-176.5	-64.4	-41.9	0	0	0	113.6	E89 D90	E89-N93 PolarHBondContact O-ND2 3.13Å; D90-N93 PolarHBondContact O-N 3.06Å; D90-N93 VanDerWaalsContact O-N 3.08Å
94	Y	85.7	Confident	94.8	Very high	119 Å²	119	80.8 Å²	80.8	47%	0.467	41%	0.411	S	S	.	.	S	Bend	trans	-119.8	164.4	-179.8	-54.4	-76.2	0	0	0	112.2	D90 E92 R96 K230	D90-Y94 WeakPolarHBondContact O-CD2 2.89Å; D90-Y94 WeakPolarHBondContact O-CE2 3.4Å; E92-Y94 VanDerWaalsContact C-N 3.32Å; E92-Y94 PolarHBondContact O-N 3.14Å; Y94-R96 PolarHBondContact O-N 2.85Å; Y94-K230 HydrophobicContact CE2-CG 4.35Å
95	K	93.1	Very high	94.8	Very high	153 Å²	153	75.9 Å²	75.9	67%	0.665	38%	0.376	S	S	*	.			trans	-58.1	126.7	174.1	-179.8	174.4	170.8	-169.1	0	110.1	Y97	K95-Y97 HydrophobicContact CB-CE2 4.18Å; K95-Y97 HydrophobicContact CD-CE1 4.41Å; K95-Y97 HydrophobicContact CD-CE2 4.36Å; K95-Y97 HydrophobicContact CG-CE2 4.06Å; K95-Y97 VanDerWaalsContact O-CD2 3.3Å; K95-Y97 WeakPolarHBondContact O-CD2 3.41Å; K95-Y97 VanDerWaalsContact O-CE2 3.29Å; K95-Y97 WeakPolarHBondContact O-CE2 3.44Å
96	R	95.1	Very high	94.9	Very high	117 Å²	117	74.1 Å²	74.1	44%	0.442	37%	0.366	S	S	.	.			trans	-84.6	140.9	175	-61	-169.5	175.6	170.5	1.2	111.1	Y91 E92 Y94 T101	Y91-R96 PolarHBondContact O-NE 2.92Å; Y91-R96 VanDerWaalsContact O-NE 3.07Å; E92-R96 IonicContact OE1-NH2 3.79Å; E92-R96 PolarHBondContact OE1-NH2 2.8Å; Y94-R96 PolarHBondContact O-N 2.85Å; R96-T101 HydrophobicContact CB-CG2 4.43Å; R96-T101 HydrophobicContact CG-CG2 4.21Å
97	Y	96.8	Very high	95	Very high	41 Å²	41	66.1 Å²	66.1	16%	0.161	33%	0.328	C	S	.	.			trans	-117.8	101.7	177.7	-66.2	-89.7	0	0	0	107.9	K95 G99 C100 T101 C304 D305	K95-Y97 HydrophobicContact CB-CE2 4.18Å; K95-Y97 HydrophobicContact CD-CE1 4.41Å; K95-Y97 HydrophobicContact CD-CE2 4.36Å; K95-Y97 HydrophobicContact CG-CE2 4.06Å; K95-Y97 VanDerWaalsContact O-CD2 3.3Å; K95-Y97 WeakPolarHBondContact O-CD2 3.41Å; K95-Y97 VanDerWaalsContact O-CE2 3.29Å; K95-Y97 WeakPolarHBondContact O-CE2 3.44Å; Y97-G99 PolarHBondContact O-N 2.9Å; Y97-C100 PolarHBondContact O-N 3.41Å; Y97-C100 VanDerWaalsContact O-N 3.09Å; Y97-T101 PolarHBondContact N-OG1 3.12Å; Y97-T101 PolarHBondContact O-N 3.44Å; Y97-T101 PolarHBondContact O-OG1 2.89Å; Y97-C304 VanDerWaalsContact CD1-O 3.27Å; Y97-C304 WeakPolarHBondContact CD1-O 3.28Å; Y97-C304 HydrophobicContact CD2-CB 4.01Å; Y97-C304 HydrophobicContact CG-CB 4.1Å; Y97-C304 VanDerWaalsContact CG-O 3.23Å; Y97-D305 HydrophobicContact CE1-CB 4.38Å; Y97-D305 HydrophobicContact CE2-CB 3.74Å; Y97-D305 WeakPolarHBondContact OH-CB 3.46Å; Y97-D305 PolarHBondContact OH-OD1 3.02Å; Y97-D305 PolarHBondContact OH-OD2 3.18Å
98	P	96.4	Very high	95.1	Very high	116 Å²	116	64 Å²	64	75%	0.753	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	135	-179.8	-27	35.1	0	0	0	111.7	C100 L199	P98-C100 VanDerWaalsContact C-N 3.31Å; P98-C100 PolarHBondContact O-N 3.29Å; P98-L199 VanDerWaalsContact O-CD1 3.27Å; P98-L199 WeakPolarHBondContact O-CD1 3.42Å
99	G	95.9	Very high	95.2	Very high	44 Å²	44	63 Å²	63	45%	0.454	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	-7.9	-178.5	0	0	0	0	0	115.4	Y97 L195 D196	Y97-G99 PolarHBondContact O-N 2.9Å; G99-L195 WeakPolarHBondContact O-CA 3.47Å; G99-D196 PolarHBondContact O-N 2.92Å
100	C	97.9	Very high	95.4	Very high	1 Å²	1	56 Å²	56	1%	0.007	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-45.7	176.3	-178.2	0	0	0	0	114	Y97 P98 L199 Y238 C304	Y97-C100 PolarHBondContact O-N 3.41Å; Y97-C100 VanDerWaalsContact O-N 3.09Å; P98-C100 VanDerWaalsContact C-N 3.31Å; P98-C100 PolarHBondContact O-N 3.29Å; C100-L199 HydrophobicContact CB-CB 4.11Å; C100-L199 PolarHBondContact SG-O 2.85Å; C100-L199 VanDerWaalsContact SG-O 3.4Å; C100-Y238 WeakPolarHBondContact O-CE2 3.38Å; C100-Y238 PolarHBondContact O-OH 3.08Å; C100-C304 HydrophobicContact CB-CB 3.58Å; C100-C304 WeakPolarHBondContact CB-SG 3.38Å; C100-C304 PolarHBondContact O-SG 2.97Å; C100-C304 WeakPolarHBondContact SG-CA 3.37Å; C100-C304 WeakPolarHBondContact SG-CB 3.47Å; C100-C304 CovalentContact SG-SG 2.04Å; C100-C304 PolarHBondContact SG-SG 3.43Å
101	T	97.5	Very high	95.6	Very high	13 Å²	13	56 Å²	56	8%	0.08	27%	0.274	C	S	.	.	S	Bend	trans	-54.5	130.6	-175	-66.2	0	0	0	0	110.7	R96 Y97 Q103 C304	R96-T101 HydrophobicContact CB-CG2 4.43Å; R96-T101 HydrophobicContact CG-CG2 4.21Å; Y97-T101 PolarHBondContact N-OG1 3.12Å; Y97-T101 PolarHBondContact O-N 3.44Å; Y97-T101 PolarHBondContact O-OG1 2.89Å; T101-Q103 PolarHBondContact O-N 2.72Å; T101-C304 PolarHBondContact N-SG 3.36Å; T101-C304 VanDerWaalsContact N-SG 3.4Å
102	P	96.9	Very high	95.8	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.006	30%	0.297	C	S	.	.			trans	-49.8	122.1	-176.8	-31.6	36.9	0	0	0	113.3	Y91 D237 Y238	Y91-P102 HydrophobicContact CD1-CB 4.14Å; Y91-P102 HydrophobicContact CD1-CG 3.87Å; Y91-P102 HydrophobicContact CD2-CB 4.08Å; Y91-P102 HydrophobicContact CE1-CB 3.89Å; Y91-P102 HydrophobicContact CE1-CG 3.41Å; Y91-P102 VanDerWaalsContact CE1-CG 3.41Å; Y91-P102 HydrophobicContact CE2-CB 3.81Å; Y91-P102 HydrophobicContact CE2-CG 4.24Å; Y91-P102 HydrophobicContact CG-CB 4.22Å; Y91-P102 HydrophobicContact CG-CG 4.45Å; P102-D237 HydrophobicContact CG-CB 4.44Å; P102-Y238 WeakPolarHBondContact CA-OH 3.17Å; P102-Y238 HydrophobicContact CG-CE1 4Å; P102-Y238 HydrophobicContact CG-CE2 4.08Å; P102-Y238 WeakPolarHBondContact CG-OH 3.48Å
103	Q	94.4	Very high	96.1	Very high	132 Å²	132	52.6 Å²	52.6	62%	0.617	27%	0.273	S	S	*	.	S	Bend	trans	-121.1	-18.8	169.2	-62.1	-61.4	-63.9	0	0	111.5	T101	T101-Q103 PolarHBondContact O-N 2.72Å
104	K	96.2	Very high	96.6	Very high	147 Å²	147	47.2 Å²	47.2	64%	0.639	24%	0.244	S	C	*	.	S	Bend	trans	-125.3	103.2	172.6	-66.9	177.4	-177.1	173.7	0	106.8	F193	K104-F193 VanDerWaalsContact O-CD1 3.23Å; K104-F193 WeakPolarHBondContact O-CD1 3.4Å
105	C	98.1	Very high	97.2	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.041	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	150.8	-177.3	-62.5	0	0	0	0	110.7	V85 C87 S278 E282	V85-C105 HydrophobicContact CG2-CB 4.1Å; V85-C105 PolarHBondContact N-O 3.22Å; V85-C105 CarbonylContact O-C 3.59Å; C87-C105 WeakPolarHBondContact CA-SG 3.45Å; C87-C105 HydrophobicContact CB-CB 3.89Å; C87-C105 WeakPolarHBondContact CB-SG 3.15Å; C87-C105 WeakPolarHBondContact SG-CB 3.29Å; C87-C105 PolarHBondContact SG-N 2.84Å; C87-C105 CovalentContact SG-SG 2.03Å; C87-C105 PolarHBondContact SG-SG 2.88Å; C105-S278 VanDerWaalsContact CB-OG 3.26Å; C105-S278 WeakPolarHBondContact CB-OG 3.38Å; C105-E282 HydrophobicContact CB-CG 4.05Å; C105-E282 PolarHBondContact SG-OE1 3.39Å
106	G	98.1	Very high	97.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.5	175.6	-171.7	0	0	0	0	0	113.3	Y83 F277 S278	Y83-G106 CarbonylContact O-C 3.58Å; Y83-G106 WeakPolarHBondContact O-CA 3.39Å; G106-F277 VanDerWaalsContact O-CA 3.22Å; G106-F277 WeakPolarHBondContact O-CA 3.43Å; G106-F277 WeakPolarHBondContact O-CB 3.34Å; G106-S278 PolarHBondContact N-OG 2.93Å; G106-S278 PolarHBondContact O-N 3.48Å
107	R	98.4	Very high	97.4	Very high	6 Å²	6	41.2 Å²	41.2	2%	0.023	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.4	171.9	-54.1	161.5	-171.8	171	3.2	107.3	V82 Y83 F258 D260 F276 F277 E282 N283	V82-R107 CarbonylContact C-O 3.59Å; V82-R107 WeakPolarHBondContact CA-O 3.45Å; Y83-R107 PolarHBondContact N-O 3.27Å; Y83-R107 PolarHBondContact O-N 2.94Å; R107-F258 HydrophobicContact CB-CE2 4.4Å; R107-F258 HydrophobicContact CB-CZ 4.17Å; R107-F258 HydrophobicContact CG-CD1 4.23Å; R107-F258 HydrophobicContact CG-CE1 3.8Å; R107-F258 HydrophobicContact CG-CE2 4.18Å; R107-F258 HydrophobicContact CG-CZ 3.77Å; R107-F258 VanDerWaalsContact NH1-CB 3.31Å; R107-D260 IonicContact CZ-OD1 2.85Å; R107-D260 IonicContact CZ-OD2 3.69Å; R107-D260 IonicContact NH1-OD1 3.76Å; R107-D260 PolarHBondContact NH1-OD1 3.07Å; R107-D260 IonicContact NH1-OD2 3.36Å; R107-D260 PolarHBondContact NH1-OD2 3Å; R107-D260 IonicContact NH2-OD1 3.96Å; R107-D260 PolarHBondContact NH2-OD1 2.77Å; R107-D260 IonicContact NH2-OD2 2.67Å; R107-F276 CarbonylContact C-O 3.48Å; R107-F277 HydrophobicContact CB-CB 4.43Å; R107-F277 HydrophobicContact CG-CB 4.17Å; R107-E282 PolarHBondContact NH2-O 3.17Å; R107-N283 WeakPolarHBondContact CG-OD1 3.31Å; R107-N283 PolarHBondContact NE-OD1 2.97Å; R107-N283 PolarHBondContact NH2-OD1 3.47Å
108	A	98.8	Very high	97.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	152.3	175.8	0	0	0	0	0	111.5	P80 R81 V82 T192 S275 F276	P80-A108 HydrophobicContact CB-CB 4.36Å; R81-A108 WeakPolarHBondContact O-CA 3.34Å; V82-A108 HydrophobicContact CG2-CB 4.21Å; A108-T192 HydrophobicContact CB-CG2 4.18Å; A108-S275 CarbonylContact O-C 3.52Å; A108-S275 WeakPolarHBondContact O-CA 3.22Å; A108-F276 HydrophobicContact CB-CD1 4.19Å; A108-F276 HydrophobicContact CB-CD2 3.97Å; A108-F276 HydrophobicContact CB-CE1 3.68Å; A108-F276 HydrophobicContact CB-CE2 3.45Å; A108-F276 VanDerWaalsContact CB-CE2 3.45Å; A108-F276 HydrophobicContact CB-CG 4.34Å; A108-F276 HydrophobicContact CB-CZ 3.29Å; A108-F276 PolarHBondContact N-O 2.74Å; A108-F276 PolarHBondContact O-N 3.26Å
109	V	98.9	Very high	97.6	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.7	177	-173	0	0	0	0	108.9	A70 I76 P80 R81 V267 R273 V274	A70-V109 HydrophobicContact CB-CB 4.11Å; A70-V109 HydrophobicContact CB-CG1 3.76Å; A70-V109 HydrophobicContact CB-CG2 3.99Å; I76-V109 HydrophobicContact CD1-CB 4.14Å; I76-V109 HydrophobicContact CD1-CG1 3.95Å; I76-V109 VanDerWaalsContact CG2-O 3.31Å; I76-V109 WeakPolarHBondContact CG2-O 3.21Å; P80-V109 WeakPolarHBondContact CA-O 3.37Å; R81-V109 PolarHBondContact N-O 2.98Å; R81-V109 PolarHBondContact O-N 2.88Å; V109-V267 HydrophobicContact CG2-CG1 4.27Å; V109-V267 HydrophobicContact CG2-CG2 3.86Å; V109-R273 VanDerWaalsContact CG1-CD 3.47Å; V109-R273 HydrophobicContact CG1-CG 3.61Å; V109-V274 WeakPolarHBondContact CA-O 3.07Å
110	T	98.8	Very high	97.8	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	144.1	175.8	-177.8	0	0	0	0	111.1	P80 G112 V113 V188 V274 F276	P80-T110 HydrophobicContact CG-CG2 4.48Å; T110-G112 PolarHBondContact OG1-N 3.23Å; T110-G112 VanDerWaalsContact OG1-N 3.13Å; T110-V113 HydrophobicContact CG2-CB 4.4Å; T110-V113 HydrophobicContact CG2-CG2 3.43Å; T110-V113 VanDerWaalsContact CG2-CG2 3.43Å; T110-V188 HydrophobicContact CG2-CG2 4.46Å; T110-V274 HydrophobicContact CG2-CB 4.12Å; T110-V274 PolarHBondContact N-O 2.85Å; T110-V274 PolarHBondContact O-N 2.84Å; T110-F276 HydrophobicContact CG2-CE1 4.05Å
111	D	98.7	Very high	97.8	Very high	19 Å²	19	39.8 Å²	39.8	10%	0.102	22%	0.216	C	C	.	.	S	Bend	trans	-107	4.1	172.2	-60.8	-39.8	0	0	0	111.4	M75 I76 R273	M75-D111 WeakPolarHBondContact CA-OD2 3.48Å; M75-D111 HydrophobicContact CG-CB 4.43Å; M75-D111 HydrophobicContact SD-CB 3.51Å; M75-D111 VanDerWaalsContact SD-CB 3.51Å; I76-D111 PolarHBondContact N-OD2 2.95Å; I76-D111 PolarHBondContact O-N 3.02Å; D111-R273 WeakPolarHBondContact OD1-CA 3.38Å; D111-R273 WeakPolarHBondContact OD1-CB 3.4Å; D111-R273 VanDerWaalsContact OD1-CG 3.29Å; D111-R273 WeakPolarHBondContact OD1-CG 3.38Å; D111-R273 IonicContact OD1-CZ 2.7Å; D111-R273 IonicContact OD1-NE 2.9Å; D111-R273 PolarHBondContact OD1-NE 3.46Å; D111-R273 IonicContact OD1-NH2 3.97Å; D111-R273 PolarHBondContact OD1-NH2 3.47Å; D111-R273 IonicContact OD2-CZ 3.3Å; D111-R273 IonicContact OD2-NE 3.39Å; D111-R273 IonicContact OD2-NH2 3.68Å; D111-R273 PolarHBondContact OD2-NH2 2.78Å
112	G	96.9	Very high	97.9	Very high	50 Å²	50	39.1 Å²	39.1	52%	0.515	21%	0.213	S	C	.	.	S	Bend	trans	-91.8	-2.4	-174.4	0	0	0	0	0	115.7	T110	T110-G112 PolarHBondContact OG1-N 3.23Å; T110-G112 VanDerWaalsContact OG1-N 3.13Å
113	V	97.3	Very high	98	Very high	17 Å²	17	41.7 Å²	41.7	10%	0.103	22%	0.222	C	C	.	.	S	Bend	trans	-95.5	-38	-169.4	177	0	0	0	0	112.7	T110 R184 I185 V188 V274	T110-V113 HydrophobicContact CG2-CB 4.4Å; T110-V113 HydrophobicContact CG2-CG2 3.43Å; T110-V113 VanDerWaalsContact CG2-CG2 3.43Å; V113-R184 HydrophobicContact CG1-CB 3.79Å; V113-R184 PolarHBondContact O-NH1 2.72Å; V113-I185 HydrophobicContact CG1-CG1 4.12Å; V113-V188 HydrophobicContact CG2-CB 4.12Å; V113-V188 HydrophobicContact CG2-CG1 3.9Å; V113-V188 HydrophobicContact CG2-CG2 4.17Å; V113-V274 HydrophobicContact CB-CG2 4.05Å; V113-V274 HydrophobicContact CG1-CG2 4.19Å
114	V	98.4	Very high	98.2	Very high	7 Å²	7	40.3 Å²	40.3	4%	0.042	21%	0.211	C	C	.	.	S	Bend	trans	-129.3	128.5	-173.3	-174.2	0	0	0	0	108.6	E118 A119 V181 L242 V274	V114-E118 HydrophobicContact CG1-CB 3.7Å; V114-A119 HydrophobicContact CG1-CB 4.35Å; V114-V181 HydrophobicContact CG1-CG2 4.32Å; V114-V181 HydrophobicContact CG2-CG1 3.73Å; V114-V181 HydrophobicContact CG2-CG2 4.4Å; V114-L242 HydrophobicContact CB-CD1 4.01Å; V114-L242 HydrophobicContact CG1-CD1 4.19Å; V114-L242 HydrophobicContact CG1-CD2 4.25Å; V114-L242 HydrophobicContact CG2-CD1 3.84Å; V114-L242 HydrophobicContact CG2-CD2 4.09Å; V114-V274 HydrophobicContact CG2-CG2 4.05Å
115	T	97.9	Very high	98.3	Very high	63 Å²	63	33.3 Å²	33.3	39%	0.387	18%	0.181	S	C	.	.			trans	-75.6	164.7	178.8	85.9	0	0	0	0	111.4	E117 E118 A119	T115-E117 VanDerWaalsContact CB-OE2 3.27Å; T115-E117 WeakPolarHBondContact CB-OE2 3.46Å; T115-E117 PolarHBondContact O-N 2.81Å; T115-E117 PolarHBondContact OG1-N 2.93Å; T115-E117 PolarHBondContact OG1-OE2 2.8Å; T115-E118 PolarHBondContact N-OE2 3.14Å; T115-E118 PolarHBondContact O-N 2.83Å; T115-E118 WeakPolarHBondContact OG1-CG 3.23Å; T115-E118 PolarHBondContact OG1-N 2.71Å; T115-A119 WeakPolarHBondContact O-CB 3.38Å; T115-A119 PolarHBondContact O-N 3.13Å
116	S	95.5	Very high	98.3	Very high	70 Å²	70	33 Å²	33	49%	0.49	18%	0.179	S	C	.	.	H	α-helix	trans	-62.2	-34.7	176.2	-61.6	0	0	0	0	112	Q120	S116-Q120 WeakPolarHBondContact O-CB 3.23Å; S116-Q120 PolarHBondContact O-N 2.81Å
117	E	98.3	Very high	98.3	Very high	129 Å²	129	36.2 Å²	36.2	60%	0.603	19%	0.194	S	C	*	.	H	α-helix	trans	-68.8	-42.5	178.4	-59.4	69.4	-149.2	0	0	111.5	T115 Q120 A121	T115-E117 VanDerWaalsContact CB-OE2 3.27Å; T115-E117 WeakPolarHBondContact CB-OE2 3.46Å; T115-E117 PolarHBondContact O-N 2.81Å; T115-E117 PolarHBondContact OG1-N 2.93Å; T115-E117 PolarHBondContact OG1-OE2 2.8Å; E117-Q120 PolarHBondContact O-N 2.83Å; E117-A121 WeakPolarHBondContact O-CB 3.47Å; E117-A121 PolarHBondContact O-N 3.02Å
118	E	98.8	Very high	98.2	Very high	40 Å²	40	39.9 Å²	39.9	19%	0.187	21%	0.208	C	C	.	.	H	α-helix	trans	-65.4	-44.3	176.4	-66.8	179.5	138	0	0	111.3	V114 T115 Q120 A121 L122 L177 R184	V114-E118 HydrophobicContact CG1-CB 3.7Å; T115-E118 PolarHBondContact N-OE2 3.14Å; T115-E118 PolarHBondContact O-N 2.83Å; T115-E118 WeakPolarHBondContact OG1-CG 3.23Å; T115-E118 PolarHBondContact OG1-N 2.71Å; E118-Q120 VanDerWaalsContact C-N 3.3Å; E118-Q120 PolarHBondContact O-N 2.8Å; E118-A121 PolarHBondContact O-N 3.49Å; E118-L122 WeakPolarHBondContact O-CG 3.31Å; E118-L122 PolarHBondContact O-N 2.76Å; E118-L177 HydrophobicContact CB-CD1 4.08Å; E118-L177 HydrophobicContact CG-CD1 3.87Å; E118-R184 VanDerWaalsContact CD-NH2 3.26Å; E118-R184 IonicContact OE1-CZ 2.74Å; E118-R184 IonicContact OE1-NH1 3.61Å; E118-R184 PolarHBondContact OE1-NH1 2.78Å; E118-R184 IonicContact OE1-NH2 3.22Å; E118-R184 PolarHBondContact OE1-NH2 3.01Å; E118-R184 IonicContact OE2-CZ 3.53Å; E118-R184 IonicContact OE2-NH1 3.34Å; E118-R184 PolarHBondContact OE2-NH1 3.32Å; E118-R184 IonicContact OE2-NH2 2.8Å; E118-R184 PolarHBondContact OE2-NH2 2.73Å
119	A	98.7	Very high	98.2	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-41.1	174.4	0	0	0	0	0	111.5	V114 T115 L122 R123 L244 A271	V114-A119 HydrophobicContact CG1-CB 4.35Å; T115-A119 WeakPolarHBondContact O-CB 3.38Å; T115-A119 PolarHBondContact O-N 3.13Å; A119-L122 PolarHBondContact O-N 3.34Å; A119-R123 WeakPolarHBondContact O-CB 3.43Å; A119-R123 PolarHBondContact O-N 3.37Å; A119-L244 HydrophobicContact CB-CD2 4.31Å; A119-A271 HydrophobicContact CB-CB 4.42Å
120	Q	98.6	Very high	98.1	Very high	111 Å²	111	39.9 Å²	39.9	52%	0.519	21%	0.208	S	C	.	.	H	α-helix	trans	-67.3	-38.1	176.5	-159.3	-165.4	23	0	0	112.1	S116 E117 E118 R123 R124	S116-Q120 WeakPolarHBondContact O-CB 3.23Å; S116-Q120 PolarHBondContact O-N 2.81Å; E117-Q120 PolarHBondContact O-N 2.83Å; E118-Q120 VanDerWaalsContact C-N 3.3Å; E118-Q120 PolarHBondContact O-N 2.8Å; Q120-R123 WeakPolarHBondContact O-CB 3.32Å; Q120-R123 PolarHBondContact O-N 2.95Å; Q120-R124 VanDerWaalsContact CG-NH1 3.31Å; Q120-R124 WeakPolarHBondContact O-CG 3.41Å; Q120-R124 PolarHBondContact O-N 3.14Å
121	A	98.8	Very high	97.9	Very high	20 Å²	20	43.8 Å²	43.8	17%	0.165	24%	0.24	C	C	.	.	H	α-helix	trans	-65	-45.2	175.6	0	0	0	0	0	111.8	E117 E118 R123 R124 L125 L177	E117-A121 WeakPolarHBondContact O-CB 3.47Å; E117-A121 PolarHBondContact O-N 3.02Å; E118-A121 PolarHBondContact O-N 3.49Å; A121-R123 VanDerWaalsContact C-N 3.32Å; A121-R123 PolarHBondContact O-N 2.96Å; A121-R124 PolarHBondContact O-N 3.42Å; A121-L125 PolarHBondContact O-N 2.88Å; A121-L177 HydrophobicContact CB-CD2 3.51Å
122	L	98.8	Very high	97.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-35.5	174.2	-72.5	170.8	0	0	0	112.5	E118 A119 L125 A126 L177 V181 F208 L242 L244 I298	E118-L122 WeakPolarHBondContact O-CG 3.31Å; E118-L122 PolarHBondContact O-N 2.76Å; A119-L122 PolarHBondContact O-N 3.34Å; L122-L125 HydrophobicContact CD2-CD1 4.25Å; L122-L125 WeakPolarHBondContact O-CB 3.41Å; L122-L125 PolarHBondContact O-N 2.98Å; L122-A126 PolarHBondContact O-N 3.01Å; L122-L177 HydrophobicContact CD2-CD2 4.24Å; L122-L177 HydrophobicContact CD2-CG 4.21Å; L122-L177 HydrophobicContact CG-CD2 3.97Å; L122-L177 HydrophobicContact CG-CG 4.22Å; L122-V181 HydrophobicContact CD1-CB 4.32Å; L122-V181 HydrophobicContact CD1-CG1 4.12Å; L122-V181 HydrophobicContact CD1-CG2 4.05Å; L122-F208 HydrophobicContact CB-CE1 4.44Å; L122-F208 HydrophobicContact CD2-CZ 4.31Å; L122-L242 HydrophobicContact CD1-CD2 3.72Å; L122-L244 HydrophobicContact CB-CD1 4.34Å; L122-L244 HydrophobicContact CB-CD2 3.9Å; L122-I298 HydrophobicContact CB-CD1 4.25Å; L122-I298 HydrophobicContact CD1-CD1 3.95Å; L122-I298 HydrophobicContact CD2-CD1 4.26Å; L122-I298 HydrophobicContact CG-CD1 4.39Å
123	R	98.8	Very high	97.6	Very high	55 Å²	55	43.2 Å²	43.2	21%	0.208	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-47.8	171.1	-174.2	-172.7	175.8	150	-6.6	111.3	A119 Q120 A121 L125 A126 E127 L244 D250 Y296	A119-R123 WeakPolarHBondContact O-CB 3.43Å; A119-R123 PolarHBondContact O-N 3.37Å; Q120-R123 WeakPolarHBondContact O-CB 3.32Å; Q120-R123 PolarHBondContact O-N 2.95Å; A121-R123 VanDerWaalsContact C-N 3.32Å; A121-R123 PolarHBondContact O-N 2.96Å; R123-L125 VanDerWaalsContact C-N 3.31Å; R123-L125 PolarHBondContact O-N 3.35Å; R123-A126 WeakPolarHBondContact O-CB 3.49Å; R123-A126 PolarHBondContact O-N 3.31Å; R123-A126 VanDerWaalsContact O-N 3.14Å; R123-E127 HydrophobicContact CG-CG 4.37Å; R123-E127 IonicContact CZ-OE1 3.22Å; R123-E127 IonicContact NE-OE1 3.64Å; R123-E127 PolarHBondContact NE-OE1 3.26Å; R123-E127 IonicContact NH2-OE1 2.74Å; R123-E127 WeakPolarHBondContact O-CG 3.44Å; R123-E127 PolarHBondContact O-N 3.25Å; R123-L244 HydrophobicContact CB-CB 4.13Å; R123-L244 WeakPolarHBondContact CD-O 3.23Å; R123-L244 HydrophobicContact CG-CB 4.5Å; R123-L244 PolarHBondContact NH1-O 2.92Å; R123-D250 IonicContact CZ-OD2 3.97Å; R123-D250 IonicContact NH1-OD1 2.75Å; R123-D250 IonicContact NH1-OD2 3.59Å; R123-D250 PolarHBondContact NH1-OD2 2.86Å; R123-Y296 HydrophobicContact CG-CD2 4.39Å; R123-Y296 HydrophobicContact CG-CG 4.45Å
124	R	98.6	Very high	97.3	Very high	102 Å²	102	43.4 Å²	43.4	39%	0.385	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-38.9	178.2	-72.8	-172.8	-63.8	-94.9	-0.9	112	Q120 A121 E127 R128	Q120-R124 VanDerWaalsContact CG-NH1 3.31Å; Q120-R124 WeakPolarHBondContact O-CG 3.41Å; Q120-R124 PolarHBondContact O-N 3.14Å; A121-R124 PolarHBondContact O-N 3.42Å; R124-E127 PolarHBondContact O-N 2.78Å; R124-R128 WeakPolarHBondContact O-CG 3.41Å; R124-R128 PolarHBondContact O-N 3.29Å; R124-R128 PolarHBondContact O-NH1 2.9Å
125	L	98.3	Very high	97.1	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-56.6	-52.4	171.8	-176.7	177.6	0	0	0	110.1	A121 L122 R123 E127 R128 G129 L144 F170 D174 F208	A121-L125 PolarHBondContact O-N 2.88Å; L122-L125 HydrophobicContact CD2-CD1 4.25Å; L122-L125 WeakPolarHBondContact O-CB 3.41Å; L122-L125 PolarHBondContact O-N 2.98Å; R123-L125 VanDerWaalsContact C-N 3.31Å; R123-L125 PolarHBondContact O-N 3.35Å; L125-E127 VanDerWaalsContact C-N 3.34Å; L125-E127 PolarHBondContact O-N 2.68Å; L125-R128 PolarHBondContact O-N 3.31Å; L125-G129 PolarHBondContact O-N 2.85Å; L125-L144 HydrophobicContact CD1-CD1 4.37Å; L125-L144 HydrophobicContact CD2-CD1 4.18Å; L125-L144 HydrophobicContact CD2-CD2 4.27Å; L125-F170 HydrophobicContact CD2-CD1 4Å; L125-F170 HydrophobicContact CD2-CE1 3.68Å; L125-F170 HydrophobicContact CG-CD1 4.05Å; L125-F170 HydrophobicContact CG-CE1 4.2Å; L125-D174 HydrophobicContact CD1-CB 3.59Å; L125-D174 HydrophobicContact CG-CB 4.08Å; L125-F208 HydrophobicContact CD1-CZ 4.22Å; L125-F208 HydrophobicContact CD2-CE1 4.35Å; L125-F208 HydrophobicContact CD2-CE2 4.04Å; L125-F208 HydrophobicContact CD2-CZ 3.84Å
126	A	98.3	Very high	96.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.5	-45.3	178.6	0	0	0	0	0	112.1	L122 R123 G129 L130 F208 Y296	L122-A126 PolarHBondContact O-N 3.01Å; R123-A126 WeakPolarHBondContact O-CB 3.49Å; R123-A126 PolarHBondContact O-N 3.31Å; R123-A126 VanDerWaalsContact O-N 3.14Å; A126-G129 PolarHBondContact O-N 3.28Å; A126-L130 HydrophobicContact CB-CD1 4.39Å; A126-L130 WeakPolarHBondContact O-CB 3.31Å; A126-L130 WeakPolarHBondContact O-CD1 3.37Å; A126-L130 VanDerWaalsContact O-CG 3.27Å; A126-L130 WeakPolarHBondContact O-CG 3.31Å; A126-L130 PolarHBondContact O-N 3.32Å; A126-F208 HydrophobicContact CB-CB 4.19Å; A126-F208 HydrophobicContact CB-CD1 3.43Å; A126-F208 VanDerWaalsContact CB-CD1 3.43Å; A126-F208 HydrophobicContact CB-CE1 4.02Å; A126-F208 HydrophobicContact CB-CG 4.02Å; A126-Y296 HydrophobicContact CB-CD1 4.19Å
127	E	98.4	Very high	96.8	Very high	67 Å²	67	42.9 Å²	42.9	31%	0.313	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-44.2	178.6	-74.7	170.1	169.1	0	0	111.7	R123 R124 L125 A131 Y296	R123-E127 HydrophobicContact CG-CG 4.37Å; R123-E127 IonicContact CZ-OE1 3.22Å; R123-E127 IonicContact NE-OE1 3.64Å; R123-E127 PolarHBondContact NE-OE1 3.26Å; R123-E127 IonicContact NH2-OE1 2.74Å; R123-E127 WeakPolarHBondContact O-CG 3.44Å; R123-E127 PolarHBondContact O-N 3.25Å; R124-E127 PolarHBondContact O-N 2.78Å; L125-E127 VanDerWaalsContact C-N 3.34Å; L125-E127 PolarHBondContact O-N 2.68Å; E127-A131 VanDerWaalsContact O-CB 3.26Å; E127-A131 WeakPolarHBondContact O-CB 3.5Å; E127-A131 PolarHBondContact O-N 2.97Å; E127-Y296 HydrophobicContact CG-CE1 4.1Å; E127-Y296 HydrophobicContact CG-CE2 4.28Å
128	R	97.8	Very high	96.6	Very high	84 Å²	84	36.8 Å²	36.8	32%	0.317	19%	0.193	S	C	.	.	H	α-helix	trans	-62.8	-48.7	176.1	-71.3	-168.7	-55.7	-85.2	6	111.9	R124 L125 A131 V169 D174	R124-R128 WeakPolarHBondContact O-CG 3.41Å; R124-R128 PolarHBondContact O-N 3.29Å; R124-R128 PolarHBondContact O-NH1 2.9Å; L125-R128 PolarHBondContact O-N 3.31Å; R128-A131 WeakPolarHBondContact O-CB 3.26Å; R128-A131 PolarHBondContact O-N 2.76Å; R128-V169 HydrophobicContact CB-CG1 4.15Å; R128-V169 PolarHBondContact NE-O 3.14Å; R128-D174 IonicContact CZ-OD2 3.87Å; R128-D174 IonicContact NH2-OD1 2.91Å; R128-D174 PolarHBondContact NH2-OD1 2.87Å; R128-D174 IonicContact NH2-OD2 2.65Å; R128-D174 PolarHBondContact NH2-OD2 2.94Å
129	G	96.9	Very high	96.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.3	-40.6	-179.9	0	0	0	0	0	113.4	L125 A126 A131 L132	L125-G129 PolarHBondContact O-N 2.85Å; A126-G129 PolarHBondContact O-N 3.28Å; G129-A131 VanDerWaalsContact C-N 3.27Å; G129-A131 PolarHBondContact O-N 2.73Å; G129-L132 PolarHBondContact O-N 3.4Å
130	L	96.8	Very high	96.6	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-81.8	-0.9	178.9	-66.5	164.4	0	0	0	113.8	A126 A133 L142 L149 R210 Y296	A126-L130 HydrophobicContact CB-CD1 4.39Å; A126-L130 WeakPolarHBondContact O-CB 3.31Å; A126-L130 WeakPolarHBondContact O-CD1 3.37Å; A126-L130 VanDerWaalsContact O-CG 3.27Å; A126-L130 WeakPolarHBondContact O-CG 3.31Å; A126-L130 PolarHBondContact O-N 3.32Å; L130-A133 CarbonylContact C-O 3.6Å; L130-L142 HydrophobicContact CD2-CB 3.91Å; L130-L142 HydrophobicContact CG-CB 4.09Å; L130-L149 HydrophobicContact CD2-CD1 3.78Å; L130-R210 HydrophobicContact CD1-CB 3.66Å; L130-R210 PolarHBondContact O-NH1 3.47Å; L130-Y296 HydrophobicContact CD1-CD1 4.5Å; L130-Y296 HydrophobicContact CD1-CE1 4.08Å
131	A	95.9	Very high	96.5	Very high	82 Å²	82	32.2 Å²	32.2	68%	0.678	17%	0.174	S	C	*	.	H	α-helix	trans	-83.5	-23.9	168.7	0	0	0	0	0	112	E127 R128 G129	E127-A131 VanDerWaalsContact O-CB 3.26Å; E127-A131 WeakPolarHBondContact O-CB 3.5Å; E127-A131 PolarHBondContact O-N 2.97Å; R128-A131 WeakPolarHBondContact O-CB 3.26Å; R128-A131 PolarHBondContact O-N 2.76Å; G129-A131 VanDerWaalsContact C-N 3.27Å; G129-A131 PolarHBondContact O-N 2.73Å
132	L	95.4	Very high	96.5	Very high	43 Å²	43	31.2 Å²	31.2	23%	0.225	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-39.3	176.4	-68.6	179.2	0	0	0	112.3	G129 L149 I158 F162 V169	G129-L132 PolarHBondContact O-N 3.4Å; L132-L149 HydrophobicContact CB-CD2 4.24Å; L132-I158 HydrophobicContact CD1-CD1 3.71Å; L132-I158 HydrophobicContact CD1-CG1 3.91Å; L132-F162 HydrophobicContact CB-CD1 4.35Å; L132-F162 HydrophobicContact CB-CD2 4.31Å; L132-F162 HydrophobicContact CB-CE1 4.04Å; L132-F162 HydrophobicContact CB-CE2 4Å; L132-F162 HydrophobicContact CB-CG 4.48Å; L132-F162 HydrophobicContact CB-CZ 3.86Å; L132-F162 HydrophobicContact CD1-CB 4.08Å; L132-F162 HydrophobicContact CD1-CD1 4.27Å; L132-F162 HydrophobicContact CD1-CD2 4.03Å; L132-F162 HydrophobicContact CD1-CG 3.88Å; L132-F162 HydrophobicContact CD2-CD1 4.13Å; L132-F162 HydrophobicContact CD2-CE1 4.36Å; L132-F162 HydrophobicContact CG-CD1 4.49Å; L132-V169 HydrophobicContact CD1-CB 4.48Å; L132-V169 HydrophobicContact CD1-CG1 4.11Å; L132-V169 HydrophobicContact CD1-CG2 3.82Å; L132-V169 HydrophobicContact CD2-CG2 4.06Å; L132-V169 HydrophobicContact CG-CG2 4.19Å
133	A	93.6	Very high	96.4	Very high	15 Å²	15	31.8 Å²	31.8	12%	0.124	17%	0.169	C	C	.	.			trans	-157.7	163.8	173.2	0	0	0	0	0	111.2	L130 L149 S150 M151 F162	L130-A133 CarbonylContact C-O 3.6Å; A133-L149 HydrophobicContact CB-CD2 3.79Å; A133-L149 HydrophobicContact CB-CG 4.18Å; A133-S150 CarbonylContact C-O 3.5Å; A133-S150 WeakPolarHBondContact CB-O 3.12Å; A133-M151 HydrophobicContact CB-CB 3.87Å; A133-M151 HydrophobicContact CB-CG 3.82Å; A133-M151 HydrophobicContact CB-SD 4.32Å; A133-F162 HydrophobicContact CB-CZ 4.33Å
134	G	91.6	Very high	96.4	Very high	20 Å²	20	29.4 Å²	29.4	21%	0.206	16%	0.16	C	C	.	.			trans	-155.3	170.7	172.3	0	0	0	0	0	112	S140 S150 M151 G152	G134-S140 WeakPolarHBondContact CA-OG 3.1Å; G134-S150 CarbonylContact C-O 3.47Å; G134-S150 WeakPolarHBondContact CA-O 3.33Å; G134-S150 PolarHBondContact N-O 3.07Å; G134-S150 VanDerWaalsContact N-O 3.12Å; G134-M151 WeakPolarHBondContact O-CA 3.39Å; G134-G152 PolarHBondContact O-N 3.31Å
135	S	93	Very high	96.2	Very high	21 Å²	21	26.7 Å²	26.7	15%	0.147	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-67.4	156.7	170.6	-172	0	0	0	0	111.8	G137 A139 S140 G152 D221	S135-G137 PolarHBondContact OG-N 3.08Å; S135-G137 VanDerWaalsContact OG-N 3.1Å; S135-A139 WeakPolarHBondContact CB-O 3.38Å; S135-S140 PolarHBondContact N-OG 2.93Å; S135-G152 WeakPolarHBondContact CA-O 3.47Å; S135-G152 PolarHBondContact OG-O 3.47Å; S135-D221 VanDerWaalsContact CB-OD1 3.32Å; S135-D221 WeakPolarHBondContact CB-OD1 3.48Å; S135-D221 PolarHBondContact OG-OD1 2.95Å
136	E	92.5	Very high	96	Very high	102 Å²	102	29.5 Å²	29.5	48%	0.477	17%	0.171	S	C	.	.	S	Bend	trans	-71.3	-17.4	165	-71.3	175.1	-170.1	0	0	112.8	G152 K153 K217	E136-G152 PolarHBondContact N-O 2.94Å; E136-G152 VanDerWaalsContact N-O 3.1Å; E136-K153 WeakPolarHBondContact OE2-CE 3.46Å; E136-K217 HydrophobicContact CB-CB 4.22Å; E136-K217 HydrophobicContact CB-CG 3.85Å
137	G	95.4	Very high	95.9	Very high	6 Å²	6	29.5 Å²	29.5	6%	0.062	17%	0.171	C	C	.	.	S	Bend	trans	-98.2	-169.4	177.6	0	0	0	0	0	114.1	S135 A139 A215 D221	S135-G137 PolarHBondContact OG-N 3.08Å; S135-G137 VanDerWaalsContact OG-N 3.1Å; G137-A139 VanDerWaalsContact C-N 3.3Å; G137-A139 PolarHBondContact O-N 2.98Å; G137-A215 WeakPolarHBondContact CA-O 3.16Å; G137-D221 WeakPolarHBondContact CA-OD1 3.08Å
138	G	94.8	Very high	95.8	Very high	2 Å²	2	27.4 Å²	27.4	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	-75.4	-9.2	-175	0	0	0	0	0	115.8	I211 N212 T214	G138-I211 CarbonylContact O-C 3.38Å; G138-I211 VanDerWaalsContact O-CA 3.23Å; G138-I211 WeakPolarHBondContact O-CA 3.05Å; G138-N212 WeakPolarHBondContact CA-OD1 3.5Å; G138-N212 PolarHBondContact O-N 3.44Å; G138-T214 VanDerWaalsContact CA-O 3.23Å; G138-T214 WeakPolarHBondContact CA-O 3.29Å; G138-T214 PolarHBondContact N-O 2.9Å
139	A	97.5	Very high	95.8	Very high	10 Å²	10	23.4 Å²	23.4	8%	0.083	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.4	-179.7	0	0	0	0	0	112.2	S135 G137 R210 I211 Y223	S135-A139 WeakPolarHBondContact CB-O 3.38Å; G137-A139 VanDerWaalsContact C-N 3.3Å; G137-A139 PolarHBondContact O-N 2.98Å; A139-R210 WeakPolarHBondContact CA-O 3.23Å; A139-I211 HydrophobicContact CB-CG1 4.28Å; A139-Y223 HydrophobicContact CB-CD1 3.89Å
140	S	98.2	Very high	95.8	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	146.4	167.5	-61.4	0	0	0	0	109.8	G134 S135 S150 R210	G134-S140 WeakPolarHBondContact CA-OG 3.1Å; S135-S140 PolarHBondContact N-OG 2.93Å; S140-S150 WeakPolarHBondContact CA-OG 3.26Å; S140-R210 PolarHBondContact N-O 3.24Å; S140-R210 PolarHBondContact O-N 2.8Å; S140-R210 PolarHBondContact OG-NH2 3.48Å
141	I	97.7	Very high	95.7	Very high	44 Å²	44	25.7 Å²	25.7	23%	0.226	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	153.9	171.6	62.8	152	0	0	0	112.2	L149 S150 F155 F207 F208	I141-L149 WeakPolarHBondContact O-CA 3.45Å; I141-S150 PolarHBondContact N-OG 3.11Å; I141-S150 PolarHBondContact O-N 3.5Å; I141-S150 VanDerWaalsContact O-N 3.08Å; I141-F155 HydrophobicContact CD1-CD1 4.25Å; I141-F155 HydrophobicContact CD1-CE1 3.61Å; I141-F155 HydrophobicContact CD1-CZ 4.18Å; I141-F155 HydrophobicContact CG1-CD1 4.2Å; I141-F155 HydrophobicContact CG1-CE1 3.42Å; I141-F155 VanDerWaalsContact CG1-CE1 3.42Å; I141-F155 HydrophobicContact CG1-CZ 4.22Å; I141-F207 HydrophobicContact CB-CB 4.49Å; I141-F207 HydrophobicContact CB-CD2 4.06Å; I141-F207 HydrophobicContact CB-CG 4.49Å; I141-F207 HydrophobicContact CG2-CD2 3.61Å; I141-F207 HydrophobicContact CG2-CE2 3.88Å; I141-F207 HydrophobicContact CG2-CG 4.42Å; I141-F208 CarbonylContact C-O 3.55Å; I141-F208 WeakPolarHBondContact CA-O 3.49Å
142	L	98.2	Very high	95.6	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	118.6	170.1	167.3	68.2	0	0	0	108.5	L130 L144 A148 L149 I158 F170 F207 F208	L130-L142 HydrophobicContact CD2-CB 3.91Å; L130-L142 HydrophobicContact CG-CB 4.09Å; L142-L144 HydrophobicContact CD1-CD2 4.44Å; L142-L144 HydrophobicContact CD2-CD2 4.21Å; L142-L144 HydrophobicContact CG-CD2 4.25Å; L142-A148 CarbonylContact C-O 3.45Å; L142-A148 WeakPolarHBondContact CA-O 3.35Å; L142-L149 HydrophobicContact CB-CD1 4.29Å; L142-L149 HydrophobicContact CD1-CB 4.5Å; L142-L149 HydrophobicContact CD1-CD1 4.28Å; L142-I158 HydrophobicContact CD1-CD1 3.88Å; L142-I158 HydrophobicContact CD1-CG2 4.46Å; L142-F170 HydrophobicContact CD2-CE1 4.35Å; L142-F170 HydrophobicContact CD2-CZ 3.92Å; L142-F207 CarbonylContact O-C 3.59Å; L142-F207 WeakPolarHBondContact O-CA 3.4Å; L142-F208 HydrophobicContact CB-CB 4.27Å; L142-F208 PolarHBondContact N-O 3.11Å; L142-F208 PolarHBondContact O-N 3.22Å
143	D	97.6	Very high	95.4	Very high	12 Å²	12	27.1 Å²	27.1	6%	0.064	16%	0.158	C	C	.	.			trans	-108.5	113.2	174.6	176.9	-7.3	0	0	0	109.4	H145 S146 G147 A148 T206 F207	D143-H145 VanDerWaalsContact C-N 3.26Å; D143-H145 PolarHBondContact O-N 2.72Å; D143-H145 WeakPolarHBondContact OD1-CA 3.29Å; D143-H145 VanDerWaalsContact OD1-CB 3.26Å; D143-H145 WeakPolarHBondContact OD1-CB 3.27Å; D143-H145 IonicContact OD1-CD2 3.45Å; D143-H145 PolarHBondContact OD1-CD2 3.22Å; D143-H145 IonicContact OD1-CG 2.8Å; D143-H145 PolarHBondContact OD1-N 3.2Å; D143-S146 WeakPolarHBondContact CB-OG 3.26Å; D143-S146 PolarHBondContact OD1-N 2.91Å; D143-S146 WeakPolarHBondContact OD2-CB 3.18Å; D143-S146 PolarHBondContact OD2-OG 2.93Å; D143-G147 CarbonylContact O-C 3.49Å; D143-G147 WeakPolarHBondContact O-CA 3.37Å; D143-G147 PolarHBondContact O-N 3.19Å; D143-A148 HydrophobicContact CB-CB 4.14Å; D143-A148 PolarHBondContact N-O 3.34Å; D143-A148 PolarHBondContact O-N 3.1Å; D143-T206 VanDerWaalsContact CG-O 3.23Å; D143-T206 VanDerWaalsContact OD1-O 3.07Å; D143-F207 HydrophobicContact CB-CB 4.2Å
144	L	96.9	Very high	95.3	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.026	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-19.4	180	-63	-177.4	0	0	0	113.4	L125 L142 Y159 F170 F175 Y178 F208 P313	L125-L144 HydrophobicContact CD1-CD1 4.37Å; L125-L144 HydrophobicContact CD2-CD1 4.18Å; L125-L144 HydrophobicContact CD2-CD2 4.27Å; L142-L144 HydrophobicContact CD1-CD2 4.44Å; L142-L144 HydrophobicContact CD2-CD2 4.21Å; L142-L144 HydrophobicContact CG-CD2 4.25Å; L144-Y159 WeakPolarHBondContact CA-OH 3.26Å; L144-Y159 WeakPolarHBondContact O-CE2 3.3Å; L144-Y159 PolarHBondContact O-OH 3.35Å; L144-F170 HydrophobicContact CD2-CE1 4.48Å; L144-F170 HydrophobicContact CD2-CE2 4.15Å; L144-F170 HydrophobicContact CD2-CZ 4.05Å; L144-F175 HydrophobicContact CB-CE1 4.4Å; L144-F175 HydrophobicContact CD2-CZ 4.47Å; L144-Y178 HydrophobicContact CD1-CD2 4.28Å; L144-Y178 HydrophobicContact CD1-CG 4.37Å; L144-F208 HydrophobicContact CD1-CE2 3.64Å; L144-F208 HydrophobicContact CD1-CZ 4.32Å; L144-F208 HydrophobicContact CG-CD2 4.36Å; L144-F208 HydrophobicContact CG-CE2 3.86Å; L144-P313 HydrophobicContact CB-CB 3.97Å; L144-P313 HydrophobicContact CB-CG 4.09Å
145	H	95.7	Very high	95.4	Very high	45 Å²	45	35.2 Å²	35.2	21%	0.208	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-54	-179.5	-61.6	-96.2	0	0	0	111.4	D143 Y178 L202 I310 S311 P313	D143-H145 VanDerWaalsContact C-N 3.26Å; D143-H145 PolarHBondContact O-N 2.72Å; D143-H145 WeakPolarHBondContact OD1-CA 3.29Å; D143-H145 VanDerWaalsContact OD1-CB 3.26Å; D143-H145 WeakPolarHBondContact OD1-CB 3.27Å; D143-H145 IonicContact OD1-CD2 3.45Å; D143-H145 PolarHBondContact OD1-CD2 3.22Å; D143-H145 IonicContact OD1-CG 2.8Å; D143-H145 PolarHBondContact OD1-N 3.2Å; H145-Y178 AromaticContact NE2-CE1 3.98Å; H145-Y178 AromaticContact NE2-CZ 3.86Å; H145-Y178 PolarHBondContact NE2-OH 2.89Å; H145-L202 VanDerWaalsContact CE1-CD2 3.44Å; H145-L202 WeakPolarHBondContact CE1-CD2 3.29Å; H145-I310 HydrophobicContact CB-CD1 4.35Å; H145-S311 PolarHBondContact CE1-O 2.72Å; H145-S311 PolarHBondContact ND1-O 3.26Å; H145-S311 VanDerWaalsContact ND1-O 3.11Å; H145-P313 WeakPolarHBondContact CE1-CD 3.31Å
146	S	94.8	Very high	95.6	Very high	58 Å²	58	35 Å²	35	41%	0.406	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-16.7	-179.2	67.1	0	0	0	0	112.8	D143 A148 N157	D143-S146 WeakPolarHBondContact CB-OG 3.26Å; D143-S146 PolarHBondContact OD1-N 2.91Å; D143-S146 WeakPolarHBondContact OD2-CB 3.18Å; D143-S146 PolarHBondContact OD2-OG 2.93Å; S146-A148 WeakPolarHBondContact OG-CB 3.43Å; S146-A148 PolarHBondContact OG-N 3.36Å; S146-N157 PolarHBondContact O-ND2 3.49Å
147	G	95.6	Very high	95.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.			trans	75.3	6.9	-168.6	0	0	0	0	0	113.4	D143 L149 N157 I158	D143-G147 CarbonylContact O-C 3.49Å; D143-G147 WeakPolarHBondContact O-CA 3.37Å; D143-G147 PolarHBondContact O-N 3.19Å; G147-L149 PolarHBondContact O-N 2.86Å; G147-N157 CarbonylContact O-C 3.49Å; G147-N157 WeakPolarHBondContact O-CA 3.35Å; G147-I158 WeakPolarHBondContact O-CG2 3.24Å; G147-I158 PolarHBondContact O-N 3.12Å
148	A	96.8	Very high	95.8	Very high	23 Å²	23	32.1 Å²	32.1	19%	0.19	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	125.6	-177.8	0	0	0	0	0	111.2	L142 D143 S146 V156	L142-A148 CarbonylContact C-O 3.45Å; L142-A148 WeakPolarHBondContact CA-O 3.35Å; D143-A148 HydrophobicContact CB-CB 4.14Å; D143-A148 PolarHBondContact N-O 3.34Å; D143-A148 PolarHBondContact O-N 3.1Å; S146-A148 WeakPolarHBondContact OG-CB 3.43Å; S146-A148 PolarHBondContact OG-N 3.36Å; A148-V156 CarbonylContact C-O 3.57Å; A148-V156 WeakPolarHBondContact CA-O 3.22Å
149	L	97.6	Very high	95.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	132.7	177	173.9	64.8	0	0	0	109.5	L130 L132 A133 I141 L142 G147 M151 F155 V156 I158 F162	L130-L149 HydrophobicContact CD2-CD1 3.78Å; L132-L149 HydrophobicContact CB-CD2 4.24Å; A133-L149 HydrophobicContact CB-CD2 3.79Å; A133-L149 HydrophobicContact CB-CG 4.18Å; I141-L149 WeakPolarHBondContact O-CA 3.45Å; L142-L149 HydrophobicContact CB-CD1 4.29Å; L142-L149 HydrophobicContact CD1-CB 4.5Å; L142-L149 HydrophobicContact CD1-CD1 4.28Å; G147-L149 PolarHBondContact O-N 2.86Å; L149-M151 PolarHBondContact O-N 3.3Å; L149-F155 WeakPolarHBondContact O-CA 3.37Å; L149-V156 HydrophobicContact CB-CG2 4.28Å; L149-V156 PolarHBondContact N-O 2.82Å; L149-V156 PolarHBondContact O-N 3.42Å; L149-I158 HydrophobicContact CB-CB 4.13Å; L149-I158 HydrophobicContact CD2-CB 4.24Å; L149-I158 HydrophobicContact CD2-CD1 3.8Å; L149-I158 HydrophobicContact CD2-CG1 3.73Å; L149-F162 HydrophobicContact CD2-CE2 3.96Å
150	S	96.9	Very high	95.6	Very high	8 Å²	8	43.6 Å²	43.6	6%	0.056	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	129.2	172.1	-62.8	0	0	0	0	111.3	A133 G134 S140 I141 F155	A133-S150 CarbonylContact C-O 3.5Å; A133-S150 WeakPolarHBondContact CB-O 3.12Å; G134-S150 CarbonylContact C-O 3.47Å; G134-S150 WeakPolarHBondContact CA-O 3.33Å; G134-S150 PolarHBondContact N-O 3.07Å; G134-S150 VanDerWaalsContact N-O 3.12Å; S140-S150 WeakPolarHBondContact CA-OG 3.26Å; I141-S150 PolarHBondContact N-OG 3.11Å; I141-S150 PolarHBondContact O-N 3.5Å; I141-S150 VanDerWaalsContact O-N 3.08Å; S150-F155 WeakPolarHBondContact OG-CE1 3.27Å
151	M	94.8	Very high	95.4	Very high	43 Å²	43	50.4 Å²	50.4	21%	0.212	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	104.7	175.1	-172.7	174.5	86.8	0	0	110.7	A133 G134 L149 K153 Q154 V156 Y161	A133-M151 HydrophobicContact CB-CB 3.87Å; A133-M151 HydrophobicContact CB-CG 3.82Å; A133-M151 HydrophobicContact CB-SD 4.32Å; G134-M151 WeakPolarHBondContact O-CA 3.39Å; L149-M151 PolarHBondContact O-N 3.3Å; M151-K153 PolarHBondContact O-N 2.89Å; M151-K153 VanDerWaalsContact O-N 3.15Å; M151-Q154 CarbonylContact C-O 3.56Å; M151-Q154 PolarHBondContact N-O 3.46Å; M151-Q154 WeakPolarHBondContact O-CG 3.48Å; M151-Q154 PolarHBondContact O-N 3.45Å; M151-V156 HydrophobicContact CB-CG1 4.21Å; M151-V156 HydrophobicContact CB-CG2 4.02Å; M151-V156 HydrophobicContact CE-CG1 3.4Å; M151-V156 VanDerWaalsContact CE-CG1 3.4Å; M151-V156 HydrophobicContact SD-CG1 3.96Å; M151-V156 HydrophobicContact SD-CG2 4.13Å; M151-Y161 HydrophobicContact CE-CE2 4.11Å; M151-Y161 HydrophobicContact SD-CE1 4.12Å
152	G	93	Very high	95.2	Very high	21 Å²	21	49.5 Å²	49.5	22%	0.216	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	66.8	-110.2	-177	0	0	0	0	0	111.4	G134 S135 E136	G134-G152 PolarHBondContact O-N 3.31Å; S135-G152 WeakPolarHBondContact CA-O 3.47Å; S135-G152 PolarHBondContact OG-O 3.47Å; E136-G152 PolarHBondContact N-O 2.94Å; E136-G152 VanDerWaalsContact N-O 3.1Å
153	K	90.7	Very high	94.8	Very high	133 Å²	133	51.5 Å²	51.5	58%	0.578	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	7.3	178.5	-61.1	-175.7	-177.2	178.9	0	114	E136 M151 T218	E136-K153 WeakPolarHBondContact OE2-CE 3.46Å; M151-K153 PolarHBondContact O-N 2.89Å; M151-K153 VanDerWaalsContact O-N 3.15Å; K153-T218 HydrophobicContact CB-CG2 3.72Å; K153-T218 HydrophobicContact CD-CG2 4.28Å; K153-T218 HydrophobicContact CG-CG2 3.76Å
154	Q	92.6	Very high	94.4	Very high	125 Å²	125	60 Å²	60	58%	0.584	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	178.6	-173.6	64.8	-177	-45.5	0	0	111.5	M151	M151-Q154 CarbonylContact C-O 3.56Å; M151-Q154 PolarHBondContact N-O 3.46Å; M151-Q154 WeakPolarHBondContact O-CG 3.48Å; M151-Q154 PolarHBondContact O-N 3.45Å
155	F	93.8	Very high	94	Very high	80 Å²	80	64.6 Å²	64.6	35%	0.351	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	142	172.3	-63.9	-76	0	0	0	110.7	I141 L149 S150 H220	I141-F155 HydrophobicContact CD1-CD1 4.25Å; I141-F155 HydrophobicContact CD1-CE1 3.61Å; I141-F155 HydrophobicContact CD1-CZ 4.18Å; I141-F155 HydrophobicContact CG1-CD1 4.2Å; I141-F155 HydrophobicContact CG1-CE1 3.42Å; I141-F155 VanDerWaalsContact CG1-CE1 3.42Å; I141-F155 HydrophobicContact CG1-CZ 4.22Å; L149-F155 WeakPolarHBondContact O-CA 3.37Å; S150-F155 WeakPolarHBondContact OG-CE1 3.27Å; F155-H220 HydrophobicContact CE2-CB 4.39Å; F155-H220 AromaticContact CE2-CD2 3.77Å; F155-H220 AromaticContact CE2-CG 3.83Å; F155-H220 AromaticContact CE2-NE2 3.97Å; F155-H220 HydrophobicContact CZ-CB 4.18Å
156	V	95.8	Very high	93.9	Very high	18 Å²	18	62.9 Å²	62.9	11%	0.109	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	158	169.6	-64.8	0	0	0	0	110.3	A148 L149 M151 Y161	A148-V156 CarbonylContact C-O 3.57Å; A148-V156 WeakPolarHBondContact CA-O 3.22Å; L149-V156 HydrophobicContact CB-CG2 4.28Å; L149-V156 PolarHBondContact N-O 2.82Å; L149-V156 PolarHBondContact O-N 3.42Å; M151-V156 HydrophobicContact CB-CG1 4.21Å; M151-V156 HydrophobicContact CB-CG2 4.02Å; M151-V156 HydrophobicContact CE-CG1 3.4Å; M151-V156 VanDerWaalsContact CE-CG1 3.4Å; M151-V156 HydrophobicContact SD-CG1 3.96Å; M151-V156 HydrophobicContact SD-CG2 4.13Å; V156-Y161 HydrophobicContact CG1-CD2 4.33Å
157	N	96.6	Very high	93.7	Very high	46 Å²	46	63.6 Å²	63.6	25%	0.246	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	111.5	166.8	-180	-62.9	0	0	0	108.6	S146 G147 Y159 R160 Y161	S146-N157 PolarHBondContact O-ND2 3.49Å; G147-N157 CarbonylContact O-C 3.49Å; G147-N157 WeakPolarHBondContact O-CA 3.35Å; N157-Y159 VanDerWaalsContact C-N 3.28Å; N157-Y159 PolarHBondContact O-N 3.4Å; N157-Y159 WeakPolarHBondContact OD1-CB 3.22Å; N157-Y159 PolarHBondContact OD1-N 3.35Å; N157-Y159 VanDerWaalsContact OD1-N 3.07Å; N157-R160 HydrophobicContact CB-CB 4.25Å; N157-R160 HydrophobicContact CB-CG 4.36Å; N157-R160 PolarHBondContact O-N 2.75Å; N157-R160 PolarHBondContact OD1-N 3.4Å; N157-Y161 VanDerWaalsContact O-CB 3.29Å; N157-Y161 WeakPolarHBondContact O-CB 3.2Å; N157-Y161 PolarHBondContact O-N 2.04Å
158	I	95.8	Very high	93.5	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-58.1	-39.9	-175.8	-159.7	-177.7	0	0	0	111.9	L132 L142 G147 L149 R160 Y161 F162 I166 F170	L132-I158 HydrophobicContact CD1-CD1 3.71Å; L132-I158 HydrophobicContact CD1-CG1 3.91Å; L142-I158 HydrophobicContact CD1-CD1 3.88Å; L142-I158 HydrophobicContact CD1-CG2 4.46Å; G147-I158 WeakPolarHBondContact O-CG2 3.24Å; G147-I158 PolarHBondContact O-N 3.12Å; L149-I158 HydrophobicContact CB-CB 4.13Å; L149-I158 HydrophobicContact CD2-CB 4.24Å; L149-I158 HydrophobicContact CD2-CD1 3.8Å; L149-I158 HydrophobicContact CD2-CG1 3.73Å; I158-R160 PolarHBondContact O-N 3.26Å; I158-Y161 PolarHBondContact O-N 2.75Å; I158-F162 HydrophobicContact CB-CD2 4.49Å; I158-F162 HydrophobicContact CG1-CD2 3.68Å; I158-F162 HydrophobicContact CG1-CE2 4.34Å; I158-F162 WeakPolarHBondContact O-CA 3.4Å; I158-F162 WeakPolarHBondContact O-CB 3.49Å; I158-F162 PolarHBondContact O-N 3.4Å; I158-I166 HydrophobicContact CD1-CD1 4.27Å; I158-I166 HydrophobicContact CG1-CD1 3.89Å; I158-I166 HydrophobicContact CG2-CD1 4.44Å; I158-F170 HydrophobicContact CD1-CE2 4.04Å; I158-F170 HydrophobicContact CD1-CZ 4.13Å
159	Y	95.1	Very high	93.5	Very high	34 Å²	34	69.9 Å²	69.9	13%	0.133	35%	0.346	C	S	.	.	H	α-helix	trans	-69.3	-32.6	-178.2	-53.1	-54.2	0	0	0	113	L144 N157 G163 I166 F170 P316	L144-Y159 WeakPolarHBondContact CA-OH 3.26Å; L144-Y159 WeakPolarHBondContact O-CE2 3.3Å; L144-Y159 PolarHBondContact O-OH 3.35Å; N157-Y159 VanDerWaalsContact C-N 3.28Å; N157-Y159 PolarHBondContact O-N 3.4Å; N157-Y159 WeakPolarHBondContact OD1-CB 3.22Å; N157-Y159 PolarHBondContact OD1-N 3.35Å; N157-Y159 VanDerWaalsContact OD1-N 3.07Å; Y159-G163 WeakPolarHBondContact O-CA 3.35Å; Y159-G163 PolarHBondContact O-N 3.03Å; Y159-I166 HydrophobicContact CD1-CD1 4.13Å; Y159-I166 HydrophobicContact CD1-CG1 4.15Å; Y159-I166 HydrophobicContact CD1-CG2 4.07Å; Y159-I166 HydrophobicContact CE1-CG2 4.33Å; Y159-F170 HydrophobicContact CE1-CE2 4.5Å; Y159-P316 HydrophobicContact CD1-CG 3.46Å; Y159-P316 VanDerWaalsContact CD1-CG 3.46Å; Y159-P316 HydrophobicContact CD2-CG 3.9Å; Y159-P316 HydrophobicContact CE1-CG 3.81Å; Y159-P316 HydrophobicContact CE2-CG 4.21Å; Y159-P316 HydrophobicContact CG-CG 3.5Å
160	R	94.3	Very high	93.4	Very high	219 Å²	219	69.9 Å²	69.9	83%	0.826	35%	0.346	S	S	*	.	H	α-helix	trans	-81.4	-40.1	174.5	-68	-179.4	179.6	170.1	0.5	112.1	N157 I158	N157-R160 HydrophobicContact CB-CB 4.25Å; N157-R160 HydrophobicContact CB-CG 4.36Å; N157-R160 PolarHBondContact O-N 2.75Å; N157-R160 PolarHBondContact OD1-N 3.4Å; I158-R160 PolarHBondContact O-N 3.26Å
161	Y	93.9	Very high	93.4	Very high	144 Å²	144	72.4 Å²	72.4	57%	0.565	36%	0.361	S	S	*	.	H	α-helix	trans	-80	-36.6	-172.6	-164.3	-86	0	0	0	112.7	M151 V156 N157 I158	M151-Y161 HydrophobicContact CE-CE2 4.11Å; M151-Y161 HydrophobicContact SD-CE1 4.12Å; V156-Y161 HydrophobicContact CG1-CD2 4.33Å; N157-Y161 VanDerWaalsContact O-CB 3.29Å; N157-Y161 WeakPolarHBondContact O-CB 3.2Å; N157-Y161 PolarHBondContact O-N 2.04Å; I158-Y161 PolarHBondContact O-N 2.75Å
162	F	93.6	Very high	93.5	Very high	26 Å²	26	74.6 Å²	74.6	11%	0.114	37%	0.371	C	S	.	.	S	Bend	trans	-113.5	19.5	-178.3	-60.1	-82.4	0	0	0	112.8	L132 A133 L149 I158 E164 Q165 I166	L132-F162 HydrophobicContact CB-CD1 4.35Å; L132-F162 HydrophobicContact CB-CD2 4.31Å; L132-F162 HydrophobicContact CB-CE1 4.04Å; L132-F162 HydrophobicContact CB-CE2 4Å; L132-F162 HydrophobicContact CB-CG 4.48Å; L132-F162 HydrophobicContact CB-CZ 3.86Å; L132-F162 HydrophobicContact CD1-CB 4.08Å; L132-F162 HydrophobicContact CD1-CD1 4.27Å; L132-F162 HydrophobicContact CD1-CD2 4.03Å; L132-F162 HydrophobicContact CD1-CG 3.88Å; L132-F162 HydrophobicContact CD2-CD1 4.13Å; L132-F162 HydrophobicContact CD2-CE1 4.36Å; L132-F162 HydrophobicContact CG-CD1 4.49Å; A133-F162 HydrophobicContact CB-CZ 4.33Å; L149-F162 HydrophobicContact CD2-CE2 3.96Å; I158-F162 HydrophobicContact CB-CD2 4.49Å; I158-F162 HydrophobicContact CG1-CD2 3.68Å; I158-F162 HydrophobicContact CG1-CE2 4.34Å; I158-F162 WeakPolarHBondContact O-CA 3.4Å; I158-F162 WeakPolarHBondContact O-CB 3.49Å; I158-F162 PolarHBondContact O-N 3.4Å; F162-E164 VanDerWaalsContact C-N 3.34Å; F162-E164 PolarHBondContact O-N 3.44Å; F162-Q165 WeakPolarHBondContact O-CA 3.38Å; F162-Q165 WeakPolarHBondContact O-CB 3.31Å; F162-Q165 PolarHBondContact O-N 2.67Å; F162-I166 HydrophobicContact CB-CD1 4.06Å; F162-I166 HydrophobicContact CB-CG1 4.49Å; F162-I166 PolarHBondContact O-N 3.12Å
163	G	89.4	Confident	93.7	Very high	41 Å²	41	80 Å²	80	42%	0.423	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-44.3	-48.3	-165.7	0	0	0	0	0	115.9	Y159 Q165 I166	Y159-G163 WeakPolarHBondContact O-CA 3.35Å; Y159-G163 PolarHBondContact O-N 3.03Å; G163-Q165 PolarHBondContact O-N 2.85Å; G163-I166 PolarHBondContact O-N 3.49Å
164	E	87.8	Confident	94.1	Very high	190 Å²	190	74.4 Å²	74.4	89%	0.888	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-65.5	-24.9	179.4	-64.3	-176.4	169.7	0	0	113.8	F162	F162-E164 VanDerWaalsContact C-N 3.34Å; F162-E164 PolarHBondContact O-N 3.44Å
165	Q	90.2	Very high	94.3	Very high	103 Å²	103	68.4 Å²	68.4	48%	0.481	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-95.8	-10.9	-177.8	-59.9	171.7	25.4	0	0	112.6	F162 G163 A167 D168 V169	F162-Q165 WeakPolarHBondContact O-CA 3.38Å; F162-Q165 WeakPolarHBondContact O-CB 3.31Å; F162-Q165 PolarHBondContact O-N 2.67Å; G163-Q165 PolarHBondContact O-N 2.85Å; Q165-A167 VanDerWaalsContact C-N 3.27Å; Q165-A167 PolarHBondContact O-N 3.43Å; Q165-D168 WeakPolarHBondContact O-CB 3.42Å; Q165-D168 PolarHBondContact O-N 3.4Å; Q165-V169 VanDerWaalsContact O-CG2 3.28Å; Q165-V169 WeakPolarHBondContact O-CG2 3.25Å; Q165-V169 PolarHBondContact O-N 2.85Å
166	I	93.1	Very high	94.5	Very high	9 Å²	9	69.8 Å²	69.8	5%	0.046	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-37.9	-174.8	-70.5	-57.1	0	0	0	112.2	I158 Y159 F162 G163 D168 V169 F170 L315	I158-I166 HydrophobicContact CD1-CD1 4.27Å; I158-I166 HydrophobicContact CG1-CD1 3.89Å; I158-I166 HydrophobicContact CG2-CD1 4.44Å; Y159-I166 HydrophobicContact CD1-CD1 4.13Å; Y159-I166 HydrophobicContact CD1-CG1 4.15Å; Y159-I166 HydrophobicContact CD1-CG2 4.07Å; Y159-I166 HydrophobicContact CE1-CG2 4.33Å; F162-I166 HydrophobicContact CB-CD1 4.06Å; F162-I166 HydrophobicContact CB-CG1 4.49Å; F162-I166 PolarHBondContact O-N 3.12Å; G163-I166 PolarHBondContact O-N 3.49Å; I166-D168 PolarHBondContact O-N 3.27Å; I166-V169 PolarHBondContact O-N 3.34Å; I166-F170 HydrophobicContact CG2-CD2 4.36Å; I166-F170 PolarHBondContact O-N 2.81Å; I166-L315 HydrophobicContact CG2-CD1 3.82Å
167	A	90.4	Very high	94.6	Very high	72 Å²	72	70.4 Å²	70.4	60%	0.595	35%	0.347	S	S	*	.	H	α-helix	trans	-64.9	-22.9	178.5	0	0	0	0	0	113.1	Q165	Q165-A167 VanDerWaalsContact C-N 3.27Å; Q165-A167 PolarHBondContact O-N 3.43Å
168	D	92.3	Very high	94.7	Very high	140 Å²	140	68.4 Å²	68.4	75%	0.749	34%	0.336	S	S	*	.	H	α-helix	trans	-86.7	-16.2	174.5	-61.7	-38.8	0	0	0	112.4	Q165 I166	Q165-D168 WeakPolarHBondContact O-CB 3.42Å; Q165-D168 PolarHBondContact O-N 3.4Å; I166-D168 PolarHBondContact O-N 3.27Å
169	V	95.7	Very high	94.9	Very high	15 Å²	15	71.7 Å²	71.7	9%	0.091	35%	0.349	C	S	.	.	H	α-helix	trans	-96.7	-41.8	-173.8	176.1	0	0	0	0	111.4	R128 L132 Q165 I166	R128-V169 HydrophobicContact CB-CG1 4.15Å; R128-V169 PolarHBondContact NE-O 3.14Å; L132-V169 HydrophobicContact CD1-CB 4.48Å; L132-V169 HydrophobicContact CD1-CG1 4.11Å; L132-V169 HydrophobicContact CD1-CG2 3.82Å; L132-V169 HydrophobicContact CD2-CG2 4.06Å; L132-V169 HydrophobicContact CG-CG2 4.19Å; Q165-V169 VanDerWaalsContact O-CG2 3.28Å; Q165-V169 WeakPolarHBondContact O-CG2 3.25Å; Q165-V169 PolarHBondContact O-N 2.85Å; I166-V169 PolarHBondContact O-N 3.34Å
170	F	96.7	Very high	95	Very high	1 Å²	1	73.4 Å²	73.4	0%	0.004	36%	0.36	C	S	.	.			trans	-128.2	148.7	-179.5	-51.6	-54.3	0	0	0	112.1	L125 L142 L144 I158 Y159 I166 D174 F175 L315	L125-F170 HydrophobicContact CD2-CD1 4Å; L125-F170 HydrophobicContact CD2-CE1 3.68Å; L125-F170 HydrophobicContact CG-CD1 4.05Å; L125-F170 HydrophobicContact CG-CE1 4.2Å; L142-F170 HydrophobicContact CD2-CE1 4.35Å; L142-F170 HydrophobicContact CD2-CZ 3.92Å; L144-F170 HydrophobicContact CD2-CE1 4.48Å; L144-F170 HydrophobicContact CD2-CE2 4.15Å; L144-F170 HydrophobicContact CD2-CZ 4.05Å; I158-F170 HydrophobicContact CD1-CE2 4.04Å; I158-F170 HydrophobicContact CD1-CZ 4.13Å; Y159-F170 HydrophobicContact CE1-CE2 4.5Å; I166-F170 HydrophobicContact CG2-CD2 4.36Å; I166-F170 PolarHBondContact O-N 2.81Å; F170-D174 WeakPolarHBondContact CA-OD2 3.33Å; F170-F175 HydrophobicContact CB-CD2 4.39Å; F170-F175 HydrophobicContact CB-CE2 3.66Å; F170-F175 HydrophobicContact CD2-CE2 4.25Å; F170-F175 HydrophobicContact CD2-CZ 4.47Å; F170-F175 HydrophobicContact CG-CE2 4.13Å; F170-L315 HydrophobicContact CB-CD1 3.96Å
171	T	96.6	Very high	95.2	Very high	60 Å²	60	63.2 Å²	63.2	37%	0.368	32%	0.322	S	S	.	.			trans	-115.5	164.1	176.9	83.1	0	0	0	0	112	E173 D174 F175	T171-E173 VanDerWaalsContact CB-OE2 3.24Å; T171-E173 WeakPolarHBondContact CB-OE2 3.44Å; T171-E173 PolarHBondContact O-N 3.28Å; T171-E173 PolarHBondContact OG1-N 2.95Å; T171-E173 PolarHBondContact OG1-OE2 2.9Å; T171-D174 PolarHBondContact N-OD2 3.3Å; T171-D174 VanDerWaalsContact O-CB 3.3Å; T171-D174 WeakPolarHBondContact O-CB 3.11Å; T171-D174 PolarHBondContact O-N 3.48Å; T171-D174 VanDerWaalsContact O-N 3.1Å; T171-D174 PolarHBondContact OG1-N 3Å; T171-F175 WeakPolarHBondContact O-CD2 3.49Å; T171-F175 PolarHBondContact O-N 2.91Å
172	E	96.3	Very high	95.5	Very high	89 Å²	89	57.9 Å²	57.9	42%	0.416	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-30.6	173.5	-79.1	-61.9	153.5	0	0	112.6	D174 F175 K176 L315	E172-D174 VanDerWaalsContact C-N 3.34Å; E172-F175 PolarHBondContact O-N 3.29Å; E172-K176 VanDerWaalsContact O-CB 3.31Å; E172-K176 WeakPolarHBondContact O-CB 3.26Å; E172-K176 PolarHBondContact O-N 2.98Å; E172-L315 WeakPolarHBondContact OE1-CB 3.45Å
173	E	97.3	Very high	95.7	Very high	135 Å²	135	57 Å²	57	63%	0.631	30%	0.299	S	S	*	.	H	α-helix	trans	-65.6	-35.9	174.8	-62.7	71.5	-154.9	0	0	112.3	T171 K176 L177	T171-E173 VanDerWaalsContact CB-OE2 3.24Å; T171-E173 WeakPolarHBondContact CB-OE2 3.44Å; T171-E173 PolarHBondContact O-N 3.28Å; T171-E173 PolarHBondContact OG1-N 2.95Å; T171-E173 PolarHBondContact OG1-OE2 2.9Å; E173-K176 PolarHBondContact O-N 3.4Å; E173-L177 WeakPolarHBondContact O-CB 3.05Å; E173-L177 PolarHBondContact O-N 2.81Å
174	D	98	Very high	96.1	Very high	15 Å²	15	58.9 Å²	58.9	8%	0.08	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-49.8	174.3	-74	-40.8	0	0	0	110.7	L125 R128 F170 T171 E172 L177 Y178	L125-D174 HydrophobicContact CD1-CB 3.59Å; L125-D174 HydrophobicContact CG-CB 4.08Å; R128-D174 IonicContact CZ-OD2 3.87Å; R128-D174 IonicContact NH2-OD1 2.91Å; R128-D174 PolarHBondContact NH2-OD1 2.87Å; R128-D174 IonicContact NH2-OD2 2.65Å; R128-D174 PolarHBondContact NH2-OD2 2.94Å; F170-D174 WeakPolarHBondContact CA-OD2 3.33Å; T171-D174 PolarHBondContact N-OD2 3.3Å; T171-D174 VanDerWaalsContact O-CB 3.3Å; T171-D174 WeakPolarHBondContact O-CB 3.11Å; T171-D174 PolarHBondContact O-N 3.48Å; T171-D174 VanDerWaalsContact O-N 3.1Å; T171-D174 PolarHBondContact OG1-N 3Å; E172-D174 VanDerWaalsContact C-N 3.34Å; D174-L177 PolarHBondContact O-N 3.26Å; D174-Y178 WeakPolarHBondContact O-CB 3.4Å; D174-Y178 PolarHBondContact O-N 2.94Å
175	F	97.7	Very high	96.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.3	-39.4	179.1	-77.7	-103	0	0	0	111.3	L144 F170 T171 E172 Y178 R179 P313 S314 L315	L144-F175 HydrophobicContact CB-CE1 4.4Å; L144-F175 HydrophobicContact CD2-CZ 4.47Å; F170-F175 HydrophobicContact CB-CD2 4.39Å; F170-F175 HydrophobicContact CB-CE2 3.66Å; F170-F175 HydrophobicContact CD2-CE2 4.25Å; F170-F175 HydrophobicContact CD2-CZ 4.47Å; F170-F175 HydrophobicContact CG-CE2 4.13Å; T171-F175 WeakPolarHBondContact O-CD2 3.49Å; T171-F175 PolarHBondContact O-N 2.91Å; E172-F175 PolarHBondContact O-N 3.29Å; F175-Y178 PolarHBondContact O-N 2.87Å; F175-R179 VanDerWaalsContact O-CG 3.27Å; F175-R179 WeakPolarHBondContact O-CG 3.32Å; F175-R179 PolarHBondContact O-N 2.97Å; F175-P313 HydrophobicContact CD1-CB 3.94Å; F175-P313 HydrophobicContact CD1-CG 4.02Å; F175-P313 WeakPolarHBondContact CD1-O 3.47Å; F175-P313 HydrophobicContact CE1-CB 3.84Å; F175-P313 HydrophobicContact CE1-CG 4.31Å; F175-S314 VanDerWaalsContact CE1-C 3.41Å; F175-S314 WeakPolarHBondContact CE1-O 3.39Å; F175-L315 HydrophobicContact CD2-CB 4.41Å; F175-L315 HydrophobicContact CD2-CD1 4.25Å; F175-L315 HydrophobicContact CE2-CB 4.27Å; F175-L315 HydrophobicContact CE2-CD1 3.51Å; F175-L315 HydrophobicContact CZ-CD1 4.03Å
176	K	98.2	Very high	97.1	Very high	109 Å²	109	46 Å²	46	47%	0.474	23%	0.234	S	C	.	.	H	α-helix	trans	-60.1	-48.1	173.8	-174.7	-176.9	176.9	-62.9	0	111.4	E172 E173 Y178 R179 D180	E172-K176 VanDerWaalsContact O-CB 3.31Å; E172-K176 WeakPolarHBondContact O-CB 3.26Å; E172-K176 PolarHBondContact O-N 2.98Å; E173-K176 PolarHBondContact O-N 3.4Å; K176-Y178 VanDerWaalsContact C-N 3.35Å; K176-Y178 PolarHBondContact O-N 3.5Å; K176-R179 PolarHBondContact O-N 3.5Å; K176-D180 IonicContact NZ-OD2 2.74Å; K176-D180 PolarHBondContact NZ-OD2 3.18Å; K176-D180 WeakPolarHBondContact O-CB 2.87Å; K176-D180 VanDerWaalsContact O-CG 3.24Å; K176-D180 PolarHBondContact O-N 2.96Å
177	L	98.6	Very high	97.3	Very high	31 Å²	31	47 Å²	47	16%	0.162	24%	0.243	C	C	.	.	H	α-helix	trans	-59.9	-46.2	178	175	61.2	0	0	0	111.3	E118 A121 L122 E173 D174 R179 D180 V181	E118-L177 HydrophobicContact CB-CD1 4.08Å; E118-L177 HydrophobicContact CG-CD1 3.87Å; A121-L177 HydrophobicContact CB-CD2 3.51Å; L122-L177 HydrophobicContact CD2-CD2 4.24Å; L122-L177 HydrophobicContact CD2-CG 4.21Å; L122-L177 HydrophobicContact CG-CD2 3.97Å; L122-L177 HydrophobicContact CG-CG 4.22Å; E173-L177 WeakPolarHBondContact O-CB 3.05Å; E173-L177 PolarHBondContact O-N 2.81Å; D174-L177 PolarHBondContact O-N 3.26Å; L177-R179 VanDerWaalsContact C-N 3.34Å; L177-R179 PolarHBondContact O-N 2.93Å; L177-D180 PolarHBondContact O-N 3.22Å; L177-V181 HydrophobicContact CD1-CG2 3.96Å; L177-V181 HydrophobicContact CG-CG2 4.5Å; L177-V181 WeakPolarHBondContact O-CB 3.33Å; L177-V181 WeakPolarHBondContact O-CG2 3.38Å; L177-V181 PolarHBondContact O-N 3.05Å
178	Y	98.6	Very high	97.7	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-56.4	-47.9	175.7	173	-84.6	0	0	0	111.4	L144 H145 D174 F175 K176 D180 V181 R182 T206 F208 I298 P313	L144-Y178 HydrophobicContact CD1-CD2 4.28Å; L144-Y178 HydrophobicContact CD1-CG 4.37Å; H145-Y178 AromaticContact NE2-CE1 3.98Å; H145-Y178 AromaticContact NE2-CZ 3.86Å; H145-Y178 PolarHBondContact NE2-OH 2.89Å; D174-Y178 WeakPolarHBondContact O-CB 3.4Å; D174-Y178 PolarHBondContact O-N 2.94Å; F175-Y178 PolarHBondContact O-N 2.87Å; K176-Y178 VanDerWaalsContact C-N 3.35Å; K176-Y178 PolarHBondContact O-N 3.5Å; Y178-D180 PolarHBondContact O-N 2.9Å; Y178-V181 PolarHBondContact O-N 3.31Å; Y178-R182 HydrophobicContact CE1-CB 4.33Å; Y178-R182 VanDerWaalsContact O-CB 3.26Å; Y178-R182 WeakPolarHBondContact O-CB 3.4Å; Y178-R182 PolarHBondContact O-N 2.9Å; Y178-T206 WeakPolarHBondContact OH-CG2 2.99Å; Y178-F208 HydrophobicContact CD2-CE2 4.2Å; Y178-F208 HydrophobicContact CD2-CZ 4.1Å; Y178-F208 HydrophobicContact CE2-CE2 4.35Å; Y178-I298 HydrophobicContact CE2-CG2 4.25Å; Y178-P313 HydrophobicContact CD1-CG 3.61Å; Y178-P313 HydrophobicContact CE1-CG 3.58Å
179	R	98.4	Very high	98.1	Very high	68 Å²	68	37.6 Å²	37.6	26%	0.257	18%	0.183	S	C	.	.	H	α-helix	trans	-60.9	-44.6	177.8	-71.4	-169.9	-59.7	-113	0.7	112.1	F175 K176 L177 R182 G183 D312 P313	F175-R179 VanDerWaalsContact O-CG 3.27Å; F175-R179 WeakPolarHBondContact O-CG 3.32Å; F175-R179 PolarHBondContact O-N 2.97Å; K176-R179 PolarHBondContact O-N 3.5Å; L177-R179 VanDerWaalsContact C-N 3.34Å; L177-R179 PolarHBondContact O-N 2.93Å; R179-R182 PolarHBondContact O-NH2 2.9Å; R179-G183 PolarHBondContact O-N 2.67Å; R179-D312 VanDerWaalsContact CD-CB 3.48Å; R179-D312 HydrophobicContact CG-CB 3.62Å; R179-P313 PolarHBondContact NH1-O 3.35Å
180	D	98.6	Very high	98.2	Very high	71 Å²	71	37.1 Å²	37.1	38%	0.38	18%	0.181	S	C	.	.	H	α-helix	trans	-65.8	-40.6	-179	-69.7	-16.3	0	0	0	111.3	K176 L177 Y178 R184	K176-D180 IonicContact NZ-OD2 2.74Å; K176-D180 PolarHBondContact NZ-OD2 3.18Å; K176-D180 WeakPolarHBondContact O-CB 2.87Å; K176-D180 VanDerWaalsContact O-CG 3.24Å; K176-D180 PolarHBondContact O-N 2.96Å; L177-D180 PolarHBondContact O-N 3.22Å; Y178-D180 PolarHBondContact O-N 2.9Å; D180-R184 PolarHBondContact O-N 2.88Å; D180-R184 VanDerWaalsContact O-N 3.17Å; D180-R184 PolarHBondContact O-NE 3.27Å
181	V	98.8	Very high	98.3	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.024	21%	0.212	C	C	.	.	H	α-helix	trans	-68	-49.6	175.6	166.4	0	0	0	0	111.4	V114 L122 L177 Y178 G183 R184 I185 L242	V114-V181 HydrophobicContact CG1-CG2 4.32Å; V114-V181 HydrophobicContact CG2-CG1 3.73Å; V114-V181 HydrophobicContact CG2-CG2 4.4Å; L122-V181 HydrophobicContact CD1-CB 4.32Å; L122-V181 HydrophobicContact CD1-CG1 4.12Å; L122-V181 HydrophobicContact CD1-CG2 4.05Å; L177-V181 HydrophobicContact CD1-CG2 3.96Å; L177-V181 HydrophobicContact CG-CG2 4.5Å; L177-V181 WeakPolarHBondContact O-CB 3.33Å; L177-V181 WeakPolarHBondContact O-CG2 3.38Å; L177-V181 PolarHBondContact O-N 3.05Å; Y178-V181 PolarHBondContact O-N 3.31Å; V181-G183 PolarHBondContact O-N 2.96Å; V181-R184 VanDerWaalsContact CG2-NH2 3.31Å; V181-R184 PolarHBondContact O-N 2.72Å; V181-R184 VanDerWaalsContact O-N 3.08Å; V181-I185 HydrophobicContact CG1-CD1 3.85Å; V181-I185 HydrophobicContact CG1-CG1 4.43Å; V181-I185 WeakPolarHBondContact O-CG1 3.44Å; V181-I185 PolarHBondContact O-N 2.95Å; V181-L242 HydrophobicContact CG1-CD2 3.68Å
182	R	98.4	Very high	98.3	Very high	32 Å²	32	42.5 Å²	42.5	12%	0.121	21%	0.205	C	C	.	.	H	α-helix	trans	-55.9	-39.9	176	175.8	-78.4	-47.1	142.4	13.3	111.4	Y178 R179 I185 Q186 L202 V300 D312	Y178-R182 HydrophobicContact CE1-CB 4.33Å; Y178-R182 VanDerWaalsContact O-CB 3.26Å; Y178-R182 WeakPolarHBondContact O-CB 3.4Å; Y178-R182 PolarHBondContact O-N 2.9Å; R179-R182 PolarHBondContact O-NH2 2.9Å; R182-I185 PolarHBondContact O-N 3.02Å; R182-Q186 WeakPolarHBondContact O-CB 3.01Å; R182-Q186 PolarHBondContact O-N 3.44Å; R182-L202 HydrophobicContact CG-CD1 3.9Å; R182-L202 HydrophobicContact CG-CD2 4.21Å; R182-V300 HydrophobicContact CG-CG1 3.81Å; R182-D312 IonicContact CZ-OD1 2.78Å; R182-D312 IonicContact CZ-OD2 2.68Å; R182-D312 VanDerWaalsContact CZ-OD2 3.3Å; R182-D312 IonicContact NE-OD1 3.25Å; R182-D312 PolarHBondContact NE-OD1 2.7Å; R182-D312 IonicContact NE-OD2 3.7Å; R182-D312 VanDerWaalsContact NH2-CG 3.29Å; R182-D312 IonicContact NH2-OD1 3.4Å; R182-D312 PolarHBondContact NH2-OD1 2.95Å; R182-D312 VanDerWaalsContact NH2-OD1 3.12Å; R182-D312 IonicContact NH2-OD2 3.26Å; R182-D312 PolarHBondContact NH2-OD2 2.95Å
183	G	98.6	Very high	98.4	Very high	8 Å²	8	38.9 Å²	38.9	8%	0.082	19%	0.187	C	C	.	.	H	α-helix	trans	-65	-38.8	176.3	0	0	0	0	0	113.9	R179 V181 A187 R197	R179-G183 PolarHBondContact O-N 2.67Å; V181-G183 PolarHBondContact O-N 2.96Å; G183-A187 PolarHBondContact O-N 2.69Å; G183-A187 VanDerWaalsContact O-N 3.07Å; G183-R197 PolarHBondContact O-NH2 3.14Å
184	R	98.7	Very high	98.4	Very high	80 Å²	80	35.4 Å²	35.4	30%	0.302	19%	0.188	S	C	.	.	H	α-helix	trans	-69.8	-38.2	174	-75.1	178.5	-79	173.3	-15.7	112.4	V113 E118 D180 V181 A187 V188	V113-R184 HydrophobicContact CG1-CB 3.79Å; V113-R184 PolarHBondContact O-NH1 2.72Å; E118-R184 VanDerWaalsContact CD-NH2 3.26Å; E118-R184 IonicContact OE1-CZ 2.74Å; E118-R184 IonicContact OE1-NH1 3.61Å; E118-R184 PolarHBondContact OE1-NH1 2.78Å; E118-R184 IonicContact OE1-NH2 3.22Å; E118-R184 PolarHBondContact OE1-NH2 3.01Å; E118-R184 IonicContact OE2-CZ 3.53Å; E118-R184 IonicContact OE2-NH1 3.34Å; E118-R184 PolarHBondContact OE2-NH1 3.32Å; E118-R184 IonicContact OE2-NH2 2.8Å; E118-R184 PolarHBondContact OE2-NH2 2.73Å; D180-R184 PolarHBondContact O-N 2.88Å; D180-R184 VanDerWaalsContact O-N 3.17Å; D180-R184 PolarHBondContact O-NE 3.27Å; V181-R184 VanDerWaalsContact CG2-NH2 3.31Å; V181-R184 PolarHBondContact O-N 2.72Å; V181-R184 VanDerWaalsContact O-N 3.08Å; R184-A187 PolarHBondContact O-N 2.95Å; R184-V188 PolarHBondContact O-N 3.29Å
185	I	98.8	Very high	98.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-47.4	173.4	-68.8	171.5	0	0	0	110.4	V113 V181 R182 A187 V188 I189 S240 L242 V274 V300 F302	V113-I185 HydrophobicContact CG1-CG1 4.12Å; V181-I185 HydrophobicContact CG1-CD1 3.85Å; V181-I185 HydrophobicContact CG1-CG1 4.43Å; V181-I185 WeakPolarHBondContact O-CG1 3.44Å; V181-I185 PolarHBondContact O-N 2.95Å; R182-I185 PolarHBondContact O-N 3.02Å; I185-A187 VanDerWaalsContact C-N 3.28Å; I185-A187 PolarHBondContact O-N 3.28Å; I185-V188 VanDerWaalsContact O-CG1 3.29Å; I185-V188 WeakPolarHBondContact O-CG1 3.34Å; I185-V188 PolarHBondContact O-N 2.84Å; I185-I189 HydrophobicContact CG2-CD1 3.76Å; I185-I189 WeakPolarHBondContact O-CD1 3.27Å; I185-I189 VanDerWaalsContact O-CG1 3.26Å; I185-I189 WeakPolarHBondContact O-CG1 3.3Å; I185-I189 PolarHBondContact O-N 3.26Å; I185-I189 VanDerWaalsContact O-N 3.1Å; I185-S240 VanDerWaalsContact CG2-OG 3.26Å; I185-S240 WeakPolarHBondContact CG2-OG 3.28Å; I185-L242 HydrophobicContact CD1-CB 4.3Å; I185-V274 HydrophobicContact CD1-CG2 4.36Å; I185-V274 HydrophobicContact CG1-CG1 4.21Å; I185-V274 HydrophobicContact CG1-CG2 4.13Å; I185-V274 HydrophobicContact CG2-CG1 4.38Å; I185-V300 HydrophobicContact CD1-CG2 4.45Å; I185-F302 HydrophobicContact CG2-CE2 3.98Å; I185-F302 HydrophobicContact CG2-CZ 4.3Å
186	Q	98.8	Very high	98.4	Very high	23 Å²	23	39.6 Å²	39.6	11%	0.107	21%	0.21	C	C	.	.	H	α-helix	trans	-56.7	-43.4	174.9	-171.2	-166	29.9	0	0	111.6	R182 A190 R197 M200 F302	R182-Q186 WeakPolarHBondContact O-CB 3.01Å; R182-Q186 PolarHBondContact O-N 3.44Å; Q186-A190 WeakPolarHBondContact O-CB 3.23Å; Q186-A190 PolarHBondContact O-N 2.95Å; Q186-A190 VanDerWaalsContact O-N 3.11Å; Q186-R197 HydrophobicContact CG-CG 4.14Å; Q186-M200 HydrophobicContact CB-CE 4.13Å; Q186-M200 HydrophobicContact CG-CE 3.37Å; Q186-M200 PolarHBondContact NE2-O 3.1Å; Q186-M200 WeakPolarHBondContact O-CE 3.11Å; Q186-F302 HydrophobicContact CB-CD1 4.44Å; Q186-F302 HydrophobicContact CB-CE1 3.57Å; Q186-F302 HydrophobicContact CB-CZ 3.68Å; Q186-F302 HydrophobicContact CG-CD1 4.06Å; Q186-F302 HydrophobicContact CG-CE1 3.62Å; Q186-F302 HydrophobicContact CG-CZ 4.2Å
187	A	98.7	Very high	98.4	Very high	30 Å²	30	39.8 Å²	39.8	25%	0.248	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-47.2	-179.7	0	0	0	0	0	112.4	G183 R184 I185 I189 A190 E191	G183-A187 PolarHBondContact O-N 2.69Å; G183-A187 VanDerWaalsContact O-N 3.07Å; R184-A187 PolarHBondContact O-N 2.95Å; I185-A187 VanDerWaalsContact C-N 3.28Å; I185-A187 PolarHBondContact O-N 3.28Å; A187-I189 VanDerWaalsContact C-N 3.33Å; A187-I189 PolarHBondContact O-N 2.68Å; A187-A190 PolarHBondContact O-N 3.05Å; A187-E191 WeakPolarHBondContact O-CB 3.45Å; A187-E191 PolarHBondContact O-N 3.46Å
188	V	98.8	Very high	98.3	Very high	14 Å²	14	43.2 Å²	43.2	9%	0.085	23%	0.23	C	C	.	.	H	α-helix	trans	-67.5	-34.2	-178.2	73	0	0	0	0	112.2	P80 T110 V113 R184 I185 T192 F276	P80-V188 HydrophobicContact CG-CG2 3.62Å; T110-V188 HydrophobicContact CG2-CG2 4.46Å; V113-V188 HydrophobicContact CG2-CB 4.12Å; V113-V188 HydrophobicContact CG2-CG1 3.9Å; V113-V188 HydrophobicContact CG2-CG2 4.17Å; R184-V188 PolarHBondContact O-N 3.29Å; I185-V188 VanDerWaalsContact O-CG1 3.29Å; I185-V188 WeakPolarHBondContact O-CG1 3.34Å; I185-V188 PolarHBondContact O-N 2.84Å; V188-T192 VanDerWaalsContact O-CB 3.22Å; V188-T192 WeakPolarHBondContact O-CB 3.5Å; V188-T192 PolarHBondContact O-N 2.83Å; V188-T192 PolarHBondContact O-OG1 2.98Å; V188-F276 HydrophobicContact CG1-CE1 4.17Å; V188-F276 HydrophobicContact CG1-CZ 4.44Å; V188-F276 HydrophobicContact CG2-CE1 4.42Å; V188-F276 HydrophobicContact CG2-CZ 4.3Å
189	I	98.8	Very high	98.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-49.5	174.3	-67.6	167	0	0	0	109.8	I185 A187 E191 T192 F193 L195 M200 Y238 F276 F302	I185-I189 HydrophobicContact CG2-CD1 3.76Å; I185-I189 WeakPolarHBondContact O-CD1 3.27Å; I185-I189 VanDerWaalsContact O-CG1 3.26Å; I185-I189 WeakPolarHBondContact O-CG1 3.3Å; I185-I189 PolarHBondContact O-N 3.26Å; I185-I189 VanDerWaalsContact O-N 3.1Å; A187-I189 VanDerWaalsContact C-N 3.33Å; A187-I189 PolarHBondContact O-N 2.68Å; I189-E191 PolarHBondContact O-N 3.28Å; I189-T192 PolarHBondContact O-N 2.96Å; I189-F193 HydrophobicContact CG2-CD2 3.94Å; I189-F193 HydrophobicContact CG2-CE2 4.3Å; I189-F193 WeakPolarHBondContact O-CD2 3.43Å; I189-F193 PolarHBondContact O-N 3.2Å; I189-L195 HydrophobicContact CG2-CD1 4.48Å; I189-M200 HydrophobicContact CB-CE 4.01Å; I189-M200 HydrophobicContact CG2-CE 3.94Å; I189-M200 HydrophobicContact CG2-SD 3.85Å; I189-Y238 HydrophobicContact CG2-CD1 3.97Å; I189-Y238 HydrophobicContact CG2-CG 3.97Å; I189-F276 HydrophobicContact CB-CD2 4.31Å; I189-F276 HydrophobicContact CD1-CB 4.15Å; I189-F276 HydrophobicContact CG1-CB 3.92Å; I189-F276 HydrophobicContact CG1-CD1 4.49Å; I189-F276 HydrophobicContact CG1-CD2 3.56Å; I189-F276 HydrophobicContact CG1-CE2 4.11Å; I189-F276 HydrophobicContact CG1-CG 3.76Å; I189-F302 HydrophobicContact CD1-CD2 3.73Å; I189-F302 HydrophobicContact CD1-CE2 3.55Å
190	A	98.6	Very high	98.3	Very high	5 Å²	5	42.6 Å²	42.6	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-44.4	-179.6	0	0	0	0	0	111.9	Q186 A187 G194 L195 R197 M200	Q186-A190 WeakPolarHBondContact O-CB 3.23Å; Q186-A190 PolarHBondContact O-N 2.95Å; Q186-A190 VanDerWaalsContact O-N 3.11Å; A187-A190 PolarHBondContact O-N 3.05Å; A190-G194 WeakPolarHBondContact O-CA 3.2Å; A190-G194 PolarHBondContact O-N 2.73Å; A190-L195 HydrophobicContact CB-CB 4.17Å; A190-L195 PolarHBondContact O-N 3.18Å; A190-R197 HydrophobicContact CB-CB 3.8Å; A190-R197 HydrophobicContact CB-CG 4.34Å; A190-M200 HydrophobicContact CB-CE 4.27Å
191	E	98.1	Very high	98.3	Very high	140 Å²	140	42.5 Å²	42.5	65%	0.654	23%	0.227	S	C	*	.	H	α-helix	trans	-61.9	-47.5	175.8	-176.5	176	-172.7	0	0	111.8	A187 I189 F193 G194	A187-E191 WeakPolarHBondContact O-CB 3.45Å; A187-E191 PolarHBondContact O-N 3.46Å; I189-E191 PolarHBondContact O-N 3.28Å; E191-F193 PolarHBondContact O-N 3.48Å; E191-G194 PolarHBondContact O-N 3.09Å
192	T	98.4	Very high	98.3	Very high	35 Å²	35	42.8 Å²	42.8	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-41.3	-175.6	-60.9	0	0	0	0	112.6	V82 A108 V188 I189 F276	V82-T192 HydrophobicContact CG1-CG2 4.41Å; V82-T192 HydrophobicContact CG2-CG2 3.62Å; A108-T192 HydrophobicContact CB-CG2 4.18Å; V188-T192 VanDerWaalsContact O-CB 3.22Å; V188-T192 WeakPolarHBondContact O-CB 3.5Å; V188-T192 PolarHBondContact O-N 2.83Å; V188-T192 PolarHBondContact O-OG1 2.98Å; I189-T192 PolarHBondContact O-N 2.96Å; T192-F276 HydrophobicContact CG2-CE2 3.74Å; T192-F276 HydrophobicContact CG2-CZ 3.94Å; T192-F276 WeakPolarHBondContact OG1-CZ 3.31Å
193	F	98.1	Very high	98.3	Very high	12 Å²	12	41.3 Å²	41.3	5%	0.053	22%	0.223	C	C	.	.	H	α-helix	trans	-95.2	-1.3	-178.5	-64.2	-61.8	0	0	0	113.8	K104 I189 E191 L195 Y238 F276	K104-F193 VanDerWaalsContact O-CD1 3.23Å; K104-F193 WeakPolarHBondContact O-CD1 3.4Å; I189-F193 HydrophobicContact CG2-CD2 3.94Å; I189-F193 HydrophobicContact CG2-CE2 4.3Å; I189-F193 WeakPolarHBondContact O-CD2 3.43Å; I189-F193 PolarHBondContact O-N 3.2Å; E191-F193 PolarHBondContact O-N 3.48Å; F193-L195 HydrophobicContact CB-CD1 4.11Å; F193-L195 HydrophobicContact CB-CD2 3.98Å; F193-L195 HydrophobicContact CB-CG 3.85Å; F193-Y238 HydrophobicContact CB-CE1 4.32Å; F193-Y238 AromaticContact CD2-CD1 3.85Å; F193-Y238 HydrophobicContact CD2-CD1 3.85Å; F193-Y238 AromaticContact CD2-CE1 3.71Å; F193-Y238 HydrophobicContact CD2-CE1 3.71Å; F193-Y238 HydrophobicContact CE2-CD1 4.01Å; F193-Y238 HydrophobicContact CE2-CE1 4.21Å; F193-Y238 HydrophobicContact CG-CE1 4.1Å; F193-F276 HydrophobicContact CD2-CE2 4.45Å; F193-F276 AromaticContact CE2-CD2 3.72Å; F193-F276 HydrophobicContact CE2-CD2 3.72Å; F193-F276 AromaticContact CE2-CE2 3.85Å; F193-F276 HydrophobicContact CE2-CE2 3.85Å; F193-F276 HydrophobicContact CZ-CD2 4.32Å; F193-F276 HydrophobicContact CZ-CE2 4.36Å
194	G	97.6	Very high	98.1	Very high	62 Å²	62	47.4 Å²	47.4	64%	0.639	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.9	46.4	179.1	0	0	0	0	0	112.9	A190 E191	A190-G194 WeakPolarHBondContact O-CA 3.2Å; A190-G194 PolarHBondContact O-N 2.73Å; E191-G194 PolarHBondContact O-N 3.09Å
195	L	97.9	Very high	98	Very high	29 Å²	29	45.2 Å²	45.2	15%	0.152	24%	0.243	C	C	.	.			trans	-101.1	157.5	-177.3	-43.6	176.2	0	0	0	111.3	G99 I189 A190 F193 R197 M200 Y238	G99-L195 WeakPolarHBondContact O-CA 3.47Å; I189-L195 HydrophobicContact CG2-CD1 4.48Å; A190-L195 HydrophobicContact CB-CB 4.17Å; A190-L195 PolarHBondContact O-N 3.18Å; F193-L195 HydrophobicContact CB-CD1 4.11Å; F193-L195 HydrophobicContact CB-CD2 3.98Å; F193-L195 HydrophobicContact CB-CG 3.85Å; L195-R197 PolarHBondContact O-N 2.86Å; L195-M200 HydrophobicContact CD1-SD 3.89Å; L195-Y238 HydrophobicContact CD1-CD2 4.19Å; L195-Y238 HydrophobicContact CD1-CE1 3.85Å; L195-Y238 HydrophobicContact CD1-CE2 3.48Å; L195-Y238 VanDerWaalsContact CD1-CE2 3.48Å; L195-Y238 WeakPolarHBondContact CD1-OH 3.31Å; L195-Y238 WeakPolarHBondContact CD2-OH 3.37Å
196	D	97.5	Very high	97.8	Very high	74 Å²	74	45.3 Å²	45.3	40%	0.396	24%	0.243	S	C	.	.			trans	-77.8	108.7	161	-171.7	-25.2	0	0	0	109.2	G99 T198 L199	G99-D196 PolarHBondContact O-N 2.92Å; D196-T198 VanDerWaalsContact CG-OG1 3.31Å; D196-T198 PolarHBondContact O-N 3.23Å; D196-T198 VanDerWaalsContact O-N 3.12Å; D196-T198 WeakPolarHBondContact OD1-CB 3.2Å; D196-T198 PolarHBondContact OD1-N 2.92Å; D196-T198 PolarHBondContact OD1-OG1 3.18Å; D196-T198 PolarHBondContact OD2-OG1 3.07Å; D196-L199 HydrophobicContact CB-CB 4.3Å; D196-L199 HydrophobicContact CB-CD1 3.91Å; D196-L199 HydrophobicContact CB-CG 4.01Å; D196-L199 PolarHBondContact O-N 3.28Å
197	R	97.6	Very high	97.7	Very high	114 Å²	114	45.6 Å²	45.6	43%	0.43	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-54.3	-32	178.7	-178.6	-176.6	168.9	-165.2	-3.9	112.8	G183 Q186 A190 L195 L199 M200	G183-R197 PolarHBondContact O-NH2 3.14Å; Q186-R197 HydrophobicContact CG-CG 4.14Å; A190-R197 HydrophobicContact CB-CB 3.8Å; A190-R197 HydrophobicContact CB-CG 4.34Å; L195-R197 PolarHBondContact O-N 2.86Å; R197-L199 PolarHBondContact O-N 3.31Å; R197-M200 PolarHBondContact O-N 3.08Å
198	T	97.7	Very high	97.7	Very high	103 Å²	103	44.3 Å²	44.3	63%	0.632	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-73.5	-17.5	-177.4	70.2	0	0	0	0	113	D196	D196-T198 VanDerWaalsContact CG-OG1 3.31Å; D196-T198 PolarHBondContact O-N 3.23Å; D196-T198 VanDerWaalsContact O-N 3.12Å; D196-T198 WeakPolarHBondContact OD1-CB 3.2Å; D196-T198 PolarHBondContact OD1-N 2.92Å; D196-T198 PolarHBondContact OD1-OG1 3.18Å; D196-T198 PolarHBondContact OD2-OG1 3.07Å
199	L	98	Very high	97.7	Very high	58 Å²	58	44 Å²	44	30%	0.304	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-99	1.4	178	-57.9	-179.6	0	0	0	113	P98 C100 D196 R197 Y201	P98-L199 VanDerWaalsContact O-CD1 3.27Å; P98-L199 WeakPolarHBondContact O-CD1 3.42Å; C100-L199 HydrophobicContact CB-CB 4.11Å; C100-L199 PolarHBondContact SG-O 2.85Å; C100-L199 VanDerWaalsContact SG-O 3.4Å; D196-L199 HydrophobicContact CB-CB 4.3Å; D196-L199 HydrophobicContact CB-CD1 3.91Å; D196-L199 HydrophobicContact CB-CG 4.01Å; D196-L199 PolarHBondContact O-N 3.28Å; R197-L199 PolarHBondContact O-N 3.31Å; L199-Y201 WeakPolarHBondContact O-CE2 3.21Å
200	M	98.3	Very high	97.7	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.241	C	C	.	.			trans	-108.7	115.1	177	-175.5	173.7	78.3	0	0	109.6	Q186 I189 A190 L195 R197 Y238 F302	Q186-M200 HydrophobicContact CB-CE 4.13Å; Q186-M200 HydrophobicContact CG-CE 3.37Å; Q186-M200 PolarHBondContact NE2-O 3.1Å; Q186-M200 WeakPolarHBondContact O-CE 3.11Å; I189-M200 HydrophobicContact CB-CE 4.01Å; I189-M200 HydrophobicContact CG2-CE 3.94Å; I189-M200 HydrophobicContact CG2-SD 3.85Å; A190-M200 HydrophobicContact CB-CE 4.27Å; L195-M200 HydrophobicContact CD1-SD 3.89Å; R197-M200 PolarHBondContact O-N 3.08Å; M200-Y238 HydrophobicContact SD-CD2 3.79Å; M200-Y238 HydrophobicContact SD-CE2 4.28Å; M200-Y238 HydrophobicContact SD-CG 4.32Å; M200-F302 HydrophobicContact CE-CB 4.49Å; M200-F302 HydrophobicContact CE-CD1 4.21Å; M200-F302 HydrophobicContact CE-CD2 4.45Å; M200-F302 HydrophobicContact CE-CG 4.12Å; M200-F302 HydrophobicContact CG-CB 3.61Å; M200-F302 HydrophobicContact CG-CD1 4.25Å; M200-F302 HydrophobicContact CG-CG 4.11Å; M200-F302 HydrophobicContact SD-CB 3.95Å; M200-F302 HydrophobicContact SD-CG 4.21Å
201	Y	98.6	Very high	97.6	Very high	68 Å²	68	46.7 Å²	46.7	27%	0.267	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	144.3	-171.5	-50	-82.6	0	0	0	111.3	L199 F302 T303 P306 A309	L199-Y201 WeakPolarHBondContact O-CE2 3.21Å; Y201-F302 CarbonylContact O-C 3.54Å; Y201-F302 WeakPolarHBondContact O-CA 3.12Å; Y201-F302 WeakPolarHBondContact O-CB 3.27Å; Y201-T303 PolarHBondContact N-O 3.03Å; Y201-T303 PolarHBondContact O-N 3Å; Y201-P306 HydrophobicContact CD2-CB 4.3Å; Y201-P306 HydrophobicContact CE1-CB 4.45Å; Y201-P306 HydrophobicContact CE2-CB 3.83Å; Y201-P306 HydrophobicContact CE2-CG 4.34Å; Y201-A309 HydrophobicContact CD1-CB 4.13Å; Y201-A309 HydrophobicContact CG-CB 3.91Å
202	L	98.5	Very high	97.6	Very high	11 Å²	11	41.6 Å²	41.6	6%	0.058	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	140.2	168.2	-177	66.1	0	0	0	109.2	H145 R182 V300 F302 A309 I310	H145-L202 VanDerWaalsContact CE1-CD2 3.44Å; H145-L202 WeakPolarHBondContact CE1-CD2 3.29Å; R182-L202 HydrophobicContact CG-CD1 3.9Å; R182-L202 HydrophobicContact CG-CD2 4.21Å; L202-V300 HydrophobicContact CD1-CG1 3.68Å; L202-F302 HydrophobicContact CB-CE1 4.48Å; L202-F302 HydrophobicContact CD1-CE1 4.15Å; L202-A309 WeakPolarHBondContact O-CA 3.47Å; L202-I310 HydrophobicContact CB-CG1 4.25Å; L202-I310 HydrophobicContact CD2-CD1 4.29Å; L202-I310 HydrophobicContact CD2-CG1 4.04Å; L202-I310 HydrophobicContact CG-CD1 4.11Å; L202-I310 HydrophobicContact CG-CG1 3.81Å; L202-I310 PolarHBondContact O-N 2.72Å
203	T	98.3	Very high	97.6	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	176.4	177.6	-160.1	0	0	0	0	112.9	T206 F236 S301 T303 H308 I310	T203-T206 PolarHBondContact O-OG1 2.8Å; T203-F236 HydrophobicContact CG2-CD1 3.61Å; T203-F236 HydrophobicContact CG2-CE1 3.81Å; T203-S301 PolarHBondContact N-O 3.43Å; T203-S301 PolarHBondContact O-OG 3.46Å; T203-T303 HydrophobicContact CG2-CG2 4.37Å; T203-H308 WeakPolarHBondContact CB-O 3.23Å; T203-H308 PolarHBondContact OG1-O 3.36Å; T203-I310 WeakPolarHBondContact O-CD1 3.49Å
204	K	95.4	Very high	97.6	Very high	135 Å²	135	45.8 Å²	45.8	59%	0.587	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.6	-176	67.2	-179	-178.6	-178.5	0	111.4	F236 I310	K204-F236 WeakPolarHBondContact O-CE1 3.48Å; K204-I310 HydrophobicContact CB-CD1 4.12Å; K204-I310 HydrophobicContact CB-CG2 4.3Å; K204-I310 HydrophobicContact CD-CG2 4.41Å; K204-I310 HydrophobicContact CG-CG2 4.39Å
205	P	94.8	Very high	97.5	Very high	34 Å²	34	46 Å²	46	22%	0.221	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-80.2	152.6	1.2	34	-38.2	0	0	0	112.9	F207 Y233 F236 S301	P205-F207 HydrophobicContact CB-CD1 3.92Å; P205-F207 HydrophobicContact CB-CE1 4.24Å; P205-F207 HydrophobicContact CG-CD1 4.28Å; P205-F207 HydrophobicContact CG-CE1 4.09Å; P205-Y233 VanDerWaalsContact CD-CD1 3.41Å; P205-Y233 HydrophobicContact CG-CD1 3.71Å; P205-Y233 HydrophobicContact CG-CE1 3.38Å; P205-Y233 HydrophobicContact CG-CG 4.47Å; P205-F236 HydrophobicContact CG-CZ 4.08Å; P205-F236 WeakPolarHBondContact O-CZ 3.44Å; P205-S301 PolarHBondContact O-OG 2.99Å
206	T	94.9	Very high	97.4	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.8	169.1	-76.1	0	0	0	0	106.6	D143 Y178 T203 T299 V300	D143-T206 VanDerWaalsContact CG-O 3.23Å; D143-T206 VanDerWaalsContact OD1-O 3.07Å; Y178-T206 WeakPolarHBondContact OH-CG2 2.99Å; T203-T206 PolarHBondContact O-OG1 2.8Å; T206-T299 VanDerWaalsContact CA-O 3.31Å; T206-T299 WeakPolarHBondContact CA-O 3.49Å; T206-T299 VanDerWaalsContact CG2-O 3.31Å; T206-T299 WeakPolarHBondContact CG2-O 3.3Å; T206-V300 HydrophobicContact CG2-CB 4.45Å; T206-V300 HydrophobicContact CG2-CG1 4.5Å; T206-V300 HydrophobicContact CG2-CG2 4.17Å
207	F	97.3	Very high	97.3	Very high	30 Å²	30	48.7 Å²	48.7	13%	0.132	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	151.1	-166	58.2	-89.1	0	0	0	113.4	I141 L142 D143 P205 I298 T299	I141-F207 HydrophobicContact CB-CB 4.49Å; I141-F207 HydrophobicContact CB-CD2 4.06Å; I141-F207 HydrophobicContact CB-CG 4.49Å; I141-F207 HydrophobicContact CG2-CD2 3.61Å; I141-F207 HydrophobicContact CG2-CE2 3.88Å; I141-F207 HydrophobicContact CG2-CG 4.42Å; L142-F207 CarbonylContact O-C 3.59Å; L142-F207 WeakPolarHBondContact O-CA 3.4Å; D143-F207 HydrophobicContact CB-CB 4.2Å; P205-F207 HydrophobicContact CB-CD1 3.92Å; P205-F207 HydrophobicContact CB-CE1 4.24Å; P205-F207 HydrophobicContact CG-CD1 4.28Å; P205-F207 HydrophobicContact CG-CE1 4.09Å; F207-I298 WeakPolarHBondContact O-CA 3.36Å; F207-T299 HydrophobicContact CE1-CG2 4.42Å; F207-T299 PolarHBondContact N-O 3.49Å; F207-T299 VanDerWaalsContact N-O 3.12Å; F207-T299 PolarHBondContact O-N 2.74Å
208	F	98.6	Very high	97	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.009	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	139.3	161.4	-65.2	-98.2	0	0	0	109.1	L122 L125 A126 I141 L142 L144 Y178 L244 A297 I298	L122-F208 HydrophobicContact CB-CE1 4.44Å; L122-F208 HydrophobicContact CD2-CZ 4.31Å; L125-F208 HydrophobicContact CD1-CZ 4.22Å; L125-F208 HydrophobicContact CD2-CE1 4.35Å; L125-F208 HydrophobicContact CD2-CE2 4.04Å; L125-F208 HydrophobicContact CD2-CZ 3.84Å; A126-F208 HydrophobicContact CB-CB 4.19Å; A126-F208 HydrophobicContact CB-CD1 3.43Å; A126-F208 VanDerWaalsContact CB-CD1 3.43Å; A126-F208 HydrophobicContact CB-CE1 4.02Å; A126-F208 HydrophobicContact CB-CG 4.02Å; I141-F208 CarbonylContact C-O 3.55Å; I141-F208 WeakPolarHBondContact CA-O 3.49Å; L142-F208 HydrophobicContact CB-CB 4.27Å; L142-F208 PolarHBondContact N-O 3.11Å; L142-F208 PolarHBondContact O-N 3.22Å; L144-F208 HydrophobicContact CD1-CE2 3.64Å; L144-F208 HydrophobicContact CD1-CZ 4.32Å; L144-F208 HydrophobicContact CG-CD2 4.36Å; L144-F208 HydrophobicContact CG-CE2 3.86Å; Y178-F208 HydrophobicContact CD2-CE2 4.2Å; Y178-F208 HydrophobicContact CD2-CZ 4.1Å; Y178-F208 HydrophobicContact CE2-CE2 4.35Å; F208-L244 HydrophobicContact CD1-CD1 3.99Å; F208-L244 HydrophobicContact CE1-CD1 4.1Å; F208-A297 CarbonylContact C-O 3.33Å; F208-A297 WeakPolarHBondContact CA-O 3.28Å; F208-I298 HydrophobicContact CD1-CD1 3.94Å; F208-I298 HydrophobicContact CD1-CG1 3.66Å; F208-I298 HydrophobicContact CE1-CD1 3.29Å; F208-I298 HydrophobicContact CE1-CG1 3.58Å; F208-I298 HydrophobicContact CE2-CD1 4.48Å; F208-I298 HydrophobicContact CG-CG1 4.41Å; F208-I298 HydrophobicContact CZ-CD1 3.61Å; F208-I298 HydrophobicContact CZ-CG1 4.22Å
209	S	98.3	Very high	96.7	Very high	9 Å²	9	47.4 Å²	47.4	6%	0.063	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.7	173.4	57.7	0	0	0	0	109.8	Y296 A297	S209-Y296 VanDerWaalsContact O-CA 3.31Å; S209-Y296 WeakPolarHBondContact O-CA 3.38Å; S209-A297 PolarHBondContact N-O 3.21Å; S209-A297 PolarHBondContact O-N 2.98Å; S209-A297 PolarHBondContact OG-O 3.16Å
210	R	98.5	Very high	96.1	Very high	51 Å²	51	50.6 Å²	50.6	19%	0.192	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	117.3	166.3	177.1	-171.3	77.3	-159.5	3.7	108.4	L130 A139 S140 T294 R295 Y296	L130-R210 HydrophobicContact CD1-CB 3.66Å; L130-R210 PolarHBondContact O-NH1 3.47Å; A139-R210 WeakPolarHBondContact CA-O 3.23Å; S140-R210 PolarHBondContact N-O 3.24Å; S140-R210 PolarHBondContact O-N 2.8Å; S140-R210 PolarHBondContact OG-NH2 3.48Å; R210-T294 HydrophobicContact CG-CG2 3.47Å; R210-T294 VanDerWaalsContact CG-CG2 3.47Å; R210-R295 WeakPolarHBondContact CA-O 3.37Å; R210-Y296 HydrophobicContact CB-CD1 3.93Å; R210-Y296 HydrophobicContact CB-CE1 3.55Å; R210-Y296 VanDerWaalsContact CD-OH 3.24Å; R210-Y296 WeakPolarHBondContact CD-OH 3.28Å; R210-Y296 HydrophobicContact CG-CD1 4.22Å; R210-Y296 HydrophobicContact CG-CE1 3.53Å; R210-Y296 HydrophobicContact CG-CE2 4.38Å
211	I	98.4	Very high	95.8	Very high	9 Å²	9	50.6 Å²	50.6	5%	0.046	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.7	-175.9	-57.6	175.8	0	0	0	110.2	G138 A139 Y223 V290 T294 R295	G138-I211 CarbonylContact O-C 3.38Å; G138-I211 VanDerWaalsContact O-CA 3.23Å; G138-I211 WeakPolarHBondContact O-CA 3.05Å; A139-I211 HydrophobicContact CB-CG1 4.28Å; I211-Y223 HydrophobicContact CD1-CD2 4.09Å; I211-Y223 HydrophobicContact CD1-CG 3.99Å; I211-Y223 HydrophobicContact CG1-CG 4.48Å; I211-Y223 HydrophobicContact CG2-CD1 3.63Å; I211-Y223 HydrophobicContact CG2-CD2 3.85Å; I211-Y223 HydrophobicContact CG2-CE1 3.28Å; I211-Y223 HydrophobicContact CG2-CE2 3.51Å; I211-Y223 HydrophobicContact CG2-CG 3.9Å; I211-V290 HydrophobicContact CB-CG2 4.42Å; I211-V290 HydrophobicContact CG2-CB 4.47Å; I211-V290 HydrophobicContact CG2-CG2 3.77Å; I211-T294 CarbonylContact O-C 3.5Å; I211-T294 WeakPolarHBondContact O-CA 3.36Å; I211-R295 HydrophobicContact CB-CB 4.41Å; I211-R295 PolarHBondContact N-O 2.78Å; I211-R295 PolarHBondContact O-N 3.29Å
212	N	97.9	Very high	95.6	Very high	33 Å²	33	51 Å²	51	18%	0.176	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	-171.1	174.2	70.3	32.9	0	0	0	111.9	G138 T214 Y223 G293	G138-N212 WeakPolarHBondContact CA-OD1 3.5Å; G138-N212 PolarHBondContact O-N 3.44Å; N212-T214 VanDerWaalsContact C-N 3.32Å; N212-T214 PolarHBondContact O-N 2.74Å; N212-T214 WeakPolarHBondContact OD1-CB 3.35Å; N212-T214 PolarHBondContact OD1-N 2.77Å; N212-T214 PolarHBondContact OD1-OG1 2.84Å; N212-Y223 PolarHBondContact O-OH 3.29Å; N212-G293 WeakPolarHBondContact CB-O 3.18Å
213	S	97.4	Very high	95.4	Very high	71 Å²	71	52.1 Å²	52.1	50%	0.497	27%	0.272	S	S	.	.	S	Bend	trans	-84.6	6.6	-176.9	57.1	0	0	0	0	115.2	V290	S213-V290 WeakPolarHBondContact CA-O 3.22Å; S213-V290 VanDerWaalsContact CB-O 3.26Å; S213-V290 WeakPolarHBondContact CB-O 3.15Å
214	T	97.4	Very high	95.3	Very high	65 Å²	65	54.2 Å²	54.2	40%	0.399	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-65.5	135.5	176	-51.3	0	0	0	0	109.9	G138 N212	G138-T214 VanDerWaalsContact CA-O 3.23Å; G138-T214 WeakPolarHBondContact CA-O 3.29Å; G138-T214 PolarHBondContact N-O 2.9Å; N212-T214 VanDerWaalsContact C-N 3.32Å; N212-T214 PolarHBondContact O-N 2.74Å; N212-T214 WeakPolarHBondContact OD1-CB 3.35Å; N212-T214 PolarHBondContact OD1-N 2.77Å; N212-T214 PolarHBondContact OD1-OG1 2.84Å
215	A	96.9	Very high	95.4	Very high	67 Å²	67	51.6 Å²	51.6	55%	0.554	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-63.9	139.7	-178.9	0	0	0	0	0	111.6	G137	G137-A215 WeakPolarHBondContact CA-O 3.16Å
216	A	95.6	Very high	95.5	Very high	30 Å²	30	53.3 Å²	53.3	25%	0.248	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-58.5	142.1	175.4	0	0	0	0	0	112.2	D221 E222 W224	A216-D221 HydrophobicContact CB-CB 3.5Å; A216-E222 HydrophobicContact CB-CG 3.76Å; A216-W224 HydrophobicContact CB-CH2 3.64Å; A216-W224 HydrophobicContact CB-CZ3 4.33Å
217	K	94.8	Very high	95.6	Very high	128 Å²	128	55.9 Å²	55.9	56%	0.557	29%	0.292	S	S	*	.	S	Bend	trans	-116.3	-22.7	175.7	-60.3	-60.5	-176.4	179.7	0	112	E136 D221	E136-K217 HydrophobicContact CB-CB 4.22Å; E136-K217 HydrophobicContact CB-CG 3.85Å; K217-D221 PolarHBondContact N-OD2 2.79Å
218	T	92	Very high	95.6	Very high	29 Å²	29	55.4 Å²	55.4	18%	0.178	29%	0.291	C	S	.	.	S	Bend	trans	-135	166	178.2	69	0	0	0	0	109.9	K153 H220 D221	K153-T218 HydrophobicContact CB-CG2 3.72Å; K153-T218 HydrophobicContact CD-CG2 4.28Å; K153-T218 HydrophobicContact CG-CG2 3.76Å; T218-H220 PolarHBondContact O-N 3.13Å; T218-H220 PolarHBondContact OG1-N 2.81Å; T218-D221 PolarHBondContact N-OD2 3.42Å; T218-D221 WeakPolarHBondContact O-CB 3.22Å; T218-D221 PolarHBondContact O-N 3.04Å; T218-D221 PolarHBondContact OG1-N 2.9Å; T218-D221 PolarHBondContact OG1-OD2 3.2Å
219	Q	90.1	Very high	95.6	Very high	161 Å²	161	55.6 Å²	55.6	75%	0.752	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-60.6	-31	173.4	-171.5	179.1	3.1	0	0	112.3	D221 E222	Q219-D221 PolarHBondContact O-N 2.82Å; Q219-E222 PolarHBondContact O-N 2.76Å
220	H	87.3	Confident	95.5	Very high	125 Å²	125	55.7 Å²	55.7	58%	0.579	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-68	-15.4	176.5	-61	-56.4	0	0	0	113.4	F155 T218	F155-H220 HydrophobicContact CE2-CB 4.39Å; F155-H220 AromaticContact CE2-CD2 3.77Å; F155-H220 AromaticContact CE2-CG 3.83Å; F155-H220 AromaticContact CE2-NE2 3.97Å; F155-H220 HydrophobicContact CZ-CB 4.18Å; T218-H220 PolarHBondContact O-N 3.13Å; T218-H220 PolarHBondContact OG1-N 2.81Å
221	D	90.8	Very high	95.4	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-86.1	-11.8	173.3	-57.5	-53	0	0	0	113	S135 G137 A216 K217 T218 Q219 Y223 W224	S135-D221 VanDerWaalsContact CB-OD1 3.32Å; S135-D221 WeakPolarHBondContact CB-OD1 3.48Å; S135-D221 PolarHBondContact OG-OD1 2.95Å; G137-D221 WeakPolarHBondContact CA-OD1 3.08Å; A216-D221 HydrophobicContact CB-CB 3.5Å; K217-D221 PolarHBondContact N-OD2 2.79Å; T218-D221 PolarHBondContact N-OD2 3.42Å; T218-D221 WeakPolarHBondContact O-CB 3.22Å; T218-D221 PolarHBondContact O-N 3.04Å; T218-D221 PolarHBondContact OG1-N 2.9Å; T218-D221 PolarHBondContact OG1-OD2 3.2Å; Q219-D221 PolarHBondContact O-N 2.82Å; D221-Y223 VanDerWaalsContact O-CD1 3.23Å; D221-Y223 WeakPolarHBondContact O-CD1 3.45Å; D221-Y223 PolarHBondContact O-N 2.74Å; D221-Y223 VanDerWaalsContact O-N 3.13Å; D221-W224 WeakPolarHBondContact O-CZ3 3.42Å
222	E	94.2	Very high	95.3	Very high	77 Å²	77	62.3 Å²	62.3	36%	0.36	33%	0.329	S	S	.	.			trans	-88.6	72	-175.6	-56.1	-168.6	150	0	0	111.7	A216 Q219 W224 H225	A216-E222 HydrophobicContact CB-CG 3.76Å; Q219-E222 PolarHBondContact O-N 2.76Å; E222-W224 VanDerWaalsContact C-N 3.29Å; E222-W224 HydrophobicContact CB-CH2 4.06Å; E222-W224 HydrophobicContact CB-CZ2 3.9Å; E222-W224 HydrophobicContact CB-CZ3 4.48Å; E222-W224 HydrophobicContact CG-CH2 3.89Å; E222-W224 HydrophobicContact CG-CZ2 3.81Å; E222-W224 PolarHBondContact O-N 3.24Å; E222-H225 VanDerWaalsContact CB-NE2 3.32Å; E222-H225 WeakPolarHBondContact CB-NE2 3.22Å; E222-H225 PolarHBondContact O-CD2 2.72Å; E222-H225 IonicContact OE2-CD2 3.81Å; E222-H225 IonicContact OE2-CE1 3.86Å; E222-H225 IonicContact OE2-NE2 3.84Å; E222-H225 PolarHBondContact OE2-NE2 2.87Å
223	Y	95.2	Very high	95.1	Very high	34 Å²	34	64.8 Å²	64.8	13%	0.133	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-6.5	-174.7	60	-96.1	0	0	0	115.7	A139 I211 N212 D221 V287 V290	A139-Y223 HydrophobicContact CB-CD1 3.89Å; I211-Y223 HydrophobicContact CD1-CD2 4.09Å; I211-Y223 HydrophobicContact CD1-CG 3.99Å; I211-Y223 HydrophobicContact CG1-CG 4.48Å; I211-Y223 HydrophobicContact CG2-CD1 3.63Å; I211-Y223 HydrophobicContact CG2-CD2 3.85Å; I211-Y223 HydrophobicContact CG2-CE1 3.28Å; I211-Y223 HydrophobicContact CG2-CE2 3.51Å; I211-Y223 HydrophobicContact CG2-CG 3.9Å; N212-Y223 PolarHBondContact O-OH 3.29Å; D221-Y223 VanDerWaalsContact O-CD1 3.23Å; D221-Y223 WeakPolarHBondContact O-CD1 3.45Å; D221-Y223 PolarHBondContact O-N 2.74Å; D221-Y223 VanDerWaalsContact O-N 3.13Å; Y223-V287 HydrophobicContact CD2-CB 4.19Å; Y223-V287 HydrophobicContact CD2-CG1 4.24Å; Y223-V287 HydrophobicContact CE2-CG1 4.43Å; Y223-V290 PolarHBondContact OH-N 3.16Å
224	W	95.9	Very high	95	Very high	45 Å²	45	63 Å²	63	17%	0.17	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	5.1	-167.3	58	76.5	0	0	0	114.2	A216 D221 E222 V287 K289	A216-W224 HydrophobicContact CB-CH2 3.64Å; A216-W224 HydrophobicContact CB-CZ3 4.33Å; D221-W224 WeakPolarHBondContact O-CZ3 3.42Å; E222-W224 VanDerWaalsContact C-N 3.29Å; E222-W224 HydrophobicContact CB-CH2 4.06Å; E222-W224 HydrophobicContact CB-CZ2 3.9Å; E222-W224 HydrophobicContact CB-CZ3 4.48Å; E222-W224 HydrophobicContact CG-CH2 3.89Å; E222-W224 HydrophobicContact CG-CZ2 3.81Å; E222-W224 PolarHBondContact O-N 3.24Å; W224-V287 VanDerWaalsContact CA-O 3.24Å; W224-V287 WeakPolarHBondContact CA-O 3.49Å; W224-V287 VanDerWaalsContact CB-O 3.22Å; W224-V287 WeakPolarHBondContact CB-O 3.32Å; W224-K289 HydrophobicContact CB-CG 3.95Å; W224-K289 HydrophobicContact CD2-CD 4.16Å; W224-K289 HydrophobicContact CD2-CG 3.86Å; W224-K289 HydrophobicContact CE3-CD 4.41Å; W224-K289 HydrophobicContact CE3-CG 3.95Å; W224-K289 HydrophobicContact CG-CD 4.34Å; W224-K289 VanDerWaalsContact CG-CE 3.48Å; W224-K289 HydrophobicContact CG-CG 3.84Å
225	H	96.3	Very high	94.9	Very high	81 Å²	81	60.3 Å²	60.3	38%	0.375	31%	0.313	S	S	.	.	S	Bend	trans	-77.7	138.9	-178.7	-64.2	-53.1	0	0	0	111.3	E222 H227	E222-H225 VanDerWaalsContact CB-NE2 3.32Å; E222-H225 WeakPolarHBondContact CB-NE2 3.22Å; E222-H225 PolarHBondContact O-CD2 2.72Å; E222-H225 IonicContact OE2-CD2 3.81Å; E222-H225 IonicContact OE2-CE1 3.86Å; E222-H225 IonicContact OE2-NE2 3.84Å; E222-H225 PolarHBondContact OE2-NE2 2.87Å; H225-H227 PolarHBondContact O-N 2.6Å; H225-H227 PolarHBondContact O-ND1 3.47Å
226	P	97.3	Very high	95	Very high	70 Å²	70	57.1 Å²	57.1	46%	0.455	29%	0.287	S	S	.	.			trans	-56.4	134.6	170.1	-22.1	32.2	0	0	0	111.6	M259 L284 H285	P226-M259 HydrophobicContact CB-SD 3.91Å; P226-M259 HydrophobicContact CG-CE 4.36Å; P226-M259 HydrophobicContact CG-SD 3.75Å; P226-L284 HydrophobicContact CB-CD1 3.98Å; P226-H285 CarbonylContact C-O 3.58Å; P226-H285 VanDerWaalsContact CA-O 3.28Å; P226-H285 WeakPolarHBondContact CA-O 3.3Å
227	H	97.7	Very high	95.1	Very high	56 Å²	56	56.1 Å²	56.1	26%	0.259	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-153.1	164.8	175.1	59.7	-76.8	0	0	0	111.8	H225 D229 H285	H225-H227 PolarHBondContact O-N 2.6Å; H225-H227 PolarHBondContact O-ND1 3.47Å; H227-D229 IonicContact CD2-OD1 3.21Å; H227-D229 IonicContact NE2-OD1 3.48Å; H227-H285 AromaticContact CD2-NE2 3.71Å; H227-H285 AromaticContact CE1-CD2 3.87Å; H227-H285 AromaticContact CE1-NE2 3.75Å; H227-H285 PolarHBondContact N-O 2.98Å; H227-H285 AromaticContact NE2-CD2 3.86Å; H227-H285 AromaticContact NE2-NE2 3.26Å; H227-H285 PolarHBondContact NE2-NE2 3.33Å; H227-H285 PolarHBondContact O-N 3.34Å
228	I	98.3	Very high	95.3	Very high	19 Å²	19	50 Å²	50	10%	0.097	25%	0.251	C	S	.	.			trans	-118.2	125.8	173.3	-65	156	0	0	0	106.6	K230 E231 T232 L284	I228-K230 HydrophobicContact CG2-CB 4.4Å; I228-K230 PolarHBondContact O-N 2.57Å; I228-E231 HydrophobicContact CB-CB 4.17Å; I228-E231 HydrophobicContact CB-CG 4.04Å; I228-E231 HydrophobicContact CD1-CG 4.46Å; I228-E231 HydrophobicContact CG2-CB 4.32Å; I228-E231 HydrophobicContact CG2-CG 3.92Å; I228-E231 PolarHBondContact O-N 2.03Å; I228-T232 WeakPolarHBondContact O-CB 3.37Å; I228-T232 PolarHBondContact O-N 2.88Å; I228-T232 PolarHBondContact O-OG1 3.46Å; I228-L284 HydrophobicContact CD1-CD1 4.3Å; I228-L284 HydrophobicContact CG1-CB 4.22Å; I228-L284 HydrophobicContact CG1-CD1 3.89Å
229	D	97.9	Very high	95.6	Very high	6 Å²	6	48.8 Å²	48.8	3%	0.032	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-40.3	-172.8	-81.8	-33	0	0	0	112.8	H227 E231 T232 Y233 F236 T239 F277 H285	H227-D229 IonicContact CD2-OD1 3.21Å; H227-D229 IonicContact NE2-OD1 3.48Å; D229-E231 VanDerWaalsContact C-N 3.33Å; D229-E231 PolarHBondContact O-N 3.29Å; D229-T232 PolarHBondContact O-N 2.89Å; D229-Y233 HydrophobicContact CB-CD2 4.5Å; D229-Y233 PolarHBondContact O-N 2.7Å; D229-F236 HydrophobicContact CB-CB 4.43Å; D229-F236 HydrophobicContact CB-CD2 3.83Å; D229-T239 WeakPolarHBondContact OD2-CB 3.39Å; D229-T239 VanDerWaalsContact OD2-CG2 3.31Å; D229-T239 WeakPolarHBondContact OD2-CG2 3.42Å; D229-T239 PolarHBondContact OD2-OG1 3.32Å; D229-F277 WeakPolarHBondContact OD2-CE2 3.26Å; D229-F277 WeakPolarHBondContact OD2-CZ 3.42Å; D229-H285 IonicContact OD1-CE1 2.74Å; D229-H285 IonicContact OD1-NE2 3.55Å; D229-H285 IonicContact OD2-CE1 2.8Å; D229-H285 PolarHBondContact OD2-CE1 3.41Å; D229-H285 IonicContact OD2-NE2 3.54Å
230	K	96.5	Very high	96	Very high	12 Å²	12	41.1 Å²	41.1	5%	0.052	21%	0.207	C	C	.	.	H	α-helix	trans	-59.4	-44.3	175.9	-174.4	71.7	-178.9	178.3	0	111.3	D90 Y94 I228 G234 F236 D237 S279	D90-K230 HydrophobicContact CB-CG 4.44Å; Y94-K230 HydrophobicContact CE2-CG 4.35Å; I228-K230 HydrophobicContact CG2-CB 4.4Å; I228-K230 PolarHBondContact O-N 2.57Å; K230-G234 VanDerWaalsContact CE-O 3.23Å; K230-G234 WeakPolarHBondContact CE-O 3.45Å; K230-G234 PolarHBondContact NZ-O 3.25Å; K230-G234 WeakPolarHBondContact O-CA 3.45Å; K230-G234 PolarHBondContact O-N 3.48Å; K230-F236 WeakPolarHBondContact CD-O 3.46Å; K230-F236 PolarHBondContact NZ-O 3.4Å; K230-D237 IonicContact NZ-OD1 2.88Å; K230-D237 PolarHBondContact NZ-OD1 3.25Å; K230-D237 IonicContact NZ-OD2 3.12Å; K230-S279 WeakPolarHBondContact CB-O 3.4Å; K230-S279 PolarHBondContact N-O 3.07Å
231	E	95.9	Very high	96.6	Very high	124 Å²	124	35.6 Å²	35.6	58%	0.579	18%	0.182	S	C	*	.	H	α-helix	trans	-69.6	-39.4	177.7	-64.1	-171.8	164.6	0	0	112.1	I228 D229	I228-E231 HydrophobicContact CB-CB 4.17Å; I228-E231 HydrophobicContact CB-CG 4.04Å; I228-E231 HydrophobicContact CD1-CG 4.46Å; I228-E231 HydrophobicContact CG2-CB 4.32Å; I228-E231 HydrophobicContact CG2-CG 3.92Å; I228-E231 PolarHBondContact O-N 2.03Å; D229-E231 VanDerWaalsContact C-N 3.33Å; D229-E231 PolarHBondContact O-N 3.29Å
232	T	95.4	Very high	97	Very high	75 Å²	75	35.6 Å²	35.6	46%	0.46	18%	0.182	S	C	.	.	H	α-helix	trans	-69.9	-41.8	-175.9	-56.7	0	0	0	0	112	I228 D229	I228-T232 WeakPolarHBondContact O-CB 3.37Å; I228-T232 PolarHBondContact O-N 2.88Å; I228-T232 PolarHBondContact O-OG1 3.46Å; D229-T232 PolarHBondContact O-N 2.89Å
233	Y	95	Very high	97.2	Very high	85 Å²	85	32 Å²	32	33%	0.333	17%	0.165	S	C	.	.	H	α-helix	trans	-114.3	-15.4	-172.4	-58.8	-67.5	0	0	0	114.6	P205 D229 S235 F236	P205-Y233 VanDerWaalsContact CD-CD1 3.41Å; P205-Y233 HydrophobicContact CG-CD1 3.71Å; P205-Y233 HydrophobicContact CG-CE1 3.38Å; P205-Y233 HydrophobicContact CG-CG 4.47Å; D229-Y233 HydrophobicContact CB-CD2 4.5Å; D229-Y233 PolarHBondContact O-N 2.7Å; Y233-S235 PolarHBondContact O-N 3.36Å; Y233-F236 HydrophobicContact CD1-CZ 4.43Å; Y233-F236 HydrophobicContact CD2-CD1 4.43Å; Y233-F236 AromaticContact CD2-CD2 3.68Å; Y233-F236 HydrophobicContact CD2-CD2 3.68Å; Y233-F236 HydrophobicContact CD2-CE1 4.15Å; Y233-F236 AromaticContact CD2-CE2 3.33Å; Y233-F236 HydrophobicContact CD2-CE2 3.33Å; Y233-F236 HydrophobicContact CD2-CG 4.21Å; Y233-F236 AromaticContact CD2-CZ 3.58Å; Y233-F236 HydrophobicContact CD2-CZ 3.58Å; Y233-F236 HydrophobicContact CE2-CD2 4.37Å; Y233-F236 AromaticContact CE2-CE2 3.7Å; Y233-F236 HydrophobicContact CE2-CE2 3.7Å; Y233-F236 HydrophobicContact CE2-CZ 4.04Å; Y233-F236 HydrophobicContact CG-CD1 4.36Å; Y233-F236 HydrophobicContact CG-CD2 4.38Å; Y233-F236 AromaticContact CG-CE1 3.99Å; Y233-F236 HydrophobicContact CG-CE1 3.99Å; Y233-F236 HydrophobicContact CG-CE2 4.02Å; Y233-F236 AromaticContact CG-CZ 3.79Å; Y233-F236 HydrophobicContact CG-CZ 3.79Å
234	G	94.3	Very high	97.4	Very high	34 Å²	34	30.4 Å²	30.4	35%	0.351	16%	0.159	S	C	.	.	S	Bend	trans	72.5	-46.4	-178.7	0	0	0	0	0	114.6	K230	K230-G234 VanDerWaalsContact CE-O 3.23Å; K230-G234 WeakPolarHBondContact CE-O 3.45Å; K230-G234 PolarHBondContact NZ-O 3.25Å; K230-G234 WeakPolarHBondContact O-CA 3.45Å; K230-G234 PolarHBondContact O-N 3.48Å
235	S	95.8	Very high	97.5	Very high	7 Å²	7	28.3 Å²	28.3	5%	0.049	15%	0.151	C	C	.	.	S	Bend	trans	-79.3	-20.2	-172.9	57.5	0	0	0	0	114.4	Y233 D237 T303	Y233-S235 PolarHBondContact O-N 3.36Å; S235-D237 PolarHBondContact O-N 3.26Å; S235-T303 WeakPolarHBondContact O-CB 3.3Å; S235-T303 PolarHBondContact O-OG1 3.12Å
236	F	98	Very high	97.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.143	C	C	.	.			trans	-75.8	123.3	-171.4	-72.3	18.5	0	0	0	111.1	T203 K204 P205 D229 K230 Y233 T239 S279 S301	T203-F236 HydrophobicContact CG2-CD1 3.61Å; T203-F236 HydrophobicContact CG2-CE1 3.81Å; K204-F236 WeakPolarHBondContact O-CE1 3.48Å; P205-F236 HydrophobicContact CG-CZ 4.08Å; P205-F236 WeakPolarHBondContact O-CZ 3.44Å; D229-F236 HydrophobicContact CB-CB 4.43Å; D229-F236 HydrophobicContact CB-CD2 3.83Å; K230-F236 WeakPolarHBondContact CD-O 3.46Å; K230-F236 PolarHBondContact NZ-O 3.4Å; Y233-F236 HydrophobicContact CD1-CZ 4.43Å; Y233-F236 HydrophobicContact CD2-CD1 4.43Å; Y233-F236 AromaticContact CD2-CD2 3.68Å; Y233-F236 HydrophobicContact CD2-CD2 3.68Å; Y233-F236 HydrophobicContact CD2-CE1 4.15Å; Y233-F236 AromaticContact CD2-CE2 3.33Å; Y233-F236 HydrophobicContact CD2-CE2 3.33Å; Y233-F236 HydrophobicContact CD2-CG 4.21Å; Y233-F236 AromaticContact CD2-CZ 3.58Å; Y233-F236 HydrophobicContact CD2-CZ 3.58Å; Y233-F236 HydrophobicContact CE2-CD2 4.37Å; Y233-F236 AromaticContact CE2-CE2 3.7Å; Y233-F236 HydrophobicContact CE2-CE2 3.7Å; Y233-F236 HydrophobicContact CE2-CZ 4.04Å; Y233-F236 HydrophobicContact CG-CD1 4.36Å; Y233-F236 HydrophobicContact CG-CD2 4.38Å; Y233-F236 AromaticContact CG-CE1 3.99Å; Y233-F236 HydrophobicContact CG-CE1 3.99Å; Y233-F236 HydrophobicContact CG-CE2 4.02Å; Y233-F236 AromaticContact CG-CZ 3.79Å; Y233-F236 HydrophobicContact CG-CZ 3.79Å; F236-T239 VanDerWaalsContact CD2-OG1 3.25Å; F236-T239 WeakPolarHBondContact CD2-OG1 3.45Å; F236-S279 WeakPolarHBondContact O-CB 3.48Å; F236-S301 WeakPolarHBondContact CE1-OG 3.31Å; F236-S301 WeakPolarHBondContact CZ-OG 3.43Å
237	D	98.4	Very high	97.6	Very high	9 Å²	9	25.1 Å²	25.1	5%	0.048	13%	0.13	C	C	.	.	S	Bend	trans	-105.5	-28.9	168.1	-65.2	-56.8	0	0	0	111.3	P102 K230 S235 S279 F302 C304	P102-D237 HydrophobicContact CG-CB 4.44Å; K230-D237 IonicContact NZ-OD1 2.88Å; K230-D237 PolarHBondContact NZ-OD1 3.25Å; K230-D237 IonicContact NZ-OD2 3.12Å; S235-D237 PolarHBondContact O-N 3.26Å; D237-S279 PolarHBondContact O-N 3.49Å; D237-F302 PolarHBondContact N-O 3.33Å; D237-C304 WeakPolarHBondContact OD2-CB 3.47Å; D237-C304 PolarHBondContact OD2-N 3.38Å
238	Y	98.8	Very high	97.6	Very high	1 Å²	1	24.7 Å²	24.7	0%	0.004	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.5	172.6	-56.9	-87.7	0	0	0	110.5	C100 P102 I189 F193 L195 M200 F277 S279 F302	C100-Y238 WeakPolarHBondContact O-CE2 3.38Å; C100-Y238 PolarHBondContact O-OH 3.08Å; P102-Y238 WeakPolarHBondContact CA-OH 3.17Å; P102-Y238 HydrophobicContact CG-CE1 4Å; P102-Y238 HydrophobicContact CG-CE2 4.08Å; P102-Y238 WeakPolarHBondContact CG-OH 3.48Å; I189-Y238 HydrophobicContact CG2-CD1 3.97Å; I189-Y238 HydrophobicContact CG2-CG 3.97Å; F193-Y238 HydrophobicContact CB-CE1 4.32Å; F193-Y238 AromaticContact CD2-CD1 3.85Å; F193-Y238 HydrophobicContact CD2-CD1 3.85Å; F193-Y238 AromaticContact CD2-CE1 3.71Å; F193-Y238 HydrophobicContact CD2-CE1 3.71Å; F193-Y238 HydrophobicContact CE2-CD1 4.01Å; F193-Y238 HydrophobicContact CE2-CE1 4.21Å; F193-Y238 HydrophobicContact CG-CE1 4.1Å; L195-Y238 HydrophobicContact CD1-CD2 4.19Å; L195-Y238 HydrophobicContact CD1-CE1 3.85Å; L195-Y238 HydrophobicContact CD1-CE2 3.48Å; L195-Y238 VanDerWaalsContact CD1-CE2 3.48Å; L195-Y238 WeakPolarHBondContact CD1-OH 3.31Å; L195-Y238 WeakPolarHBondContact CD2-OH 3.37Å; M200-Y238 HydrophobicContact SD-CD2 3.79Å; M200-Y238 HydrophobicContact SD-CE2 4.28Å; M200-Y238 HydrophobicContact SD-CG 4.32Å; Y238-F277 WeakPolarHBondContact CA-O 3.36Å; Y238-S279 WeakPolarHBondContact CA-OG 3.16Å; Y238-S279 PolarHBondContact N-OG 2.95Å; Y238-F302 PolarHBondContact N-O 2.9Å; Y238-F302 VanDerWaalsContact N-O 3.12Å; Y238-F302 PolarHBondContact O-N 3.32Å
239	T	98.8	Very high	97.6	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	145.6	176.9	-65.1	0	0	0	0	110.6	D229 F236 F276 F277 S279 T299	D229-T239 WeakPolarHBondContact OD2-CB 3.39Å; D229-T239 VanDerWaalsContact OD2-CG2 3.31Å; D229-T239 WeakPolarHBondContact OD2-CG2 3.42Å; D229-T239 PolarHBondContact OD2-OG1 3.32Å; F236-T239 VanDerWaalsContact CD2-OG1 3.25Å; F236-T239 WeakPolarHBondContact CD2-OG1 3.45Å; T239-F276 CarbonylContact O-C 3.57Å; T239-F276 WeakPolarHBondContact O-CA 3.3Å; T239-F276 WeakPolarHBondContact O-CB 3.47Å; T239-F277 HydrophobicContact CG2-CE1 4.1Å; T239-F277 HydrophobicContact CG2-CE2 4.29Å; T239-F277 HydrophobicContact CG2-CZ 3.68Å; T239-F277 PolarHBondContact N-O 3.18Å; T239-F277 PolarHBondContact O-N 3.4Å; T239-S279 PolarHBondContact N-OG 3.21Å; T239-S279 PolarHBondContact OG1-OG 3.47Å; T239-T299 HydrophobicContact CG2-CG2 4.21Å
240	S	98.8	Very high	97.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	147.7	171.6	66.7	0	0	0	0	112	I185 S275 T299 V300	I185-S240 VanDerWaalsContact CG2-OG 3.26Å; I185-S240 WeakPolarHBondContact CG2-OG 3.28Å; S240-S275 CarbonylContact C-O 3.56Å; S240-S275 WeakPolarHBondContact CA-O 3.26Å; S240-T299 CarbonylContact O-C 3.57Å; S240-T299 WeakPolarHBondContact O-CA 3.48Å; S240-V300 PolarHBondContact N-O 3.25Å; S240-V300 PolarHBondContact O-N 2.89Å; S240-V300 WeakPolarHBondContact OG-CB 3.3Å; S240-V300 PolarHBondContact OG-O 2.87Å
241	L	98.8	Very high	97.7	Very high	10 Å²	10	28 Å²	28	5%	0.052	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.7	169.6	-63.6	95.8	0	0	0	108.6	Y243 F256 V274 S275 F277 I298	L241-Y243 HydrophobicContact CB-CE1 4.32Å; L241-Y243 HydrophobicContact CD2-CE1 4.47Å; L241-F256 HydrophobicContact CD1-CD2 4.19Å; L241-F256 HydrophobicContact CD1-CE2 3.72Å; L241-F256 HydrophobicContact CD1-CZ 4.07Å; L241-F256 HydrophobicContact CD2-CD2 3.93Å; L241-F256 HydrophobicContact CD2-CE2 3.99Å; L241-V274 WeakPolarHBondContact O-CA 3.2Å; L241-S275 PolarHBondContact N-O 3.14Å; L241-S275 PolarHBondContact O-N 3Å; L241-F277 HydrophobicContact CD1-CE1 3.75Å; L241-F277 HydrophobicContact CD1-CZ 4.42Å; L241-I298 CarbonylContact C-O 3.39Å; L241-I298 VanDerWaalsContact CA-O 3.3Å; L241-I298 WeakPolarHBondContact CA-O 3.44Å
242	L	98.9	Very high	97.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	116.5	163.1	170.9	60	0	0	0	108.7	V114 L122 V181 I185 L244 V274 A297 I298	V114-L242 HydrophobicContact CB-CD1 4.01Å; V114-L242 HydrophobicContact CG1-CD1 4.19Å; V114-L242 HydrophobicContact CG1-CD2 4.25Å; V114-L242 HydrophobicContact CG2-CD1 3.84Å; V114-L242 HydrophobicContact CG2-CD2 4.09Å; L122-L242 HydrophobicContact CD1-CD2 3.72Å; V181-L242 HydrophobicContact CG1-CD2 3.68Å; I185-L242 HydrophobicContact CD1-CB 4.3Å; L242-L244 HydrophobicContact CD2-CD2 4.08Å; L242-L244 HydrophobicContact CG-CD2 3.94Å; L242-V274 HydrophobicContact CD1-CG2 3.94Å; L242-A297 CarbonylContact O-C 3.49Å; L242-A297 VanDerWaalsContact O-CA 3.22Å; L242-A297 WeakPolarHBondContact O-CA 3.36Å; L242-I298 HydrophobicContact CB-CB 4.32Å; L242-I298 HydrophobicContact CD2-CD1 4.06Å; L242-I298 PolarHBondContact N-O 2.98Å; L242-I298 PolarHBondContact O-N 3.43Å
243	Y	98.9	Very high	97.9	Very high	1 Å²	1	21.4 Å²	21.4	0%	0.004	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	135.1	177.4	-60.5	-68	0	0	0	111.1	L241 F256 V267 P269 R270 A271 G272 R273 A297	L241-Y243 HydrophobicContact CB-CE1 4.32Å; L241-Y243 HydrophobicContact CD2-CE1 4.47Å; Y243-F256 WeakPolarHBondContact OH-CB 3.49Å; Y243-V267 HydrophobicContact CE2-CG1 3.84Å; Y243-P269 HydrophobicContact CD1-CB 3.46Å; Y243-P269 VanDerWaalsContact CD1-CB 3.46Å; Y243-P269 HydrophobicContact CD1-CG 3.65Å; Y243-P269 HydrophobicContact CD2-CB 4.29Å; Y243-P269 HydrophobicContact CE1-CB 3.91Å; Y243-P269 HydrophobicContact CE1-CG 3.56Å; Y243-P269 HydrophobicContact CG-CB 3.66Å; Y243-P269 HydrophobicContact CG-CG 4.25Å; Y243-R270 VanDerWaalsContact CB-O 3.27Å; Y243-R270 WeakPolarHBondContact CB-O 3.46Å; Y243-A271 WeakPolarHBondContact O-CA 3.36Å; Y243-G272 PolarHBondContact O-N 3.35Å; Y243-R273 HydrophobicContact CD2-CB 3.96Å; Y243-R273 HydrophobicContact CD2-CG 3.95Å; Y243-R273 WeakPolarHBondContact CD2-O 3.27Å; Y243-R273 HydrophobicContact CE2-CG 4.34Å; Y243-R273 PolarHBondContact N-O 3.1Å; Y243-A297 HydrophobicContact CD1-CB 4.27Å
244	L	98.9	Very high	98	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.01	12%	0.119	C	C	.	.			trans	-116.6	8	-177.9	-55.3	179.6	0	0	0	112.2	A119 L122 R123 F208 L242 Y296 I298	A119-L244 HydrophobicContact CB-CD2 4.31Å; L122-L244 HydrophobicContact CB-CD1 4.34Å; L122-L244 HydrophobicContact CB-CD2 3.9Å; R123-L244 HydrophobicContact CB-CB 4.13Å; R123-L244 WeakPolarHBondContact CD-O 3.23Å; R123-L244 HydrophobicContact CG-CB 4.5Å; R123-L244 PolarHBondContact NH1-O 2.92Å; F208-L244 HydrophobicContact CD1-CD1 3.99Å; F208-L244 HydrophobicContact CE1-CD1 4.1Å; L242-L244 HydrophobicContact CD2-CD2 4.08Å; L242-L244 HydrophobicContact CG-CD2 3.94Å; L244-Y296 PolarHBondContact N-O 3.48Å; L244-I298 HydrophobicContact CD1-CD1 4.19Å; L244-I298 HydrophobicContact CD1-CG1 3.7Å; L244-I298 HydrophobicContact CD2-CD1 4.43Å; L244-I298 HydrophobicContact CD2-CG1 4.36Å; L244-I298 HydrophobicContact CG-CG1 4.17Å
245	S	98.4	Very high	98.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	-145.8	150.4	-179.4	-52.5	0	0	0	0	110.5	D250 Y296	S245-D250 WeakPolarHBondContact CA-OD2 3.48Å; S245-Y296 WeakPolarHBondContact OG-CB 3.3Å; S245-Y296 PolarHBondContact OG-N 2.73Å
246	D	98.5	Very high	98.3	Very high	38 Å²	38	16.5 Å²	16.5	20%	0.203	10%	0.104	C	C	.	.			trans	-95.2	121.2	-176	-74.5	-64.5	0	0	0	112.8	G248 S249 D250 R270 A271	D246-G248 PolarHBondContact O-N 2.77Å; D246-S249 PolarHBondContact O-N 2.89Å; D246-S249 VanDerWaalsContact O-N 3.14Å; D246-D250 PolarHBondContact N-OD2 2.77Å; D246-D250 PolarHBondContact O-N 3.36Å; D246-R270 WeakPolarHBondContact OD1-CA 3.43Å; D246-A271 PolarHBondContact OD1-N 2.8Å
247	Y	98.4	Very high	98.3	Very high	46 Å²	46	16.5 Å²	16.5	18%	0.18	10%	0.104	C	C	.	.	B	Isolated β-bridge	trans	-61.3	135.1	172	175	-107.4	0	0	0	111.7	R72 S249 F251 G253 R255 E268 P269	R72-Y247 PolarHBondContact NE-O 2.68Å; R72-Y247 PolarHBondContact NH2-O 2.9Å; Y247-S249 PolarHBondContact O-N 2.96Å; Y247-F251 HydrophobicContact CD2-CD2 4.47Å; Y247-F251 HydrophobicContact CD2-CE2 4.03Å; Y247-G253 WeakPolarHBondContact CD2-O 3.39Å; Y247-G253 VanDerWaalsContact CE2-O 3.26Å; Y247-G253 WeakPolarHBondContact CE2-O 3.29Å; Y247-R255 HydrophobicContact CD2-CG 3.96Å; Y247-R255 HydrophobicContact CE1-CG 4.31Å; Y247-R255 HydrophobicContact CE2-CG 3.62Å; Y247-R255 HydrophobicContact CG-CG 4.44Å; Y247-E268 HydrophobicContact CD1-CB 3.86Å; Y247-E268 HydrophobicContact CD1-CG 3.8Å; Y247-E268 HydrophobicContact CE1-CG 3.98Å; Y247-E268 VanDerWaalsContact CE1-OE1 3.28Å; Y247-E268 WeakPolarHBondContact CE1-OE1 3.41Å; Y247-E268 HydrophobicContact CG-CB 4.38Å; Y247-P269 VanDerWaalsContact CB-O 3.27Å; Y247-P269 WeakPolarHBondContact CB-O 3.33Å; Y247-P269 PolarHBondContact N-O 2.86Å
248	G	97.5	Very high	98.3	Very high	48 Å²	48	16.1 Å²	16.1	50%	0.495	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	4.4	-175.8	0	0	0	0	0	114.7	D246 F251	D246-G248 PolarHBondContact O-N 2.77Å; G248-F251 WeakPolarHBondContact CA-O 3.24Å; G248-F251 PolarHBondContact N-O 2.78Å
249	S	97.9	Very high	98.2	Very high	64 Å²	64	18.6 Å²	18.6	45%	0.448	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-55.8	172.8	-178.1	0	0	0	0	111.5	D246 Y247 W292	D246-S249 PolarHBondContact O-N 2.89Å; D246-S249 VanDerWaalsContact O-N 3.14Å; Y247-S249 PolarHBondContact O-N 2.96Å; S249-W292 WeakPolarHBondContact O-CZ3 3.32Å
250	D	98.4	Very high	97.9	Very high	43 Å²	43	20.2 Å²	20.2	23%	0.23	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-25.5	-178.5	-67.1	-25.2	0	0	0	112.3	R123 S245 D246 G293 T294	R123-D250 IonicContact CZ-OD2 3.97Å; R123-D250 IonicContact NH1-OD1 2.75Å; R123-D250 IonicContact NH1-OD2 3.59Å; R123-D250 PolarHBondContact NH1-OD2 2.86Å; S245-D250 WeakPolarHBondContact CA-OD2 3.48Å; D246-D250 PolarHBondContact N-OD2 2.77Å; D246-D250 PolarHBondContact O-N 3.36Å; D250-G293 VanDerWaalsContact O-CA 3.29Å; D250-G293 WeakPolarHBondContact O-CA 3.2Å; D250-T294 PolarHBondContact O-N 2.86Å; D250-T294 VanDerWaalsContact O-N 3.13Å
251	F	98.6	Very high	97.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	163.9	178.2	69.2	-82.8	0	0	0	112	Y247 G248 G253 P269 V290 W292 R295	Y247-F251 HydrophobicContact CD2-CD2 4.47Å; Y247-F251 HydrophobicContact CD2-CE2 4.03Å; G248-F251 WeakPolarHBondContact CA-O 3.24Å; G248-F251 PolarHBondContact N-O 2.78Å; F251-G253 WeakPolarHBondContact CE2-O 3.11Å; F251-P269 HydrophobicContact CE1-CB 4.24Å; F251-P269 HydrophobicContact CE2-CG 4.43Å; F251-P269 HydrophobicContact CZ-CB 3.67Å; F251-P269 HydrophobicContact CZ-CG 3.74Å; F251-V290 HydrophobicContact CB-CG1 4.31Å; F251-V290 HydrophobicContact CD2-CG2 4.42Å; F251-W292 CarbonylContact C-O 3.59Å; F251-W292 WeakPolarHBondContact CA-O 3.44Å; F251-W292 VanDerWaalsContact CB-O 3.23Å; F251-W292 WeakPolarHBondContact CB-O 3.41Å; F251-R295 HydrophobicContact CD1-CB 3.92Å; F251-R295 HydrophobicContact CD1-CG 4.42Å; F251-R295 HydrophobicContact CD2-CB 4Å; F251-R295 HydrophobicContact CD2-CG 4.5Å; F251-R295 HydrophobicContact CE1-CB 3.96Å; F251-R295 HydrophobicContact CE1-CG 3.94Å; F251-R295 HydrophobicContact CE2-CB 4.01Å; F251-R295 HydrophobicContact CE2-CG 4.01Å; F251-R295 HydrophobicContact CG-CB 3.94Å; F251-R295 HydrophobicContact CZ-CB 3.98Å; F251-R295 HydrophobicContact CZ-CG 3.69Å
252	T	97.9	Very high	96.8	Very high	48 Å²	48	35.2 Å²	35.2	29%	0.294	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	162.2	170.4	58.9	0	0	0	0	110.5	V290 T291 W292	T252-V290 WeakPolarHBondContact O-CA 3.48Å; T252-T291 PolarHBondContact O-N 2.95Å; T252-T291 PolarHBondContact O-OG1 3.15Å; T252-T291 PolarHBondContact OG1-OG1 3.44Å; T252-W292 HydrophobicContact CG2-CE3 4.47Å; T252-W292 PolarHBondContact N-O 3.1Å
253	G	96.7	Very high	96.4	Very high	11 Å²	11	36 Å²	36	11%	0.113	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.9	-149.2	-156.9	0	0	0	0	0	110.2	Y247 F251 R255 K289	Y247-G253 WeakPolarHBondContact CD2-O 3.39Å; Y247-G253 VanDerWaalsContact CE2-O 3.26Å; Y247-G253 WeakPolarHBondContact CE2-O 3.29Å; F251-G253 WeakPolarHBondContact CE2-O 3.11Å; G253-R255 PolarHBondContact O-N 3.02Å; G253-K289 WeakPolarHBondContact CA-O 3.34Å
254	G	97.4	Very high	96.2	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.			trans	63.8	8.8	169.7	0	0	0	0	0	116.8	E288 K289 R295	G254-E288 WeakPolarHBondContact CA-O 3.43Å; G254-E288 PolarHBondContact N-O 3.3Å; G254-K289 PolarHBondContact N-O 3.41Å; G254-R295 WeakPolarHBondContact O-CD 3.44Å; G254-R295 PolarHBondContact O-NE 2.96Å; G254-R295 VanDerWaalsContact O-NE 3.14Å
255	R	98.1	Very high	96.1	Very high	20 Å²	20	38.9 Å²	38.9	8%	0.075	22%	0.217	C	C	.	.			trans	-63.9	150.3	174.4	-61.3	178.3	-71.8	-175.4	1.3	109.5	D62 Y247 G253 E288	D62-R255 IonicContact OD1-CZ 2.72Å; D62-R255 IonicContact OD1-NH1 3.7Å; D62-R255 PolarHBondContact OD1-NH1 3.46Å; D62-R255 VanDerWaalsContact OD1-NH1 3.14Å; D62-R255 IonicContact OD1-NH2 3.66Å; D62-R255 PolarHBondContact OD1-NH2 2.87Å; Y247-R255 HydrophobicContact CD2-CG 3.96Å; Y247-R255 HydrophobicContact CE1-CG 4.31Å; Y247-R255 HydrophobicContact CE2-CG 3.62Å; Y247-R255 HydrophobicContact CG-CG 4.44Å; G253-R255 PolarHBondContact O-N 3.02Å; R255-E288 HydrophobicContact CB-CG 4.39Å; R255-E288 WeakPolarHBondContact CB-OE2 3.35Å; R255-E288 WeakPolarHBondContact CG-OE2 3.36Å; R255-E288 IonicContact CZ-OE1 3.23Å; R255-E288 IonicContact CZ-OE2 3.49Å; R255-E288 PolarHBondContact N-OE2 3.49Å; R255-E288 VanDerWaalsContact NE-CD 3.33Å; R255-E288 IonicContact NE-OE1 2.89Å; R255-E288 PolarHBondContact NE-OE1 3.31Å; R255-E288 IonicContact NE-OE2 3.14Å; R255-E288 PolarHBondContact NE-OE2 3.12Å; R255-E288 IonicContact NH2-OE1 2.68Å; R255-E288 PolarHBondContact NH2-OE1 2.99Å; R255-E288 IonicContact NH2-OE2 2.87Å; R255-E288 PolarHBondContact O-N 3.44Å
256	F	98.4	Very high	96.1	Very high	3 Å²	3	38.9 Å²	38.9	1%	0.013	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	131.1	171.5	-170.2	-87.6	0	0	0	108.7	L241 Y243 F258 T266 V267 F277 H285 V287	L241-F256 HydrophobicContact CD1-CD2 4.19Å; L241-F256 HydrophobicContact CD1-CE2 3.72Å; L241-F256 HydrophobicContact CD1-CZ 4.07Å; L241-F256 HydrophobicContact CD2-CD2 3.93Å; L241-F256 HydrophobicContact CD2-CE2 3.99Å; Y243-F256 WeakPolarHBondContact OH-CB 3.49Å; F256-F258 HydrophobicContact CD1-CD2 4.17Å; F256-F258 AromaticContact CD1-CE2 3.84Å; F256-F258 HydrophobicContact CD1-CE2 3.84Å; F256-F258 HydrophobicContact CD1-CZ 4.04Å; F256-F258 HydrophobicContact CE1-CD1 4.03Å; F256-F258 HydrophobicContact CE1-CD2 4.14Å; F256-F258 AromaticContact CE1-CE1 3.62Å; F256-F258 HydrophobicContact CE1-CE1 3.62Å; F256-F258 AromaticContact CE1-CE2 3.74Å; F256-F258 HydrophobicContact CE1-CE2 3.74Å; F256-F258 HydrophobicContact CE1-CG 4.28Å; F256-F258 AromaticContact CE1-CZ 3.47Å; F256-F258 HydrophobicContact CE1-CZ 3.47Å; F256-F258 VanDerWaalsContact CE1-CZ 3.47Å; F256-F258 HydrophobicContact CZ-CE1 4.44Å; F256-F258 HydrophobicContact CZ-CZ 4.48Å; F256-T266 CarbonylContact O-C 3.55Å; F256-T266 VanDerWaalsContact O-CA 3.24Å; F256-T266 WeakPolarHBondContact O-CA 3.17Å; F256-V267 HydrophobicContact CB-CB 4.46Å; F256-V267 PolarHBondContact N-O 3.07Å; F256-V267 PolarHBondContact O-N 2.93Å; F256-F277 HydrophobicContact CE1-CE1 4.16Å; F256-F277 AromaticContact CZ-CE1 3.75Å; F256-F277 HydrophobicContact CZ-CE1 3.75Å; F256-F277 AromaticContact CZ-CZ 3.9Å; F256-F277 HydrophobicContact CZ-CZ 3.9Å; F256-H285 HydrophobicContact CE1-CB 3.79Å; F256-H285 AromaticContact CE2-CD2 3.5Å; F256-H285 VanDerWaalsContact CE2-CD2 3.5Å; F256-H285 WeakPolarHBondContact CE2-CD2 3.24Å; F256-H285 HydrophobicContact CZ-CB 3.7Å; F256-H285 AromaticContact CZ-CD2 3.18Å; F256-H285 WeakPolarHBondContact CZ-CD2 3.21Å; F256-H285 AromaticContact CZ-CG 3.41Å; F256-H285 VanDerWaalsContact CZ-CG 3.41Å; F256-H285 AromaticContact CZ-NE2 3.78Å; F256-V287 HydrophobicContact CD2-CG2 4.22Å
257	V	98.2	Very high	96.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	115.2	-171	-169.7	0	0	0	0	109.4	I65 M259 N264 R265 T266 H285 R286 E288	I65-V257 HydrophobicContact CD1-CG1 4.12Å; V257-M259 HydrophobicContact CG1-CG 4.4Å; V257-N264 HydrophobicContact CG1-CB 3.65Å; V257-R265 WeakPolarHBondContact CA-O 3.4Å; V257-T266 HydrophobicContact CG1-CG2 4.41Å; V257-T266 HydrophobicContact CG2-CG2 4.11Å; V257-H285 CarbonylContact O-C 3.56Å; V257-H285 WeakPolarHBondContact O-CA 3.19Å; V257-H285 WeakPolarHBondContact O-CB 3.4Å; V257-R286 HydrophobicContact CB-CG 3.99Å; V257-R286 HydrophobicContact CG2-CG 4.45Å; V257-R286 PolarHBondContact N-O 3.12Å; V257-R286 PolarHBondContact O-N 3.49Å; V257-E288 HydrophobicContact CG2-CG 3.61Å
258	F	98.3	Very high	96.1	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	134.8	162.3	-63.4	-81.6	0	0	0	109.3	L69 R107 F256 N264 R265 V267 F277 N283 H285	L69-F258 HydrophobicContact CD1-CD2 4.03Å; L69-F258 HydrophobicContact CD1-CE2 4.31Å; R107-F258 HydrophobicContact CB-CE2 4.4Å; R107-F258 HydrophobicContact CB-CZ 4.17Å; R107-F258 HydrophobicContact CG-CD1 4.23Å; R107-F258 HydrophobicContact CG-CE1 3.8Å; R107-F258 HydrophobicContact CG-CE2 4.18Å; R107-F258 HydrophobicContact CG-CZ 3.77Å; R107-F258 VanDerWaalsContact NH1-CB 3.31Å; F256-F258 HydrophobicContact CD1-CD2 4.17Å; F256-F258 AromaticContact CD1-CE2 3.84Å; F256-F258 HydrophobicContact CD1-CE2 3.84Å; F256-F258 HydrophobicContact CD1-CZ 4.04Å; F256-F258 HydrophobicContact CE1-CD1 4.03Å; F256-F258 HydrophobicContact CE1-CD2 4.14Å; F256-F258 AromaticContact CE1-CE1 3.62Å; F256-F258 HydrophobicContact CE1-CE1 3.62Å; F256-F258 AromaticContact CE1-CE2 3.74Å; F256-F258 HydrophobicContact CE1-CE2 3.74Å; F256-F258 HydrophobicContact CE1-CG 4.28Å; F256-F258 AromaticContact CE1-CZ 3.47Å; F256-F258 HydrophobicContact CE1-CZ 3.47Å; F256-F258 VanDerWaalsContact CE1-CZ 3.47Å; F256-F258 HydrophobicContact CZ-CE1 4.44Å; F256-F258 HydrophobicContact CZ-CZ 4.48Å; F258-N264 CarbonylContact O-C 3.59Å; F258-N264 WeakPolarHBondContact O-CA 3.26Å; F258-R265 HydrophobicContact CB-CB 4.46Å; F258-R265 PolarHBondContact N-O 2.72Å; F258-R265 PolarHBondContact O-N 2.67Å; F258-V267 HydrophobicContact CE2-CG2 4.08Å; F258-F277 HydrophobicContact CE1-CB 4.29Å; F258-F277 AromaticContact CE1-CD1 3.87Å; F258-F277 HydrophobicContact CE1-CD1 3.87Å; F258-F277 HydrophobicContact CE1-CD2 4.3Å; F258-F277 HydrophobicContact CE1-CE1 4.26Å; F258-F277 AromaticContact CE1-CG 3.9Å; F258-F277 HydrophobicContact CE1-CG 3.9Å; F258-F277 HydrophobicContact CZ-CB 4.38Å; F258-F277 AromaticContact CZ-CD1 3.74Å; F258-F277 HydrophobicContact CZ-CD1 3.74Å; F258-F277 HydrophobicContact CZ-CE1 4.26Å; F258-F277 HydrophobicContact CZ-CG 4.13Å; F258-N283 HydrophobicContact CD1-CB 4.33Å; F258-N283 HydrophobicContact CE1-CB 4.24Å; F258-H285 HydrophobicContact CD1-CB 4.2Å
259	M	96.5	Very high	96.1	Very high	54 Å²	54	33.9 Å²	33.9	27%	0.266	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	97.2	-175.9	-62.3	-173.9	61.8	0	0	109.9	P226 V257 N264 L284 R286	P226-M259 HydrophobicContact CB-SD 3.91Å; P226-M259 HydrophobicContact CG-CE 4.36Å; P226-M259 HydrophobicContact CG-SD 3.75Å; V257-M259 HydrophobicContact CG1-CG 4.4Å; M259-N264 WeakPolarHBondContact CA-OD1 3.01Å; M259-N264 WeakPolarHBondContact CG-OD1 3.35Å; M259-L284 HydrophobicContact CB-CD2 4.01Å; M259-L284 HydrophobicContact CB-CG 4.1Å; M259-L284 PolarHBondContact N-O 3.02Å; M259-R286 HydrophobicContact CG-CG 4.47Å; M259-R286 HydrophobicContact SD-CG 3.91Å
260	D	92.6	Very high	96.2	Very high	36 Å²	36	33.5 Å²	33.5	19%	0.193	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	157.7	179.5	-57.9	-59.2	0	0	0	111.7	R107 N262 G263 R265	R107-D260 IonicContact CZ-OD1 2.85Å; R107-D260 IonicContact CZ-OD2 3.69Å; R107-D260 IonicContact NH1-OD1 3.76Å; R107-D260 PolarHBondContact NH1-OD1 3.07Å; R107-D260 IonicContact NH1-OD2 3.36Å; R107-D260 PolarHBondContact NH1-OD2 3Å; R107-D260 IonicContact NH2-OD1 3.96Å; R107-D260 PolarHBondContact NH2-OD1 2.77Å; R107-D260 IonicContact NH2-OD2 2.67Å; D260-N262 WeakPolarHBondContact CB-OD1 3.35Å; D260-N262 PolarHBondContact O-N 2.64Å; D260-N262 VanDerWaalsContact O-N 3.12Å; D260-G263 WeakPolarHBondContact CB-O 3.42Å; D260-G263 PolarHBondContact N-O 2.9Å; D260-G263 PolarHBondContact O-N 3.25Å; D260-G263 VanDerWaalsContact O-N 3.07Å; D260-R265 VanDerWaalsContact CB-NH1 3.33Å; D260-R265 WeakPolarHBondContact OD2-CD 3.23Å; D260-R265 IonicContact OD2-CZ 2.64Å; D260-R265 IonicContact OD2-NE 3.8Å; D260-R265 IonicContact OD2-NH1 3.25Å; D260-R265 PolarHBondContact OD2-NH1 2.66Å
261	Q	88	Confident	96.2	Very high	213 Å²	213	32.4 Å²	32.4	100%	0.995	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-29.4	175.5	-64	-179.7	2.1	0	0	113.1
262	N	87.2	Confident	96.2	Very high	111 Å²	111	32.6 Å²	32.6	59%	0.594	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	11.6	-178.5	65.8	-2.8	0	0	0	113.8	D260 R265	D260-N262 WeakPolarHBondContact CB-OD1 3.35Å; D260-N262 PolarHBondContact O-N 2.64Å; D260-N262 VanDerWaalsContact O-N 3.12Å; N262-R265 PolarHBondContact ND2-NH2 3.35Å; N262-R265 PolarHBondContact OD1-NH1 3.41Å; N262-R265 PolarHBondContact OD1-NH2 3.42Å
263	G	90.3	Very high	96.2	Very high	17 Å²	17	30.3 Å²	30.3	18%	0.175	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128.9	159.5	174.7	0	0	0	0	0	114.3	T66 D260	T66-G263 WeakPolarHBondContact OG1-CA 3.1Å; D260-G263 WeakPolarHBondContact CB-O 3.42Å; D260-G263 PolarHBondContact N-O 2.9Å; D260-G263 PolarHBondContact O-N 3.25Å; D260-G263 VanDerWaalsContact O-N 3.07Å
264	N	94.8	Very high	96.3	Very high	21 Å²	21	29.8 Å²	29.8	11%	0.112	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	141.6	-177	-59	-43.6	0	0	0	111.7	D64 I65 T66 E67 V257 F258 M259	D64-N264 VanDerWaalsContact O-CB 3.22Å; D64-N264 WeakPolarHBondContact O-CB 3.2Å; D64-N264 PolarHBondContact O-ND2 3.33Å; I65-N264 HydrophobicContact CD1-CB 3.88Å; T66-N264 PolarHBondContact N-O 3.05Å; T66-N264 PolarHBondContact OG1-N 3.15Å; E67-N264 PolarHBondContact N-O 3.06Å; V257-N264 HydrophobicContact CG1-CB 3.65Å; F258-N264 CarbonylContact O-C 3.59Å; F258-N264 WeakPolarHBondContact O-CA 3.26Å; M259-N264 WeakPolarHBondContact CA-OD1 3.01Å; M259-N264 WeakPolarHBondContact CG-OD1 3.35Å
265	R	96.8	Very high	96.4	Very high	43 Å²	43	29.8 Å²	29.8	16%	0.162	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131.3	-179.6	-58.5	-169.5	162.9	71.5	6.8	110.6	E67 L69 V257 F258 D260 N262	E67-R265 HydrophobicContact CB-CG 4.13Å; E67-R265 CarbonylContact O-C 3.56Å; E67-R265 VanDerWaalsContact O-CA 3.3Å; E67-R265 WeakPolarHBondContact O-CA 3.45Å; E67-R265 IonicContact OE2-CZ 3.83Å; E67-R265 IonicContact OE2-NE 3.96Å; E67-R265 PolarHBondContact OE2-NE 3.32Å; E67-R265 IonicContact OE2-NH2 2.72Å; L69-R265 HydrophobicContact CD1-CB 3.98Å; L69-R265 HydrophobicContact CD2-CB 4.08Å; L69-R265 HydrophobicContact CD2-CG 4.4Å; L69-R265 HydrophobicContact CG-CB 3.87Å; V257-R265 WeakPolarHBondContact CA-O 3.4Å; F258-R265 HydrophobicContact CB-CB 4.46Å; F258-R265 PolarHBondContact N-O 2.72Å; F258-R265 PolarHBondContact O-N 2.67Å; D260-R265 VanDerWaalsContact CB-NH1 3.33Å; D260-R265 WeakPolarHBondContact OD2-CD 3.23Å; D260-R265 IonicContact OD2-CZ 2.64Å; D260-R265 IonicContact OD2-NE 3.8Å; D260-R265 IonicContact OD2-NH1 3.25Å; D260-R265 PolarHBondContact OD2-NH1 2.66Å; N262-R265 PolarHBondContact ND2-NH2 3.35Å; N262-R265 PolarHBondContact OD1-NH1 3.41Å; N262-R265 PolarHBondContact OD1-NH2 3.42Å
266	T	97.3	Very high	96.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	148.8	-173.9	62.7	0	0	0	0	113.8	I65 E67 T68 L69 F256 V257	I65-T266 HydrophobicContact CB-CG2 4.47Å; I65-T266 HydrophobicContact CD1-CG2 3.51Å; I65-T266 HydrophobicContact CG1-CG2 3.96Å; I65-T266 HydrophobicContact CG2-CG2 3.69Å; E67-T266 PolarHBondContact O-N 3.39Å; T68-T266 CarbonylContact C-O 3.5Å; T68-T266 PolarHBondContact OG1-OG1 2.66Å; L69-T266 WeakPolarHBondContact CB-O 3.08Å; L69-T266 PolarHBondContact N-O 2.88Å; F256-T266 CarbonylContact O-C 3.55Å; F256-T266 VanDerWaalsContact O-CA 3.24Å; F256-T266 WeakPolarHBondContact O-CA 3.17Å; V257-T266 HydrophobicContact CG1-CG2 4.41Å; V257-T266 HydrophobicContact CG2-CG2 4.11Å
267	V	98.6	Very high	96.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120.4	162	172.9	0	0	0	0	106.9	L69 A70 V109 Y243 F256 F258 P269	L69-V267 HydrophobicContact CB-CG2 4.3Å; L69-V267 HydrophobicContact CD1-CG2 4.48Å; A70-V267 HydrophobicContact CB-CG1 4.24Å; V109-V267 HydrophobicContact CG2-CG1 4.27Å; V109-V267 HydrophobicContact CG2-CG2 3.86Å; Y243-V267 HydrophobicContact CE2-CG1 3.84Å; F256-V267 HydrophobicContact CB-CB 4.46Å; F256-V267 PolarHBondContact N-O 3.07Å; F256-V267 PolarHBondContact O-N 2.93Å; F258-V267 HydrophobicContact CE2-CG2 4.08Å; V267-P269 VanDerWaalsContact O-CD 3.31Å; V267-P269 WeakPolarHBondContact O-CD 3.36Å
268	E	98.6	Very high	96.5	Very high	26 Å²	26	28.7 Å²	28.7	12%	0.121	15%	0.145	C	C	.	.			trans	-81.1	121	173.5	-63.8	-174.2	153.8	0	0	109.4	T68 A70 S71 R72 Y247 R273	T68-E268 HydrophobicContact CG2-CG 4Å; A70-E268 WeakPolarHBondContact O-CB 2.98Å; A70-E268 PolarHBondContact O-N 3.46Å; S71-E268 WeakPolarHBondContact CA-OE2 3.32Å; S71-E268 WeakPolarHBondContact CB-OE2 3.2Å; S71-E268 PolarHBondContact OG-OE2 2.88Å; R72-E268 HydrophobicContact CB-CB 4.04Å; R72-E268 PolarHBondContact N-OE2 3.5Å; Y247-E268 HydrophobicContact CD1-CB 3.86Å; Y247-E268 HydrophobicContact CD1-CG 3.8Å; Y247-E268 HydrophobicContact CE1-CG 3.98Å; Y247-E268 VanDerWaalsContact CE1-OE1 3.28Å; Y247-E268 WeakPolarHBondContact CE1-OE1 3.41Å; Y247-E268 HydrophobicContact CG-CB 4.38Å; E268-R273 PolarHBondContact O-NH1 3.42Å; E268-R273 VanDerWaalsContact O-NH1 3.11Å
269	P	98.6	Very high	96.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.			trans	-61.1	137.9	177.9	-31.5	41	0	0	0	113.3	R72 Y243 Y247 F251 V267	R72-P269 VanDerWaalsContact CG-O 3.3Å; R72-P269 WeakPolarHBondContact CG-O 3.32Å; Y243-P269 HydrophobicContact CD1-CB 3.46Å; Y243-P269 VanDerWaalsContact CD1-CB 3.46Å; Y243-P269 HydrophobicContact CD1-CG 3.65Å; Y243-P269 HydrophobicContact CD2-CB 4.29Å; Y243-P269 HydrophobicContact CE1-CB 3.91Å; Y243-P269 HydrophobicContact CE1-CG 3.56Å; Y243-P269 HydrophobicContact CG-CB 3.66Å; Y243-P269 HydrophobicContact CG-CG 4.25Å; Y247-P269 VanDerWaalsContact CB-O 3.27Å; Y247-P269 WeakPolarHBondContact CB-O 3.33Å; Y247-P269 PolarHBondContact N-O 2.86Å; F251-P269 HydrophobicContact CE1-CB 4.24Å; F251-P269 HydrophobicContact CE2-CG 4.43Å; F251-P269 HydrophobicContact CZ-CB 3.67Å; F251-P269 HydrophobicContact CZ-CG 3.74Å; V267-P269 VanDerWaalsContact O-CD 3.31Å; V267-P269 WeakPolarHBondContact O-CD 3.36Å
270	R	98.4	Very high	96.5	Very high	56 Å²	56	26.1 Å²	26.1	21%	0.211	13%	0.132	C	C	.	.			trans	-137.3	135.8	175.1	176.9	-174.6	179.3	121.4	5.8	107.8	R72 E74 Y243 D246 G272 R273	R72-R270 HydrophobicContact CG-CB 4.04Å; R72-R270 HydrophobicContact CG-CG 4.41Å; R72-R270 PolarHBondContact O-NH1 2.83Å; R72-R270 VanDerWaalsContact O-NH1 3.1Å; E74-R270 PolarHBondContact O-NH1 2.85Å; Y243-R270 VanDerWaalsContact CB-O 3.27Å; Y243-R270 WeakPolarHBondContact CB-O 3.46Å; D246-R270 WeakPolarHBondContact OD1-CA 3.43Å; R270-G272 PolarHBondContact O-N 3.46Å; R270-R273 HydrophobicContact CB-CB 3.92Å; R270-R273 WeakPolarHBondContact O-CB 3.14Å; R270-R273 PolarHBondContact O-N 2.88Å
271	A	98.5	Very high	96.8	Very high	21 Å²	21	26.3 Å²	26.3	17%	0.174	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	125.1	178.4	0	0	0	0	0	111.1	A119 Y243 D246	A119-A271 HydrophobicContact CB-CB 4.42Å; Y243-A271 WeakPolarHBondContact O-CA 3.36Å; D246-A271 PolarHBondContact OD1-N 2.8Å
272	G	98.6	Very high	97.2	Very high	3 Å²	3	17.2 Å²	17.2	3%	0.031	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	91	-11.9	-176.6	0	0	0	0	0	115.1	Y243 R270 V274	Y243-G272 PolarHBondContact O-N 3.35Å; R270-G272 PolarHBondContact O-N 3.46Å; G272-V274 PolarHBondContact O-N 3.27Å
273	R	98.8	Very high	97.7	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.			trans	-70.1	131.9	176.6	177.4	167.9	-74.7	178.4	-3.2	111	A70 S71 E74 V109 D111 Y243 E268 R270	A70-R273 PolarHBondContact O-NH1 2.8Å; S71-R273 VanDerWaalsContact C-NH1 3.3Å; S71-R273 PolarHBondContact O-NH1 3.27Å; S71-R273 PolarHBondContact O-NH2 3.48Å; S71-R273 VanDerWaalsContact O-NH2 3.16Å; E74-R273 PolarHBondContact O-NH2 2.85Å; V109-R273 VanDerWaalsContact CG1-CD 3.47Å; V109-R273 HydrophobicContact CG1-CG 3.61Å; D111-R273 WeakPolarHBondContact OD1-CA 3.38Å; D111-R273 WeakPolarHBondContact OD1-CB 3.4Å; D111-R273 VanDerWaalsContact OD1-CG 3.29Å; D111-R273 WeakPolarHBondContact OD1-CG 3.38Å; D111-R273 IonicContact OD1-CZ 2.7Å; D111-R273 IonicContact OD1-NE 2.9Å; D111-R273 PolarHBondContact OD1-NE 3.46Å; D111-R273 IonicContact OD1-NH2 3.97Å; D111-R273 PolarHBondContact OD1-NH2 3.47Å; D111-R273 IonicContact OD2-CZ 3.3Å; D111-R273 IonicContact OD2-NE 3.39Å; D111-R273 IonicContact OD2-NH2 3.68Å; D111-R273 PolarHBondContact OD2-NH2 2.78Å; Y243-R273 HydrophobicContact CD2-CB 3.96Å; Y243-R273 HydrophobicContact CD2-CG 3.95Å; Y243-R273 WeakPolarHBondContact CD2-O 3.27Å; Y243-R273 HydrophobicContact CE2-CG 4.34Å; Y243-R273 PolarHBondContact N-O 3.1Å; E268-R273 PolarHBondContact O-NH1 3.42Å; E268-R273 VanDerWaalsContact O-NH1 3.11Å; R270-R273 HydrophobicContact CB-CB 3.92Å; R270-R273 WeakPolarHBondContact O-CB 3.14Å; R270-R273 PolarHBondContact O-N 2.88Å
274	V	98.9	Very high	98.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	123.2	170.3	-174.5	0	0	0	0	108.6	V109 T110 V113 V114 I185 L241 L242 G272 F276	V109-V274 WeakPolarHBondContact CA-O 3.07Å; T110-V274 HydrophobicContact CG2-CB 4.12Å; T110-V274 PolarHBondContact N-O 2.85Å; T110-V274 PolarHBondContact O-N 2.84Å; V113-V274 HydrophobicContact CB-CG2 4.05Å; V113-V274 HydrophobicContact CG1-CG2 4.19Å; V114-V274 HydrophobicContact CG2-CG2 4.05Å; I185-V274 HydrophobicContact CD1-CG2 4.36Å; I185-V274 HydrophobicContact CG1-CG1 4.21Å; I185-V274 HydrophobicContact CG1-CG2 4.13Å; I185-V274 HydrophobicContact CG2-CG1 4.38Å; L241-V274 WeakPolarHBondContact O-CA 3.2Å; L242-V274 HydrophobicContact CD1-CG2 3.94Å; G272-V274 PolarHBondContact O-N 3.27Å; V274-F276 HydrophobicContact CG1-CD1 4.07Å
275	S	98.8	Very high	98.3	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132.1	166	-177.4	0	0	0	0	108.6	A108 S240 L241	A108-S275 CarbonylContact O-C 3.52Å; A108-S275 WeakPolarHBondContact O-CA 3.22Å; S240-S275 CarbonylContact C-O 3.56Å; S240-S275 WeakPolarHBondContact CA-O 3.26Å; L241-S275 PolarHBondContact N-O 3.14Å; L241-S275 PolarHBondContact O-N 3Å
276	F	98.9	Very high	98.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	151.1	-177.5	61.8	-87.9	0	0	0	111.8	P80 R107 A108 T110 V188 I189 T192 F193 T239 V274	P80-F276 HydrophobicContact CB-CE1 4.4Å; P80-F276 HydrophobicContact CB-CZ 4.16Å; P80-F276 HydrophobicContact CG-CZ 4.28Å; R107-F276 CarbonylContact C-O 3.48Å; A108-F276 HydrophobicContact CB-CD1 4.19Å; A108-F276 HydrophobicContact CB-CD2 3.97Å; A108-F276 HydrophobicContact CB-CE1 3.68Å; A108-F276 HydrophobicContact CB-CE2 3.45Å; A108-F276 VanDerWaalsContact CB-CE2 3.45Å; A108-F276 HydrophobicContact CB-CG 4.34Å; A108-F276 HydrophobicContact CB-CZ 3.29Å; A108-F276 PolarHBondContact N-O 2.74Å; A108-F276 PolarHBondContact O-N 3.26Å; T110-F276 HydrophobicContact CG2-CE1 4.05Å; V188-F276 HydrophobicContact CG1-CE1 4.17Å; V188-F276 HydrophobicContact CG1-CZ 4.44Å; V188-F276 HydrophobicContact CG2-CE1 4.42Å; V188-F276 HydrophobicContact CG2-CZ 4.3Å; I189-F276 HydrophobicContact CB-CD2 4.31Å; I189-F276 HydrophobicContact CD1-CB 4.15Å; I189-F276 HydrophobicContact CG1-CB 3.92Å; I189-F276 HydrophobicContact CG1-CD1 4.49Å; I189-F276 HydrophobicContact CG1-CD2 3.56Å; I189-F276 HydrophobicContact CG1-CE2 4.11Å; I189-F276 HydrophobicContact CG1-CG 3.76Å; T192-F276 HydrophobicContact CG2-CE2 3.74Å; T192-F276 HydrophobicContact CG2-CZ 3.94Å; T192-F276 WeakPolarHBondContact OG1-CZ 3.31Å; F193-F276 HydrophobicContact CD2-CE2 4.45Å; F193-F276 AromaticContact CE2-CD2 3.72Å; F193-F276 HydrophobicContact CE2-CD2 3.72Å; F193-F276 AromaticContact CE2-CE2 3.85Å; F193-F276 HydrophobicContact CE2-CE2 3.85Å; F193-F276 HydrophobicContact CZ-CD2 4.32Å; F193-F276 HydrophobicContact CZ-CE2 4.36Å; T239-F276 CarbonylContact O-C 3.57Å; T239-F276 WeakPolarHBondContact O-CA 3.3Å; T239-F276 WeakPolarHBondContact O-CB 3.47Å; V274-F276 HydrophobicContact CG1-CD1 4.07Å
277	F	98.9	Very high	98.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	161.7	-172.2	54.5	-87.9	0	0	0	111.5	G106 R107 D229 Y238 T239 L241 F256 F258 N283 H285	G106-F277 VanDerWaalsContact O-CA 3.22Å; G106-F277 WeakPolarHBondContact O-CA 3.43Å; G106-F277 WeakPolarHBondContact O-CB 3.34Å; R107-F277 HydrophobicContact CB-CB 4.43Å; R107-F277 HydrophobicContact CG-CB 4.17Å; D229-F277 WeakPolarHBondContact OD2-CE2 3.26Å; D229-F277 WeakPolarHBondContact OD2-CZ 3.42Å; Y238-F277 WeakPolarHBondContact CA-O 3.36Å; T239-F277 HydrophobicContact CG2-CE1 4.1Å; T239-F277 HydrophobicContact CG2-CE2 4.29Å; T239-F277 HydrophobicContact CG2-CZ 3.68Å; T239-F277 PolarHBondContact N-O 3.18Å; T239-F277 PolarHBondContact O-N 3.4Å; L241-F277 HydrophobicContact CD1-CE1 3.75Å; L241-F277 HydrophobicContact CD1-CZ 4.42Å; F256-F277 HydrophobicContact CE1-CE1 4.16Å; F256-F277 AromaticContact CZ-CE1 3.75Å; F256-F277 HydrophobicContact CZ-CE1 3.75Å; F256-F277 AromaticContact CZ-CZ 3.9Å; F256-F277 HydrophobicContact CZ-CZ 3.9Å; F258-F277 HydrophobicContact CE1-CB 4.29Å; F258-F277 AromaticContact CE1-CD1 3.87Å; F258-F277 HydrophobicContact CE1-CD1 3.87Å; F258-F277 HydrophobicContact CE1-CD2 4.3Å; F258-F277 HydrophobicContact CE1-CE1 4.26Å; F258-F277 AromaticContact CE1-CG 3.9Å; F258-F277 HydrophobicContact CE1-CG 3.9Å; F258-F277 HydrophobicContact CZ-CB 4.38Å; F258-F277 AromaticContact CZ-CD1 3.74Å; F258-F277 HydrophobicContact CZ-CD1 3.74Å; F258-F277 HydrophobicContact CZ-CE1 4.26Å; F258-F277 HydrophobicContact CZ-CG 4.13Å; F277-N283 HydrophobicContact CD2-CB 3.68Å; F277-N283 HydrophobicContact CE2-CB 4.2Å; F277-N283 HydrophobicContact CG-CB 4.45Å; F277-H285 AromaticContact CE2-CE1 3.8Å; F277-H285 AromaticContact CE2-ND1 3.98Å; F277-H285 AromaticContact CZ-CE1 3.71Å
278	S	98.7	Very high	98.3	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	134.2	170	55.4	0	0	0	0	110.5	Y91 C105 G106 G280 E282 N283	Y91-S278 WeakPolarHBondContact OH-CB 3.41Å; C105-S278 VanDerWaalsContact CB-OG 3.26Å; C105-S278 WeakPolarHBondContact CB-OG 3.38Å; G106-S278 PolarHBondContact N-OG 2.93Å; G106-S278 PolarHBondContact O-N 3.48Å; S278-G280 VanDerWaalsContact C-N 3.34Å; S278-G280 PolarHBondContact O-N 3.4Å; S278-E282 VanDerWaalsContact CB-OE1 3.26Å; S278-E282 WeakPolarHBondContact CB-OE1 2.98Å; S278-E282 PolarHBondContact OG-OE1 2.89Å; S278-N283 PolarHBondContact O-ND2 3.49Å; S278-N283 PolarHBondContact OG-ND2 3.38Å
279	S	98.4	Very high	98.3	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.007	10%	0.095	C	C	.	.			trans	-81.4	-3.7	-161.4	-72.4	0	0	0	0	117.1	Y91 K230 F236 D237 Y238 T239	Y91-S279 PolarHBondContact OH-N 3.39Å; K230-S279 WeakPolarHBondContact CB-O 3.4Å; K230-S279 PolarHBondContact N-O 3.07Å; F236-S279 WeakPolarHBondContact O-CB 3.48Å; D237-S279 PolarHBondContact O-N 3.49Å; Y238-S279 WeakPolarHBondContact CA-OG 3.16Å; Y238-S279 PolarHBondContact N-OG 2.95Å; T239-S279 PolarHBondContact N-OG 3.21Å; T239-S279 PolarHBondContact OG1-OG 3.47Å
280	G	97.9	Very high	98.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	-72.1	-179.5	-177	0	0	0	0	0	114.3	D90 Y91 S278 E282 N283	D90-G280 WeakPolarHBondContact OD2-CA 3.49Å; Y91-G280 WeakPolarHBondContact OH-CA 3.43Å; Y91-G280 PolarHBondContact OH-N 3.32Å; S278-G280 VanDerWaalsContact C-N 3.34Å; S278-G280 PolarHBondContact O-N 3.4Å; G280-E282 VanDerWaalsContact CA-OE2 3.32Å; G280-E282 WeakPolarHBondContact CA-OE2 3.39Å; G280-E282 PolarHBondContact O-N 2.89Å; G280-N283 PolarHBondContact O-N 3.37Å
281	S	97.3	Very high	98.2	Very high	40 Å²	40	21.2 Å²	21.2	28%	0.28	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-60.2	-16.6	-174.4	-63	0	0	0	0	114	S88 D90 N283	S88-S281 PolarHBondContact OG-N 3.01Å; D90-S281 PolarHBondContact OD1-OG 2.89Å; D90-S281 VanDerWaalsContact OD2-CB 3.3Å; D90-S281 WeakPolarHBondContact OD2-CB 3.27Å; D90-S281 PolarHBondContact OD2-N 3.33Å; D90-S281 PolarHBondContact OD2-OG 3.42Å; S281-N283 PolarHBondContact O-N 2.88Å; S281-N283 VanDerWaalsContact O-N 3.16Å
282	E	97.6	Very high	98.2	Very high	23 Å²	23	27.4 Å²	27.4	11%	0.107	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-64.8	-11.7	171.2	73.1	-82	-173.6	0	0	113.8	V85 Q86 S88 Y91 C105 R107 S278 G280	V85-E282 HydrophobicContact CG2-CB 3.94Å; V85-E282 HydrophobicContact CG2-CG 3.54Å; Q86-E282 WeakPolarHBondContact O-CB 3.21Å; S88-E282 WeakPolarHBondContact CB-OE2 3.25Å; S88-E282 PolarHBondContact N-OE2 2.83Å; S88-E282 VanDerWaalsContact N-OE2 3.07Å; S88-E282 PolarHBondContact OG-OE2 2.92Å; Y91-E282 WeakPolarHBondContact CE2-OE1 3.29Å; Y91-E282 PolarHBondContact OH-OE1 3.33Å; C105-E282 HydrophobicContact CB-CG 4.05Å; C105-E282 PolarHBondContact SG-OE1 3.39Å; R107-E282 PolarHBondContact NH2-O 3.17Å; S278-E282 VanDerWaalsContact CB-OE1 3.26Å; S278-E282 WeakPolarHBondContact CB-OE1 2.98Å; S278-E282 PolarHBondContact OG-OE1 2.89Å; G280-E282 VanDerWaalsContact CA-OE2 3.32Å; G280-E282 WeakPolarHBondContact CA-OE2 3.39Å; G280-E282 PolarHBondContact O-N 2.89Å
283	N	98.2	Very high	98.2	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-125.3	48.6	179.9	-71.6	-55.4	0	0	0	111.8	R107 F258 F277 S278 G280 S281 H285	R107-N283 WeakPolarHBondContact CG-OD1 3.31Å; R107-N283 PolarHBondContact NE-OD1 2.97Å; R107-N283 PolarHBondContact NH2-OD1 3.47Å; F258-N283 HydrophobicContact CD1-CB 4.33Å; F258-N283 HydrophobicContact CE1-CB 4.24Å; F277-N283 HydrophobicContact CD2-CB 3.68Å; F277-N283 HydrophobicContact CE2-CB 4.2Å; F277-N283 HydrophobicContact CG-CB 4.45Å; S278-N283 PolarHBondContact O-ND2 3.49Å; S278-N283 PolarHBondContact OG-ND2 3.38Å; G280-N283 PolarHBondContact O-N 3.37Å; S281-N283 PolarHBondContact O-N 2.88Å; S281-N283 VanDerWaalsContact O-N 3.16Å; N283-H285 PolarHBondContact O-N 3.44Å; N283-H285 PolarHBondContact O-ND1 3.14Å
284	L	98.4	Very high	98.2	Very high	56 Å²	56	30.1 Å²	30.1	29%	0.293	15%	0.152	S	C	.	.			trans	-54.2	128.3	164.9	177.6	67.8	0	0	0	109.8	P226 I228 M259	P226-L284 HydrophobicContact CB-CD1 3.98Å; I228-L284 HydrophobicContact CD1-CD1 4.3Å; I228-L284 HydrophobicContact CG1-CB 4.22Å; I228-L284 HydrophobicContact CG1-CD1 3.89Å; M259-L284 HydrophobicContact CB-CD2 4.01Å; M259-L284 HydrophobicContact CB-CG 4.1Å; M259-L284 PolarHBondContact N-O 3.02Å
285	H	98.5	Very high	98.1	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.019	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	165.6	-174.2	62.7	-91.6	0	0	0	113.5	P226 H227 D229 F256 V257 F258 F277 N283	P226-H285 CarbonylContact C-O 3.58Å; P226-H285 VanDerWaalsContact CA-O 3.28Å; P226-H285 WeakPolarHBondContact CA-O 3.3Å; H227-H285 AromaticContact CD2-NE2 3.71Å; H227-H285 AromaticContact CE1-CD2 3.87Å; H227-H285 AromaticContact CE1-NE2 3.75Å; H227-H285 PolarHBondContact N-O 2.98Å; H227-H285 AromaticContact NE2-CD2 3.86Å; H227-H285 AromaticContact NE2-NE2 3.26Å; H227-H285 PolarHBondContact NE2-NE2 3.33Å; H227-H285 PolarHBondContact O-N 3.34Å; D229-H285 IonicContact OD1-CE1 2.74Å; D229-H285 IonicContact OD1-NE2 3.55Å; D229-H285 IonicContact OD2-CE1 2.8Å; D229-H285 PolarHBondContact OD2-CE1 3.41Å; D229-H285 IonicContact OD2-NE2 3.54Å; F256-H285 HydrophobicContact CE1-CB 3.79Å; F256-H285 AromaticContact CE2-CD2 3.5Å; F256-H285 VanDerWaalsContact CE2-CD2 3.5Å; F256-H285 WeakPolarHBondContact CE2-CD2 3.24Å; F256-H285 HydrophobicContact CZ-CB 3.7Å; F256-H285 AromaticContact CZ-CD2 3.18Å; F256-H285 WeakPolarHBondContact CZ-CD2 3.21Å; F256-H285 AromaticContact CZ-CG 3.41Å; F256-H285 VanDerWaalsContact CZ-CG 3.41Å; F256-H285 AromaticContact CZ-NE2 3.78Å; V257-H285 CarbonylContact O-C 3.56Å; V257-H285 WeakPolarHBondContact O-CA 3.19Å; V257-H285 WeakPolarHBondContact O-CB 3.4Å; F258-H285 HydrophobicContact CD1-CB 4.2Å; F277-H285 AromaticContact CE2-CE1 3.8Å; F277-H285 AromaticContact CE2-ND1 3.98Å; F277-H285 AromaticContact CZ-CE1 3.71Å; N283-H285 PolarHBondContact O-N 3.44Å; N283-H285 PolarHBondContact O-ND1 3.14Å
286	R	98	Very high	98.1	Very high	48 Å²	48	31.4 Å²	31.4	18%	0.181	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	167.1	173.5	64.2	178.6	178.5	86.4	-0.8	111.2	V257 M259	V257-R286 HydrophobicContact CB-CG 3.99Å; V257-R286 HydrophobicContact CG2-CG 4.45Å; V257-R286 PolarHBondContact N-O 3.12Å; V257-R286 PolarHBondContact O-N 3.49Å; M259-R286 HydrophobicContact CG-CG 4.47Å; M259-R286 HydrophobicContact SD-CG 3.91Å
287	V	97.8	Very high	98.1	Very high	13 Å²	13	31.4 Å²	31.4	8%	0.079	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	134.8	166.8	-175	0	0	0	0	108.7	Y223 W224 F256	Y223-V287 HydrophobicContact CD2-CB 4.19Å; Y223-V287 HydrophobicContact CD2-CG1 4.24Å; Y223-V287 HydrophobicContact CE2-CG1 4.43Å; W224-V287 VanDerWaalsContact CA-O 3.24Å; W224-V287 WeakPolarHBondContact CA-O 3.49Å; W224-V287 VanDerWaalsContact CB-O 3.22Å; W224-V287 WeakPolarHBondContact CB-O 3.32Å; F256-V287 HydrophobicContact CD2-CG2 4.22Å
288	E	97.2	Very high	98.1	Very high	22 Å²	22	31.6 Å²	31.6	10%	0.103	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-62.5	150.3	169.8	-69.5	-179.2	155.4	0	0	111.1	G254 R255 V257 V290	G254-E288 WeakPolarHBondContact CA-O 3.43Å; G254-E288 PolarHBondContact N-O 3.3Å; R255-E288 HydrophobicContact CB-CG 4.39Å; R255-E288 WeakPolarHBondContact CB-OE2 3.35Å; R255-E288 WeakPolarHBondContact CG-OE2 3.36Å; R255-E288 IonicContact CZ-OE1 3.23Å; R255-E288 IonicContact CZ-OE2 3.49Å; R255-E288 PolarHBondContact N-OE2 3.49Å; R255-E288 VanDerWaalsContact NE-CD 3.33Å; R255-E288 IonicContact NE-OE1 2.89Å; R255-E288 PolarHBondContact NE-OE1 3.31Å; R255-E288 IonicContact NE-OE2 3.14Å; R255-E288 PolarHBondContact NE-OE2 3.12Å; R255-E288 IonicContact NH2-OE1 2.68Å; R255-E288 PolarHBondContact NH2-OE1 2.99Å; R255-E288 IonicContact NH2-OE2 2.87Å; R255-E288 PolarHBondContact O-N 3.44Å; V257-E288 HydrophobicContact CG2-CG 3.61Å; E288-V290 PolarHBondContact O-N 2.97Å
289	K	97.4	Very high	98.1	Very high	114 Å²	114	32.4 Å²	32.4	50%	0.496	16%	0.164	S	C	.	.	P	Polyproline II helix	trans	-60.4	130.1	170.6	-71	-178.9	174.2	178.4	0	109.7	W224 G253 G254 T291	W224-K289 HydrophobicContact CB-CG 3.95Å; W224-K289 HydrophobicContact CD2-CD 4.16Å; W224-K289 HydrophobicContact CD2-CG 3.86Å; W224-K289 HydrophobicContact CE3-CD 4.41Å; W224-K289 HydrophobicContact CE3-CG 3.95Å; W224-K289 HydrophobicContact CG-CD 4.34Å; W224-K289 VanDerWaalsContact CG-CE 3.48Å; W224-K289 HydrophobicContact CG-CG 3.84Å; G253-K289 WeakPolarHBondContact CA-O 3.34Å; G254-K289 PolarHBondContact N-O 3.41Å; K289-T291 PolarHBondContact O-N 2.94Å
290	V	98.3	Very high	98.1	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.03	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	125.4	169.2	174.6	0	0	0	0	107.5	I211 S213 Y223 F251 T252 E288 W292 R295	I211-V290 HydrophobicContact CB-CG2 4.42Å; I211-V290 HydrophobicContact CG2-CB 4.47Å; I211-V290 HydrophobicContact CG2-CG2 3.77Å; S213-V290 WeakPolarHBondContact CA-O 3.22Å; S213-V290 VanDerWaalsContact CB-O 3.26Å; S213-V290 WeakPolarHBondContact CB-O 3.15Å; Y223-V290 PolarHBondContact OH-N 3.16Å; F251-V290 HydrophobicContact CB-CG1 4.31Å; F251-V290 HydrophobicContact CD2-CG2 4.42Å; T252-V290 WeakPolarHBondContact O-CA 3.48Å; E288-V290 PolarHBondContact O-N 2.97Å; V290-W292 WeakPolarHBondContact CG1-O 3.37Å; V290-R295 HydrophobicContact CG2-CB 4.17Å
291	T	97.4	Very high	98.1	Very high	95 Å²	95	32.5 Å²	32.5	58%	0.583	16%	0.164	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	-26.8	-179.3	52.3	0	0	0	0	111.9	T252 K289	T252-T291 PolarHBondContact O-N 2.95Å; T252-T291 PolarHBondContact O-OG1 3.15Å; T252-T291 PolarHBondContact OG1-OG1 3.44Å; K289-T291 PolarHBondContact O-N 2.94Å
292	W	98.1	Very high	98.2	Very high	151 Å²	151	30.6 Å²	30.6	57%	0.572	15%	0.151	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-154.7	151.7	175.6	173.2	89.4	0	0	0	110.8	S249 F251 T252 V290	S249-W292 WeakPolarHBondContact O-CZ3 3.32Å; F251-W292 CarbonylContact C-O 3.59Å; F251-W292 WeakPolarHBondContact CA-O 3.44Å; F251-W292 VanDerWaalsContact CB-O 3.23Å; F251-W292 WeakPolarHBondContact CB-O 3.41Å; T252-W292 HydrophobicContact CG2-CE3 4.47Å; T252-W292 PolarHBondContact N-O 3.1Å; V290-W292 WeakPolarHBondContact CG1-O 3.37Å
293	G	98.3	Very high	98.3	Very high	20 Å²	20	29.5 Å²	29.5	21%	0.206	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.6	-160.8	175.6	0	0	0	0	0	113.3	N212 D250	N212-G293 WeakPolarHBondContact CB-O 3.18Å; D250-G293 VanDerWaalsContact O-CA 3.29Å; D250-G293 WeakPolarHBondContact O-CA 3.2Å
294	T	98.4	Very high	98.3	Very high	39 Å²	39	29.5 Å²	29.5	24%	0.239	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	130	-179.2	-58.3	0	0	0	0	111.1	R210 I211 D250 Y296	R210-T294 HydrophobicContact CG-CG2 3.47Å; R210-T294 VanDerWaalsContact CG-CG2 3.47Å; I211-T294 CarbonylContact O-C 3.5Å; I211-T294 WeakPolarHBondContact O-CA 3.36Å; D250-T294 PolarHBondContact O-N 2.86Å; D250-T294 VanDerWaalsContact O-N 3.13Å; T294-Y296 HydrophobicContact CG2-CD2 3.99Å; T294-Y296 HydrophobicContact CG2-CE2 3.44Å; T294-Y296 VanDerWaalsContact CG2-CE2 3.44Å
295	R	98.6	Very high	98.2	Very high	3 Å²	3	28.3 Å²	28.3	1%	0.011	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	123.5	177	177	-172.7	179.4	-75.2	7.8	109.7	R210 I211 F251 G254 V290	R210-R295 WeakPolarHBondContact CA-O 3.37Å; I211-R295 HydrophobicContact CB-CB 4.41Å; I211-R295 PolarHBondContact N-O 2.78Å; I211-R295 PolarHBondContact O-N 3.29Å; F251-R295 HydrophobicContact CD1-CB 3.92Å; F251-R295 HydrophobicContact CD1-CG 4.42Å; F251-R295 HydrophobicContact CD2-CB 4Å; F251-R295 HydrophobicContact CD2-CG 4.5Å; F251-R295 HydrophobicContact CE1-CB 3.96Å; F251-R295 HydrophobicContact CE1-CG 3.94Å; F251-R295 HydrophobicContact CE2-CB 4.01Å; F251-R295 HydrophobicContact CE2-CG 4.01Å; F251-R295 HydrophobicContact CG-CB 3.94Å; F251-R295 HydrophobicContact CZ-CB 3.98Å; F251-R295 HydrophobicContact CZ-CG 3.69Å; G254-R295 WeakPolarHBondContact O-CD 3.44Å; G254-R295 PolarHBondContact O-NE 2.96Å; G254-R295 VanDerWaalsContact O-NE 3.14Å; V290-R295 HydrophobicContact CG2-CB 4.17Å
296	Y	98.8	Very high	98.2	Very high	24 Å²	24	31.3 Å²	31.3	9%	0.094	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	137.8	167.9	-67.2	-91.1	0	0	0	111.5	R123 A126 E127 L130 S209 R210 L244 S245 T294	R123-Y296 HydrophobicContact CG-CD2 4.39Å; R123-Y296 HydrophobicContact CG-CG 4.45Å; A126-Y296 HydrophobicContact CB-CD1 4.19Å; E127-Y296 HydrophobicContact CG-CE1 4.1Å; E127-Y296 HydrophobicContact CG-CE2 4.28Å; L130-Y296 HydrophobicContact CD1-CD1 4.5Å; L130-Y296 HydrophobicContact CD1-CE1 4.08Å; S209-Y296 VanDerWaalsContact O-CA 3.31Å; S209-Y296 WeakPolarHBondContact O-CA 3.38Å; R210-Y296 HydrophobicContact CB-CD1 3.93Å; R210-Y296 HydrophobicContact CB-CE1 3.55Å; R210-Y296 VanDerWaalsContact CD-OH 3.24Å; R210-Y296 WeakPolarHBondContact CD-OH 3.28Å; R210-Y296 HydrophobicContact CG-CD1 4.22Å; R210-Y296 HydrophobicContact CG-CE1 3.53Å; R210-Y296 HydrophobicContact CG-CE2 4.38Å; L244-Y296 PolarHBondContact N-O 3.48Å; S245-Y296 WeakPolarHBondContact OG-CB 3.3Å; S245-Y296 PolarHBondContact OG-N 2.73Å; T294-Y296 HydrophobicContact CG2-CD2 3.99Å; T294-Y296 HydrophobicContact CG2-CE2 3.44Å; T294-Y296 VanDerWaalsContact CG2-CE2 3.44Å
297	A	98.8	Very high	98.2	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	158	172.2	0	0	0	0	0	111.4	F208 S209 L242 Y243	F208-A297 CarbonylContact C-O 3.33Å; F208-A297 WeakPolarHBondContact CA-O 3.28Å; S209-A297 PolarHBondContact N-O 3.21Å; S209-A297 PolarHBondContact O-N 2.98Å; S209-A297 PolarHBondContact OG-O 3.16Å; L242-A297 CarbonylContact O-C 3.49Å; L242-A297 VanDerWaalsContact O-CA 3.22Å; L242-A297 WeakPolarHBondContact O-CA 3.36Å; Y243-A297 HydrophobicContact CD1-CB 4.27Å
298	I	98.7	Very high	98.2	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.015	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.7	169	-41	-174.3	0	0	0	108.3	L122 Y178 F207 F208 L241 L242 L244 V300	L122-I298 HydrophobicContact CB-CD1 4.25Å; L122-I298 HydrophobicContact CD1-CD1 3.95Å; L122-I298 HydrophobicContact CD2-CD1 4.26Å; L122-I298 HydrophobicContact CG-CD1 4.39Å; Y178-I298 HydrophobicContact CE2-CG2 4.25Å; F207-I298 WeakPolarHBondContact O-CA 3.36Å; F208-I298 HydrophobicContact CD1-CD1 3.94Å; F208-I298 HydrophobicContact CD1-CG1 3.66Å; F208-I298 HydrophobicContact CE1-CD1 3.29Å; F208-I298 HydrophobicContact CE1-CG1 3.58Å; F208-I298 HydrophobicContact CE2-CD1 4.48Å; F208-I298 HydrophobicContact CG-CG1 4.41Å; F208-I298 HydrophobicContact CZ-CD1 3.61Å; F208-I298 HydrophobicContact CZ-CG1 4.22Å; L241-I298 CarbonylContact C-O 3.39Å; L241-I298 VanDerWaalsContact CA-O 3.3Å; L241-I298 WeakPolarHBondContact CA-O 3.44Å; L242-I298 HydrophobicContact CB-CB 4.32Å; L242-I298 HydrophobicContact CD2-CD1 4.06Å; L242-I298 PolarHBondContact N-O 2.98Å; L242-I298 PolarHBondContact O-N 3.43Å; L244-I298 HydrophobicContact CD1-CD1 4.19Å; L244-I298 HydrophobicContact CD1-CG1 3.7Å; L244-I298 HydrophobicContact CD2-CD1 4.43Å; L244-I298 HydrophobicContact CD2-CG1 4.36Å; L244-I298 HydrophobicContact CG-CG1 4.17Å; I298-V300 HydrophobicContact CB-CG2 4.5Å; I298-V300 HydrophobicContact CG2-CG2 3.77Å
299	T	98.6	Very high	98.2	Very high	17 Å²	17	37.7 Å²	37.7	10%	0.104	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.4	166.6	-60.8	0	0	0	0	108.2	T206 F207 T239 S240	T206-T299 VanDerWaalsContact CA-O 3.31Å; T206-T299 WeakPolarHBondContact CA-O 3.49Å; T206-T299 VanDerWaalsContact CG2-O 3.31Å; T206-T299 WeakPolarHBondContact CG2-O 3.3Å; F207-T299 HydrophobicContact CE1-CG2 4.42Å; F207-T299 PolarHBondContact N-O 3.49Å; F207-T299 VanDerWaalsContact N-O 3.12Å; F207-T299 PolarHBondContact O-N 2.74Å; T239-T299 HydrophobicContact CG2-CG2 4.21Å; S240-T299 CarbonylContact O-C 3.57Å; S240-T299 WeakPolarHBondContact O-CA 3.48Å
300	V	98.5	Very high	98.2	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.018	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.8	175.7	-176	0	0	0	0	108.2	R182 I185 L202 T206 S240 I298 F302	R182-V300 HydrophobicContact CG-CG1 3.81Å; I185-V300 HydrophobicContact CD1-CG2 4.45Å; L202-V300 HydrophobicContact CD1-CG1 3.68Å; T206-V300 HydrophobicContact CG2-CB 4.45Å; T206-V300 HydrophobicContact CG2-CG1 4.5Å; T206-V300 HydrophobicContact CG2-CG2 4.17Å; S240-V300 PolarHBondContact N-O 3.25Å; S240-V300 PolarHBondContact O-N 2.89Å; S240-V300 WeakPolarHBondContact OG-CB 3.3Å; S240-V300 PolarHBondContact OG-O 2.87Å; I298-V300 HydrophobicContact CB-CG2 4.5Å; I298-V300 HydrophobicContact CG2-CG2 3.77Å; V300-F302 HydrophobicContact CG1-CE1 4.48Å; V300-F302 HydrophobicContact CG1-CE2 3.79Å; V300-F302 HydrophobicContact CG1-CZ 3.64Å
301	S	98.1	Very high	98.2	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	149.5	-172.3	55.3	0	0	0	0	112	T203 P205 F236	T203-S301 PolarHBondContact N-O 3.43Å; T203-S301 PolarHBondContact O-OG 3.46Å; P205-S301 PolarHBondContact O-OG 2.99Å; F236-S301 WeakPolarHBondContact CE1-OG 3.31Å; F236-S301 WeakPolarHBondContact CZ-OG 3.43Å
302	F	98.8	Very high	98.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	146.1	-178.6	-58	-86.8	0	0	0	111.4	I185 Q186 I189 M200 Y201 L202 D237 Y238 V300	I185-F302 HydrophobicContact CG2-CE2 3.98Å; I185-F302 HydrophobicContact CG2-CZ 4.3Å; Q186-F302 HydrophobicContact CB-CD1 4.44Å; Q186-F302 HydrophobicContact CB-CE1 3.57Å; Q186-F302 HydrophobicContact CB-CZ 3.68Å; Q186-F302 HydrophobicContact CG-CD1 4.06Å; Q186-F302 HydrophobicContact CG-CE1 3.62Å; Q186-F302 HydrophobicContact CG-CZ 4.2Å; I189-F302 HydrophobicContact CD1-CD2 3.73Å; I189-F302 HydrophobicContact CD1-CE2 3.55Å; M200-F302 HydrophobicContact CE-CB 4.49Å; M200-F302 HydrophobicContact CE-CD1 4.21Å; M200-F302 HydrophobicContact CE-CD2 4.45Å; M200-F302 HydrophobicContact CE-CG 4.12Å; M200-F302 HydrophobicContact CG-CB 3.61Å; M200-F302 HydrophobicContact CG-CD1 4.25Å; M200-F302 HydrophobicContact CG-CG 4.11Å; M200-F302 HydrophobicContact SD-CB 3.95Å; M200-F302 HydrophobicContact SD-CG 4.21Å; Y201-F302 CarbonylContact O-C 3.54Å; Y201-F302 WeakPolarHBondContact O-CA 3.12Å; Y201-F302 WeakPolarHBondContact O-CB 3.27Å; L202-F302 HydrophobicContact CB-CE1 4.48Å; L202-F302 HydrophobicContact CD1-CE1 4.15Å; D237-F302 PolarHBondContact N-O 3.33Å; Y238-F302 PolarHBondContact N-O 2.9Å; Y238-F302 VanDerWaalsContact N-O 3.12Å; Y238-F302 PolarHBondContact O-N 3.32Å; V300-F302 HydrophobicContact CG1-CE1 4.48Å; V300-F302 HydrophobicContact CG1-CE2 3.79Å; V300-F302 HydrophobicContact CG1-CZ 3.64Å
303	T	98.6	Very high	98	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	151.1	176.9	-170.5	0	0	0	0	110	Y201 T203 S235 D305 H308	Y201-T303 PolarHBondContact N-O 3.03Å; Y201-T303 PolarHBondContact O-N 3Å; T203-T303 HydrophobicContact CG2-CG2 4.37Å; S235-T303 WeakPolarHBondContact O-CB 3.3Å; S235-T303 PolarHBondContact O-OG1 3.12Å; T303-D305 VanDerWaalsContact CG2-O 3.26Å; T303-D305 WeakPolarHBondContact CG2-O 3.42Å; T303-D305 PolarHBondContact OG1-N 2.94Å; T303-D305 VanDerWaalsContact OG1-N 3.14Å; T303-H308 HydrophobicContact CG2-CB 3.93Å
304	C	98.3	Very high	97.7	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.007	20%	0.204	C	C	.	.	S	Bend	trans	-89.8	-10.6	168.6	-60.8	0	0	0	0	112.6	Y97 C100 T101 D237 P306	Y97-C304 VanDerWaalsContact CD1-O 3.27Å; Y97-C304 WeakPolarHBondContact CD1-O 3.28Å; Y97-C304 HydrophobicContact CD2-CB 4.01Å; Y97-C304 HydrophobicContact CG-CB 4.1Å; Y97-C304 VanDerWaalsContact CG-O 3.23Å; C100-C304 HydrophobicContact CB-CB 3.58Å; C100-C304 WeakPolarHBondContact CB-SG 3.38Å; C100-C304 PolarHBondContact O-SG 2.97Å; C100-C304 WeakPolarHBondContact SG-CA 3.37Å; C100-C304 WeakPolarHBondContact SG-CB 3.47Å; C100-C304 CovalentContact SG-SG 2.04Å; C100-C304 PolarHBondContact SG-SG 3.43Å; T101-C304 PolarHBondContact N-SG 3.36Å; T101-C304 VanDerWaalsContact N-SG 3.4Å; D237-C304 WeakPolarHBondContact OD2-CB 3.47Å; D237-C304 PolarHBondContact OD2-N 3.38Å; C304-P306 WeakPolarHBondContact O-CD 3.45Å
305	D	97.8	Very high	97.1	Very high	30 Å²	30	33 Å²	33	16%	0.16	20%	0.203	C	C	.	.			trans	-91.3	111.8	178.3	-174.6	9.1	0	0	0	111.4	Y97 T303 S307 H308	Y97-D305 HydrophobicContact CE1-CB 4.38Å; Y97-D305 HydrophobicContact CE2-CB 3.74Å; Y97-D305 WeakPolarHBondContact OH-CB 3.46Å; Y97-D305 PolarHBondContact OH-OD1 3.02Å; Y97-D305 PolarHBondContact OH-OD2 3.18Å; T303-D305 VanDerWaalsContact CG2-O 3.26Å; T303-D305 WeakPolarHBondContact CG2-O 3.42Å; T303-D305 PolarHBondContact OG1-N 2.94Å; T303-D305 VanDerWaalsContact OG1-N 3.14Å; D305-S307 PolarHBondContact O-N 3.26Å; D305-S307 WeakPolarHBondContact OD1-CB 3.48Å; D305-S307 PolarHBondContact OD1-N 3.44Å; D305-S307 PolarHBondContact OD1-OG 2.98Å; D305-S307 PolarHBondContact OD2-OG 2.89Å; D305-H308 PolarHBondContact O-N 3.02Å; D305-H308 IonicContact OD2-CD2 3.5Å; D305-H308 PolarHBondContact OD2-CD2 3.13Å; D305-H308 IonicContact OD2-NE2 3.77Å
306	P	97.7	Very high	96.2	Very high	68 Å²	68	39.3 Å²	39.3	44%	0.442	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-60.9	-18.9	177.8	25.6	-34.8	0	0	0	113.3	Y201 C304 H308 A309	Y201-P306 HydrophobicContact CD2-CB 4.3Å; Y201-P306 HydrophobicContact CE1-CB 4.45Å; Y201-P306 HydrophobicContact CE2-CB 3.83Å; Y201-P306 HydrophobicContact CE2-CG 4.34Å; C304-P306 WeakPolarHBondContact O-CD 3.45Å; P306-H308 PolarHBondContact O-N 3.03Å; P306-A309 VanDerWaalsContact O-CB 3.29Å; P306-A309 WeakPolarHBondContact O-CB 3.34Å; P306-A309 PolarHBondContact O-N 3.1Å
307	S	97.5	Very high	96.1	Very high	88 Å²	88	40.1 Å²	40.1	62%	0.615	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-66.3	-23.3	175.4	90.7	0	0	0	0	113.2	D305	D305-S307 PolarHBondContact O-N 3.26Å; D305-S307 WeakPolarHBondContact OD1-CB 3.48Å; D305-S307 PolarHBondContact OD1-N 3.44Å; D305-S307 PolarHBondContact OD1-OG 2.98Å; D305-S307 PolarHBondContact OD2-OG 2.89Å
308	H	97.8	Very high	96	Very high	86 Å²	86	42.1 Å²	42.1	40%	0.398	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-102.3	6	177.9	-71	-61.3	0	0	0	113.1	T203 T303 D305 P306	T203-H308 WeakPolarHBondContact CB-O 3.23Å; T203-H308 PolarHBondContact OG1-O 3.36Å; T303-H308 HydrophobicContact CG2-CB 3.93Å; D305-H308 PolarHBondContact O-N 3.02Å; D305-H308 IonicContact OD2-CD2 3.5Å; D305-H308 PolarHBondContact OD2-CD2 3.13Å; D305-H308 IonicContact OD2-NE2 3.77Å; P306-H308 PolarHBondContact O-N 3.03Å
309	A	98.2	Very high	95.8	Very high	43 Å²	43	44.3 Å²	44.3	36%	0.355	28%	0.278	S	S	.	.			trans	-66.5	138.5	178	0	0	0	0	0	111.4	Y201 L202 P306	Y201-A309 HydrophobicContact CD1-CB 4.13Å; Y201-A309 HydrophobicContact CG-CB 3.91Å; L202-A309 WeakPolarHBondContact O-CA 3.47Å; P306-A309 VanDerWaalsContact O-CB 3.29Å; P306-A309 WeakPolarHBondContact O-CB 3.34Å; P306-A309 PolarHBondContact O-N 3.1Å
310	I	97.8	Very high	95.7	Very high	44 Å²	44	45.9 Å²	45.9	23%	0.226	29%	0.288	C	S	.	.			trans	-119	152.2	170.5	68.5	177.3	0	0	0	110.2	H145 L202 T203 K204	H145-I310 HydrophobicContact CB-CD1 4.35Å; L202-I310 HydrophobicContact CB-CG1 4.25Å; L202-I310 HydrophobicContact CD2-CD1 4.29Å; L202-I310 HydrophobicContact CD2-CG1 4.04Å; L202-I310 HydrophobicContact CG-CD1 4.11Å; L202-I310 HydrophobicContact CG-CG1 3.81Å; L202-I310 PolarHBondContact O-N 2.72Å; T203-I310 WeakPolarHBondContact O-CD1 3.49Å; K204-I310 HydrophobicContact CB-CD1 4.12Å; K204-I310 HydrophobicContact CB-CG2 4.3Å; K204-I310 HydrophobicContact CD-CG2 4.41Å; K204-I310 HydrophobicContact CG-CG2 4.39Å
311	S	96.9	Very high	95.5	Very high	102 Å²	102	48.6 Å²	48.6	71%	0.713	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-73.6	161	170.7	-58.2	0	0	0	0	110.9	H145	H145-S311 PolarHBondContact CE1-O 2.72Å; H145-S311 PolarHBondContact ND1-O 3.26Å; H145-S311 VanDerWaalsContact ND1-O 3.11Å
312	D	96.9	Very high	95.3	Very high	55 Å²	55	51.8 Å²	51.8	29%	0.294	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-60	151.8	165.6	-81.9	-55.8	0	0	0	111.3	R179 R182	R179-D312 VanDerWaalsContact CD-CB 3.48Å; R179-D312 HydrophobicContact CG-CB 3.62Å; R182-D312 IonicContact CZ-OD1 2.78Å; R182-D312 IonicContact CZ-OD2 2.68Å; R182-D312 VanDerWaalsContact CZ-OD2 3.3Å; R182-D312 IonicContact NE-OD1 3.25Å; R182-D312 PolarHBondContact NE-OD1 2.7Å; R182-D312 IonicContact NE-OD2 3.7Å; R182-D312 VanDerWaalsContact NH2-CG 3.29Å; R182-D312 IonicContact NH2-OD1 3.4Å; R182-D312 PolarHBondContact NH2-OD1 2.95Å; R182-D312 VanDerWaalsContact NH2-OD1 3.12Å; R182-D312 IonicContact NH2-OD2 3.26Å; R182-D312 PolarHBondContact NH2-OD2 2.95Å
313	P	94.9	Very high	95.1	Very high	8 Å²	8	55.5 Å²	55.5	5%	0.052	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-73.9	151.5	178.6	35.2	-32	0	0	0	109.5	L144 H145 F175 Y178 R179	L144-P313 HydrophobicContact CB-CB 3.97Å; L144-P313 HydrophobicContact CB-CG 4.09Å; H145-P313 WeakPolarHBondContact CE1-CD 3.31Å; F175-P313 HydrophobicContact CD1-CB 3.94Å; F175-P313 HydrophobicContact CD1-CG 4.02Å; F175-P313 WeakPolarHBondContact CD1-O 3.47Å; F175-P313 HydrophobicContact CE1-CB 3.84Å; F175-P313 HydrophobicContact CE1-CG 4.31Å; Y178-P313 HydrophobicContact CD1-CG 3.61Å; Y178-P313 HydrophobicContact CE1-CG 3.58Å; R179-P313 PolarHBondContact NH1-O 3.35Å
314	S	91.6	Very high	94.8	Very high	75 Å²	75	59.7 Å²	59.7	52%	0.524	38%	0.375	S	S	.	.			trans	-129.6	153	171.7	59.2	0	0	0	0	109.3	F175 P316	F175-S314 VanDerWaalsContact CE1-C 3.41Å; F175-S314 WeakPolarHBondContact CE1-O 3.39Å; S314-P316 WeakPolarHBondContact O-CD 3.46Å
315	L	86.4	Confident	94.5	Very high	41 Å²	41	64.6 Å²	64.6	22%	0.215	41%	0.406	C	S	.	.			trans	-62.1	126.9	168.8	-160.5	66.9	0	0	0	107.8	I166 F170 E172 F175	I166-L315 HydrophobicContact CG2-CD1 3.82Å; F170-L315 HydrophobicContact CB-CD1 3.96Å; E172-L315 WeakPolarHBondContact OE1-CB 3.45Å; F175-L315 HydrophobicContact CD2-CB 4.41Å; F175-L315 HydrophobicContact CD2-CD1 4.25Å; F175-L315 HydrophobicContact CE2-CB 4.27Å; F175-L315 HydrophobicContact CE2-CD1 3.51Å; F175-L315 HydrophobicContact CZ-CD1 4.03Å
316	P	80.6	Confident	94.2	Very high	135 Å²	135	67.7 Å²	67.7	88%	0.877	43%	0.428	S	S	*	.			trans	-68.3	0	-176.7	-20.1	31.8	0	0	0	115.3	Y159 S314	Y159-P316 HydrophobicContact CD1-CG 3.46Å; Y159-P316 VanDerWaalsContact CD1-CG 3.46Å; Y159-P316 HydrophobicContact CD2-CG 3.9Å; Y159-P316 HydrophobicContact CE1-CG 3.81Å; Y159-P316 HydrophobicContact CE2-CG 4.21Å; Y159-P316 HydrophobicContact CG-CG 3.5Å; S314-P316 WeakPolarHBondContact O-CD 3.46Å

Retrieved 316 of 316 residues in 155.9 ms (Link to these results)

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