A0A087YDS1_POEFO Loading...

Methyltransferase 22, Kin17 lysine

AlphaFold DB , UniProt , Accession A0A087YDS1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 393 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	34.4	Very low	46.7	Very low	241 Å²	241	145.3 Å²	145.3	100%	1.187	72%	0.724	S	S	*	*				0	101.3	0	-90.7	-172.5	-87.6	0	0	105.7	Q3	M1-Q3 PolarHBondContact O-N 2.86Å
2	D	36.2	Very low	49.4	Very low	162 Å²	162	141.3 Å²	141.3	87%	0.866	71%	0.706	S	S	*	*			trans	-59.8	119.5	172	-63.8	-47.2	0	0	0	107.4	M4	D2-M4 PolarHBondContact O-N 2.95Å
3	Q	38.1	Very low	51.3	Low	174 Å²	174	130.7 Å²	130.7	81%	0.813	65%	0.654	S	S	*	*			trans	-59.5	103.4	169.1	-90.9	177.7	-18.9	0	0	107.1	M1 T5	M1-Q3 PolarHBondContact O-N 2.86Å; Q3-T5 PolarHBondContact O-N 2.89Å; Q3-T5 PolarHBondContact O-OG1 3.3Å
4	M	34.2	Very low	52.4	Low	169 Å²	169	124.9 Å²	124.9	83%	0.833	63%	0.627	S	S	*	*			trans	-65.2	80.9	154.9	-81.9	179.5	174.7	0	0	107	D2 F6	D2-M4 PolarHBondContact O-N 2.95Å; M4-F6 PolarHBondContact O-N 3.31Å
5	T	31.4	Very low	53.2	Low	101 Å²	101	118.5 Å²	118.5	62%	0.62	60%	0.596	S	S	*	*			trans	-68.5	107.6	159.7	-5.2	0	0	0	0	105.2	Q3 K7	Q3-T5 PolarHBondContact O-N 2.89Å; Q3-T5 PolarHBondContact O-OG1 3.3Å; T5-K7 PolarHBondContact O-N 3.42Å
6	F	31.3	Very low	53.6	Low	174 Å²	174	112.5 Å²	112.5	76%	0.763	57%	0.566	S	S	*	*			trans	-63.6	92.9	167.7	-88.1	-95.7	0	0	0	107.6	M4 H8	M4-F6 PolarHBondContact O-N 3.31Å; F6-H8 AromaticContact CD1-ND1 3.75Å; F6-H8 PolarHBondContact O-N 3.37Å
7	K	40.3	Very low	53.5	Low	184 Å²	184	113 Å²	113	80%	0.8	57%	0.567	S	S	*	*			trans	-84.2	59.5	168.5	-75.6	-172.4	173.4	-174.6	0	109.6	T5	T5-K7 PolarHBondContact O-N 3.42Å
8	H	47.4	Very low	53.1	Low	135 Å²	135	112.8 Å²	112.8	63%	0.625	56%	0.564	S	S	*	*			trans	-123.5	95.1	175.1	-58.9	95.5	0	0	0	107.3	F6 T10	F6-H8 AromaticContact CD1-ND1 3.75Å; F6-H8 PolarHBondContact O-N 3.37Å; H8-T10 WeakPolarHBondContact CB-OG1 3.47Å; H8-T10 PolarHBondContact O-N 2.87Å
9	D	65.3	Low	53.2	Low	150 Å²	150	113.7 Å²	113.7	80%	0.802	56%	0.56	S	S	*	*			trans	-67	67.2	164.5	-66.7	-37.1	0	0	0	107.9
10	T	76.9	Confident	52.6	Low	70 Å²	70	114.1 Å²	114.1	43%	0.429	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.9	121.2	-178.1	-58.3	0	0	0	0	108.9	H8 L12 A156 T157	H8-T10 WeakPolarHBondContact CB-OG1 3.47Å; H8-T10 PolarHBondContact O-N 2.87Å; T10-L12 HydrophobicContact CG2-CD2 4.21Å; T10-A156 HydrophobicContact CG2-CB 3.71Å; T10-T157 WeakPolarHBondContact CA-O 2.94Å
11	V	78.4	Confident	52.5	Low	38 Å²	38	115.9 Å²	115.9	23%	0.23	58%	0.583	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.8	127.1	172.4	-178.2	0	0	0	0	108.1	A156 T157 L159 V162 Q165 W167	V11-A156 WeakPolarHBondContact O-CA 3.34Å; V11-T157 PolarHBondContact N-O 3.23Å; V11-T157 PolarHBondContact O-N 3.16Å; V11-L159 HydrophobicContact CG2-CB 4.46Å; V11-L159 HydrophobicContact CG2-CD1 4.07Å; V11-V162 HydrophobicContact CB-CG1 3.91Å; V11-V162 HydrophobicContact CG1-CG1 3.9Å; V11-V162 HydrophobicContact CG2-CG1 3.93Å; V11-Q165 PolarHBondContact O-NE2 2.96Å; V11-W167 HydrophobicContact CG1-CH2 3.5Å; V11-W167 VanDerWaalsContact CG1-CH2 3.5Å; V11-W167 HydrophobicContact CG1-CZ2 3.97Å
12	L	79.1	Confident	53.5	Low	97 Å²	97	107.4 Å²	107.4	51%	0.508	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	143.6	178.2	-60.2	178.2	0	0	0	110.7	T10 A156	T10-L12 HydrophobicContact CG2-CD2 4.21Å; L12-A156 HydrophobicContact CD2-CB 3.68Å
13	S	74.4	Confident	54.5	Low	4 Å²	4	108.4 Å²	108.4	3%	0.028	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-82.5	117.2	173.6	179.9	0	0	0	0	110.4	V15 M155 Q165 V166	S13-V15 PolarHBondContact O-N 2.97Å; S13-M155 PolarHBondContact N-O 3.28Å; S13-Q165 VanDerWaalsContact CA-OE1 3.24Å; S13-Q165 VanDerWaalsContact CB-OE1 3.24Å; S13-Q165 VanDerWaalsContact N-OE1 3.07Å; S13-V166 PolarHBondContact OG-O 3.17Å; S13-V166 VanDerWaalsContact OG-O 3.05Å
14	D	66.6	Low	55.8	Low	50 Å²	50	102.8 Å²	102.8	27%	0.267	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-72.2	-14.2	178.8	-65	-35.2	0	0	0	113.4	H16 M17 H18	D14-H16 VanDerWaalsContact C-N 3.27Å; D14-H16 PolarHBondContact O-N 3.19Å; D14-M17 PolarHBondContact O-N 2.86Å; D14-M17 WeakPolarHBondContact OD1-CE 3.48Å; D14-H18 PolarHBondContact O-CD2 3.35Å; D14-H18 VanDerWaalsContact O-CD2 3.32Å
15	V	64.6	Low	57.4	Low	28 Å²	28	101.3 Å²	101.3	17%	0.17	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-68.5	-25.9	-175.7	175.3	0	0	0	0	112.3	S13 F41 V166 R168 L171	S13-V15 PolarHBondContact O-N 2.97Å; V15-F41 HydrophobicContact CG1-CE1 4.2Å; V15-F41 HydrophobicContact CG1-CZ 4.45Å; V15-V166 HydrophobicContact CG1-CG1 4.43Å; V15-V166 HydrophobicContact CG2-CG1 4.46Å; V15-V166 VanDerWaalsContact CG2-O 3.27Å; V15-V166 WeakPolarHBondContact CG2-O 3.43Å; V15-R168 HydrophobicContact CG2-CG 4.1Å; V15-L171 HydrophobicContact CG1-CD1 3.87Å; V15-L171 HydrophobicContact CG2-CD1 3.96Å
16	H	59.8	Low	59.8	Low	23 Å²	23	101.6 Å²	101.6	11%	0.106	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-102.8	-5	-176.5	-52.8	-74.1	0	0	0	113.7	D14 H18 H24 S39 H153 M155	D14-H16 VanDerWaalsContact C-N 3.27Å; D14-H16 PolarHBondContact O-N 3.19Å; H16-H18 VanDerWaalsContact C-N 3.28Å; H16-H18 PolarHBondContact O-N 3.44Å; H16-H24 AromaticContact ND1-CE1 3.69Å; H16-S39 PolarHBondContact CE1-OG 3.49Å; H16-S39 VanDerWaalsContact CE1-OG 3.26Å; H16-S39 PolarHBondContact ND1-OG 3.24Å; H16-H153 AromaticContact CD2-CE1 3.54Å; H16-H153 AromaticContact CE1-CE1 3.24Å; H16-H153 PolarHBondContact CE1-CE1 3.21Å; H16-H153 AromaticContact CE1-NE2 3.39Å; H16-H153 PolarHBondContact CE1-NE2 3.27Å; H16-H153 AromaticContact ND1-CE1 3.95Å; H16-H153 AromaticContact NE2-CE1 2.91Å; H16-H153 PolarHBondContact NE2-CE1 2.73Å; H16-H153 AromaticContact NE2-ND1 3.41Å; H16-H153 PolarHBondContact NE2-ND1 2.79Å; H16-H153 AromaticContact NE2-NE2 3.51Å; H16-M155 HydrophobicContact CB-CE 3.78Å; H16-M155 HydrophobicContact CB-SD 4.34Å
17	M	50.4	Low	62.2	Low	121 Å²	121	96.6 Å²	96.6	60%	0.596	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-11.6	-177.4	-67.3	-140.4	-69.4	0	0	114.3	D14	D14-M17 PolarHBondContact O-N 2.86Å; D14-M17 WeakPolarHBondContact OD1-CE 3.48Å
18	H	47.9	Very low	64.5	Low	110 Å²	110	91.5 Å²	91.5	51%	0.509	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	6.1	-170.3	-61.4	-69.5	0	0	0	115.6	D14 H16 P20 R168	D14-H18 PolarHBondContact O-CD2 3.35Å; D14-H18 VanDerWaalsContact O-CD2 3.32Å; H16-H18 VanDerWaalsContact C-N 3.28Å; H16-H18 PolarHBondContact O-N 3.44Å; H18-P20 VanDerWaalsContact O-CD 3.24Å; H18-P20 WeakPolarHBondContact O-CD 3.42Å; H18-R168 PolarHBondContact CD2-NH2 2.77Å; H18-R168 PolarHBondContact NE2-NH2 2.95Å
19	R	53.3	Low	66.4	Low	129 Å²	129	90 Å²	90	49%	0.487	46%	0.464	S	S	.	.			trans	-113.7	85.6	176	-72.1	-173.9	154.4	-173.1	-5.5	110.9	N21 T22	R19-N21 PolarHBondContact O-N 2.86Å; R19-T22 HydrophobicContact CB-CG2 4.48Å; R19-T22 WeakPolarHBondContact CB-OG1 3.42Å; R19-T22 PolarHBondContact O-N 3.15Å; R19-T22 PolarHBondContact O-OG1 3.1Å
20	P	43	Very low	67.3	Low	121 Å²	121	84 Å²	84	79%	0.786	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-5.8	-168.2	18.8	-29.5	0	0	0	116.4	H18	H18-P20 VanDerWaalsContact O-CD 3.24Å; H18-P20 WeakPolarHBondContact O-CD 3.42Å
21	N	49.7	Very low	67.5	Low	153 Å²	153	84.8 Å²	84.8	82%	0.818	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.2	17.1	-176	-69.8	-21.4	0	0	0	114.6	R19	R19-N21 PolarHBondContact O-N 2.86Å
22	T	56.1	Low	67.7	Low	63 Å²	63	86 Å²	86	39%	0.387	45%	0.454	S	S	.	.			trans	-95	118.9	174.6	34	0	0	0	0	111.4	R19 H24	R19-T22 HydrophobicContact CB-CG2 4.48Å; R19-T22 WeakPolarHBondContact CB-OG1 3.42Å; R19-T22 PolarHBondContact O-N 3.15Å; R19-T22 PolarHBondContact O-OG1 3.1Å; T22-H24 PolarHBondContact O-CD2 3.4Å; T22-H24 VanDerWaalsContact O-CD2 3.25Å; T22-H24 PolarHBondContact O-N 2.85Å; T22-H24 PolarHBondContact OG1-NE2 2.72Å
23	H	57.1	Low	67.9	Low	182 Å²	182	83.6 Å²	83.6	84%	0.843	45%	0.452	S	S	*	.			trans	-69.7	110.5	169.2	-67.4	-74.8	0	0	0	109.5	L25	H23-L25 PolarHBondContact O-N 2.74Å
24	H	65.6	Low	68.5	Low	57 Å²	57	84.5 Å²	84.5	26%	0.264	46%	0.456	S	S	.	.			trans	-87.6	97.4	169.9	-63.1	-83.8	0	0	0	108.5	H16 T22 M26 F37 M155	H16-H24 AromaticContact ND1-CE1 3.69Å; T22-H24 PolarHBondContact O-CD2 3.4Å; T22-H24 VanDerWaalsContact O-CD2 3.25Å; T22-H24 PolarHBondContact O-N 2.85Å; T22-H24 PolarHBondContact OG1-NE2 2.72Å; H24-M26 PolarHBondContact O-N 3.33Å; H24-F37 HydrophobicContact CB-CD1 3.91Å; H24-F37 HydrophobicContact CB-CE1 4.46Å; H24-M155 HydrophobicContact CB-CE 3.48Å; H24-M155 VanDerWaalsContact CB-CE 3.48Å; H24-M155 HydrophobicContact CB-SD 4.48Å; H24-M155 WeakPolarHBondContact ND1-CE 3.48Å
25	L	67.6	Low	69.5	Low	137 Å²	137	84.5 Å²	84.5	72%	0.717	46%	0.459	S	S	*	.			trans	-71.7	120	177.7	-76.1	154.2	0	0	0	109.5	H23 T27	H23-L25 PolarHBondContact O-N 2.74Å; L25-T27 PolarHBondContact O-N 2.7Å
26	M	81.1	Confident	70.7	Confident	107 Å²	107	83.2 Å²	83.2	53%	0.527	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	123.9	166.7	-178.4	-173.5	70.9	0	0	107.9	H24 L29 P35 F37	H24-M26 PolarHBondContact O-N 3.33Å; M26-L29 HydrophobicContact SD-CD2 3.99Å; M26-P35 HydrophobicContact CG-CB 4.05Å; M26-P35 HydrophobicContact SD-CB 3.81Å; M26-F37 HydrophobicContact CB-CE1 4.27Å
27	T	81.6	Confident	72.2	Confident	70 Å²	70	83.7 Å²	83.7	43%	0.429	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-41	-179	-50.1	0	0	0	0	110.9	L25 V36	L25-T27 PolarHBondContact O-N 2.7Å; T27-V36 PolarHBondContact N-O 3.18Å
28	R	88.8	Confident	74.1	Confident	77 Å²	77	82.3 Å²	82.3	29%	0.291	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	175.5	178.4	60.3	163.2	-170.2	66.7	3.8	111.7	V36	R28-V36 HydrophobicContact CG-CB 4.19Å; R28-V36 VanDerWaalsContact NH1-CG2 3.31Å; R28-V36 PolarHBondContact O-N 3.29Å
29	L	87.5	Confident	76	Confident	103 Å²	103	77.5 Å²	77.5	54%	0.539	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	149.3	163.2	-61.9	176	0	0	0	110.2	M26 Q34 P35	M26-L29 HydrophobicContact SD-CD2 3.99Å; L29-Q34 WeakPolarHBondContact CA-O 3.28Å; L29-P35 HydrophobicContact CD2-CB 4.45Å
30	N	84.4	Confident	77.8	Confident	23 Å²	23	78.2 Å²	78.2	12%	0.123	42%	0.423	C	S	.	.			trans	-86	177.1	167.9	72.2	9.9	0	0	0	111.9	A32 G33 Q34 V36	N30-A32 PolarHBondContact O-N 3.16Å; N30-A32 WeakPolarHBondContact OD1-CA 3.23Å; N30-A32 WeakPolarHBondContact OD1-CB 3.3Å; N30-A32 PolarHBondContact OD1-N 3.21Å; N30-G33 PolarHBondContact O-N 3.27Å; N30-G33 PolarHBondContact OD1-N 2.93Å; N30-G33 VanDerWaalsContact OD1-N 3.1Å; N30-Q34 PolarHBondContact N-O 3.39Å; N30-Q34 PolarHBondContact ND2-OE1 3.33Å; N30-Q34 WeakPolarHBondContact OD1-CB 3.46Å; N30-Q34 PolarHBondContact OD1-N 3.46Å; N30-V36 HydrophobicContact CB-CG2 4.07Å
31	S	81.3	Confident	80	Confident	87 Å²	87	73.4 Å²	73.4	61%	0.608	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-35.2	175.7	47	0	0	0	0	113.2	G33 D218	S31-G33 VanDerWaalsContact C-N 3.31Å; S31-D218 PolarHBondContact OG-OD1 3.4Å; S31-D218 PolarHBondContact OG-OD2 3.46Å
32	A	81.6	Confident	82	Confident	63 Å²	63	74 Å²	74	52%	0.521	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	4.2	177.5	0	0	0	0	0	113.9	N30 Q34	N30-A32 PolarHBondContact O-N 3.16Å; N30-A32 WeakPolarHBondContact OD1-CA 3.23Å; N30-A32 WeakPolarHBondContact OD1-CB 3.3Å; N30-A32 PolarHBondContact OD1-N 3.21Å; A32-Q34 VanDerWaalsContact C-N 3.29Å; A32-Q34 HydrophobicContact CB-CG 4.38Å; A32-Q34 PolarHBondContact O-N 3.03Å
33	G	84.3	Confident	83.6	Confident	47 Å²	47	72.2 Å²	72.2	49%	0.485	37%	0.368	S	S	.	.	S	Bend	trans	74.7	12.8	-179.1	0	0	0	0	0	114.9	N30 S31	N30-G33 PolarHBondContact O-N 3.27Å; N30-G33 PolarHBondContact OD1-N 2.93Å; N30-G33 VanDerWaalsContact OD1-N 3.1Å; S31-G33 VanDerWaalsContact C-N 3.31Å
34	Q	85.8	Confident	85.2	Confident	24 Å²	24	67.3 Å²	67.3	11%	0.112	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-81.9	141.4	176.7	-57.5	162.4	-27.2	0	0	110.6	L29 N30 A32 V36 T154 P158 D161 K164	L29-Q34 WeakPolarHBondContact CA-O 3.28Å; N30-Q34 PolarHBondContact N-O 3.39Å; N30-Q34 PolarHBondContact ND2-OE1 3.33Å; N30-Q34 WeakPolarHBondContact OD1-CB 3.46Å; N30-Q34 PolarHBondContact OD1-N 3.46Å; A32-Q34 VanDerWaalsContact C-N 3.29Å; A32-Q34 HydrophobicContact CB-CG 4.38Å; A32-Q34 PolarHBondContact O-N 3.03Å; Q34-V36 PolarHBondContact O-N 3.01Å; Q34-T154 HydrophobicContact CB-CG2 4.21Å; Q34-P158 VanDerWaalsContact NE2-CD 3.28Å; Q34-D161 PolarHBondContact NE2-OD2 2.9Å; Q34-D161 PolarHBondContact OE1-OD2 2.74Å; Q34-K164 VanDerWaalsContact OE1-NZ 3.11Å
35	P	88.1	Confident	85.8	Confident	49 Å²	49	69.3 Å²	69.3	32%	0.318	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	128.1	177.4	29.1	-34	0	0	0	111.3	M26 L29 F37 T154	M26-P35 HydrophobicContact CG-CB 4.05Å; M26-P35 HydrophobicContact SD-CB 3.81Å; L29-P35 HydrophobicContact CD2-CB 4.45Å; P35-F37 HydrophobicContact CB-CE2 3.8Å; P35-F37 HydrophobicContact CB-CZ 3.95Å; P35-F37 HydrophobicContact CG-CE2 3.88Å; P35-F37 HydrophobicContact CG-CZ 4.18Å; P35-T154 WeakPolarHBondContact O-CG2 3.26Å
36	V	89.9	Confident	85.6	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.012	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129	174	178	0	0	0	0	109.2	T27 R28 N30 Q34 E152	T27-V36 PolarHBondContact N-O 3.18Å; R28-V36 HydrophobicContact CG-CB 4.19Å; R28-V36 VanDerWaalsContact NH1-CG2 3.31Å; R28-V36 PolarHBondContact O-N 3.29Å; N30-V36 HydrophobicContact CB-CG2 4.07Å; Q34-V36 PolarHBondContact O-N 3.01Å; V36-E152 HydrophobicContact CG1-CB 3.84Å; V36-E152 HydrophobicContact CG1-CG 4.42Å
37	F	90.5	Very high	83.7	Confident	32 Å²	32	66.5 Å²	66.5	14%	0.14	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	151.7	179.5	-58.7	-90.8	0	0	0	109.5	H24 M26 P35 E152 H153 M155	H24-F37 HydrophobicContact CB-CD1 3.91Å; H24-F37 HydrophobicContact CB-CE1 4.46Å; M26-F37 HydrophobicContact CB-CE1 4.27Å; P35-F37 HydrophobicContact CB-CE2 3.8Å; P35-F37 HydrophobicContact CB-CZ 3.95Å; P35-F37 HydrophobicContact CG-CE2 3.88Å; P35-F37 HydrophobicContact CG-CZ 4.18Å; F37-E152 CarbonylContact O-C 3.57Å; F37-E152 WeakPolarHBondContact O-CA 3.44Å; F37-H153 PolarHBondContact N-O 3.27Å; F37-H153 PolarHBondContact O-N 2.85Å; F37-M155 HydrophobicContact CB-CE 4.19Å; F37-M155 HydrophobicContact CD1-CE 4.19Å; F37-M155 HydrophobicContact CD1-SD 4.25Å; F37-M155 HydrophobicContact CD2-CB 4.23Å; F37-M155 HydrophobicContact CD2-CE 4.42Å; F37-M155 HydrophobicContact CD2-CG 3.64Å; F37-M155 HydrophobicContact CD2-SD 4.03Å; F37-M155 HydrophobicContact CE1-SD 4.27Å; F37-M155 HydrophobicContact CE2-CB 4.06Å; F37-M155 HydrophobicContact CE2-CG 3.88Å; F37-M155 HydrophobicContact CE2-SD 4.06Å; F37-M155 HydrophobicContact CG-CE 4.01Å; F37-M155 HydrophobicContact CG-CG 4.16Å; F37-M155 HydrophobicContact CG-SD 4.11Å; F37-M155 HydrophobicContact CZ-SD 4.17Å
38	R	89.9	Confident	81.7	Confident	93 Å²	93	69.8 Å²	69.8	35%	0.351	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.9	172.3	-170.5	175.8	-178.4	-175.9	5.3	109.6	Q150 I151 E152	R38-Q150 VanDerWaalsContact NH2-CD 3.3Å; R38-I151 WeakPolarHBondContact CA-O 3.42Å; R38-E152 HydrophobicContact CB-CG 4.16Å; R38-E152 HydrophobicContact CG-CG 4.13Å
39	S	89.4	Confident	79	Confident	9 Å²	9	73.8 Å²	73.8	6%	0.063	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	145	175	-71.8	0	0	0	0	111	H16 I151 H153	H16-S39 PolarHBondContact CE1-OG 3.49Å; H16-S39 VanDerWaalsContact CE1-OG 3.26Å; H16-S39 PolarHBondContact ND1-OG 3.24Å; S39-I151 PolarHBondContact N-O 3.36Å; S39-I151 PolarHBondContact O-N 2.81Å; S39-H153 WeakPolarHBondContact CB-NE2 3.24Å; S39-H153 PolarHBondContact OG-NE2 3.18Å
40	R	90	Very high	76.3	Confident	143 Å²	143	76.4 Å²	76.4	54%	0.54	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	119.2	176.3	-61.5	-177	-178.2	178.5	-0.2	109.2	I148 I149 Q150	R40-I148 HydrophobicContact CB-CG2 3.98Å; R40-I148 HydrophobicContact CG-CG2 4.31Å; R40-I149 CarbonylContact C-O 3.22Å; R40-I149 WeakPolarHBondContact CA-O 3.35Å; R40-Q150 HydrophobicContact CG-CG 4.41Å
41	F	90.2	Very high	74	Confident	20 Å²	20	81 Å²	81	9%	0.088	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.7	174.9	-60.6	-91.3	0	0	0	108.5	V15 I148 I149 I151 V166 L171 L365	V15-F41 HydrophobicContact CG1-CE1 4.2Å; V15-F41 HydrophobicContact CG1-CZ 4.45Å; F41-I148 WeakPolarHBondContact O-CA 3.25Å; F41-I149 HydrophobicContact CB-CB 4.29Å; F41-I149 PolarHBondContact N-O 3.22Å; F41-I149 PolarHBondContact O-N 3.11Å; F41-I151 HydrophobicContact CD2-CB 4.4Å; F41-I151 HydrophobicContact CD2-CG1 4.02Å; F41-I151 HydrophobicContact CE2-CB 4Å; F41-I151 HydrophobicContact CE2-CG1 3.99Å; F41-V166 HydrophobicContact CZ-CG1 4.14Å; F41-V166 HydrophobicContact CZ-CG2 4.36Å; F41-L171 HydrophobicContact CD1-CD2 4.13Å; F41-L171 HydrophobicContact CE1-CD2 3.96Å; F41-L365 HydrophobicContact CB-CD2 4.23Å
42	R	90.4	Very high	71.6	Confident	167 Å²	167	83.9 Å²	83.9	63%	0.63	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	125	176.2	-177.8	179.5	-68.5	173.2	-2.2	108.8	D147 I148	R42-D147 CarbonylContact C-O 3.54Å; R42-D147 WeakPolarHBondContact CA-O 3.38Å; R42-I148 HydrophobicContact CB-CG1 4.48Å
43	I	91.5	Very high	69.3	Low	24 Å²	24	86 Å²	86	12%	0.123	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-73	121.7	167.3	-61.6	178.6	0	0	0	107.5	D147 I149 L178 M233 F364 L365	I43-D147 HydrophobicContact CB-CB 4.26Å; I43-D147 PolarHBondContact N-O 3.18Å; I43-I149 HydrophobicContact CD1-CD1 4.07Å; I43-I149 HydrophobicContact CD1-CG1 4.31Å; I43-I149 HydrophobicContact CG1-CD1 4.1Å; I43-I149 HydrophobicContact CG1-CG1 4.41Å; I43-L178 HydrophobicContact CD1-CD1 4.22Å; I43-L178 HydrophobicContact CD1-CD2 4.32Å; I43-L178 HydrophobicContact CG1-CD1 4.31Å; I43-L178 HydrophobicContact CG2-CD1 4.16Å; I43-M233 HydrophobicContact CD1-CE 3.47Å; I43-M233 VanDerWaalsContact CD1-CE 3.47Å; I43-F364 HydrophobicContact CG2-CB 4.29Å; I43-F364 HydrophobicContact CG2-CD1 4.4Å; I43-L365 HydrophobicContact CG1-CD2 4.24Å
44	L	89.5	Confident	66.6	Low	80 Å²	80	86.9 Å²	86.9	42%	0.419	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-82.6	139.4	174.8	-56.7	176.7	0	0	0	109.1	F364	L44-F364 WeakPolarHBondContact CB-O 3.5Å; L44-F364 WeakPolarHBondContact CG-O 3.49Å; L44-F364 PolarHBondContact N-O 3.36Å; L44-F364 VanDerWaalsContact O-CD1 3.3Å; L44-F364 WeakPolarHBondContact O-CD1 3.44Å
45	A	77.6	Confident	63.9	Low	98 Å²	98	93.1 Å²	93.1	81%	0.81	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-66.8	142.7	174.2	0	0	0	0	0	110.3	S47	A45-S47 PolarHBondContact O-N 3.3Å
46	D	64	Low	60.9	Low	71 Å²	71	94.1 Å²	94.1	38%	0.38	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-66.4	122.4	174.8	-150.8	-3	0	0	0	108.7	H48 S362 F364	D46-H48 PolarHBondContact O-N 2.99Å; D46-H48 IonicContact OD1-CD2 3.8Å; D46-H48 IonicContact OD2-CD2 3.23Å; D46-H48 PolarHBondContact OD2-CD2 3.36Å; D46-H48 VanDerWaalsContact OD2-CD2 3.23Å; D46-H48 IonicContact OD2-NE2 3.67Å; D46-S362 WeakPolarHBondContact OD1-CB 3.31Å; D46-S362 PolarHBondContact OD1-OG 3.25Å; D46-F364 HydrophobicContact CB-CE1 3.96Å; D46-F364 HydrophobicContact CB-CZ 4.4Å
47	S	42.1	Very low	57.9	Low	114 Å²	114	100 Å²	100	80%	0.797	59%	0.586	S	S	*	*			trans	-83.6	60.6	178.3	42.8	0	0	0	0	109.7	A45 D49	A45-S47 PolarHBondContact O-N 3.3Å; S47-D49 PolarHBondContact O-N 3.16Å
48	H	39.1	Very low	54.8	Low	140 Å²	140	104.5 Å²	104.5	65%	0.648	62%	0.616	S	S	*	*			trans	-86.2	98.4	161.9	-82.3	-59.6	0	0	0	107.9	D46 D50	D46-H48 PolarHBondContact O-N 2.99Å; D46-H48 IonicContact OD1-CD2 3.8Å; D46-H48 IonicContact OD2-CD2 3.23Å; D46-H48 PolarHBondContact OD2-CD2 3.36Å; D46-H48 VanDerWaalsContact OD2-CD2 3.23Å; D46-H48 IonicContact OD2-NE2 3.67Å; H48-D50 VanDerWaalsContact C-N 3.3Å; H48-D50 PolarHBondContact O-N 2.83Å
49	D	31.2	Very low	51.8	Low	161 Å²	161	107.8 Å²	107.8	86%	0.861	64%	0.64	S	S	*	*			trans	-57	96.3	162.8	-85.4	-30.1	0	0	0	108.2	S47 S51	S47-D49 PolarHBondContact O-N 3.16Å; D49-S51 VanDerWaalsContact C-N 3.29Å; D49-S51 PolarHBondContact O-N 3.13Å
50	D	31.5	Very low	48.8	Very low	158 Å²	158	115.7 Å²	115.7	85%	0.845	68%	0.676	S	S	*	*			trans	-63.3	98.4	158.4	-96	-27.4	0	0	0	107	H48 D52	H48-D50 VanDerWaalsContact C-N 3.3Å; H48-D50 PolarHBondContact O-N 2.83Å; D50-D52 PolarHBondContact O-N 2.82Å
51	S	36.7	Very low	45.9	Very low	119 Å²	119	118.3 Å²	118.3	83%	0.832	69%	0.694	S	S	*	*			trans	-64.4	85.8	163.3	60.3	0	0	0	0	108.4	D49	D49-S51 VanDerWaalsContact C-N 3.29Å; D49-S51 PolarHBondContact O-N 3.13Å
52	D	30.9	Very low	42.8	Very low	148 Å²	148	125.7 Å²	125.7	79%	0.791	73%	0.727	S	S	*	*			trans	-98.2	126.9	162	-155.7	5.8	0	0	0	111	D50	D50-D52 PolarHBondContact O-N 2.82Å
53	S	33.1	Very low	39.8	Very low	108 Å²	108	125.6 Å²	125.6	76%	0.755	73%	0.733	S	S	*	*			trans	-75.6	122.1	-175.2	48.3	0	0	0	0	112
54	G	28.1	Very low	36.7	Very low	65 Å²	65	133.3 Å²	133.3	67%	0.67	77%	0.766	S	S	*	*			trans	98.4	107.7	134.8	0	0	0	0	0	117.5
55	T	29.1	Very low	33.7	Very low	154 Å²	154	134.8 Å²	134.8	95%	0.945	78%	0.783	S	S	*	*				-167.8	131.4	104.6	13.9	0	0	0	0	109.5
56	G	24.7	Very low	31.5	Very low	71 Å²	71	136.3 Å²	136.3	73%	0.732	78%	0.784	S	S	*	*			trans	-79.1	167.4	-163.9	0	0	0	0	0	115.6
57	S	27	Very low	29.7	Very low	126 Å²	126	144.3 Å²	144.3	88%	0.881	81%	0.809	S	S	*	*			trans	-155.1	135.3	132.7	-81.8	0	0	0	0	109.6
58	T	25.3	Very low	28.9	Very low	125 Å²	125	148.2 Å²	148.2	77%	0.767	81%	0.812	S	S	*	*			trans	-50.4	140.1	179.1	47.1	0	0	0	0	113.6
59	N	27.6	Very low	28.3	Very low	162 Å²	162	149.7 Å²	149.7	87%	0.866	82%	0.824	S	S	*	*				-155.9	121.7	121.8	-95.3	-18.7	0	0	0	110.2
60	E	25.8	Very low	27.9	Very low	175 Å²	175	145.6 Å²	145.6	82%	0.818	82%	0.82	S	S	*	*			trans	-61.7	135.5	168	-62.5	-177.7	138.6	0	0	109.3
61	E	28.1	Very low	27.6	Very low	198 Å²	198	141.6 Å²	141.6	93%	0.925	82%	0.816	S	S	*	*			trans	-148.5	125.9	139.1	-115.8	172	-158.3	0	0	111.4
62	K	25.3	Very low	27	Very low	176 Å²	176	142.7 Å²	142.7	77%	0.765	82%	0.818	S	S	*	*			trans	-70	139.6	-178.3	-69.5	161	174	160.8	0	109.8
63	H	27.8	Very low	26.8	Very low	165 Å²	165	140.7 Å²	140.7	76%	0.764	82%	0.816	S	S	*	*				-166.9	111.6	119.3	-103.4	-49.3	0	0	0	115.7
64	K	27	Very low	27	Very low	186 Å²	186	140.6 Å²	140.6	81%	0.809	81%	0.813	S	S	*	*			trans	30.4	114.5	138.5	-66.6	-179.8	176.1	179.3	0	120.1
65	S	26.7	Very low	26.8	Very low	111 Å²	111	145.9 Å²	145.9	78%	0.776	82%	0.82	S	S	*	*			trans	-63.9	164.4	147	-24.7	0	0	0	0	112.1
66	P	30.8	Very low	26.7	Very low	130 Å²	130	148 Å²	148	84%	0.844	82%	0.819	S	S	*	*				-130.2	157.9	124.5	27.4	-11.6	0	0	0	114.1
67	R	25.4	Very low	26.7	Very low	239 Å²	239	151.9 Å²	151.9	90%	0.902	82%	0.823	S	S	*	*			trans	-86.6	156.8	-173.7	-67.4	172.6	166.5	-179	-5.1	112.3
68	K	26.2	Very low	26.8	Very low	195 Å²	195	154.8 Å²	154.8	85%	0.848	82%	0.823	S	S	*	*			trans	-0.4	138.8	145.4	-73.8	179.2	168.2	-179.3	0	119.4
69	D	25.6	Very low	26.8	Very low	171 Å²	171	158 Å²	158	91%	0.914	83%	0.829	S	S	*	*				-168.1	148.3	120.8	-87.5	-24	0	0	0	106.3
70	G	24.3	Very low	26.8	Very low	75 Å²	75	153.9 Å²	153.9	77%	0.773	83%	0.825	S	S	*	*			cis	134.8	105.8	13.2	0	0	0	0	0	109.6
71	G	24	Very low	26.8	Very low	74 Å²	74	149.4 Å²	149.4	76%	0.763	83%	0.826	S	S	*	*			trans	83.3	155.2	162.6	0	0	0	0	0	116.9
72	T	23.6	Very low	26.9	Very low	143 Å²	143	147.7 Å²	147.7	88%	0.877	82%	0.823	S	S	*	*			cis	-170	144	-2.3	-55.5	0	0	0	0	105.4
73	S	27.4	Very low	27.3	Very low	106 Å²	106	148.4 Å²	148.4	74%	0.741	83%	0.829	S	S	*	*			trans	-66.1	176.1	171.1	-30.1	0	0	0	0	111.7
74	P	36.4	Very low	27.4	Very low	105 Å²	105	143.7 Å²	143.7	68%	0.682	83%	0.825	S	S	*	*			cis	-151.7	173.9	41	39.4	-15.3	0	0	0	118.9
75	E	25.3	Very low	27.9	Very low	177 Å²	177	142.5 Å²	142.5	83%	0.827	83%	0.828	S	S	*	*			trans	50.9	123.6	144	-71.2	169	-176	0	0	121.8
76	Q	26.6	Very low	28.7	Very low	198 Å²	198	143.3 Å²	143.3	93%	0.925	83%	0.828	S	S	*	*				-160.8	127.5	124.2	-106.8	166.7	34.1	0	0	111.7
77	D	24.7	Very low	29.5	Very low	152 Å²	152	145.1 Å²	145.1	81%	0.813	83%	0.825	S	S	*	*			trans	-58.6	149.4	165.4	-62.8	-60.6	0	0	0	111.6
78	E	28.8	Very low	30.6	Very low	188 Å²	188	137.8 Å²	137.8	88%	0.879	81%	0.808	S	S	*	*				-175.1	141.8	111.3	-97.7	-169	-167.7	0	0	113.7
79	E	26.5	Very low	31.9	Very low	191 Å²	191	133.2 Å²	133.2	89%	0.893	80%	0.8	S	S	*	*			trans	-31.2	156.5	168.9	-66.4	177.2	144.9	0	0	119.4
80	G	27.1	Very low	33.6	Very low	77 Å²	77	129.8 Å²	129.8	79%	0.794	78%	0.781	S	S	*	*			trans	162.8	79.9	151.1	0	0	0	0	0	115
81	G	26	Very low	36	Very low	81 Å²	81	129.5 Å²	129.5	84%	0.835	76%	0.761	S	S	*	*			trans	-67.3	146.3	167.8	0	0	0	0	0	112.3
82	N	28.5	Very low	37.8	Very low	162 Å²	162	136 Å²	136	87%	0.866	77%	0.772	S	S	*	*			trans	-149.7	120	149.1	-154.9	20.4	0	0	0	111.2
83	Q	34	Very low	40.2	Very low	191 Å²	191	135.2 Å²	135.2	89%	0.893	76%	0.763	S	S	*	*			trans	-66.2	124.6	166.3	-74.9	172.3	-6.2	0	0	108.8
84	G	31.5	Very low	42.1	Very low	65 Å²	65	132.2 Å²	132.2	67%	0.67	75%	0.748	S	S	*	*			trans	-122.8	93.6	166.4	0	0	0	0	0	108.6	V86	G84-V86 PolarHBondContact O-N 2.81Å
85	N	36.6	Very low	43.7	Very low	162 Å²	162	132.3 Å²	132.3	87%	0.866	74%	0.743	S	S	*	*			trans	-64.6	108.7	170.6	-159	29.5	0	0	0	107.8
86	V	42.9	Very low	45.4	Very low	128 Å²	128	129.2 Å²	129.2	78%	0.776	73%	0.731	S	S	*	*			trans	-116.9	107	173.2	-172.5	0	0	0	0	106.7	G84	G84-V86 PolarHBondContact O-N 2.81Å
87	E	47.2	Very low	46.6	Very low	167 Å²	167	124.2 Å²	124.2	78%	0.78	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-60.6	134.9	170	-79.5	179.9	152.4	0	0	109.1	C89	E87-C89 PolarHBondContact O-N 2.87Å
88	P	48.4	Very low	48.1	Very low	85 Å²	85	122.4 Å²	122.4	55%	0.552	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-69.1	132.9	177.9	-9.6	24	0	0	0	110.3	L90 L96	P88-L90 HydrophobicContact CB-CD2 4.43Å; P88-L90 PolarHBondContact O-N 3.23Å; P88-L96 HydrophobicContact CB-CD2 3.14Å; P88-L96 HydrophobicContact CG-CD2 4.01Å
89	C	54.1	Low	48.8	Very low	100 Å²	100	118.9 Å²	118.9	68%	0.676	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-66.3	116.5	168.9	-70	0	0	0	0	108.6	E87 D97	E87-C89 PolarHBondContact O-N 2.87Å; C89-D97 PolarHBondContact O-N 2.99Å
90	L	61.4	Low	49.5	Very low	98 Å²	98	118.5 Å²	118.5	51%	0.513	70%	0.695	S	S	.	*	B	Isolated β-bridge	trans	-104.5	145.7	175.7	-55.8	174.5	0	0	0	110	P88 D95 L96	P88-L90 HydrophobicContact CB-CD2 4.43Å; P88-L90 PolarHBondContact O-N 3.23Å; L90-D95 CarbonylContact C-O 3.53Å; L90-D95 WeakPolarHBondContact CA-O 3.33Å; L90-D95 WeakPolarHBondContact CB-O 3.34Å; L90-D95 WeakPolarHBondContact CD2-O 3.41Å; L90-L96 HydrophobicContact CD2-CD2 3.7Å; L90-L96 HydrophobicContact CD2-CG 4.12Å
91	D	74.4	Confident	50	Low	69 Å²	69	126.1 Å²	126.1	37%	0.369	70%	0.699	S	S	.	*			trans	-82.5	-177.4	170.8	58	1.7	0	0	0	112.1	D93 G94 D95	D91-D93 PolarHBondContact O-N 3.32Å; D91-G94 PolarHBondContact O-N 2.79Å; D91-G94 VanDerWaalsContact O-N 3.08Å; D91-D95 PolarHBondContact N-O 2.81Å; D91-D95 VanDerWaalsContact N-O 3.07Å; D91-D95 WeakPolarHBondContact OD1-CA 3.34Å; D91-D95 PolarHBondContact OD1-N 2.76Å
92	E	63	Low	50.4	Low	212 Å²	212	127.2 Å²	127.2	99%	0.991	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-15.2	-170	-78.6	-161.1	144.1	0	0	114.7
93	D	72.9	Confident	50.7	Low	126 Å²	126	131.6 Å²	131.6	67%	0.674	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-0.5	173.1	58.8	-12.6	0	0	0	114	D91	D91-D93 PolarHBondContact O-N 3.32Å
94	G	66.7	Low	50.5	Low	42 Å²	42	131.3 Å²	131.3	43%	0.433	69%	0.692	S	S	.	*	S	Bend	trans	92.5	15.5	169.6	0	0	0	0	0	114.9	D91	D91-G94 PolarHBondContact O-N 2.79Å; D91-G94 VanDerWaalsContact O-N 3.08Å
95	D	70.8	Confident	51	Low	107 Å²	107	134.2 Å²	134.2	57%	0.572	70%	0.702	S	S	*	*			trans	-89.9	164.2	173.2	-77.5	-14.6	0	0	0	111	L90 D91 D97	L90-D95 CarbonylContact C-O 3.53Å; L90-D95 WeakPolarHBondContact CA-O 3.33Å; L90-D95 WeakPolarHBondContact CB-O 3.34Å; L90-D95 WeakPolarHBondContact CD2-O 3.41Å; D91-D95 PolarHBondContact N-O 2.81Å; D91-D95 VanDerWaalsContact N-O 3.07Å; D91-D95 WeakPolarHBondContact OD1-CA 3.34Å; D91-D95 PolarHBondContact OD1-N 2.76Å; D95-D97 PolarHBondContact O-N 2.84Å
96	L	61.5	Low	50.9	Low	112 Å²	112	131.7 Å²	131.7	59%	0.586	70%	0.697	S	S	*	*	B	Isolated β-bridge	trans	-76.4	116.6	-178.7	-70.8	167.3	0	0	0	111.1	P88 L90 V98	P88-L96 HydrophobicContact CB-CD2 3.14Å; P88-L96 HydrophobicContact CG-CD2 4.01Å; L90-L96 HydrophobicContact CD2-CD2 3.7Å; L90-L96 HydrophobicContact CD2-CG 4.12Å; L96-V98 PolarHBondContact O-N 2.86Å
97	D	51.3	Low	50.6	Low	93 Å²	93	131.7 Å²	131.7	50%	0.497	70%	0.697	S	S	.	*			trans	-75.4	91.1	-178.5	-170.6	12.5	0	0	0	111.4	C89 D95 T99	C89-D97 PolarHBondContact O-N 2.99Å; D95-D97 PolarHBondContact O-N 2.84Å; D97-T99 PolarHBondContact O-N 3.44Å
98	V	56.5	Low	50.2	Low	115 Å²	115	130.6 Å²	130.6	70%	0.697	70%	0.697	S	S	*	*			trans	-86	92.6	176.7	-172.2	0	0	0	0	109.7	L96 H100	L96-V98 PolarHBondContact O-N 2.86Å; V98-H100 PolarHBondContact O-N 2.89Å
99	T	43.6	Very low	49.7	Very low	114 Å²	114	135.6 Å²	135.6	70%	0.699	71%	0.713	S	S	*	*			trans	-63.3	110.6	174.7	55.2	0	0	0	0	111.5	D97 R101	D97-T99 PolarHBondContact O-N 3.44Å; T99-R101 PolarHBondContact O-N 3.49Å; T99-R101 VanDerWaalsContact O-N 3.11Å
100	H	41.8	Very low	48.8	Very low	183 Å²	183	139.1 Å²	139.1	85%	0.847	73%	0.725	S	S	*	*			trans	-61.4	113.9	170.2	-87.9	-79.7	0	0	0	110.1	V98	V98-H100 PolarHBondContact O-N 2.89Å
101	R	37.2	Very low	48.1	Very low	236 Å²	236	137.6 Å²	137.6	89%	0.891	73%	0.733	S	S	*	*			trans	-62.6	124.7	177.2	-156.8	178.2	-166.3	-174.4	3.4	109.4	T99 R103	T99-R101 PolarHBondContact O-N 3.49Å; T99-R101 VanDerWaalsContact O-N 3.11Å; R101-R103 PolarHBondContact O-N 3Å
102	P	34.6	Very low	46.3	Very low	104 Å²	104	145.6 Å²	145.6	68%	0.675	76%	0.758	S	S	*	*			trans	-67.1	132.9	179.4	25.4	-31	0	0	0	109.7	K104	P102-K104 PolarHBondContact O-N 3.45Å
103	R	33.6	Very low	45.2	Very low	254 Å²	254	143.2 Å²	143.2	96%	0.958	75%	0.752	S	S	*	*			trans	-61.8	104.8	170.6	-82.2	-179.8	169	166.4	-3.2	108.7	R101	R101-R103 PolarHBondContact O-N 3Å
104	K	31.3	Very low	43.5	Very low	185 Å²	185	144.6 Å²	144.6	80%	0.804	76%	0.758	S	S	*	*			trans	-89.6	119.7	164.7	-85.2	-176.4	175.7	179.4	0	108.8	P102 S106	P102-K104 PolarHBondContact O-N 3.45Å; K104-S106 PolarHBondContact O-N 2.87Å
105	S	41.4	Very low	42.2	Very low	126 Å²	126	149.2 Å²	149.2	88%	0.881	78%	0.778	S	S	*	*			trans	-72.2	111.6	159.9	43.4	0	0	0	0	108.9
106	S	33.4	Very low	40.5	Very low	110 Å²	110	148 Å²	148	77%	0.769	78%	0.777	S	S	*	*			trans	-157.4	141.6	160.6	55.1	0	0	0	0	111	K104	K104-S106 PolarHBondContact O-N 2.87Å
107	V	37.6	Very low	39.1	Very low	127 Å²	127	148.3 Å²	148.3	77%	0.77	79%	0.785	S	S	*	*			trans	-75	140.1	-173.4	174.3	0	0	0	0	111.3
108	D	38	Very low	38.3	Very low	145 Å²	145	150.8 Å²	150.8	78%	0.775	80%	0.797	S	S	*	*			trans	60.9	140	155.2	-63	-23.2	0	0	0	124.8
109	E	37.7	Very low	37.3	Very low	190 Å²	190	151.9 Å²	151.9	89%	0.888	80%	0.798	S	S	*	*			trans	65.8	96.5	154.2	-72.8	-175.3	160.1	0	0	120.2
110	D	35.7	Very low	36.8	Very low	174 Å²	174	153.9 Å²	153.9	93%	0.93	80%	0.804	S	S	*	*				176.8	143.6	110.7	-159.6	7.8	0	0	0	110.7
111	G	47.6	Very low	36.2	Very low	66 Å²	66	153.8 Å²	153.8	68%	0.68	80%	0.803	S	S	*	*			trans	-73.6	129.4	-153.2	0	0	0	0	0	117.7
112	R	36.6	Very low	36	Very low	236 Å²	236	150.9 Å²	150.9	89%	0.891	80%	0.8	S	S	*	*			trans	-140.7	125.6	145.7	-76	-165.5	-86.2	-164.5	-6.7	108.2	L114	R112-L114 PolarHBondContact O-N 3.21Å; R112-L114 VanDerWaalsContact O-N 3.12Å
113	D	38.5	Very low	35.9	Very low	163 Å²	163	151 Å²	151	87%	0.872	80%	0.803	S	S	*	*			trans	-56.4	114.2	179.8	-91.8	-25	0	0	0	110.5	V115	D113-V115 PolarHBondContact O-N 2.76Å; D113-V115 VanDerWaalsContact O-N 3.15Å
114	L	38.4	Very low	35.9	Very low	154 Å²	154	144.8 Å²	144.8	81%	0.806	79%	0.793	S	S	*	*			trans	-69	105.6	160.2	-89.7	112.1	0	0	0	107.1	R112 C116	R112-L114 PolarHBondContact O-N 3.21Å; R112-L114 VanDerWaalsContact O-N 3.12Å; L114-C116 PolarHBondContact O-N 2.77Å
115	V	38.2	Very low	36.1	Very low	140 Å²	140	141.2 Å²	141.2	85%	0.848	79%	0.789	S	S	*	*			trans	-71.1	87.2	164	-177.1	0	0	0	0	107.2	D113	D113-V115 PolarHBondContact O-N 2.76Å; D113-V115 VanDerWaalsContact O-N 3.15Å
116	C	36.4	Very low	35.5	Very low	81 Å²	81	142.4 Å²	142.4	55%	0.547	79%	0.785	S	S	.	*			trans	-77.3	133.9	163.1	-60.1	0	0	0	0	107.6	L114 I118	L114-C116 PolarHBondContact O-N 2.77Å; C116-I118 PolarHBondContact O-N 3.08Å; C116-I118 VanDerWaalsContact O-N 3.11Å
117	P	31.6	Very low	35.8	Very low	118 Å²	118	144.8 Å²	144.8	77%	0.766	79%	0.788	S	S	*	*			trans	-57.8	121.8	169.7	23	-30.2	0	0	0	108.7	I119	P117-I119 PolarHBondContact O-N 3.21Å; P117-I119 VanDerWaalsContact O-N 3.17Å
118	I	33.6	Very low	35.7	Very low	145 Å²	145	146.1 Å²	146.1	74%	0.744	79%	0.792	S	S	*	*			trans	-72.2	107.4	174.1	-62.7	172.5	0	0	0	106.4	C116 L120	C116-I118 PolarHBondContact O-N 3.08Å; C116-I118 VanDerWaalsContact O-N 3.11Å; I118-L120 HydrophobicContact CG2-CD2 3.93Å; I118-L120 HydrophobicContact CG2-CG 4.28Å; I118-L120 PolarHBondContact O-N 3.43Å; I118-L120 VanDerWaalsContact O-N 3.07Å
119	I	37.2	Very low	35.8	Very low	139 Å²	139	147.2 Å²	147.2	71%	0.713	79%	0.792	S	S	*	*			trans	-69.4	102.4	167.3	-61.1	173	0	0	0	106.3	P117 Q121	P117-I119 PolarHBondContact O-N 3.21Å; P117-I119 VanDerWaalsContact O-N 3.17Å; I119-Q121 PolarHBondContact O-N 3.24Å
120	L	31.8	Very low	35.8	Very low	156 Å²	156	146 Å²	146	82%	0.817	79%	0.792	S	S	*	*			trans	-72.4	111.8	171.1	-67.9	171.1	0	0	0	107.8	I118	I118-L120 HydrophobicContact CG2-CD2 3.93Å; I118-L120 HydrophobicContact CG2-CG 4.28Å; I118-L120 PolarHBondContact O-N 3.43Å; I118-L120 VanDerWaalsContact O-N 3.07Å
121	Q	30.6	Very low	36	Very low	180 Å²	180	146.5 Å²	146.5	84%	0.841	79%	0.788	S	S	*	*			trans	79.9	88.1	169.6	-152.2	167.4	-11.5	0	0	116.6	I119 S123	I119-Q121 PolarHBondContact O-N 3.24Å; Q121-S123 PolarHBondContact O-N 3.39Å
122	Q	32.4	Very low	35.6	Very low	176 Å²	176	151.1 Å²	151.1	82%	0.822	80%	0.797	S	S	*	*			trans	-71.4	110.9	150.6	-80.4	175.2	-34.3	0	0	108.5	V124	Q122-V124 PolarHBondContact O-N 2.95Å
123	S	32.6	Very low	35.4	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.6	123	154.4	51.2	0	0	0	0	107.6	Q121	Q121-S123 PolarHBondContact O-N 3.39Å
124	V	32.3	Very low	35.3	Very low	122 Å²	122	145.4 Å²	145.4	74%	0.739	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-51.4	131.6	173.1	-171	0	0	0	0	108.7	Q122 D126	Q122-V124 PolarHBondContact O-N 2.95Å; V124-D126 PolarHBondContact O-N 2.94Å
125	P	35.7	Very low	35.6	Very low	110 Å²	110	145.2 Å²	145.2	71%	0.714	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-72.2	116.3	169.3	29	-29.1	0	0	0	107.4	L127	P125-L127 PolarHBondContact O-N 2.94Å
126	D	29.6	Very low	35.5	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-60.6	130.4	162.6	-81	-39.9	0	0	0	108	V124 D128	V124-D126 PolarHBondContact O-N 2.94Å; D126-D128 PolarHBondContact O-N 3.49Å
127	L	40.8	Very low	36.1	Very low	159 Å²	159	150.3 Å²	150.3	83%	0.832	81%	0.811	S	S	*	*			trans	-70	100.2	177.4	-69.6	159.8	0	0	0	108.7	P125	P125-L127 PolarHBondContact O-N 2.94Å
128	D	34.3	Very low	36.3	Very low	156 Å²	156	152 Å²	152	83%	0.834	81%	0.814	S	S	*	*			trans	-103.8	106.3	155.8	-71.1	-32	0	0	0	108.1	D126	D126-D128 PolarHBondContact O-N 3.49Å
129	Q	41.2	Very low	36.9	Very low	168 Å²	168	153.1 Å²	153.1	79%	0.785	82%	0.821	S	S	*	*			trans	-56.5	132	155.4	-68.7	160.2	38.5	0	0	107
130	D	36.2	Very low	37	Very low	165 Å²	165	155 Å²	155	88%	0.882	83%	0.827	S	S	*	*				-163	120.5	123.4	-85.1	-30.7	0	0	0	108.6
131	E	41.3	Very low	37.6	Very low	183 Å²	183	156.6 Å²	156.6	86%	0.855	83%	0.83	S	S	*	*			trans	-74.9	145.8	171.8	-65.8	179.8	156	0	0	109.6
132	D	37.7	Very low	38.2	Very low	163 Å²	163	152.3 Å²	152.3	87%	0.872	82%	0.817	S	S	*	*			trans	5.9	113.9	153.1	-58	-37.3	0	0	0	117.2
133	S	32.7	Very low	38.5	Very low	122 Å²	122	149.1 Å²	149.1	85%	0.853	81%	0.812	S	S	*	*			trans	-146.7	125	149.9	-73.6	0	0	0	0	109.7
134	D	37	Very low	39.3	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	80%	0.8	S	S	*	*			trans	-60.6	150.8	179.7	-62.2	-59.1	0	0	0	112.9
135	D	45.3	Very low	40.8	Very low	150 Å²	150	143.7 Å²	143.7	80%	0.802	78%	0.779	S	S	*	*			trans	21.9	109.5	154.6	-66.8	-31.1	0	0	0	118.3
136	D	35.9	Very low	42.7	Very low	165 Å²	165	146.5 Å²	146.5	88%	0.882	78%	0.78	S	S	*	*			trans	-156.4	129.9	131.6	-94.7	-36.1	0	0	0	109.6	D138	D136-D138 PolarHBondContact O-N 2.83Å
137	D	47.6	Very low	45.4	Very low	164 Å²	164	143.7 Å²	143.7	88%	0.877	77%	0.765	S	S	*	*			trans	-53.5	114.2	165.7	-79.8	-55.4	0	0	0	109.3
138	D	37.2	Very low	47.8	Very low	153 Å²	153	137.3 Å²	137.3	82%	0.818	73%	0.731	S	S	*	*			trans	-149	131.2	154.3	-102.8	-29.8	0	0	0	110.6	D136 E140	D136-D138 PolarHBondContact O-N 2.83Å; D138-E140 VanDerWaalsContact C-N 3.26Å; D138-E140 PolarHBondContact O-N 2.94Å
139	D	45.3	Very low	50.6	Low	168 Å²	168	129.9 Å²	129.9	90%	0.898	69%	0.691	S	S	*	*			trans	-56.3	77.3	173.3	-79.2	-54.2	0	0	0	111.6	E141	D139-E141 VanDerWaalsContact C-N 3.26Å; D139-E141 PolarHBondContact O-N 2.8Å
140	E	39.5	Very low	53.1	Low	179 Å²	179	122.9 Å²	122.9	84%	0.836	66%	0.659	S	S	*	*			trans	-76.9	86.4	164.3	-85	-160	163.5	0	0	109.6	D138 T142	D138-E140 VanDerWaalsContact C-N 3.26Å; D138-E140 PolarHBondContact O-N 2.94Å; E140-T142 VanDerWaalsContact C-N 3.27Å; E140-T142 PolarHBondContact O-N 3.32Å
141	E	44.4	Very low	55.8	Low	189 Å²	189	115 Å²	115	88%	0.883	62%	0.617	S	S	*	*			trans	-5	79.7	144.2	-148.3	175.3	-148.8	0	0	112.6	D139 C143	D139-E141 VanDerWaalsContact C-N 3.26Å; D139-E141 PolarHBondContact O-N 2.8Å; E141-C143 VanDerWaalsContact C-N 3.31Å; E141-C143 PolarHBondContact O-N 2.94Å
142	T	43.6	Very low	58.4	Low	91 Å²	91	106.7 Å²	106.7	56%	0.558	58%	0.578	S	S	*	*			trans	-63	102.4	173.1	-65.5	0	0	0	0	105	E140 C144	E140-T142 VanDerWaalsContact C-N 3.27Å; E140-T142 PolarHBondContact O-N 3.32Å; T142-C144 PolarHBondContact O-N 2.93Å
143	C	37.9	Very low	61	Low	109 Å²	109	99 Å²	99	74%	0.736	54%	0.536	S	S	*	.			trans	-38.7	105.5	168.2	170.8	0	0	0	0	107.4	E141 S145	E141-C143 VanDerWaalsContact C-N 3.31Å; E141-C143 PolarHBondContact O-N 2.94Å; C143-S145 PolarHBondContact O-N 3.03Å
144	C	48.8	Very low	63.8	Low	71 Å²	71	93.1 Å²	93.1	48%	0.48	50%	0.496	S	S	.	.			trans	-75.4	79.9	-175.8	-152.1	0	0	0	0	105.8	T142 K146 H232	T142-C144 PolarHBondContact O-N 2.93Å; C144-K146 PolarHBondContact O-N 3.03Å; C144-H232 VanDerWaalsContact SG-CB 3.54Å; C144-H232 PolarHBondContact SG-CD2 3.07Å; C144-H232 PolarHBondContact SG-ND1 3.36Å
145	S	65.3	Low	66.1	Low	43 Å²	43	87.4 Å²	87.4	30%	0.301	47%	0.465	S	S	.	.			trans	-56.2	119.6	176.1	55.3	0	0	0	0	106.3	C143 D147 I148	C143-S145 PolarHBondContact O-N 3.03Å; S145-D147 PolarHBondContact O-N 2.97Å; S145-I148 PolarHBondContact O-N 3.29Å; S145-I148 WeakPolarHBondContact OG-CB 3.36Å; S145-I148 WeakPolarHBondContact OG-CD1 3.48Å; S145-I148 WeakPolarHBondContact OG-CG1 3.36Å
146	K	74.6	Confident	68.1	Low	170 Å²	170	82.1 Å²	82.1	74%	0.739	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-17.5	-171.8	-64.9	-179.8	179.4	179	0	113.7	C144	C144-K146 PolarHBondContact O-N 3.03Å
147	D	86.5	Confident	70.6	Confident	92 Å²	92	74.4 Å²	74.4	49%	0.492	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	8.4	-174.1	-46.7	-50.1	0	0	0	113.6	R42 I43 S145	R42-D147 CarbonylContact C-O 3.54Å; R42-D147 WeakPolarHBondContact CA-O 3.38Å; I43-D147 HydrophobicContact CB-CB 4.26Å; I43-D147 PolarHBondContact N-O 3.18Å; S145-D147 PolarHBondContact O-N 2.97Å
148	I	91.4	Very high	72.5	Confident	25 Å²	25	68.7 Å²	68.7	13%	0.128	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.8	176.2	-67.5	-178.7	0	0	0	110.9	R40 F41 R42 S145 Q150 H232	R40-I148 HydrophobicContact CB-CG2 3.98Å; R40-I148 HydrophobicContact CG-CG2 4.31Å; F41-I148 WeakPolarHBondContact O-CA 3.25Å; R42-I148 HydrophobicContact CB-CG1 4.48Å; S145-I148 PolarHBondContact O-N 3.29Å; S145-I148 WeakPolarHBondContact OG-CB 3.36Å; S145-I148 WeakPolarHBondContact OG-CD1 3.48Å; S145-I148 WeakPolarHBondContact OG-CG1 3.36Å; I148-Q150 HydrophobicContact CG2-CG 4.11Å; I148-H232 PolarHBondContact O-CE1 2.78Å; I148-H232 PolarHBondContact O-NE2 2.64Å
149	I	92.6	Very high	74.7	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	131.8	168.4	-52.3	168.3	0	0	0	108.9	R40 F41 I43 I151 L198 I201 I202 N230 M233	R40-I149 CarbonylContact C-O 3.22Å; R40-I149 WeakPolarHBondContact CA-O 3.35Å; F41-I149 HydrophobicContact CB-CB 4.29Å; F41-I149 PolarHBondContact N-O 3.22Å; F41-I149 PolarHBondContact O-N 3.11Å; I43-I149 HydrophobicContact CD1-CD1 4.07Å; I43-I149 HydrophobicContact CD1-CG1 4.31Å; I43-I149 HydrophobicContact CG1-CD1 4.1Å; I43-I149 HydrophobicContact CG1-CG1 4.41Å; I149-I151 HydrophobicContact CG2-CD1 3.72Å; I149-I151 HydrophobicContact CG2-CG1 3.88Å; I149-L198 HydrophobicContact CD1-CD1 4.18Å; I149-L198 HydrophobicContact CG2-CD1 3.99Å; I149-I201 HydrophobicContact CG2-CG2 4.34Å; I149-I202 HydrophobicContact CD1-CD1 3.51Å; I149-I202 HydrophobicContact CD1-CG1 3.51Å; I149-N230 VanDerWaalsContact CA-OD1 3.24Å; I149-N230 WeakPolarHBondContact CA-OD1 3.48Å; I149-N230 WeakPolarHBondContact CG2-OD1 3.46Å; I149-M233 HydrophobicContact CB-SD 4.46Å; I149-M233 HydrophobicContact CG1-CE 3.82Å; I149-M233 HydrophobicContact CG1-SD 3.66Å
150	Q	93.4	Very high	76.7	Confident	22 Å²	22	66 Å²	66	10%	0.103	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.8	177.2	-61	-177.9	-29.5	0	0	109.8	R38 R40 I148 N230	R38-Q150 VanDerWaalsContact NH2-CD 3.3Å; R40-Q150 HydrophobicContact CG-CG 4.41Å; I148-Q150 HydrophobicContact CG2-CG 4.11Å; Q150-N230 PolarHBondContact N-OD1 3.44Å; Q150-N230 PolarHBondContact O-ND2 3.42Å
151	I	94.6	Very high	79.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.9	-179.4	-58.4	-61.5	0	0	0	109.1	R38 S39 F41 I149 H153 V166 T196 L198 I201 N226	R38-I151 WeakPolarHBondContact CA-O 3.42Å; S39-I151 PolarHBondContact N-O 3.36Å; S39-I151 PolarHBondContact O-N 2.81Å; F41-I151 HydrophobicContact CD2-CB 4.4Å; F41-I151 HydrophobicContact CD2-CG1 4.02Å; F41-I151 HydrophobicContact CE2-CB 4Å; F41-I151 HydrophobicContact CE2-CG1 3.99Å; I149-I151 HydrophobicContact CG2-CD1 3.72Å; I149-I151 HydrophobicContact CG2-CG1 3.88Å; I151-H153 HydrophobicContact CG2-CB 4.31Å; I151-H153 PolarHBondContact O-CD2 2.92Å; I151-V166 HydrophobicContact CG2-CG2 3.88Å; I151-T196 HydrophobicContact CG2-CG2 4.21Å; I151-L198 HydrophobicContact CD1-CB 4.26Å; I151-L198 HydrophobicContact CD1-CD1 4Å; I151-L198 HydrophobicContact CG1-CD1 3.94Å; I151-I201 HydrophobicContact CD1-CD1 3.63Å; I151-N226 HydrophobicContact CD1-CB 4.32Å
152	E	94.5	Very high	81.4	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.037	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.5	162	-67.6	174.1	117.3	0	0	110.4	V36 F37 R38 L222 R225 N226 L229	V36-E152 HydrophobicContact CG1-CB 3.84Å; V36-E152 HydrophobicContact CG1-CG 4.42Å; F37-E152 CarbonylContact O-C 3.57Å; F37-E152 WeakPolarHBondContact O-CA 3.44Å; R38-E152 HydrophobicContact CB-CG 4.16Å; R38-E152 HydrophobicContact CG-CG 4.13Å; E152-L222 HydrophobicContact CB-CD1 3.95Å; E152-R225 IonicContact OE1-CZ 3.89Å; E152-R225 IonicContact OE1-NE 3.38Å; E152-R225 IonicContact OE1-NH1 2.74Å; E152-R225 PolarHBondContact OE1-NH1 3.01Å; E152-R225 IonicContact OE1-NH2 3.53Å; E152-R225 PolarHBondContact OE1-NH2 3.34Å; E152-R225 WeakPolarHBondContact OE2-CD 3.26Å; E152-R225 WeakPolarHBondContact OE2-CG 3.48Å; E152-R225 IonicContact OE2-CZ 3.42Å; E152-R225 IonicContact OE2-NE 2.95Å; E152-R225 PolarHBondContact OE2-NE 2.81Å; E152-R225 IonicContact OE2-NH1 2.82Å; E152-R225 PolarHBondContact OE2-NH1 3.06Å; E152-R225 IonicContact OE2-NH2 3.56Å; E152-R225 PolarHBondContact OE2-NH2 3.35Å; E152-N226 WeakPolarHBondContact CA-OD1 3.28Å; E152-N226 WeakPolarHBondContact CB-OD1 3.41Å; E152-N226 PolarHBondContact N-OD1 3.17Å; E152-N226 PolarHBondContact O-ND2 2.87Å; E152-L229 HydrophobicContact CG-CD1 3.99Å
153	H	93.5	Very high	83.7	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	169.5	-175	64.8	91	0	0	0	110.4	H16 F37 S39 I151 K164 V166 T196	H16-H153 AromaticContact CD2-CE1 3.54Å; H16-H153 AromaticContact CE1-CE1 3.24Å; H16-H153 PolarHBondContact CE1-CE1 3.21Å; H16-H153 AromaticContact CE1-NE2 3.39Å; H16-H153 PolarHBondContact CE1-NE2 3.27Å; H16-H153 AromaticContact ND1-CE1 3.95Å; H16-H153 AromaticContact NE2-CE1 2.91Å; H16-H153 PolarHBondContact NE2-CE1 2.73Å; H16-H153 AromaticContact NE2-ND1 3.41Å; H16-H153 PolarHBondContact NE2-ND1 2.79Å; H16-H153 AromaticContact NE2-NE2 3.51Å; F37-H153 PolarHBondContact N-O 3.27Å; F37-H153 PolarHBondContact O-N 2.85Å; S39-H153 WeakPolarHBondContact CB-NE2 3.24Å; S39-H153 PolarHBondContact OG-NE2 3.18Å; I151-H153 HydrophobicContact CG2-CB 4.31Å; I151-H153 PolarHBondContact O-CD2 2.92Å; H153-K164 CarbonylContact C-O 3.58Å; H153-K164 VanDerWaalsContact CA-O 3.27Å; H153-K164 WeakPolarHBondContact CA-O 3.27Å; H153-K164 VanDerWaalsContact CB-O 3.28Å; H153-K164 WeakPolarHBondContact CB-O 3.38Å; H153-V166 HydrophobicContact CB-CG2 4.06Å; H153-T196 HydrophobicContact CB-CG2 3.87Å
154	T	91.1	Very high	86.4	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.			trans	-106.7	139.1	172.3	-54.9	0	0	0	0	109	Q34 P35 A156 T157 K164 Q165	Q34-T154 HydrophobicContact CB-CG2 4.21Å; P35-T154 WeakPolarHBondContact O-CG2 3.26Å; T154-A156 WeakPolarHBondContact CG2-O 3.45Å; T154-T157 HydrophobicContact CG2-CG2 3.46Å; T154-T157 VanDerWaalsContact CG2-CG2 3.46Å; T154-K164 PolarHBondContact N-O 3.22Å; T154-Q165 VanDerWaalsContact O-CG 3.31Å; T154-Q165 WeakPolarHBondContact O-CG 3.41Å
155	M	85.9	Confident	88.6	Confident	37 Å²	37	39.1 Å²	39.1	18%	0.182	21%	0.208	C	C	.	.	S	Bend	trans	-86.9	-20.2	-179.6	-68.6	-176.4	170.6	0	0	114.3	S13 H16 H24 F37	S13-M155 PolarHBondContact N-O 3.28Å; H16-M155 HydrophobicContact CB-CE 3.78Å; H16-M155 HydrophobicContact CB-SD 4.34Å; H24-M155 HydrophobicContact CB-CE 3.48Å; H24-M155 VanDerWaalsContact CB-CE 3.48Å; H24-M155 HydrophobicContact CB-SD 4.48Å; H24-M155 WeakPolarHBondContact ND1-CE 3.48Å; F37-M155 HydrophobicContact CB-CE 4.19Å; F37-M155 HydrophobicContact CD1-CE 4.19Å; F37-M155 HydrophobicContact CD1-SD 4.25Å; F37-M155 HydrophobicContact CD2-CB 4.23Å; F37-M155 HydrophobicContact CD2-CE 4.42Å; F37-M155 HydrophobicContact CD2-CG 3.64Å; F37-M155 HydrophobicContact CD2-SD 4.03Å; F37-M155 HydrophobicContact CE1-SD 4.27Å; F37-M155 HydrophobicContact CE2-CB 4.06Å; F37-M155 HydrophobicContact CE2-CG 3.88Å; F37-M155 HydrophobicContact CE2-SD 4.06Å; F37-M155 HydrophobicContact CG-CE 4.01Å; F37-M155 HydrophobicContact CG-CG 4.16Å; F37-M155 HydrophobicContact CG-SD 4.11Å; F37-M155 HydrophobicContact CZ-SD 4.17Å
156	A	86	Confident	89.9	Confident	39 Å²	39	37 Å²	37	32%	0.322	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	120	-175.3	0	0	0	0	0	109.6	T10 V11 L12 T154	T10-A156 HydrophobicContact CG2-CB 3.71Å; V11-A156 WeakPolarHBondContact O-CA 3.34Å; L12-A156 HydrophobicContact CD2-CB 3.68Å; T154-A156 WeakPolarHBondContact CG2-O 3.45Å
157	T	87.9	Confident	90.9	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.012	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	158.8	-176.8	67.3	0	0	0	0	111	T10 V11 T154 D161 V162 K164 Q165	T10-T157 WeakPolarHBondContact CA-O 2.94Å; V11-T157 PolarHBondContact N-O 3.23Å; V11-T157 PolarHBondContact O-N 3.16Å; T154-T157 HydrophobicContact CG2-CG2 3.46Å; T154-T157 VanDerWaalsContact CG2-CG2 3.46Å; T157-D161 HydrophobicContact CG2-CB 4.13Å; T157-D161 PolarHBondContact OG1-O 3.01Å; T157-V162 PolarHBondContact OG1-N 3.08Å; T157-K164 HydrophobicContact CG2-CB 4.35Å; T157-Q165 HydrophobicContact CG2-CG 4Å; T157-Q165 PolarHBondContact OG1-NE2 2.99Å
158	P	87.5	Confident	91.3	Very high	44 Å²	44	26.7 Å²	26.7	29%	0.286	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	163.9	158.3	29.6	-33.6	0	0	0	110.5	Q34 E160 D161	Q34-P158 VanDerWaalsContact NE2-CD 3.28Å; P158-E160 HydrophobicContact CB-CG 4.21Å; P158-E160 HydrophobicContact CG-CG 3.99Å; P158-E160 PolarHBondContact O-N 3.33Å; P158-D161 HydrophobicContact CG-CB 4.02Å; P158-D161 PolarHBondContact O-N 2.96Å
159	L	85.1	Confident	91.5	Very high	96 Å²	96	25.5 Å²	25.5	50%	0.503	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-58.3	-34.5	-177.1	-173.2	63.4	0	0	0	113.2	V11 D161 V162 Y285	V11-L159 HydrophobicContact CG2-CB 4.46Å; V11-L159 HydrophobicContact CG2-CD1 4.07Å; L159-D161 PolarHBondContact O-N 2.9Å; L159-V162 HydrophobicContact CD1-CG1 4.12Å; L159-V162 WeakPolarHBondContact O-CG1 3.46Å; L159-V162 VanDerWaalsContact O-CG2 3.26Å; L159-V162 WeakPolarHBondContact O-CG2 3.34Å; L159-V162 PolarHBondContact O-N 3.48Å; L159-Y285 HydrophobicContact CD1-CD2 4.25Å; L159-Y285 HydrophobicContact CD1-CE2 4.49Å
160	E	87.2	Confident	91.7	Very high	170 Å²	170	26.1 Å²	26.1	79%	0.794	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	-66.3	-17.2	177.9	62.9	-168.2	-168.7	0	0	114.1	P158	P158-E160 HydrophobicContact CB-CG 4.21Å; P158-E160 HydrophobicContact CG-CG 3.99Å; P158-E160 PolarHBondContact O-N 3.33Å
161	D	90.5	Very high	91.8	Very high	33 Å²	33	25.1 Å²	25.1	18%	0.176	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-114	10.6	-173.7	-88.6	-29.9	0	0	0	113.1	Q34 T157 P158 L159 G163 K164	Q34-D161 PolarHBondContact NE2-OD2 2.9Å; Q34-D161 PolarHBondContact OE1-OD2 2.74Å; T157-D161 HydrophobicContact CG2-CB 4.13Å; T157-D161 PolarHBondContact OG1-O 3.01Å; P158-D161 HydrophobicContact CG-CB 4.02Å; P158-D161 PolarHBondContact O-N 2.96Å; L159-D161 PolarHBondContact O-N 2.9Å; D161-G163 PolarHBondContact O-N 2.86Å; D161-K164 HydrophobicContact CB-CD 4.11Å; D161-K164 WeakPolarHBondContact O-CB 3.23Å; D161-K164 PolarHBondContact O-N 3.41Å; D161-K164 VanDerWaalsContact OD1-CE 3.27Å; D161-K164 WeakPolarHBondContact OD1-CE 3.38Å; D161-K164 IonicContact OD1-NZ 2.7Å; D161-K164 PolarHBondContact OD1-NZ 3.25Å; D161-K164 IonicContact OD2-NZ 2.92Å; D161-K164 PolarHBondContact OD2-NZ 3.26Å
162	V	91.4	Very high	92	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.042	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-59.2	-21.2	-178.2	-69.2	0	0	0	0	113.9	V11 T157 L159 K164 Q165 W167 Y285	V11-V162 HydrophobicContact CB-CG1 3.91Å; V11-V162 HydrophobicContact CG1-CG1 3.9Å; V11-V162 HydrophobicContact CG2-CG1 3.93Å; T157-V162 PolarHBondContact OG1-N 3.08Å; L159-V162 HydrophobicContact CD1-CG1 4.12Å; L159-V162 WeakPolarHBondContact O-CG1 3.46Å; L159-V162 VanDerWaalsContact O-CG2 3.26Å; L159-V162 WeakPolarHBondContact O-CG2 3.34Å; L159-V162 PolarHBondContact O-N 3.48Å; V162-K164 PolarHBondContact O-N 3.05Å; V162-Q165 PolarHBondContact O-N 3.47Å; V162-Q165 VanDerWaalsContact O-N 3.12Å; V162-W167 HydrophobicContact CB-CZ2 3.87Å; V162-W167 HydrophobicContact CG1-CZ2 4.08Å; V162-W167 PolarHBondContact O-NE1 3.48Å; V162-Y285 HydrophobicContact CG2-CE1 4.24Å; V162-Y285 HydrophobicContact CG2-CE2 4.21Å
163	G	92.7	Very high	92.1	Very high	19 Å²	19	24.8 Å²	24.8	20%	0.196	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-62.3	-20.7	172.3	0	0	0	0	0	113.7	D161 Q165 G195 T196 L219	D161-G163 PolarHBondContact O-N 2.86Å; G163-Q165 PolarHBondContact O-N 3.06Å; G163-G195 CarbonylContact O-C 3.57Å; G163-G195 WeakPolarHBondContact O-CA 3.49Å; G163-T196 PolarHBondContact O-N 2.75Å; G163-L219 WeakPolarHBondContact O-CD1 3.44Å
164	K	94.1	Very high	92.3	Very high	11 Å²	11	24.8 Å²	24.8	5%	0.048	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-77.3	-5.5	176.2	-61.9	170.5	179.5	159.9	0	113	Q34 H153 T154 T157 D161 V162 L219 L222	Q34-K164 VanDerWaalsContact OE1-NZ 3.11Å; H153-K164 CarbonylContact C-O 3.58Å; H153-K164 VanDerWaalsContact CA-O 3.27Å; H153-K164 WeakPolarHBondContact CA-O 3.27Å; H153-K164 VanDerWaalsContact CB-O 3.28Å; H153-K164 WeakPolarHBondContact CB-O 3.38Å; T154-K164 PolarHBondContact N-O 3.22Å; T157-K164 HydrophobicContact CG2-CB 4.35Å; D161-K164 HydrophobicContact CB-CD 4.11Å; D161-K164 WeakPolarHBondContact O-CB 3.23Å; D161-K164 PolarHBondContact O-N 3.41Å; D161-K164 VanDerWaalsContact OD1-CE 3.27Å; D161-K164 WeakPolarHBondContact OD1-CE 3.38Å; D161-K164 IonicContact OD1-NZ 2.7Å; D161-K164 PolarHBondContact OD1-NZ 3.25Å; D161-K164 IonicContact OD2-NZ 2.92Å; D161-K164 PolarHBondContact OD2-NZ 3.26Å; V162-K164 PolarHBondContact O-N 3.05Å; K164-L219 HydrophobicContact CG-CD1 3.93Å; K164-L222 HydrophobicContact CB-CD2 4.14Å; K164-L222 HydrophobicContact CG-CD2 4.19Å
165	Q	94.3	Very high	92.6	Very high	3 Å²	3	24.8 Å²	24.8	1%	0.014	14%	0.136	C	C	.	.	S	Bend	trans	-99.5	159.7	-179.6	-44.1	-165.4	12.8	0	0	111.6	V11 S13 T154 T157 V162 G163 W167 T196	V11-Q165 PolarHBondContact O-NE2 2.96Å; S13-Q165 VanDerWaalsContact CA-OE1 3.24Å; S13-Q165 VanDerWaalsContact CB-OE1 3.24Å; S13-Q165 VanDerWaalsContact N-OE1 3.07Å; T154-Q165 VanDerWaalsContact O-CG 3.31Å; T154-Q165 WeakPolarHBondContact O-CG 3.41Å; T157-Q165 HydrophobicContact CG2-CG 4Å; T157-Q165 PolarHBondContact OG1-NE2 2.99Å; V162-Q165 PolarHBondContact O-N 3.47Å; V162-Q165 VanDerWaalsContact O-N 3.12Å; G163-Q165 PolarHBondContact O-N 3.06Å; Q165-W167 HydrophobicContact CB-CZ2 4.33Å; Q165-W167 HydrophobicContact CG-CZ2 4.48Å; Q165-T196 WeakPolarHBondContact O-CG2 3.48Å
166	V	93.9	Very high	93.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.131	C	C	.	.			trans	-93.3	129.8	167.7	-178.7	0	0	0	0	108.9	S13 V15 F41 I151 H153 L171 T196 L198	S13-V166 PolarHBondContact OG-O 3.17Å; S13-V166 VanDerWaalsContact OG-O 3.05Å; V15-V166 HydrophobicContact CG1-CG1 4.43Å; V15-V166 HydrophobicContact CG2-CG1 4.46Å; V15-V166 VanDerWaalsContact CG2-O 3.27Å; V15-V166 WeakPolarHBondContact CG2-O 3.43Å; F41-V166 HydrophobicContact CZ-CG1 4.14Å; F41-V166 HydrophobicContact CZ-CG2 4.36Å; I151-V166 HydrophobicContact CG2-CG2 3.88Å; H153-V166 HydrophobicContact CB-CG2 4.06Å; V166-L171 HydrophobicContact CG1-CD2 4.33Å; V166-L171 HydrophobicContact CG1-CG 4.37Å; V166-T196 HydrophobicContact CG2-CG2 4.08Å; V166-L198 HydrophobicContact CG1-CD2 3.85Å
167	W	94.7	Very high	93.7	Very high	30 Å²	30	21.9 Å²	21.9	11%	0.114	12%	0.115	C	C	.	.			trans	-112.8	152.9	-177.2	-64.6	102.1	0	0	0	112.3	V11 V162 Q165 G169 A170 L171 D282	V11-W167 HydrophobicContact CG1-CH2 3.5Å; V11-W167 VanDerWaalsContact CG1-CH2 3.5Å; V11-W167 HydrophobicContact CG1-CZ2 3.97Å; V162-W167 HydrophobicContact CB-CZ2 3.87Å; V162-W167 HydrophobicContact CG1-CZ2 4.08Å; V162-W167 PolarHBondContact O-NE1 3.48Å; Q165-W167 HydrophobicContact CB-CZ2 4.33Å; Q165-W167 HydrophobicContact CG-CZ2 4.48Å; W167-G169 VanDerWaalsContact C-N 3.29Å; W167-G169 PolarHBondContact O-N 3.23Å; W167-A170 WeakPolarHBondContact O-CB 3.23Å; W167-A170 PolarHBondContact O-N 3.29Å; W167-A170 VanDerWaalsContact O-N 3.07Å; W167-L171 PolarHBondContact O-N 2.9Å; W167-D282 HydrophobicContact CB-CB 3.85Å; W167-D282 WeakPolarHBondContact CB-OD2 3.46Å; W167-D282 HydrophobicContact CG-CB 4.24Å
168	R	94.3	Very high	94.1	Very high	15 Å²	15	22.1 Å²	22.1	6%	0.057	12%	0.116	C	C	.	.	H	α-helix	trans	-63.6	-33.4	-175.7	-71.1	-179	174.4	-142.6	4	112.3	V15 H18 A170 L171 L172 E368 L373	V15-R168 HydrophobicContact CG2-CG 4.1Å; H18-R168 PolarHBondContact CD2-NH2 2.77Å; H18-R168 PolarHBondContact NE2-NH2 2.95Å; R168-A170 VanDerWaalsContact C-N 3.31Å; R168-A170 PolarHBondContact O-N 3.11Å; R168-L171 WeakPolarHBondContact O-CB 3.31Å; R168-L171 PolarHBondContact O-N 3.33Å; R168-L172 PolarHBondContact O-N 3.19Å; R168-E368 IonicContact CZ-OE2 2.74Å; R168-E368 PolarHBondContact NH1-O 3.1Å; R168-E368 VanDerWaalsContact NH1-O 3.15Å; R168-E368 IonicContact NH1-OE2 3.92Å; R168-E368 PolarHBondContact NH1-OE2 3.06Å; R168-E368 IonicContact NH2-OE2 3.36Å; R168-E368 PolarHBondContact NH2-OE2 2.83Å; R168-L373 HydrophobicContact CB-CD1 4.4Å; R168-L373 HydrophobicContact CB-CD2 3.94Å
169	G	95.8	Very high	94.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.5	-37.3	172.7	0	0	0	0	0	112.5	W167 L171 L172 L173 D282 S313	W167-G169 VanDerWaalsContact C-N 3.29Å; W167-G169 PolarHBondContact O-N 3.23Å; G169-L171 VanDerWaalsContact C-N 3.31Å; G169-L171 PolarHBondContact O-N 3.36Å; G169-L172 PolarHBondContact O-N 3.16Å; G169-L173 WeakPolarHBondContact O-CB 3.32Å; G169-L173 PolarHBondContact O-N 3.38Å; G169-D282 WeakPolarHBondContact CA-OD2 3.46Å; G169-D282 PolarHBondContact N-OD2 2.89Å; G169-S313 WeakPolarHBondContact CA-OG 3.04Å; G169-S313 PolarHBondContact O-OG 3.12Å
170	A	97	Very high	95	Very high	13 Å²	13	21 Å²	21	11%	0.107	11%	0.109	C	C	.	.	H	α-helix	trans	-63.9	-38.6	175.6	0	0	0	0	0	111.4	W167 R168 A174 L198 T199 A281	W167-A170 WeakPolarHBondContact O-CB 3.23Å; W167-A170 PolarHBondContact O-N 3.29Å; W167-A170 VanDerWaalsContact O-N 3.07Å; R168-A170 VanDerWaalsContact C-N 3.31Å; R168-A170 PolarHBondContact O-N 3.11Å; A170-A174 WeakPolarHBondContact O-CB 3.44Å; A170-A174 PolarHBondContact O-N 3.48Å; A170-L198 HydrophobicContact CB-CD2 4.4Å; A170-T199 HydrophobicContact CB-CG2 3.81Å; A170-T199 WeakPolarHBondContact O-CG2 3.34Å; A170-A281 HydrophobicContact CB-CB 4.04Å
171	L	96.4	Very high	95.4	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-68.4	-38.8	175.3	-59.6	170.2	0	0	0	112.2	V15 F41 V166 W167 R168 G169 A174 D175 L198 L365 Y367	V15-L171 HydrophobicContact CG1-CD1 3.87Å; V15-L171 HydrophobicContact CG2-CD1 3.96Å; F41-L171 HydrophobicContact CD1-CD2 4.13Å; F41-L171 HydrophobicContact CE1-CD2 3.96Å; V166-L171 HydrophobicContact CG1-CD2 4.33Å; V166-L171 HydrophobicContact CG1-CG 4.37Å; W167-L171 PolarHBondContact O-N 2.9Å; R168-L171 WeakPolarHBondContact O-CB 3.31Å; R168-L171 PolarHBondContact O-N 3.33Å; G169-L171 VanDerWaalsContact C-N 3.31Å; G169-L171 PolarHBondContact O-N 3.36Å; L171-A174 WeakPolarHBondContact O-CB 3.43Å; L171-A174 PolarHBondContact O-N 3.17Å; L171-D175 PolarHBondContact O-N 3.07Å; L171-L198 HydrophobicContact CD2-CD2 3.68Å; L171-L198 HydrophobicContact CG-CD2 4.49Å; L171-L365 HydrophobicContact CB-CD1 4.49Å; L171-L365 HydrophobicContact CD2-CD1 3.66Å; L171-Y367 HydrophobicContact CB-CD1 3.79Å; L171-Y367 HydrophobicContact CB-CD2 4.15Å; L171-Y367 HydrophobicContact CB-CE1 3.86Å; L171-Y367 HydrophobicContact CB-CE2 4.19Å; L171-Y367 HydrophobicContact CB-CG 3.97Å; L171-Y367 HydrophobicContact CD1-CD1 4.21Å; L171-Y367 HydrophobicContact CD1-CD2 4.23Å; L171-Y367 HydrophobicContact CD1-CG 3.79Å
172	L	97.5	Very high	95.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.7	-45.3	174.3	-175.9	73.5	0	0	0	112.2	R168 G169 A174 D175 F176 L359 F361 Y367 R369 L373 L375	R168-L172 PolarHBondContact O-N 3.19Å; G169-L172 PolarHBondContact O-N 3.16Å; L172-A174 VanDerWaalsContact C-N 3.31Å; L172-D175 PolarHBondContact O-N 2.75Å; L172-F176 PolarHBondContact O-N 3.16Å; L172-F176 VanDerWaalsContact O-N 3.08Å; L172-L359 HydrophobicContact CD1-CD1 4.14Å; L172-L359 HydrophobicContact CD1-CD2 4.17Å; L172-L359 HydrophobicContact CD2-CD1 4.3Å; L172-L359 HydrophobicContact CD2-CD2 4.07Å; L172-L359 HydrophobicContact CG-CD2 4.48Å; L172-F361 HydrophobicContact CD1-CE2 4.23Å; L172-F361 HydrophobicContact CD1-CZ 3.8Å; L172-F361 HydrophobicContact CG-CZ 4.22Å; L172-Y367 VanDerWaalsContact CA-OH 3.31Å; L172-Y367 WeakPolarHBondContact CA-OH 3.42Å; L172-Y367 WeakPolarHBondContact CD1-OH 3.41Å; L172-R369 HydrophobicContact CD1-CG 4.09Å; L172-L373 HydrophobicContact CD2-CB 3.94Å; L172-L373 HydrophobicContact CD2-CD2 4.44Å; L172-L375 HydrophobicContact CD2-CB 4.37Å
173	L	98	Very high	95.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.7	-39	178.2	-179.1	60.1	0	0	0	110.9	G169 F176 I177 T199 I279 A281 F311 L375	G169-L173 WeakPolarHBondContact O-CB 3.32Å; G169-L173 PolarHBondContact O-N 3.38Å; L173-F176 HydrophobicContact CD1-CD1 4.29Å; L173-F176 WeakPolarHBondContact O-CB 3.13Å; L173-F176 PolarHBondContact O-N 3.15Å; L173-I177 HydrophobicContact CD1-CD1 4.48Å; L173-I177 HydrophobicContact CG-CD1 4.05Å; L173-I177 WeakPolarHBondContact O-CD1 3.39Å; L173-I177 VanDerWaalsContact O-CG1 3.23Å; L173-I177 WeakPolarHBondContact O-CG1 3.26Å; L173-I177 PolarHBondContact O-N 3.06Å; L173-T199 HydrophobicContact CB-CG2 4.4Å; L173-T199 HydrophobicContact CD2-CG2 4.09Å; L173-T199 HydrophobicContact CG-CG2 4.45Å; L173-I279 HydrophobicContact CD2-CB 4.03Å; L173-I279 HydrophobicContact CD2-CD1 4.39Å; L173-I279 HydrophobicContact CD2-CG1 4.47Å; L173-A281 HydrophobicContact CB-CB 4.45Å; L173-A281 HydrophobicContact CD2-CB 3.95Å; L173-F311 HydrophobicContact CD1-CB 4.25Å; L173-L375 HydrophobicContact CD1-CD1 4.18Å
174	A	97.4	Very high	96.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.4	-48.4	173	0	0	0	0	0	113	A170 L171 L172 F176 I177 L178 I202 L365	A170-A174 WeakPolarHBondContact O-CB 3.44Å; A170-A174 PolarHBondContact O-N 3.48Å; L171-A174 WeakPolarHBondContact O-CB 3.43Å; L171-A174 PolarHBondContact O-N 3.17Å; L172-A174 VanDerWaalsContact C-N 3.31Å; A174-F176 VanDerWaalsContact C-N 3.3Å; A174-F176 PolarHBondContact O-N 2.9Å; A174-I177 PolarHBondContact O-N 3.43Å; A174-L178 WeakPolarHBondContact O-CG 3.43Å; A174-L178 PolarHBondContact O-N 2.82Å; A174-I202 HydrophobicContact CB-CD1 3.28Å; A174-L365 HydrophobicContact CB-CD1 3.65Å
175	D	97.3	Very high	96.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.6	-43.1	174.7	-83	-11.8	0	0	0	111.7	L171 L172 L178 S179 F361 Q363 F364 L365 Y367 R369	L171-D175 PolarHBondContact O-N 3.07Å; L172-D175 PolarHBondContact O-N 2.75Å; D175-L178 PolarHBondContact O-N 3.05Å; D175-S179 PolarHBondContact O-N 2.87Å; D175-S179 PolarHBondContact O-OG 2.89Å; D175-F361 HydrophobicContact CB-CD2 4.1Å; D175-F361 HydrophobicContact CB-CE2 3.69Å; D175-Q363 WeakPolarHBondContact OD2-CA 3.37Å; D175-Q363 WeakPolarHBondContact OD2-CG 3.42Å; D175-F364 HydrophobicContact CB-CD2 4.42Å; D175-F364 WeakPolarHBondContact OD1-CA 3.33Å; D175-F364 WeakPolarHBondContact OD1-CB 3.47Å; D175-F364 PolarHBondContact OD1-N 2.74Å; D175-L365 PolarHBondContact OD1-N 2.74Å; D175-Y367 VanDerWaalsContact OD2-CE1 3.26Å; D175-Y367 WeakPolarHBondContact OD2-CE1 3.36Å; D175-Y367 PolarHBondContact OD2-OH 3.32Å; D175-R369 IonicContact OD2-CZ 2.79Å; D175-R369 IonicContact OD2-NH2 2.73Å; D175-R369 PolarHBondContact OD2-NH2 3.47Å
176	F	98	Very high	96.2	Very high	15 Å²	15	34.2 Å²	34.2	7%	0.066	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-46.1	178	176.6	-109.9	0	0	0	111.8	L172 L173 A174 L178 S179 E180 F184 F311 V357 F361 L375	L172-F176 PolarHBondContact O-N 3.16Å; L172-F176 VanDerWaalsContact O-N 3.08Å; L173-F176 HydrophobicContact CD1-CD1 4.29Å; L173-F176 WeakPolarHBondContact O-CB 3.13Å; L173-F176 PolarHBondContact O-N 3.15Å; A174-F176 VanDerWaalsContact C-N 3.3Å; A174-F176 PolarHBondContact O-N 2.9Å; F176-L178 VanDerWaalsContact C-N 3.3Å; F176-L178 PolarHBondContact O-N 2.9Å; F176-S179 WeakPolarHBondContact CA-OG 3.41Å; F176-S179 PolarHBondContact O-N 3.38Å; F176-S179 VanDerWaalsContact O-N 3.16Å; F176-S179 PolarHBondContact O-OG 3.26Å; F176-E180 HydrophobicContact CD2-CG 4.16Å; F176-E180 HydrophobicContact CE2-CG 3.69Å; F176-E180 HydrophobicContact CZ-CG 4.03Å; F176-E180 WeakPolarHBondContact O-CB 3.47Å; F176-E180 PolarHBondContact O-N 2.96Å; F176-F184 HydrophobicContact CD1-CZ 4.41Å; F176-F184 HydrophobicContact CE1-CE2 4.32Å; F176-F184 AromaticContact CE1-CZ 3.88Å; F176-F184 HydrophobicContact CE1-CZ 3.88Å; F176-F311 AromaticContact CE1-CD1 3.6Å; F176-F311 HydrophobicContact CE1-CD1 3.6Å; F176-F311 HydrophobicContact CE1-CD2 4.17Å; F176-F311 AromaticContact CE1-CE1 3.5Å; F176-F311 HydrophobicContact CE1-CE1 3.5Å; F176-F311 VanDerWaalsContact CE1-CE1 3.5Å; F176-F311 HydrophobicContact CE1-CE2 4.08Å; F176-F311 AromaticContact CE1-CG 3.93Å; F176-F311 HydrophobicContact CE1-CG 3.93Å; F176-F311 AromaticContact CE1-CZ 3.75Å; F176-F311 HydrophobicContact CE1-CZ 3.75Å; F176-F311 HydrophobicContact CZ-CD1 4.01Å; F176-F311 AromaticContact CZ-CE1 3.51Å; F176-F311 HydrophobicContact CZ-CE1 3.51Å; F176-F311 AromaticContact CZ-CZ 3.83Å; F176-F311 HydrophobicContact CZ-CZ 3.83Å; F176-V357 HydrophobicContact CE2-CG1 4.07Å; F176-F361 HydrophobicContact CB-CD2 4.42Å; F176-F361 HydrophobicContact CB-CE1 4.24Å; F176-F361 HydrophobicContact CB-CE2 3.96Å; F176-F361 HydrophobicContact CB-CZ 3.85Å; F176-F361 AromaticContact CD2-CD1 3.97Å; F176-F361 HydrophobicContact CD2-CD1 3.97Å; F176-F361 AromaticContact CD2-CE1 3.96Å; F176-F361 HydrophobicContact CD2-CE1 3.96Å; F176-F361 HydrophobicContact CD2-CG 4.43Å; F176-F361 HydrophobicContact CD2-CZ 4.43Å; F176-L375 HydrophobicContact CB-CD2 3.91Å; F176-L375 HydrophobicContact CD1-CD2 3.85Å; F176-L375 HydrophobicContact CD2-CD2 3.63Å; F176-L375 HydrophobicContact CE1-CD2 4.26Å; F176-L375 HydrophobicContact CE2-CD2 4.08Å; F176-L375 HydrophobicContact CG-CD2 3.5Å; F176-L375 HydrophobicContact CZ-CD2 4.38Å
177	I	97.4	Very high	96.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.7	-43.8	176.4	-65.7	162	0	0	0	110.9	L173 A174 S179 E180 K181 F184 I202 M203 I279	L173-I177 HydrophobicContact CD1-CD1 4.48Å; L173-I177 HydrophobicContact CG-CD1 4.05Å; L173-I177 WeakPolarHBondContact O-CD1 3.39Å; L173-I177 VanDerWaalsContact O-CG1 3.23Å; L173-I177 WeakPolarHBondContact O-CG1 3.26Å; L173-I177 PolarHBondContact O-N 3.06Å; A174-I177 PolarHBondContact O-N 3.43Å; I177-S179 VanDerWaalsContact C-N 3.31Å; I177-S179 PolarHBondContact O-N 2.46Å; I177-E180 CarbonylContact O-C 3.52Å; I177-E180 PolarHBondContact O-N 3.43Å; I177-K181 PolarHBondContact O-N 3.43Å; I177-F184 HydrophobicContact CG1-CE2 4.37Å; I177-F184 HydrophobicContact CG2-CD2 4.36Å; I177-I202 HydrophobicContact CB-CG2 4.16Å; I177-I202 HydrophobicContact CG2-CG2 3.91Å; I177-M203 HydrophobicContact CB-CE 4.5Å; I177-M203 HydrophobicContact CD1-CB 4.32Å; I177-M203 HydrophobicContact CD1-CE 3.7Å; I177-M203 HydrophobicContact CG1-CE 3.6Å; I177-M203 HydrophobicContact CG2-CE 4.09Å; I177-M203 HydrophobicContact CG2-SD 4.04Å; I177-I279 HydrophobicContact CD1-CD1 4.24Å
178	L	95.8	Very high	96.6	Very high	7 Å²	7	33.4 Å²	33.4	4%	0.037	18%	0.175	C	C	.	.	H	α-helix	trans	-68	-29.4	178.9	-70.8	170.2	0	0	0	113	I43 A174 D175 F176 K181 I202 F364	I43-L178 HydrophobicContact CD1-CD1 4.22Å; I43-L178 HydrophobicContact CD1-CD2 4.32Å; I43-L178 HydrophobicContact CG1-CD1 4.31Å; I43-L178 HydrophobicContact CG2-CD1 4.16Å; A174-L178 WeakPolarHBondContact O-CG 3.43Å; A174-L178 PolarHBondContact O-N 2.82Å; D175-L178 PolarHBondContact O-N 3.05Å; F176-L178 VanDerWaalsContact C-N 3.3Å; F176-L178 PolarHBondContact O-N 2.9Å; L178-K181 VanDerWaalsContact O-CE 3.28Å; L178-K181 WeakPolarHBondContact O-CE 3.03Å; L178-K181 WeakPolarHBondContact O-CG 2.97Å; L178-I202 HydrophobicContact CD1-CG2 4.26Å; L178-I202 HydrophobicContact CD2-CG2 3.9Å; L178-I202 HydrophobicContact CG-CG2 3.73Å; L178-F364 HydrophobicContact CB-CB 4.42Å; L178-F364 HydrophobicContact CB-CD1 4.21Å; L178-F364 HydrophobicContact CB-CD2 3.54Å; L178-F364 HydrophobicContact CB-CE1 4.41Å; L178-F364 HydrophobicContact CB-CE2 3.76Å; L178-F364 HydrophobicContact CB-CG 3.8Å; L178-F364 HydrophobicContact CB-CZ 4.21Å; L178-F364 HydrophobicContact CD1-CB 3.57Å; L178-F364 HydrophobicContact CD1-CD1 4.46Å; L178-F364 HydrophobicContact CD1-CD2 4.26Å; L178-F364 HydrophobicContact CD1-CG 3.87Å; L178-F364 HydrophobicContact CG-CG 4.48Å
179	S	96.4	Very high	96.8	Very high	36 Å²	36	32.7 Å²	32.7	25%	0.252	17%	0.172	S	C	.	.	H	α-helix	trans	-76.4	-28.3	173.5	62.8	0	0	0	0	113.8	D175 F176 I177 F361	D175-S179 PolarHBondContact O-N 2.87Å; D175-S179 PolarHBondContact O-OG 2.89Å; F176-S179 WeakPolarHBondContact CA-OG 3.41Å; F176-S179 PolarHBondContact O-N 3.38Å; F176-S179 VanDerWaalsContact O-N 3.16Å; F176-S179 PolarHBondContact O-OG 3.26Å; I177-S179 VanDerWaalsContact C-N 3.31Å; I177-S179 PolarHBondContact O-N 2.46Å; S179-F361 WeakPolarHBondContact OG-CB 3.21Å
180	E	95.6	Very high	96.9	Very high	82 Å²	82	32.7 Å²	32.7	38%	0.383	17%	0.172	S	C	.	.			trans	-115.3	35.2	-170.8	-69.8	-66.9	156.4	0	0	112.3	F176 I177 D182 T183 F184	F176-E180 HydrophobicContact CD2-CG 4.16Å; F176-E180 HydrophobicContact CE2-CG 3.69Å; F176-E180 HydrophobicContact CZ-CG 4.03Å; F176-E180 WeakPolarHBondContact O-CB 3.47Å; F176-E180 PolarHBondContact O-N 2.96Å; I177-E180 CarbonylContact O-C 3.52Å; I177-E180 PolarHBondContact O-N 3.43Å; E180-D182 VanDerWaalsContact C-N 3.29Å; E180-D182 PolarHBondContact O-N 2.91Å; E180-T183 VanDerWaalsContact O-CB 3.25Å; E180-T183 WeakPolarHBondContact O-CB 3.41Å; E180-T183 PolarHBondContact O-N 2.81Å; E180-T183 PolarHBondContact OE2-OG1 3.02Å; E180-F184 HydrophobicContact CB-CD2 4.44Å; E180-F184 HydrophobicContact CB-CE2 3.89Å; E180-F184 VanDerWaalsContact O-CD2 3.24Å; E180-F184 WeakPolarHBondContact O-CD2 3.11Å
181	K	94.6	Very high	97	Very high	91 Å²	91	32.2 Å²	32.2	40%	0.396	17%	0.168	S	C	.	.	H	α-helix	trans	-53.6	-42.6	-174.2	-68.5	175.6	-177.1	174.2	0	113.2	I177 L178 T183 F184 R185 T206	I177-K181 PolarHBondContact O-N 3.43Å; L178-K181 VanDerWaalsContact O-CE 3.28Å; L178-K181 WeakPolarHBondContact O-CE 3.03Å; L178-K181 WeakPolarHBondContact O-CG 2.97Å; K181-T183 PolarHBondContact O-N 3.16Å; K181-F184 PolarHBondContact O-N 2.87Å; K181-R185 PolarHBondContact O-N 2.61Å; K181-T206 HydrophobicContact CB-CG2 4.28Å; K181-T206 WeakPolarHBondContact O-CG2 3.37Å
182	D	96.2	Very high	97.1	Very high	126 Å²	126	32.1 Å²	32.1	67%	0.674	17%	0.168	S	C	*	.	H	α-helix	trans	-64.5	-27.8	-179.1	-73.5	-39.8	0	0	0	112.9	E180 F184 R185	E180-D182 VanDerWaalsContact C-N 3.29Å; E180-D182 PolarHBondContact O-N 2.91Å; D182-F184 VanDerWaalsContact C-N 3.34Å; D182-F184 PolarHBondContact O-N 2.93Å; D182-R185 IonicContact OD1-NH1 3.3Å; D182-R185 PolarHBondContact OD1-NH1 2.72Å
183	T	96.8	Very high	97.1	Very high	66 Å²	66	32.8 Å²	32.8	41%	0.405	17%	0.174	S	C	.	.	H	α-helix	trans	-65.3	-37	176.6	-64.4	0	0	0	0	112	E180 K181 F277	E180-T183 VanDerWaalsContact O-CB 3.25Å; E180-T183 WeakPolarHBondContact O-CB 3.41Å; E180-T183 PolarHBondContact O-N 2.81Å; E180-T183 PolarHBondContact OE2-OG1 3.02Å; K181-T183 PolarHBondContact O-N 3.16Å; T183-F277 HydrophobicContact CG2-CE1 4.09Å; T183-F277 HydrophobicContact CG2-CZ 3.89Å; T183-F277 WeakPolarHBondContact O-CE2 3.32Å; T183-F277 WeakPolarHBondContact O-CZ 3.28Å
184	F	97.3	Very high	97.1	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-96.2	-2.7	-175.4	-56.8	-69.3	0	0	0	113.5	F176 I177 E180 K181 D182 G186 A187 M203 T206 A207 F277 F311	F176-F184 HydrophobicContact CD1-CZ 4.41Å; F176-F184 HydrophobicContact CE1-CE2 4.32Å; F176-F184 AromaticContact CE1-CZ 3.88Å; F176-F184 HydrophobicContact CE1-CZ 3.88Å; I177-F184 HydrophobicContact CG1-CE2 4.37Å; I177-F184 HydrophobicContact CG2-CD2 4.36Å; E180-F184 HydrophobicContact CB-CD2 4.44Å; E180-F184 HydrophobicContact CB-CE2 3.89Å; E180-F184 VanDerWaalsContact O-CD2 3.24Å; E180-F184 WeakPolarHBondContact O-CD2 3.11Å; K181-F184 PolarHBondContact O-N 2.87Å; D182-F184 VanDerWaalsContact C-N 3.34Å; D182-F184 PolarHBondContact O-N 2.93Å; F184-G186 PolarHBondContact O-N 2.92Å; F184-A187 WeakPolarHBondContact O-CB 3.47Å; F184-A187 PolarHBondContact O-N 3.48Å; F184-A187 VanDerWaalsContact O-N 3.11Å; F184-M203 HydrophobicContact CB-CE 4.5Å; F184-M203 HydrophobicContact CB-SD 3.72Å; F184-M203 HydrophobicContact CD1-CE 3.68Å; F184-M203 HydrophobicContact CD1-SD 3.96Å; F184-M203 HydrophobicContact CD2-CE 4.19Å; F184-M203 HydrophobicContact CD2-SD 4.28Å; F184-M203 HydrophobicContact CE1-CE 3.84Å; F184-M203 HydrophobicContact CE2-CE 4.34Å; F184-M203 HydrophobicContact CG-CE 3.86Å; F184-M203 HydrophobicContact CG-SD 3.72Å; F184-M203 HydrophobicContact CZ-CE 4.17Å; F184-T206 HydrophobicContact CB-CG2 3.59Å; F184-A207 WeakPolarHBondContact O-CA 3.33Å; F184-F277 HydrophobicContact CD1-CB 4.5Å; F184-F277 HydrophobicContact CD1-CD1 4.07Å; F184-F277 AromaticContact CD1-CD2 3.85Å; F184-F277 HydrophobicContact CD1-CD2 3.85Å; F184-F277 HydrophobicContact CD1-CE1 4.23Å; F184-F277 HydrophobicContact CD1-CE2 4.02Å; F184-F277 AromaticContact CD1-CG 3.88Å; F184-F277 HydrophobicContact CD1-CG 3.88Å; F184-F277 HydrophobicContact CD1-CZ 4.21Å; F184-F277 HydrophobicContact CE1-CB 4.47Å; F184-F277 AromaticContact CE1-CD1 3.77Å; F184-F277 HydrophobicContact CE1-CD1 3.77Å; F184-F277 HydrophobicContact CE1-CD2 4.38Å; F184-F277 HydrophobicContact CE1-CE1 4.04Å; F184-F277 AromaticContact CE1-CG 3.95Å; F184-F277 HydrophobicContact CE1-CG 3.95Å; F184-F277 HydrophobicContact CE1-CZ 4.46Å; F184-F311 HydrophobicContact CE1-CD2 4.09Å; F184-F311 AromaticContact CE1-CE2 3.75Å; F184-F311 HydrophobicContact CE1-CE2 3.75Å; F184-F311 HydrophobicContact CZ-CD2 4.13Å; F184-F311 AromaticContact CZ-CE2 3.79Å; F184-F311 HydrophobicContact CZ-CE2 3.79Å; F184-F311 HydrophobicContact CZ-CZ 4.47Å
185	R	96.4	Very high	97.1	Very high	188 Å²	188	33.5 Å²	33.5	71%	0.709	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	120.6	-170.8	-167.1	176.8	-157.5	145.9	3.7	112.1	K181 D182 A187 T206	K181-R185 PolarHBondContact O-N 2.61Å; D182-R185 IonicContact OD1-NH1 3.3Å; D182-R185 PolarHBondContact OD1-NH1 2.72Å; R185-A187 PolarHBondContact O-N 3.43Å; R185-T206 WeakPolarHBondContact CA-O 3.5Å
186	G	94.3	Very high	97.1	Very high	47 Å²	47	33.7 Å²	33.7	49%	0.485	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	6.8	177.2	0	0	0	0	0	115.1	F184 T206 K208	F184-G186 PolarHBondContact O-N 2.92Å; G186-T206 PolarHBondContact N-O 3.28Å; G186-K208 WeakPolarHBondContact O-CB 3.47Å
187	A	97.3	Very high	97.1	Very high	7 Å²	7	33 Å²	33	6%	0.058	18%	0.179	C	C	.	.			trans	-77.6	161	179.9	0	0	0	0	0	112.6	F184 R185 V189 K208 T209 F277	F184-A187 WeakPolarHBondContact O-CB 3.47Å; F184-A187 PolarHBondContact O-N 3.48Å; F184-A187 VanDerWaalsContact O-N 3.11Å; R185-A187 PolarHBondContact O-N 3.43Å; A187-V189 HydrophobicContact CB-CG2 4.36Å; A187-K208 PolarHBondContact O-N 2.93Å; A187-T209 PolarHBondContact O-N 2.54Å; A187-F277 HydrophobicContact CB-CD2 3.69Å; A187-F277 HydrophobicContact CB-CE2 3.73Å
188	T	98.3	Very high	97.1	Very high	6 Å²	6	33 Å²	33	4%	0.037	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.2	161.2	-62.4	0	0	0	0	108.9	T209 Y211 N274 N276	T188-T209 CarbonylContact C-O 3.58Å; T188-T209 WeakPolarHBondContact CA-O 3.49Å; T188-T209 HydrophobicContact CG2-CG2 4.45Å; T188-Y211 HydrophobicContact CG2-CD2 4.09Å; T188-Y211 HydrophobicContact CG2-CE2 3.82Å; T188-N274 WeakPolarHBondContact CB-O 3.44Å; T188-N276 PolarHBondContact O-N 3.33Å
189	V	98.7	Very high	97.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	138.1	-174.1	-173.9	0	0	0	0	110.5	A187 M203 A207 T209 V210 Y211 F277 I279	A187-V189 HydrophobicContact CB-CG2 4.36Å; V189-M203 HydrophobicContact CB-CG 4.05Å; V189-M203 HydrophobicContact CG1-CE 4.12Å; V189-M203 HydrophobicContact CG1-CG 4.03Å; V189-M203 HydrophobicContact CG1-SD 4.48Å; V189-M203 HydrophobicContact CG2-CE 4.43Å; V189-M203 HydrophobicContact CG2-CG 3.91Å; V189-M203 HydrophobicContact CG2-SD 3.93Å; V189-A207 HydrophobicContact CG2-CB 3.81Å; V189-T209 PolarHBondContact N-O 3.37Å; V189-V210 HydrophobicContact CB-CG2 4.48Å; V189-V210 CarbonylContact O-C 3.54Å; V189-V210 WeakPolarHBondContact O-CA 3.34Å; V189-Y211 PolarHBondContact O-N 2.87Å; V189-F277 WeakPolarHBondContact CA-O 3.3Å; V189-F277 HydrophobicContact CG1-CB 4.1Å; V189-F277 HydrophobicContact CG2-CB 4.12Å; V189-F277 HydrophobicContact CG2-CD2 4.37Å; V189-I279 HydrophobicContact CG1-CD1 4.19Å; V189-I279 HydrophobicContact CG1-CG1 4.16Å; V189-I279 HydrophobicContact CG1-CG2 4.12Å
190	L	98.8	Very high	97.3	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.4	171.3	173.1	67.8	0	0	0	110	L192 T213 L246 W263 L271 T275 F277 I278 I279 L300	L190-L192 HydrophobicContact CD1-CD2 4.48Å; L190-L192 HydrophobicContact CD2-CD2 3.86Å; L190-L192 HydrophobicContact CD2-CG 4.33Å; L190-L192 HydrophobicContact CG-CD2 4.1Å; L190-L192 HydrophobicContact CG-CG 4.39Å; L190-T213 HydrophobicContact CD1-CG2 3.48Å; L190-T213 VanDerWaalsContact CD1-CG2 3.48Å; L190-L246 HydrophobicContact CD1-CD1 4.35Å; L190-W263 HydrophobicContact CD1-CH2 4.36Å; L190-L271 HydrophobicContact CB-CD1 4.12Å; L190-L271 HydrophobicContact CD1-CD1 3.96Å; L190-L271 HydrophobicContact CD2-CD1 4.15Å; L190-L271 HydrophobicContact CG-CD1 4.29Å; L190-T275 HydrophobicContact CB-CG2 3.92Å; L190-F277 PolarHBondContact N-O 2.69Å; L190-I278 HydrophobicContact CB-CG1 4.25Å; L190-I278 HydrophobicContact CD2-CD1 4.44Å; L190-I278 HydrophobicContact CD2-CG1 4.29Å; L190-I278 CarbonylContact O-C 3.57Å; L190-I278 VanDerWaalsContact O-CA 3.23Å; L190-I278 WeakPolarHBondContact O-CA 3.24Å; L190-I279 PolarHBondContact O-N 3.06Å; L190-L300 HydrophobicContact CD2-CD1 3.53Å
191	E	98.8	Very high	97.4	Very high	3 Å²	3	27.2 Å²	27.2	1%	0.014	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.1	168.5	-176.8	173.1	-163.1	0	0	109.9	A194 T199 S200 Y211 T213 I279	E191-A194 HydrophobicContact CB-CB 4.35Å; E191-A194 VanDerWaalsContact CD-CA 3.48Å; E191-A194 HydrophobicContact CG-CB 3.7Å; E191-A194 WeakPolarHBondContact OE1-CA 3.37Å; E191-A194 WeakPolarHBondContact OE2-CB 2.9Å; E191-T199 PolarHBondContact OE1-OG1 2.95Å; E191-T199 PolarHBondContact OE2-OG1 2.47Å; E191-S200 WeakPolarHBondContact OE2-CA 3.39Å; E191-S200 WeakPolarHBondContact OE2-CB 3.43Å; E191-S200 PolarHBondContact OE2-N 2.92Å; E191-S200 PolarHBondContact OE2-OG 3.31Å; E191-Y211 PolarHBondContact N-O 2.84Å; E191-T213 WeakPolarHBondContact O-CB 3.33Å; E191-T213 PolarHBondContact O-N 2.94Å; E191-T213 VanDerWaalsContact O-N 3.09Å; E191-T213 PolarHBondContact O-OG1 3.18Å; E191-I279 CarbonylContact C-O 3.49Å; E191-I279 WeakPolarHBondContact CA-O 3.36Å; E191-I279 HydrophobicContact CB-CD1 4.18Å; E191-I279 HydrophobicContact CB-CG1 3.74Å; E191-I279 HydrophobicContact CG-CD1 4.33Å; E191-I279 HydrophobicContact CG-CG1 3.92Å
192	L	98.7	Very high	97.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.6	174	-64.2	176.4	0	0	0	109.5	L190 L246 W248 I278 I279 A280 V283 L293 T296 L297	L190-L192 HydrophobicContact CD1-CD2 4.48Å; L190-L192 HydrophobicContact CD2-CD2 3.86Å; L190-L192 HydrophobicContact CD2-CG 4.33Å; L190-L192 HydrophobicContact CG-CD2 4.1Å; L190-L192 HydrophobicContact CG-CG 4.39Å; L192-L246 HydrophobicContact CD2-CD1 3.81Å; L192-L246 HydrophobicContact CD2-CD2 4.06Å; L192-W248 HydrophobicContact CB-CZ2 4.05Å; L192-I278 HydrophobicContact CD1-CG2 3.66Å; L192-I278 HydrophobicContact CG-CG2 3.88Å; L192-I279 PolarHBondContact N-O 3.47Å; L192-A280 HydrophobicContact CB-CB 4.37Å; L192-A280 WeakPolarHBondContact O-CB 3.41Å; L192-V283 WeakPolarHBondContact O-CG1 3.37Å; L192-L293 HydrophobicContact CB-CD1 4.17Å; L192-L293 HydrophobicContact CD1-CD1 3.71Å; L192-T296 HydrophobicContact CD2-CG2 4.39Å; L192-L297 HydrophobicContact CD1-CD2 3.62Å; L192-L297 HydrophobicContact CD1-CG 4.22Å
193	G	98	Very high	97.7	Very high	13 Å²	13	16.9 Å²	16.9	13%	0.134	10%	0.097	C	C	.	.	S	Bend	trans	71.8	52.5	178.4	0	0	0	0	0	111.1	G195 T213 D214	G193-G195 PolarHBondContact O-N 3.28Å; G193-T213 WeakPolarHBondContact CA-O 3.44Å; G193-T213 PolarHBondContact N-O 3.02Å; G193-D214 VanDerWaalsContact C-OD2 3.25Å; G193-D214 WeakPolarHBondContact CA-OD2 3.41Å
194	A	97.9	Very high	97.7	Very high	8 Å²	8	13.7 Å²	13.7	7%	0.066	8%	0.078	C	C	.	.			trans	-67.1	-21.4	-171.7	0	0	0	0	0	114.2	E191 T196 G197 C212 T213 D214	E191-A194 HydrophobicContact CB-CB 4.35Å; E191-A194 VanDerWaalsContact CD-CA 3.48Å; E191-A194 HydrophobicContact CG-CB 3.7Å; E191-A194 WeakPolarHBondContact OE1-CA 3.37Å; E191-A194 WeakPolarHBondContact OE2-CB 2.9Å; A194-T196 PolarHBondContact O-N 2.8Å; A194-G197 PolarHBondContact O-N 3.45Å; A194-C212 HydrophobicContact CB-CB 4.35Å; A194-C212 WeakPolarHBondContact CB-SG 3.43Å; A194-T213 PolarHBondContact N-O 3.15Å; A194-D214 PolarHBondContact N-OD2 3.37Å
195	G	97.1	Very high	97.6	Very high	8 Å²	8	15.1 Å²	15.1	8%	0.082	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	-111.8	-177	0	0	0	0	0	112	G163 G193 G197 D214 L219	G163-G195 CarbonylContact O-C 3.57Å; G163-G195 WeakPolarHBondContact O-CA 3.49Å; G193-G195 PolarHBondContact O-N 3.28Å; G195-G197 PolarHBondContact O-N 3.32Å; G195-D214 WeakPolarHBondContact CA-OD2 3.33Å; G195-D214 PolarHBondContact N-OD2 2.82Å; G195-L219 WeakPolarHBondContact O-CD1 3.33Å
196	T	96.9	Very high	97.5	Very high	4 Å²	4	7.3 Å²	7.3	3%	0.025	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-13.2	178.1	58.9	0	0	0	0	114.2	I151 H153 G163 Q165 V166 A194 L198 N226	I151-T196 HydrophobicContact CG2-CG2 4.21Å; H153-T196 HydrophobicContact CB-CG2 3.87Å; G163-T196 PolarHBondContact O-N 2.75Å; Q165-T196 WeakPolarHBondContact O-CG2 3.48Å; V166-T196 HydrophobicContact CG2-CG2 4.08Å; A194-T196 PolarHBondContact O-N 2.8Å; T196-L198 VanDerWaalsContact C-N 3.33Å; T196-N226 WeakPolarHBondContact O-CB 3.45Å; T196-N226 PolarHBondContact O-ND2 3.26Å
197	G	97.9	Very high	97.7	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	4%	0.038	C	C	.	.			trans	80.6	9.9	-177.3	0	0	0	0	0	114.4	A194 G195 T199 S200 I201	A194-G197 PolarHBondContact O-N 3.45Å; G195-G197 PolarHBondContact O-N 3.32Å; G197-T199 VanDerWaalsContact C-N 3.3Å; G197-T199 PolarHBondContact O-N 3.46Å; G197-S200 WeakPolarHBondContact O-CB 3.48Å; G197-S200 PolarHBondContact O-N 3.27Å; G197-I201 WeakPolarHBondContact O-CD1 3.31Å; G197-I201 VanDerWaalsContact O-CG1 3.3Å; G197-I201 WeakPolarHBondContact O-CG1 3.35Å; G197-I201 PolarHBondContact O-N 2.87Å
198	L	97.6	Very high	97.7	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-54	-45.3	-178.7	173.1	61.5	0	0	0	112.3	I149 I151 V166 A170 L171 T196 I201 I202	I149-L198 HydrophobicContact CD1-CD1 4.18Å; I149-L198 HydrophobicContact CG2-CD1 3.99Å; I151-L198 HydrophobicContact CD1-CB 4.26Å; I151-L198 HydrophobicContact CD1-CD1 4Å; I151-L198 HydrophobicContact CG1-CD1 3.94Å; V166-L198 HydrophobicContact CG1-CD2 3.85Å; A170-L198 HydrophobicContact CB-CD2 4.4Å; L171-L198 HydrophobicContact CD2-CD2 3.68Å; L171-L198 HydrophobicContact CG-CD2 4.49Å; T196-L198 VanDerWaalsContact C-N 3.33Å; L198-I201 PolarHBondContact O-N 3.48Å; L198-I202 HydrophobicContact CD1-CD1 3.97Å; L198-I202 HydrophobicContact CG-CD1 4.41Å; L198-I202 WeakPolarHBondContact O-CG1 3.16Å; L198-I202 PolarHBondContact O-N 2.62Å
199	T	98.1	Very high	97.7	Very high	1 Å²	1	11 Å²	11	1%	0.006	6%	0.061	C	C	.	.	H	α-helix	trans	-76.1	-34.9	-177.1	93.4	0	0	0	0	111.8	A170 L173 E191 G197 I201 I202 M203 I279 A281	A170-T199 HydrophobicContact CB-CG2 3.81Å; A170-T199 WeakPolarHBondContact O-CG2 3.34Å; L173-T199 HydrophobicContact CB-CG2 4.4Å; L173-T199 HydrophobicContact CD2-CG2 4.09Å; L173-T199 HydrophobicContact CG-CG2 4.45Å; E191-T199 PolarHBondContact OE1-OG1 2.95Å; E191-T199 PolarHBondContact OE2-OG1 2.47Å; G197-T199 VanDerWaalsContact C-N 3.3Å; G197-T199 PolarHBondContact O-N 3.46Å; T199-I201 PolarHBondContact O-N 2.81Å; T199-I202 PolarHBondContact O-N 3.17Å; T199-M203 VanDerWaalsContact O-CB 3.26Å; T199-M203 WeakPolarHBondContact O-CB 3.21Å; T199-M203 PolarHBondContact O-N 3.49Å; T199-I279 WeakPolarHBondContact OG1-CD1 3.49Å; T199-A281 HydrophobicContact CG2-CB 4.34Å
200	S	98.5	Very high	97.7	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-55.7	-46.3	168.2	-84.3	0	0	0	0	113.4	E191 G197 I202 M203 A204 V210 C212	E191-S200 WeakPolarHBondContact OE2-CA 3.39Å; E191-S200 WeakPolarHBondContact OE2-CB 3.43Å; E191-S200 PolarHBondContact OE2-N 2.92Å; E191-S200 PolarHBondContact OE2-OG 3.31Å; G197-S200 WeakPolarHBondContact O-CB 3.48Å; G197-S200 PolarHBondContact O-N 3.27Å; S200-I202 VanDerWaalsContact C-N 3.33Å; S200-I202 PolarHBondContact O-N 3.14Å; S200-M203 PolarHBondContact O-N 2.99Å; S200-A204 WeakPolarHBondContact O-CB 3.36Å; S200-A204 PolarHBondContact O-N 2.91Å; S200-V210 WeakPolarHBondContact OG-CG1 3.35Å; S200-C212 WeakPolarHBondContact OG-CA 3.3Å; S200-C212 WeakPolarHBondContact OG-CB 3.19Å
201	I	98.1	Very high	97.7	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-59.7	-46.7	179.5	-70.5	158.7	0	0	0	110.2	I149 I151 G197 L198 T199 A204 N226 I227 N230	I149-I201 HydrophobicContact CG2-CG2 4.34Å; I151-I201 HydrophobicContact CD1-CD1 3.63Å; G197-I201 WeakPolarHBondContact O-CD1 3.31Å; G197-I201 VanDerWaalsContact O-CG1 3.3Å; G197-I201 WeakPolarHBondContact O-CG1 3.35Å; G197-I201 PolarHBondContact O-N 2.87Å; L198-I201 PolarHBondContact O-N 3.48Å; T199-I201 PolarHBondContact O-N 2.81Å; I201-A204 PolarHBondContact O-N 2.81Å; I201-N226 HydrophobicContact CD1-CB 4Å; I201-I227 HydrophobicContact CG1-CG1 4.03Å; I201-N230 HydrophobicContact CD1-CB 4.47Å; I201-N230 HydrophobicContact CG2-CB 3.57Å
202	I	97.1	Very high	97.7	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-68	-43	179.8	-67.7	173.4	0	0	0	110.9	I149 A174 I177 L178 L198 T199 S200 A204 T205 L365	I149-I202 HydrophobicContact CD1-CD1 3.51Å; I149-I202 HydrophobicContact CD1-CG1 3.51Å; A174-I202 HydrophobicContact CB-CD1 3.28Å; I177-I202 HydrophobicContact CB-CG2 4.16Å; I177-I202 HydrophobicContact CG2-CG2 3.91Å; L178-I202 HydrophobicContact CD1-CG2 4.26Å; L178-I202 HydrophobicContact CD2-CG2 3.9Å; L178-I202 HydrophobicContact CG-CG2 3.73Å; L198-I202 HydrophobicContact CD1-CD1 3.97Å; L198-I202 HydrophobicContact CG-CD1 4.41Å; L198-I202 WeakPolarHBondContact O-CG1 3.16Å; L198-I202 PolarHBondContact O-N 2.62Å; T199-I202 PolarHBondContact O-N 3.17Å; S200-I202 VanDerWaalsContact C-N 3.33Å; S200-I202 PolarHBondContact O-N 3.14Å; I202-A204 VanDerWaalsContact C-N 3.28Å; I202-A204 PolarHBondContact O-N 3.19Å; I202-T205 WeakPolarHBondContact O-CB 3.18Å; I202-T205 PolarHBondContact O-N 2.81Å; I202-T205 PolarHBondContact O-OG1 2.8Å; I202-L365 HydrophobicContact CD1-CD1 4.28Å
203	M	98.2	Very high	97.7	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-57.9	-41.1	176.4	-175.8	58.1	79.8	0	0	111.7	I177 F184 V189 T199 S200 T205 T206 A207 V210 I279	I177-M203 HydrophobicContact CB-CE 4.5Å; I177-M203 HydrophobicContact CD1-CB 4.32Å; I177-M203 HydrophobicContact CD1-CE 3.7Å; I177-M203 HydrophobicContact CG1-CE 3.6Å; I177-M203 HydrophobicContact CG2-CE 4.09Å; I177-M203 HydrophobicContact CG2-SD 4.04Å; F184-M203 HydrophobicContact CB-CE 4.5Å; F184-M203 HydrophobicContact CB-SD 3.72Å; F184-M203 HydrophobicContact CD1-CE 3.68Å; F184-M203 HydrophobicContact CD1-SD 3.96Å; F184-M203 HydrophobicContact CD2-CE 4.19Å; F184-M203 HydrophobicContact CD2-SD 4.28Å; F184-M203 HydrophobicContact CE1-CE 3.84Å; F184-M203 HydrophobicContact CE2-CE 4.34Å; F184-M203 HydrophobicContact CG-CE 3.86Å; F184-M203 HydrophobicContact CG-SD 3.72Å; F184-M203 HydrophobicContact CZ-CE 4.17Å; V189-M203 HydrophobicContact CB-CG 4.05Å; V189-M203 HydrophobicContact CG1-CE 4.12Å; V189-M203 HydrophobicContact CG1-CG 4.03Å; V189-M203 HydrophobicContact CG1-SD 4.48Å; V189-M203 HydrophobicContact CG2-CE 4.43Å; V189-M203 HydrophobicContact CG2-CG 3.91Å; V189-M203 HydrophobicContact CG2-SD 3.93Å; T199-M203 VanDerWaalsContact O-CB 3.26Å; T199-M203 WeakPolarHBondContact O-CB 3.21Å; T199-M203 PolarHBondContact O-N 3.49Å; S200-M203 PolarHBondContact O-N 2.99Å; M203-T205 PolarHBondContact O-N 2.71Å; M203-T205 VanDerWaalsContact O-N 3.17Å; M203-T206 PolarHBondContact O-N 2.78Å; M203-A207 HydrophobicContact CG-CB 3.84Å; M203-A207 WeakPolarHBondContact O-CB 3.45Å; M203-A207 PolarHBondContact O-N 2.91Å; M203-A207 HydrophobicContact SD-CB 4.01Å; M203-V210 HydrophobicContact CB-CG2 4.02Å; M203-V210 HydrophobicContact CG-CG1 4.44Å; M203-V210 HydrophobicContact CG-CG2 3.66Å; M203-I279 HydrophobicContact CB-CD1 4.43Å; M203-I279 HydrophobicContact CE-CD1 3.96Å; M203-I279 HydrophobicContact CE-CG2 4.02Å
204	A	97.6	Very high	97.7	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-8.8	178.4	0	0	0	0	0	114.7	S200 I201 I202 T206 V210 T234 G239 V241	S200-A204 WeakPolarHBondContact O-CB 3.36Å; S200-A204 PolarHBondContact O-N 2.91Å; I201-A204 PolarHBondContact O-N 2.81Å; I202-A204 VanDerWaalsContact C-N 3.28Å; I202-A204 PolarHBondContact O-N 3.19Å; A204-T206 PolarHBondContact O-N 3.5Å; A204-V210 HydrophobicContact CB-CG2 4.01Å; A204-T234 HydrophobicContact CB-CG2 3.66Å; A204-G239 WeakPolarHBondContact O-CA 3.43Å; A204-V241 HydrophobicContact CB-CG2 3.29Å
205	T	95.4	Very high	97.5	Very high	31 Å²	31	13.9 Å²	13.9	19%	0.19	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-4.2	167.7	72.2	0	0	0	0	113	I202 M203 M233 A237	I202-T205 WeakPolarHBondContact O-CB 3.18Å; I202-T205 PolarHBondContact O-N 2.81Å; I202-T205 PolarHBondContact O-OG1 2.8Å; M203-T205 PolarHBondContact O-N 2.71Å; M203-T205 VanDerWaalsContact O-N 3.17Å; T205-M233 HydrophobicContact CG2-CB 4.11Å; T205-M233 HydrophobicContact CG2-CE 4.39Å; T205-A237 WeakPolarHBondContact O-CB 3.44Å
206	T	95.3	Very high	97.4	Very high	24 Å²	24	15.5 Å²	15.5	15%	0.147	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.3	-44.8	-174.3	-82.9	0	0	0	0	113.2	K181 F184 R185 G186 M203 A204	K181-T206 HydrophobicContact CB-CG2 4.28Å; K181-T206 WeakPolarHBondContact O-CG2 3.37Å; F184-T206 HydrophobicContact CB-CG2 3.59Å; R185-T206 WeakPolarHBondContact CA-O 3.5Å; G186-T206 PolarHBondContact N-O 3.28Å; M203-T206 PolarHBondContact O-N 2.78Å; A204-T206 PolarHBondContact O-N 3.5Å
207	A	97.5	Very high	97.2	Very high	3 Å²	3	19.6 Å²	19.6	3%	0.025	11%	0.111	C	C	.	.			trans	-71.8	155.8	177.3	0	0	0	0	0	111.2	F184 V189 M203 V210 G239	F184-A207 WeakPolarHBondContact O-CA 3.33Å; V189-A207 HydrophobicContact CG2-CB 3.81Å; M203-A207 HydrophobicContact CG-CB 3.84Å; M203-A207 WeakPolarHBondContact O-CB 3.45Å; M203-A207 PolarHBondContact O-N 2.91Å; M203-A207 HydrophobicContact SD-CB 4.01Å; A207-V210 HydrophobicContact CB-CG2 3.91Å; A207-G239 WeakPolarHBondContact O-CA 3.23Å
208	K	97.2	Very high	97	Very high	126 Å²	126	22.9 Å²	22.9	55%	0.548	13%	0.128	S	C	.	.	S	Bend	trans	-75.6	-48.1	175.4	178.1	-170.5	171	-161.9	0	110.8	G186 A187 G239 E240	G186-K208 WeakPolarHBondContact O-CB 3.47Å; A187-K208 PolarHBondContact O-N 2.93Å; K208-G239 WeakPolarHBondContact O-CA 3.38Å; K208-E240 PolarHBondContact O-N 3.32Å
209	T	98.1	Very high	96.9	Very high	7 Å²	7	23.6 Å²	23.6	4%	0.043	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	133	-176.2	-53.2	0	0	0	0	109.1	A187 T188 V189 Y211 E240	A187-T209 PolarHBondContact O-N 2.54Å; T188-T209 CarbonylContact C-O 3.58Å; T188-T209 WeakPolarHBondContact CA-O 3.49Å; T188-T209 HydrophobicContact CG2-CG2 4.45Å; V189-T209 PolarHBondContact N-O 3.37Å; T209-Y211 HydrophobicContact CG2-CD2 4.38Å; T209-Y211 HydrophobicContact CG2-CE2 3.94Å; T209-E240 CarbonylContact C-O 3.54Å; T209-E240 WeakPolarHBondContact CA-O 3.39Å
210	V	98.7	Very high	96.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.4	174.6	-172.4	0	0	0	0	109.6	V189 S200 M203 A204 A207 C212 E240 V241 K242	V189-V210 HydrophobicContact CB-CG2 4.48Å; V189-V210 CarbonylContact O-C 3.54Å; V189-V210 WeakPolarHBondContact O-CA 3.34Å; S200-V210 WeakPolarHBondContact OG-CG1 3.35Å; M203-V210 HydrophobicContact CB-CG2 4.02Å; M203-V210 HydrophobicContact CG-CG1 4.44Å; M203-V210 HydrophobicContact CG-CG2 3.66Å; A204-V210 HydrophobicContact CB-CG2 4.01Å; A207-V210 HydrophobicContact CB-CG2 3.91Å; V210-C212 PolarHBondContact O-N 3.39Å; V210-E240 PolarHBondContact N-O 2.99Å; V210-V241 HydrophobicContact CB-CG1 4.42Å; V210-V241 HydrophobicContact CB-CG2 4.34Å; V210-V241 CarbonylContact O-C 3.45Å; V210-V241 WeakPolarHBondContact O-CA 3.41Å; V210-K242 PolarHBondContact O-N 2.85Å
211	Y	98.7	Very high	96.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	100	169.1	-69.5	-79	0	0	0	109.1	T188 V189 E191 T209 T213 K242 K244 W263 E267 D270 L271	T188-Y211 HydrophobicContact CG2-CD2 4.09Å; T188-Y211 HydrophobicContact CG2-CE2 3.82Å; V189-Y211 PolarHBondContact O-N 2.87Å; E191-Y211 PolarHBondContact N-O 2.84Å; T209-Y211 HydrophobicContact CG2-CD2 4.38Å; T209-Y211 HydrophobicContact CG2-CE2 3.94Å; Y211-T213 PolarHBondContact O-N 3.45Å; Y211-K242 CarbonylContact C-O 3.56Å; Y211-K242 WeakPolarHBondContact CA-O 3.48Å; Y211-K242 HydrophobicContact CD1-CB 3.92Å; Y211-K242 HydrophobicContact CD1-CD 4.39Å; Y211-K242 HydrophobicContact CE1-CB 4.11Å; Y211-K242 HydrophobicContact CE1-CD 3.74Å; Y211-K244 HydrophobicContact CD1-CG 4.24Å; Y211-W263 HydrophobicContact CD1-CE3 4.41Å; Y211-W263 AromaticContact CD1-CH2 3.62Å; Y211-W263 HydrophobicContact CD1-CH2 3.62Å; Y211-W263 AromaticContact CD1-CZ3 3.4Å; Y211-W263 HydrophobicContact CD1-CZ3 3.4Å; Y211-W263 VanDerWaalsContact CD1-CZ3 3.4Å; Y211-W263 HydrophobicContact CE1-CE3 4.3Å; Y211-W263 HydrophobicContact CE1-CH2 4.24Å; Y211-W263 AromaticContact CE1-CZ3 3.55Å; Y211-W263 HydrophobicContact CE1-CZ3 3.55Å; Y211-W263 AromaticContact CG-CH2 3.91Å; Y211-W263 HydrophobicContact CG-CH2 3.91Å; Y211-W263 AromaticContact CG-CZ3 3.99Å; Y211-W263 HydrophobicContact CG-CZ3 3.99Å; Y211-E267 HydrophobicContact CE1-CB 4.13Å; Y211-E267 HydrophobicContact CE1-CG 4.34Å; Y211-E267 PolarHBondContact OH-O 2.7Å; Y211-D270 PolarHBondContact OH-OD2 3.28Å; Y211-D270 VanDerWaalsContact OH-OD2 3.08Å; Y211-L271 HydrophobicContact CD2-CD1 3.81Å; Y211-L271 HydrophobicContact CE2-CB 4.5Å; Y211-L271 HydrophobicContact CE2-CD1 4.23Å; Y211-L271 HydrophobicContact CG-CD1 4.24Å
212	C	98.6	Very high	96.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	110.4	170.1	170.5	0	0	0	0	107.5	A194 S200 V210 C223 I227 V241 K242 V243 K244	A194-C212 HydrophobicContact CB-CB 4.35Å; A194-C212 WeakPolarHBondContact CB-SG 3.43Å; S200-C212 WeakPolarHBondContact OG-CA 3.3Å; S200-C212 WeakPolarHBondContact OG-CB 3.19Å; V210-C212 PolarHBondContact O-N 3.39Å; C212-C223 WeakPolarHBondContact CB-SG 3.47Å; C212-C223 WeakPolarHBondContact SG-CB 3.47Å; C212-C223 CovalentContact SG-SG 2.11Å; C212-C223 PolarHBondContact SG-SG 3.49Å; C212-I227 HydrophobicContact CB-CD1 4.31Å; C212-V241 HydrophobicContact CB-CG1 3.91Å; C212-K242 PolarHBondContact N-O 2.89Å; C212-V243 HydrophobicContact CB-CG2 4.21Å; C212-V243 WeakPolarHBondContact O-CA 3.29Å; C212-K244 PolarHBondContact O-N 3.39Å
213	T	98.7	Very high	96.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137.6	-178.1	78.1	0	0	0	0	114.7	L190 E191 G193 A194 Y211 K244 L246 W263	L190-T213 HydrophobicContact CD1-CG2 3.48Å; L190-T213 VanDerWaalsContact CD1-CG2 3.48Å; E191-T213 WeakPolarHBondContact O-CB 3.33Å; E191-T213 PolarHBondContact O-N 2.94Å; E191-T213 VanDerWaalsContact O-N 3.09Å; E191-T213 PolarHBondContact O-OG1 3.18Å; G193-T213 WeakPolarHBondContact CA-O 3.44Å; G193-T213 PolarHBondContact N-O 3.02Å; A194-T213 PolarHBondContact N-O 3.15Å; Y211-T213 PolarHBondContact O-N 3.45Å; T213-K244 VanDerWaalsContact CA-O 3.24Å; T213-K244 WeakPolarHBondContact CA-O 3.48Å; T213-K244 WeakPolarHBondContact CB-O 3.36Å; T213-K244 HydrophobicContact CG2-CB 4.32Å; T213-L246 HydrophobicContact CG2-CB 4.15Å; T213-L246 HydrophobicContact CG2-CD1 4.32Å; T213-W263 HydrophobicContact CG2-CH2 4.07Å; T213-W263 HydrophobicContact CG2-CZ2 3.69Å
214	D	97.9	Very high	96.7	Very high	24 Å²	24	33.3 Å²	33.3	13%	0.128	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	-170.6	175.1	-142.3	-56.4	0	0	0	110.7	G193 A194 G195 L219 L220 K244 Q245 L246	G193-D214 VanDerWaalsContact C-OD2 3.25Å; G193-D214 WeakPolarHBondContact CA-OD2 3.41Å; A194-D214 PolarHBondContact N-OD2 3.37Å; G195-D214 WeakPolarHBondContact CA-OD2 3.33Å; G195-D214 PolarHBondContact N-OD2 2.82Å; D214-L219 HydrophobicContact CB-CD2 4.14Å; D214-L219 VanDerWaalsContact CG-CD2 3.45Å; D214-L219 WeakPolarHBondContact OD1-CD2 3.39Å; D214-L220 HydrophobicContact CB-CD2 3.98Å; D214-K244 PolarHBondContact N-O 2.98Å; D214-Q245 WeakPolarHBondContact O-CA 3.45Å; D214-L246 PolarHBondContact O-N 3.09Å
215	V	95.3	Very high	96.6	Very high	61 Å²	61	36.6 Å²	36.6	37%	0.37	19%	0.186	S	C	.	.	S	Bend	trans	-121	151.7	174	-61.3	0	0	0	0	111.5	L246 N247	V215-L246 WeakPolarHBondContact CG1-O 3.36Å; V215-N247 VanDerWaalsContact CG1-CA 3.48Å; V215-N247 HydrophobicContact CG1-CB 3.63Å
216	G	93.8	Very high	96.7	Very high	42 Å²	42	35.1 Å²	35.1	43%	0.433	18%	0.177	S	C	.	.			trans	91.8	116.8	-179.9	0	0	0	0	0	111.9	D218 L219 L220	G216-D218 VanDerWaalsContact C-N 3.27Å; G216-D218 PolarHBondContact O-N 3.5Å; G216-L219 PolarHBondContact O-N 3.02Å; G216-L220 WeakPolarHBondContact O-CG 3.43Å; G216-L220 PolarHBondContact O-N 3.08Å
217	E	93.3	Very high	96.8	Very high	91 Å²	91	34.8 Å²	34.8	43%	0.425	17%	0.174	S	C	.	.	H	α-helix	trans	-58.2	-38.7	-174.9	-162.2	-173.3	-155.2	0	0	112.5	L219 L220 R221 F261	E217-L219 PolarHBondContact O-N 3.15Å; E217-L220 PolarHBondContact O-N 2.8Å; E217-R221 WeakPolarHBondContact O-CB 3.46Å; E217-R221 WeakPolarHBondContact O-CG 3.12Å; E217-R221 PolarHBondContact O-N 2.95Å; E217-R221 IonicContact OE1-CZ 3.24Å; E217-R221 IonicContact OE1-NH1 2.8Å; E217-R221 IonicContact OE1-NH2 2.64Å; E217-R221 PolarHBondContact OE1-NH2 3.15Å; E217-R221 IonicContact OE2-CZ 3.47Å; E217-R221 IonicContact OE2-NH1 2.92Å; E217-R221 PolarHBondContact OE2-NH1 3.12Å; E217-R221 IonicContact OE2-NH2 2.67Å; E217-R221 PolarHBondContact OE2-NH2 2.9Å; E217-F261 HydrophobicContact CG-CD2 4.23Å; E217-F261 HydrophobicContact CG-CE2 3.98Å
218	D	93.8	Very high	96.8	Very high	68 Å²	68	40.5 Å²	40.5	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-66.2	-35.6	177.3	-72.4	-25.6	0	0	0	113.2	S31 G216 R221 L222	S31-D218 PolarHBondContact OG-OD1 3.4Å; S31-D218 PolarHBondContact OG-OD2 3.46Å; G216-D218 VanDerWaalsContact C-N 3.27Å; G216-D218 PolarHBondContact O-N 3.5Å; D218-R221 IonicContact OD1-NH1 3.59Å; D218-L222 PolarHBondContact O-N 2.59Å; D218-L222 VanDerWaalsContact O-N 3.14Å
219	L	95.6	Very high	96.7	Very high	16 Å²	16	36.2 Å²	36.2	8%	0.084	18%	0.181	C	C	.	.	H	α-helix	trans	-73.5	-40.8	175.9	179.3	58.1	0	0	0	110.8	G163 K164 G195 D214 G216 E217 R221 L222 C223	G163-L219 WeakPolarHBondContact O-CD1 3.44Å; K164-L219 HydrophobicContact CG-CD1 3.93Å; G195-L219 WeakPolarHBondContact O-CD1 3.33Å; D214-L219 HydrophobicContact CB-CD2 4.14Å; D214-L219 VanDerWaalsContact CG-CD2 3.45Å; D214-L219 WeakPolarHBondContact OD1-CD2 3.39Å; G216-L219 PolarHBondContact O-N 3.02Å; E217-L219 PolarHBondContact O-N 3.15Å; L219-R221 PolarHBondContact O-N 3.34Å; L219-L222 HydrophobicContact CD1-CD2 4.29Å; L219-L222 CarbonylContact O-C 3.53Å; L219-L222 WeakPolarHBondContact O-CA 3.31Å; L219-L222 VanDerWaalsContact O-CB 3.3Å; L219-L222 WeakPolarHBondContact O-CB 3.38Å; L219-L222 PolarHBondContact O-N 3.17Å; L219-C223 PolarHBondContact O-N 3.17Å
220	L	97.3	Very high	96.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.8	-40.3	175.9	-66.1	169.5	0	0	0	111.6	D214 G216 E217 L222 C223 H224 V243 Q245 F261	D214-L220 HydrophobicContact CB-CD2 3.98Å; G216-L220 WeakPolarHBondContact O-CG 3.43Å; G216-L220 PolarHBondContact O-N 3.08Å; E217-L220 PolarHBondContact O-N 2.8Å; L220-L222 VanDerWaalsContact C-N 3.28Å; L220-L222 PolarHBondContact O-N 2.73Å; L220-C223 PolarHBondContact O-N 3.39Å; L220-H224 WeakPolarHBondContact O-CB 3.32Å; L220-H224 PolarHBondContact O-N 3.04Å; L220-V243 HydrophobicContact CB-CG1 4Å; L220-V243 HydrophobicContact CD2-CG1 3.71Å; L220-V243 HydrophobicContact CG-CG1 4.46Å; L220-Q245 HydrophobicContact CD1-CB 3.86Å; L220-Q245 HydrophobicContact CD1-CG 4.33Å; L220-F261 HydrophobicContact CB-CD1 4.03Å; L220-F261 HydrophobicContact CB-CD2 3.59Å; L220-F261 HydrophobicContact CB-CE1 4.12Å; L220-F261 HydrophobicContact CB-CE2 3.7Å; L220-F261 HydrophobicContact CB-CG 3.77Å; L220-F261 HydrophobicContact CB-CZ 3.96Å; L220-F261 HydrophobicContact CD1-CB 3.74Å; L220-F261 HydrophobicContact CD1-CD2 3.82Å; L220-F261 HydrophobicContact CD1-CG 3.85Å; L220-F261 HydrophobicContact CG-CD2 4.35Å; L220-F261 HydrophobicContact CG-CG 4.37Å
221	R	96.9	Very high	96.3	Very high	94 Å²	94	39.6 Å²	39.6	36%	0.355	20%	0.196	S	C	.	.	H	α-helix	trans	-61	-36.1	170.1	-74.7	177	-178.9	128.6	5.3	112.5	E217 D218 L219 R225 E260 F261	E217-R221 WeakPolarHBondContact O-CB 3.46Å; E217-R221 WeakPolarHBondContact O-CG 3.12Å; E217-R221 PolarHBondContact O-N 2.95Å; E217-R221 IonicContact OE1-CZ 3.24Å; E217-R221 IonicContact OE1-NH1 2.8Å; E217-R221 IonicContact OE1-NH2 2.64Å; E217-R221 PolarHBondContact OE1-NH2 3.15Å; E217-R221 IonicContact OE2-CZ 3.47Å; E217-R221 IonicContact OE2-NH1 2.92Å; E217-R221 PolarHBondContact OE2-NH1 3.12Å; E217-R221 IonicContact OE2-NH2 2.67Å; E217-R221 PolarHBondContact OE2-NH2 2.9Å; D218-R221 IonicContact OD1-NH1 3.59Å; L219-R221 PolarHBondContact O-N 3.34Å; R221-R225 WeakPolarHBondContact O-CB 3.23Å; R221-R225 PolarHBondContact O-N 3.41Å; R221-E260 IonicContact CZ-OE2 2.66Å; R221-E260 IonicContact NE-OE2 3.47Å; R221-E260 PolarHBondContact NE-OE2 3.15Å; R221-E260 VanDerWaalsContact NE-OE2 3.13Å; R221-E260 IonicContact NH2-OE2 2.9Å; R221-E260 PolarHBondContact NH2-OE2 3.35Å; R221-F261 HydrophobicContact CB-CZ 4.41Å; R221-F261 HydrophobicContact CG-CE2 3.8Å; R221-F261 HydrophobicContact CG-CZ 3.63Å
222	L	96.1	Very high	96	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-66.1	-48.1	173.3	-176.6	67.4	0	0	0	111.5	E152 K164 D218 L219 L220 H224 R225 N226	E152-L222 HydrophobicContact CB-CD1 3.95Å; K164-L222 HydrophobicContact CB-CD2 4.14Å; K164-L222 HydrophobicContact CG-CD2 4.19Å; D218-L222 PolarHBondContact O-N 2.59Å; D218-L222 VanDerWaalsContact O-N 3.14Å; L219-L222 HydrophobicContact CD1-CD2 4.29Å; L219-L222 CarbonylContact O-C 3.53Å; L219-L222 WeakPolarHBondContact O-CA 3.31Å; L219-L222 VanDerWaalsContact O-CB 3.3Å; L219-L222 WeakPolarHBondContact O-CB 3.38Å; L219-L222 PolarHBondContact O-N 3.17Å; L220-L222 VanDerWaalsContact C-N 3.28Å; L220-L222 PolarHBondContact O-N 2.73Å; L222-H224 VanDerWaalsContact C-N 3.32Å; L222-H224 PolarHBondContact O-N 2.89Å; L222-R225 PolarHBondContact O-N 3.35Å; L222-N226 PolarHBondContact O-N 2.99Å
223	C	96.9	Very high	95.6	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-55.4	-49.7	174.1	-179.7	0	0	0	0	109.6	C212 L219 L220 R225 N226 I227 V243	C212-C223 WeakPolarHBondContact CB-SG 3.47Å; C212-C223 WeakPolarHBondContact SG-CB 3.47Å; C212-C223 CovalentContact SG-SG 2.11Å; C212-C223 PolarHBondContact SG-SG 3.49Å; L219-C223 PolarHBondContact O-N 3.17Å; L220-C223 PolarHBondContact O-N 3.39Å; C223-R225 VanDerWaalsContact C-N 3.34Å; C223-R225 PolarHBondContact O-N 2.94Å; C223-N226 PolarHBondContact O-N 3.11Å; C223-N226 VanDerWaalsContact O-N 3.15Å; C223-I227 WeakPolarHBondContact O-CD1 3.24Å; C223-I227 WeakPolarHBondContact O-CG1 3.48Å; C223-I227 PolarHBondContact O-N 2.85Å; C223-I227 WeakPolarHBondContact SG-CD1 3.37Å; C223-V243 HydrophobicContact CB-CG1 4.29Å; C223-V243 HydrophobicContact CB-CG2 4.39Å
224	H	97.4	Very high	95.2	Very high	104 Å²	104	43.1 Å²	43.1	48%	0.481	21%	0.214	S	C	.	.	H	α-helix	trans	-58.5	-43.3	-179.8	-173.7	-85.1	0	0	0	112.6	L220 L222 I227 F228 V243 F261	L220-H224 WeakPolarHBondContact O-CB 3.32Å; L220-H224 PolarHBondContact O-N 3.04Å; L222-H224 VanDerWaalsContact C-N 3.32Å; L222-H224 PolarHBondContact O-N 2.89Å; H224-I227 PolarHBondContact O-N 3.34Å; H224-F228 PolarHBondContact O-N 3.26Å; H224-V243 HydrophobicContact CB-CG2 4.02Å; H224-F261 HydrophobicContact CB-CE1 4.36Å
225	R	96.6	Very high	94.7	Very high	69 Å²	69	47 Å²	47	26%	0.26	23%	0.234	S	C	.	.	H	α-helix	trans	-66.3	-40.2	177.1	-168.5	159.4	61.9	122.1	18.8	112	E152 R221 L222 C223 I227 F228 L229	E152-R225 IonicContact OE1-CZ 3.89Å; E152-R225 IonicContact OE1-NE 3.38Å; E152-R225 IonicContact OE1-NH1 2.74Å; E152-R225 PolarHBondContact OE1-NH1 3.01Å; E152-R225 IonicContact OE1-NH2 3.53Å; E152-R225 PolarHBondContact OE1-NH2 3.34Å; E152-R225 WeakPolarHBondContact OE2-CD 3.26Å; E152-R225 WeakPolarHBondContact OE2-CG 3.48Å; E152-R225 IonicContact OE2-CZ 3.42Å; E152-R225 IonicContact OE2-NE 2.95Å; E152-R225 PolarHBondContact OE2-NE 2.81Å; E152-R225 IonicContact OE2-NH1 2.82Å; E152-R225 PolarHBondContact OE2-NH1 3.06Å; E152-R225 IonicContact OE2-NH2 3.56Å; E152-R225 PolarHBondContact OE2-NH2 3.35Å; R221-R225 WeakPolarHBondContact O-CB 3.23Å; R221-R225 PolarHBondContact O-N 3.41Å; L222-R225 PolarHBondContact O-N 3.35Å; C223-R225 VanDerWaalsContact C-N 3.34Å; C223-R225 PolarHBondContact O-N 2.94Å; R225-I227 VanDerWaalsContact C-N 3.35Å; R225-F228 PolarHBondContact O-N 2.89Å; R225-L229 VanDerWaalsContact O-CG 3.29Å; R225-L229 WeakPolarHBondContact O-CG 3.42Å; R225-L229 PolarHBondContact O-N 2.99Å
226	N	97.6	Very high	94.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.7	-40.1	174.9	-73.6	-22.7	0	0	0	111.9	I151 E152 T196 I201 L222 C223 L229 N230	I151-N226 HydrophobicContact CD1-CB 4.32Å; E152-N226 WeakPolarHBondContact CA-OD1 3.28Å; E152-N226 WeakPolarHBondContact CB-OD1 3.41Å; E152-N226 PolarHBondContact N-OD1 3.17Å; E152-N226 PolarHBondContact O-ND2 2.87Å; T196-N226 WeakPolarHBondContact O-CB 3.45Å; T196-N226 PolarHBondContact O-ND2 3.26Å; I201-N226 HydrophobicContact CD1-CB 4Å; L222-N226 PolarHBondContact O-N 2.99Å; C223-N226 PolarHBondContact O-N 3.11Å; C223-N226 VanDerWaalsContact O-N 3.15Å; N226-L229 PolarHBondContact O-N 3.32Å; N226-N230 PolarHBondContact O-N 3.37Å; N226-N230 PolarHBondContact O-ND2 2.8Å
227	I	97.1	Very high	94.1	Very high	16 Å²	16	49.8 Å²	49.8	8%	0.082	25%	0.251	C	S	.	.	H	α-helix	trans	-60.4	-47.8	174	-69.1	155.7	0	0	0	110.5	I201 C212 C223 H224 R225 L229 N230 Q231 V241 V243	I201-I227 HydrophobicContact CG1-CG1 4.03Å; C212-I227 HydrophobicContact CB-CD1 4.31Å; C223-I227 WeakPolarHBondContact O-CD1 3.24Å; C223-I227 WeakPolarHBondContact O-CG1 3.48Å; C223-I227 PolarHBondContact O-N 2.85Å; C223-I227 WeakPolarHBondContact SG-CD1 3.37Å; H224-I227 PolarHBondContact O-N 3.34Å; R225-I227 VanDerWaalsContact C-N 3.35Å; I227-L229 VanDerWaalsContact C-N 3.3Å; I227-L229 PolarHBondContact O-N 2.89Å; I227-N230 PolarHBondContact O-N 2.93Å; I227-Q231 PolarHBondContact O-N 2.91Å; I227-V241 HydrophobicContact CD1-CB 3.96Å; I227-V241 HydrophobicContact CD1-CG1 3.32Å; I227-V241 HydrophobicContact CG1-CB 4.19Å; I227-V241 HydrophobicContact CG1-CG1 3.88Å; I227-V241 HydrophobicContact CG2-CB 3.91Å; I227-V241 HydrophobicContact CG2-CG1 4.5Å; I227-V241 HydrophobicContact CG2-CG2 4.32Å; I227-V243 HydrophobicContact CD1-CG2 3.22Å
228	F	96.4	Very high	94	Very high	123 Å²	123	48.3 Å²	48.3	54%	0.539	26%	0.259	S	S	.	.	H	α-helix	trans	-58	-41	177.8	-179	-98.2	0	0	0	112.5	H224 R225 N230 Q231	H224-F228 PolarHBondContact O-N 3.26Å; R225-F228 PolarHBondContact O-N 2.89Å; F228-N230 PolarHBondContact O-N 2.91Å; F228-N230 VanDerWaalsContact O-N 3.15Å; F228-Q231 WeakPolarHBondContact O-CG 3.33Å; F228-Q231 PolarHBondContact O-N 3.41Å
229	L	95.2	Very high	94.1	Very high	36 Å²	36	45.5 Å²	45.5	19%	0.188	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-14.1	177.2	-71.3	175.5	0	0	0	114.3	E152 R225 N226 I227	E152-L229 HydrophobicContact CG-CD1 3.99Å; R225-L229 VanDerWaalsContact O-CG 3.29Å; R225-L229 WeakPolarHBondContact O-CG 3.42Å; R225-L229 PolarHBondContact O-N 2.99Å; N226-L229 PolarHBondContact O-N 3.32Å; I227-L229 VanDerWaalsContact C-N 3.3Å; I227-L229 PolarHBondContact O-N 2.89Å
230	N	96.2	Very high	94.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	18.3	-175.6	-63.2	-79.5	0	0	0	113.8	I149 Q150 I201 N226 I227 F228 H232 M233 T234	I149-N230 VanDerWaalsContact CA-OD1 3.24Å; I149-N230 WeakPolarHBondContact CA-OD1 3.48Å; I149-N230 WeakPolarHBondContact CG2-OD1 3.46Å; Q150-N230 PolarHBondContact N-OD1 3.44Å; Q150-N230 PolarHBondContact O-ND2 3.42Å; I201-N230 HydrophobicContact CD1-CB 4.47Å; I201-N230 HydrophobicContact CG2-CB 3.57Å; N226-N230 PolarHBondContact O-N 3.37Å; N226-N230 PolarHBondContact O-ND2 2.8Å; I227-N230 PolarHBondContact O-N 2.93Å; F228-N230 PolarHBondContact O-N 2.91Å; F228-N230 VanDerWaalsContact O-N 3.15Å; N230-H232 PolarHBondContact O-N 3.45Å; N230-M233 PolarHBondContact O-N 3.21Å; N230-T234 PolarHBondContact O-N 2.85Å
231	Q	93.6	Very high	94.2	Very high	78 Å²	78	50.7 Å²	50.7	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-56.9	-30.1	177.7	-77	179.9	-26.2	0	0	113.3	I227 F228 M233 T234 D235	I227-Q231 PolarHBondContact O-N 2.91Å; F228-Q231 WeakPolarHBondContact O-CG 3.33Å; F228-Q231 PolarHBondContact O-N 3.41Å; Q231-M233 PolarHBondContact O-N 3.39Å; Q231-T234 WeakPolarHBondContact CA-OG1 3.38Å; Q231-T234 PolarHBondContact O-N 3.2Å; Q231-T234 PolarHBondContact O-OG1 3.32Å; Q231-D235 VanDerWaalsContact O-CB 3.28Å; Q231-D235 WeakPolarHBondContact O-CB 3.06Å; Q231-D235 PolarHBondContact O-N 2.72Å
232	H	92.4	Very high	94.2	Very high	48 Å²	48	48.3 Å²	48.3	22%	0.222	26%	0.264	C	S	.	.	H	α-helix	trans	-59	-20.6	175.3	65.1	-77.4	0	0	0	113.9	C144 I148 N230 P236	C144-H232 VanDerWaalsContact SG-CB 3.54Å; C144-H232 PolarHBondContact SG-CD2 3.07Å; C144-H232 PolarHBondContact SG-ND1 3.36Å; I148-H232 PolarHBondContact O-CE1 2.78Å; I148-H232 PolarHBondContact O-NE2 2.64Å; N230-H232 PolarHBondContact O-N 3.45Å; H232-P236 WeakPolarHBondContact O-CD 3.48Å; H232-P236 WeakPolarHBondContact O-CG 3.49Å
233	M	90.1	Very high	94.3	Very high	20 Å²	20	48.4 Å²	48.4	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-96.8	-38.4	177.9	-55.7	-178	65.5	0	0	112.5	I43 I149 T205 N230 Q231	I43-M233 HydrophobicContact CD1-CE 3.47Å; I43-M233 VanDerWaalsContact CD1-CE 3.47Å; I149-M233 HydrophobicContact CB-SD 4.46Å; I149-M233 HydrophobicContact CG1-CE 3.82Å; I149-M233 HydrophobicContact CG1-SD 3.66Å; T205-M233 HydrophobicContact CG2-CB 4.11Å; T205-M233 HydrophobicContact CG2-CE 4.39Å; N230-M233 PolarHBondContact O-N 3.21Å; Q231-M233 PolarHBondContact O-N 3.39Å
234	T	89.3	Confident	94.4	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.043	27%	0.27	C	S	.	.	H	α-helix	trans	-82	-38.5	-175.8	55.8	0	0	0	0	112.4	A204 N230 Q231 A237 G238 G239	A204-T234 HydrophobicContact CB-CG2 3.66Å; N230-T234 PolarHBondContact O-N 2.85Å; Q231-T234 WeakPolarHBondContact CA-OG1 3.38Å; Q231-T234 PolarHBondContact O-N 3.2Å; Q231-T234 PolarHBondContact O-OG1 3.32Å; T234-A237 PolarHBondContact O-N 3.12Å; T234-A237 VanDerWaalsContact O-N 3.13Å; T234-G238 PolarHBondContact O-N 3.47Å; T234-G239 PolarHBondContact O-N 3.26Å
235	D	88.8	Confident	94.4	Very high	104 Å²	104	46.7 Å²	46.7	56%	0.556	26%	0.257	S	S	*	.	H	α-helix	trans	-62.4	-44	-175.9	-64.6	-6.1	0	0	0	112.8	Q231 A237 G238	Q231-D235 VanDerWaalsContact O-CB 3.28Å; Q231-D235 WeakPolarHBondContact O-CB 3.06Å; Q231-D235 PolarHBondContact O-N 2.72Å; D235-A237 VanDerWaalsContact C-N 3.26Å; D235-A237 PolarHBondContact O-N 2.8Å; D235-G238 PolarHBondContact O-N 2.9Å; D235-G238 VanDerWaalsContact O-N 3.16Å
236	P	88.8	Confident	94.5	Very high	109 Å²	109	43.6 Å²	43.6	71%	0.708	25%	0.246	S	C	*	.	H	α-helix	trans	-66.5	-27.4	176.4	-20.8	34.6	0	0	0	113.5	H232 G238	H232-P236 WeakPolarHBondContact O-CD 3.48Å; H232-P236 WeakPolarHBondContact O-CG 3.49Å; P236-G238 VanDerWaalsContact C-N 3.34Å
237	A	87.3	Confident	94.4	Very high	54 Å²	54	45.7 Å²	45.7	45%	0.446	26%	0.257	S	S	.	.	H	α-helix	trans	-79.8	-19.9	176	0	0	0	0	0	112.4	T205 T234 D235 G239	T205-A237 WeakPolarHBondContact O-CB 3.44Å; T234-A237 PolarHBondContact O-N 3.12Å; T234-A237 VanDerWaalsContact O-N 3.13Å; D235-A237 VanDerWaalsContact C-N 3.26Å; D235-A237 PolarHBondContact O-N 2.8Å; A237-G239 VanDerWaalsContact C-N 3.29Å
238	G	91.1	Very high	94.4	Very high	59 Å²	59	46.3 Å²	46.3	61%	0.608	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	18.3	-176.2	0	0	0	0	0	113.9	T234 D235 P236	T234-G238 PolarHBondContact O-N 3.47Å; D235-G238 PolarHBondContact O-N 2.9Å; D235-G238 VanDerWaalsContact O-N 3.16Å; P236-G238 VanDerWaalsContact C-N 3.34Å
239	G	94.8	Very high	94.3	Very high	9 Å²	9	44.8 Å²	44.8	9%	0.093	26%	0.255	C	S	.	.			trans	-85.6	134.7	177.6	0	0	0	0	0	112	A204 A207 K208 T234 A237	A204-G239 WeakPolarHBondContact O-CA 3.43Å; A207-G239 WeakPolarHBondContact O-CA 3.23Å; K208-G239 WeakPolarHBondContact O-CA 3.38Å; T234-G239 PolarHBondContact O-N 3.26Å; A237-G239 VanDerWaalsContact C-N 3.29Å
240	E	96.8	Very high	94.2	Very high	101 Å²	101	47.3 Å²	47.3	47%	0.472	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131.8	177.8	-173.2	-177	-168.2	0	0	110.4	K208 T209 V210 K242	K208-E240 PolarHBondContact O-N 3.32Å; T209-E240 CarbonylContact C-O 3.54Å; T209-E240 WeakPolarHBondContact CA-O 3.39Å; V210-E240 PolarHBondContact N-O 2.99Å; E240-K242 HydrophobicContact CG-CG 4.27Å; E240-K242 WeakPolarHBondContact OE1-CE 3.37Å; E240-K242 IonicContact OE1-NZ 3.86Å; E240-K242 WeakPolarHBondContact OE2-CE 3.47Å; E240-K242 IonicContact OE2-NZ 3.97Å
241	V	98.1	Very high	93.6	Very high	24 Å²	24	55.5 Å²	55.5	15%	0.145	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.3	171.1	-169.7	0	0	0	0	110.1	A204 V210 C212 I227	A204-V241 HydrophobicContact CB-CG2 3.29Å; V210-V241 HydrophobicContact CB-CG1 4.42Å; V210-V241 HydrophobicContact CB-CG2 4.34Å; V210-V241 CarbonylContact O-C 3.45Å; V210-V241 WeakPolarHBondContact O-CA 3.41Å; C212-V241 HydrophobicContact CB-CG1 3.91Å; I227-V241 HydrophobicContact CD1-CB 3.96Å; I227-V241 HydrophobicContact CD1-CG1 3.32Å; I227-V241 HydrophobicContact CG1-CB 4.19Å; I227-V241 HydrophobicContact CG1-CG1 3.88Å; I227-V241 HydrophobicContact CG2-CB 3.91Å; I227-V241 HydrophobicContact CG2-CG1 4.5Å; I227-V241 HydrophobicContact CG2-CG2 4.32Å
242	K	98.3	Very high	93.3	Very high	44 Å²	44	55.9 Å²	55.9	19%	0.191	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	116.5	177.3	-62.5	-177.9	-178.2	-180	0	109.5	V210 Y211 C212 E240 E267	V210-K242 PolarHBondContact O-N 2.85Å; Y211-K242 CarbonylContact C-O 3.56Å; Y211-K242 WeakPolarHBondContact CA-O 3.48Å; Y211-K242 HydrophobicContact CD1-CB 3.92Å; Y211-K242 HydrophobicContact CD1-CD 4.39Å; Y211-K242 HydrophobicContact CE1-CB 4.11Å; Y211-K242 HydrophobicContact CE1-CD 3.74Å; C212-K242 PolarHBondContact N-O 2.89Å; E240-K242 HydrophobicContact CG-CG 4.27Å; E240-K242 WeakPolarHBondContact OE1-CE 3.37Å; E240-K242 IonicContact OE1-NZ 3.86Å; E240-K242 WeakPolarHBondContact OE2-CE 3.47Å; E240-K242 IonicContact OE2-NZ 3.97Å; K242-E267 HydrophobicContact CD-CG 4.46Å
243	V	98.4	Very high	93.3	Very high	11 Å²	11	54.4 Å²	54.4	7%	0.067	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123	176.4	-175.1	0	0	0	0	109.6	C212 L220 C223 H224 I227 F261	C212-V243 HydrophobicContact CB-CG2 4.21Å; C212-V243 WeakPolarHBondContact O-CA 3.29Å; L220-V243 HydrophobicContact CB-CG1 4Å; L220-V243 HydrophobicContact CD2-CG1 3.71Å; L220-V243 HydrophobicContact CG-CG1 4.46Å; C223-V243 HydrophobicContact CB-CG1 4.29Å; C223-V243 HydrophobicContact CB-CG2 4.39Å; H224-V243 HydrophobicContact CB-CG2 4.02Å; I227-V243 HydrophobicContact CD1-CG2 3.22Å; V243-F261 HydrophobicContact CB-CD1 4.17Å; V243-F261 HydrophobicContact CB-CE1 4.38Å; V243-F261 HydrophobicContact CG1-CD1 3.84Å; V243-F261 HydrophobicContact CG1-CE1 4.07Å
244	K	98.2	Very high	93.4	Very high	24 Å²	24	54.6 Å²	54.6	10%	0.104	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	147.4	-175.9	-61.1	-70.7	155.4	167.6	0	112.3	Y211 C212 T213 D214 F261 S262 W263 E267	Y211-K244 HydrophobicContact CD1-CG 4.24Å; C212-K244 PolarHBondContact O-N 3.39Å; T213-K244 VanDerWaalsContact CA-O 3.24Å; T213-K244 WeakPolarHBondContact CA-O 3.48Å; T213-K244 WeakPolarHBondContact CB-O 3.36Å; T213-K244 HydrophobicContact CG2-CB 4.32Å; D214-K244 PolarHBondContact N-O 2.98Å; K244-F261 WeakPolarHBondContact CA-O 3.19Å; K244-S262 WeakPolarHBondContact CD-O 3.38Å; K244-S262 PolarHBondContact NZ-O 3.32Å; K244-W263 HydrophobicContact CB-CD2 3.98Å; K244-W263 VanDerWaalsContact CB-CE2 3.42Å; K244-W263 HydrophobicContact CB-CH2 4.06Å; K244-W263 HydrophobicContact CB-CZ2 3.48Å; K244-W263 VanDerWaalsContact CB-CZ2 3.48Å; K244-W263 HydrophobicContact CD-CD2 4.29Å; K244-W263 HydrophobicContact CD-CG 4.42Å; K244-W263 HydrophobicContact CG-CD2 4.07Å; K244-W263 HydrophobicContact CG-CE3 4.21Å; K244-W263 HydrophobicContact CG-CH2 4.24Å; K244-W263 HydrophobicContact CG-CZ2 4.11Å; K244-W263 HydrophobicContact CG-CZ3 4.29Å; K244-E267 VanDerWaalsContact CE-CD 3.5Å; K244-E267 WeakPolarHBondContact CE-OE1 3.4Å; K244-E267 VanDerWaalsContact CE-OE2 3.23Å; K244-E267 WeakPolarHBondContact CE-OE2 3.34Å; K244-E267 IonicContact NZ-OE1 3.13Å; K244-E267 PolarHBondContact NZ-OE1 2.89Å; K244-E267 IonicContact NZ-OE2 3.58Å; K244-E267 PolarHBondContact NZ-OE2 3.04Å
245	Q	97.8	Very high	93.6	Very high	44 Å²	44	57.4 Å²	57.4	21%	0.206	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.3	175.7	-177.7	178.8	-25.7	0	0	110.7	D214 L220 F261 W263	D214-Q245 WeakPolarHBondContact O-CA 3.45Å; L220-Q245 HydrophobicContact CD1-CB 3.86Å; L220-Q245 HydrophobicContact CD1-CG 4.33Å; Q245-F261 HydrophobicContact CB-CB 4.4Å; Q245-F261 PolarHBondContact N-O 2.92Å; Q245-W263 PolarHBondContact O-NE1 3.4Å
246	L	97.8	Very high	93.7	Very high	5 Å²	5	56.3 Å²	56.3	3%	0.026	32%	0.323	C	S	.	.			trans	-137.7	107	171.6	-165	162.6	0	0	0	109.6	L190 L192 T213 D214 V215 L253 W263 T296	L190-L246 HydrophobicContact CD1-CD1 4.35Å; L192-L246 HydrophobicContact CD2-CD1 3.81Å; L192-L246 HydrophobicContact CD2-CD2 4.06Å; T213-L246 HydrophobicContact CG2-CB 4.15Å; T213-L246 HydrophobicContact CG2-CD1 4.32Å; D214-L246 PolarHBondContact O-N 3.09Å; V215-L246 WeakPolarHBondContact CG1-O 3.36Å; L246-L253 HydrophobicContact CD1-CD2 3.79Å; L246-L253 HydrophobicContact CG-CD2 3.84Å; L246-W263 HydrophobicContact CD1-CZ2 4.33Å; L246-T296 HydrophobicContact CD2-CG2 4.02Å
247	N	96.6	Very high	93.7	Very high	44 Å²	44	55.4 Å²	55.4	24%	0.235	33%	0.325	C	S	.	.			trans	-95.7	115.3	176.9	-174.2	-19.4	0	0	0	110.6	V215 L249 Q250	V215-N247 VanDerWaalsContact CG1-CA 3.48Å; V215-N247 HydrophobicContact CG1-CB 3.63Å; N247-L249 PolarHBondContact O-N 2.62Å; N247-L249 WeakPolarHBondContact OD1-CB 3.35Å; N247-L249 PolarHBondContact OD1-N 2.11Å; N247-Q250 HydrophobicContact CB-CB 4.21Å; N247-Q250 HydrophobicContact CB-CG 4Å; N247-Q250 PolarHBondContact O-N 2.94Å
248	W	96.7	Very high	93.9	Very high	28 Å²	28	60.1 Å²	60.1	11%	0.106	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.5	-179.5	-56.2	-26.9	0	0	0	114.5	L192 Q250 V283 L289 L293	L192-W248 HydrophobicContact CB-CZ2 4.05Å; W248-Q250 VanDerWaalsContact C-N 3.29Å; W248-V283 HydrophobicContact CH2-CB 3.63Å; W248-V283 HydrophobicContact CH2-CG1 3.68Å; W248-V283 HydrophobicContact CZ2-CB 4.46Å; W248-V283 HydrophobicContact CZ2-CG1 4.2Å; W248-V283 HydrophobicContact CZ3-CB 4.31Å; W248-L289 HydrophobicContact CE3-CB 4.39Å; W248-L289 HydrophobicContact CZ3-CB 4.38Å; W248-L293 HydrophobicContact CD2-CB 4.27Å; W248-L293 HydrophobicContact CD2-CD1 4.43Å; W248-L293 HydrophobicContact CE3-CB 4.06Å; W248-L293 HydrophobicContact CH2-CD1 4.46Å; W248-L293 HydrophobicContact CZ2-CD1 4.06Å; W248-L293 HydrophobicContact CZ3-CB 4.38Å
249	L	94.6	Very high	93.9	Very high	91 Å²	91	60.7 Å²	60.7	48%	0.476	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-4.2	177.1	-53.9	-177.7	0	0	0	112.3	N247 L289	N247-L249 PolarHBondContact O-N 2.62Å; N247-L249 WeakPolarHBondContact OD1-CB 3.35Å; N247-L249 PolarHBondContact OD1-N 2.11Å; L249-L289 HydrophobicContact CD1-CD2 4.34Å; L249-L289 HydrophobicContact CG-CD2 4.5Å
250	Q	92.2	Very high	93.9	Very high	89 Å²	89	65.6 Å²	65.6	42%	0.416	35%	0.352	S	S	.	.	S	Bend	trans	-106.1	149	176.7	-66.2	-176	-16.3	0	0	112	N247 W248 R299	N247-Q250 HydrophobicContact CB-CB 4.21Å; N247-Q250 HydrophobicContact CB-CG 4Å; N247-Q250 PolarHBondContact O-N 2.94Å; W248-Q250 VanDerWaalsContact C-N 3.29Å; Q250-R299 PolarHBondContact O-NH2 3.19Å
251	H	83.3	Confident	93.9	Very high	173 Å²	173	61.3 Å²	61.3	80%	0.801	33%	0.332	S	S	*	.	S	Bend	trans	-91.4	-7.7	-171.7	-68	33.2	0	0	0	114	R299	H251-R299 PolarHBondContact O-NH1 3.25Å
252	S	88.7	Confident	93.8	Very high	85 Å²	85	60.8 Å²	60.8	59%	0.594	33%	0.329	S	S	*	.	S	Bend	trans	-134.4	156.1	178.9	56.4	0	0	0	0	110.5
253	L	92.3	Very high	93.8	Very high	17 Å²	17	58.9 Å²	58.9	9%	0.089	32%	0.321	C	S	.	.			trans	-71.2	145.9	167.2	-61.3	174.6	0	0	0	108.7	L246 T255 W263 V268 L271 Y272	L246-L253 HydrophobicContact CD1-CD2 3.79Å; L246-L253 HydrophobicContact CG-CD2 3.84Å; L253-T255 PolarHBondContact O-N 3.36Å; L253-W263 HydrophobicContact CB-CD2 4.49Å; L253-W263 HydrophobicContact CB-CG 4.07Å; L253-W263 HydrophobicContact CD1-CD2 4.15Å; L253-W263 HydrophobicContact CD1-CE3 4.36Å; L253-W263 HydrophobicContact CD1-CG 4.5Å; L253-W263 HydrophobicContact CD2-CZ2 4.25Å; L253-V268 HydrophobicContact CB-CG2 4.44Å; L253-V268 HydrophobicContact CD1-CG1 4.18Å; L253-V268 HydrophobicContact CD1-CG2 3.93Å; L253-L271 HydrophobicContact CD1-CD2 3.69Å; L253-Y272 HydrophobicContact CD1-CE2 4.31Å
254	C	91.3	Very high	93.7	Very high	24 Å²	24	61.5 Å²	61.5	16%	0.162	34%	0.337	C	S	.	.			trans	-80.6	106.9	-178.7	-177.7	0	0	0	0	110	S262 W263	C254-S262 CarbonylContact O-C 3.58Å; C254-S262 WeakPolarHBondContact O-CA 3.24Å; C254-S262 WeakPolarHBondContact O-CB 3.27Å; C254-W263 PolarHBondContact O-N 3.29Å
255	T	93.3	Very high	93.6	Very high	66 Å²	66	66.8 Å²	66.8	41%	0.405	36%	0.362	S	S	.	.			trans	-104.7	20.9	179.3	56.5	0	0	0	0	113.5	L253 A257 W263 V268	L253-T255 PolarHBondContact O-N 3.36Å; T255-A257 PolarHBondContact O-N 2.9Å; T255-W263 WeakPolarHBondContact CA-O 3.17Å; T255-W263 HydrophobicContact CG2-CB 4.2Å; T255-V268 HydrophobicContact CG2-CG2 4.07Å
256	D	91.6	Very high	93.5	Very high	81 Å²	81	72.7 Å²	72.7	43%	0.433	39%	0.39	S	S	.	.			trans	-72.7	108.4	177.6	-170.5	-14.5	0	0	0	111.2	D258 L259 S262	D256-D258 PolarHBondContact O-N 3.31Å; D256-D258 VanDerWaalsContact O-N 3.09Å; D256-D258 PolarHBondContact OD1-N 3.41Å; D256-D258 VanDerWaalsContact OD1-N 3.09Å; D256-L259 HydrophobicContact CB-CD1 4.1Å; D256-L259 HydrophobicContact CB-CG 4.23Å; D256-L259 PolarHBondContact O-N 2.95Å; D256-S262 WeakPolarHBondContact O-CB 3.37Å; D256-S262 PolarHBondContact O-OG 3.47Å
257	A	88.6	Confident	93.5	Very high	90 Å²	90	73.6 Å²	73.6	74%	0.744	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-16.3	-176.7	0	0	0	0	0	114.3	T255 L259	T255-A257 PolarHBondContact O-N 2.9Å; A257-L259 VanDerWaalsContact C-N 3.29Å
258	D	90.6	Very high	93.5	Very high	153 Å²	153	72.6 Å²	72.6	82%	0.818	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.9	176.8	-68.6	-27.5	0	0	0	112.6	D256	D256-D258 PolarHBondContact O-N 3.31Å; D256-D258 VanDerWaalsContact O-N 3.09Å; D256-D258 PolarHBondContact OD1-N 3.41Å; D256-D258 VanDerWaalsContact OD1-N 3.09Å
259	L	92.3	Very high	93.5	Very high	72 Å²	72	73.4 Å²	73.4	38%	0.377	40%	0.402	S	S	.	.	S	Bend	trans	-97.3	131.7	179.2	-61.7	178.6	0	0	0	111.8	D256 A257 F261 S262	D256-L259 HydrophobicContact CB-CD1 4.1Å; D256-L259 HydrophobicContact CB-CG 4.23Å; D256-L259 PolarHBondContact O-N 2.95Å; A257-L259 VanDerWaalsContact C-N 3.29Å; L259-F261 VanDerWaalsContact C-N 3.31Å; L259-F261 PolarHBondContact O-N 2.88Å; L259-S262 WeakPolarHBondContact O-CB 3.44Å; L259-S262 PolarHBondContact O-N 2.93Å; L259-S262 PolarHBondContact O-OG 2.96Å
260	E	94.4	Very high	93.6	Very high	111 Å²	111	71 Å²	71	52%	0.519	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-40.3	-175	-174.7	177.7	177.9	0	0	113.5	R221	R221-E260 IonicContact CZ-OE2 2.66Å; R221-E260 IonicContact NE-OE2 3.47Å; R221-E260 PolarHBondContact NE-OE2 3.15Å; R221-E260 VanDerWaalsContact NE-OE2 3.13Å; R221-E260 IonicContact NH2-OE2 2.9Å; R221-E260 PolarHBondContact NH2-OE2 3.35Å
261	F	96.6	Very high	93.8	Very high	11 Å²	11	66.7 Å²	66.7	5%	0.048	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	22.7	-175.8	-55.7	-73.1	0	0	0	113.3	E217 L220 R221 H224 V243 K244 Q245 L259	E217-F261 HydrophobicContact CG-CD2 4.23Å; E217-F261 HydrophobicContact CG-CE2 3.98Å; L220-F261 HydrophobicContact CB-CD1 4.03Å; L220-F261 HydrophobicContact CB-CD2 3.59Å; L220-F261 HydrophobicContact CB-CE1 4.12Å; L220-F261 HydrophobicContact CB-CE2 3.7Å; L220-F261 HydrophobicContact CB-CG 3.77Å; L220-F261 HydrophobicContact CB-CZ 3.96Å; L220-F261 HydrophobicContact CD1-CB 3.74Å; L220-F261 HydrophobicContact CD1-CD2 3.82Å; L220-F261 HydrophobicContact CD1-CG 3.85Å; L220-F261 HydrophobicContact CG-CD2 4.35Å; L220-F261 HydrophobicContact CG-CG 4.37Å; R221-F261 HydrophobicContact CB-CZ 4.41Å; R221-F261 HydrophobicContact CG-CE2 3.8Å; R221-F261 HydrophobicContact CG-CZ 3.63Å; H224-F261 HydrophobicContact CB-CE1 4.36Å; V243-F261 HydrophobicContact CB-CD1 4.17Å; V243-F261 HydrophobicContact CB-CE1 4.38Å; V243-F261 HydrophobicContact CG1-CD1 3.84Å; V243-F261 HydrophobicContact CG1-CE1 4.07Å; K244-F261 WeakPolarHBondContact CA-O 3.19Å; Q245-F261 HydrophobicContact CB-CB 4.4Å; Q245-F261 PolarHBondContact N-O 2.92Å; L259-F261 VanDerWaalsContact C-N 3.31Å; L259-F261 PolarHBondContact O-N 2.88Å
262	S	96.3	Very high	94.3	Very high	14 Å²	14	61 Å²	61	10%	0.098	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-67.2	157.7	173.8	59.8	0	0	0	0	112	K244 C254 D256 L259	K244-S262 WeakPolarHBondContact CD-O 3.38Å; K244-S262 PolarHBondContact NZ-O 3.32Å; C254-S262 CarbonylContact O-C 3.58Å; C254-S262 WeakPolarHBondContact O-CA 3.24Å; C254-S262 WeakPolarHBondContact O-CB 3.27Å; D256-S262 WeakPolarHBondContact O-CB 3.37Å; D256-S262 PolarHBondContact O-OG 3.47Å; L259-S262 WeakPolarHBondContact O-CB 3.44Å; L259-S262 PolarHBondContact O-N 2.93Å; L259-S262 PolarHBondContact O-OG 2.96Å
263	W	97.8	Very high	94.7	Very high	3 Å²	3	61.1 Å²	61.1	1%	0.011	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-85.1	138.2	172.7	-63.8	78	0	0	0	110.3	L190 Y211 T213 K244 Q245 L246 L253 C254 T255 E267 V268 L271	L190-W263 HydrophobicContact CD1-CH2 4.36Å; Y211-W263 HydrophobicContact CD1-CE3 4.41Å; Y211-W263 AromaticContact CD1-CH2 3.62Å; Y211-W263 HydrophobicContact CD1-CH2 3.62Å; Y211-W263 AromaticContact CD1-CZ3 3.4Å; Y211-W263 HydrophobicContact CD1-CZ3 3.4Å; Y211-W263 VanDerWaalsContact CD1-CZ3 3.4Å; Y211-W263 HydrophobicContact CE1-CE3 4.3Å; Y211-W263 HydrophobicContact CE1-CH2 4.24Å; Y211-W263 AromaticContact CE1-CZ3 3.55Å; Y211-W263 HydrophobicContact CE1-CZ3 3.55Å; Y211-W263 AromaticContact CG-CH2 3.91Å; Y211-W263 HydrophobicContact CG-CH2 3.91Å; Y211-W263 AromaticContact CG-CZ3 3.99Å; Y211-W263 HydrophobicContact CG-CZ3 3.99Å; T213-W263 HydrophobicContact CG2-CH2 4.07Å; T213-W263 HydrophobicContact CG2-CZ2 3.69Å; K244-W263 HydrophobicContact CB-CD2 3.98Å; K244-W263 VanDerWaalsContact CB-CE2 3.42Å; K244-W263 HydrophobicContact CB-CH2 4.06Å; K244-W263 HydrophobicContact CB-CZ2 3.48Å; K244-W263 VanDerWaalsContact CB-CZ2 3.48Å; K244-W263 HydrophobicContact CD-CD2 4.29Å; K244-W263 HydrophobicContact CD-CG 4.42Å; K244-W263 HydrophobicContact CG-CD2 4.07Å; K244-W263 HydrophobicContact CG-CE3 4.21Å; K244-W263 HydrophobicContact CG-CH2 4.24Å; K244-W263 HydrophobicContact CG-CZ2 4.11Å; K244-W263 HydrophobicContact CG-CZ3 4.29Å; Q245-W263 PolarHBondContact O-NE1 3.4Å; L246-W263 HydrophobicContact CD1-CZ2 4.33Å; L253-W263 HydrophobicContact CB-CD2 4.49Å; L253-W263 HydrophobicContact CB-CG 4.07Å; L253-W263 HydrophobicContact CD1-CD2 4.15Å; L253-W263 HydrophobicContact CD1-CE3 4.36Å; L253-W263 HydrophobicContact CD1-CG 4.5Å; L253-W263 HydrophobicContact CD2-CZ2 4.25Å; C254-W263 PolarHBondContact O-N 3.29Å; T255-W263 WeakPolarHBondContact CA-O 3.17Å; T255-W263 HydrophobicContact CG2-CB 4.2Å; W263-E267 HydrophobicContact CE3-CB 4.03Å; W263-V268 HydrophobicContact CB-CG2 3.7Å; W263-V268 HydrophobicContact CE3-CG2 4.44Å; W263-V268 HydrophobicContact CG-CG2 4.33Å; W263-L271 HydrophobicContact CH2-CD1 4.1Å; W263-L271 HydrophobicContact CH2-CD2 3.99Å; W263-L271 HydrophobicContact CZ3-CB 4.22Å; W263-L271 HydrophobicContact CZ3-CD1 4.22Å; W263-L271 HydrophobicContact CZ3-CD2 3.98Å; W263-L271 HydrophobicContact CZ3-CG 4.38Å
264	T	97.1	Very high	94.8	Very high	66 Å²	66	63.8 Å²	63.8	41%	0.405	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-85.2	156.7	164.4	73.3	0	0	0	0	110.2	E266 E267 V268	T264-E266 PolarHBondContact O-N 3Å; T264-E267 PolarHBondContact N-OE2 3.24Å; T264-E267 PolarHBondContact O-N 2.92Å; T264-E267 VanDerWaalsContact O-N 3.08Å; T264-E267 VanDerWaalsContact OG1-CG 3.27Å; T264-E267 WeakPolarHBondContact OG1-CG 3.48Å; T264-E267 PolarHBondContact OG1-N 2.81Å; T264-E267 VanDerWaalsContact OG1-N 3.17Å; T264-E267 PolarHBondContact OG1-OE2 2.79Å; T264-V268 WeakPolarHBondContact O-CG2 3.42Å; T264-V268 PolarHBondContact O-N 3.43Å
265	E	95.6	Very high	95.1	Very high	136 Å²	136	62.6 Å²	62.6	64%	0.636	34%	0.342	S	S	*	.	H	α-helix	trans	-57.9	-33.8	175.7	-63.5	-63.2	158	0	0	112.3	V268 A269	E265-V268 PolarHBondContact O-N 3.42Å; E265-A269 WeakPolarHBondContact O-CB 3.5Å; E265-A269 PolarHBondContact O-N 3.24Å
266	E	96.3	Very high	95.3	Very high	168 Å²	168	62.4 Å²	62.4	79%	0.785	34%	0.338	S	S	*	.	H	α-helix	trans	-66.5	-40.8	175.8	-64.3	179.2	-179.4	0	0	111.9	T264 A269 D270	T264-E266 PolarHBondContact O-N 3Å; E266-A269 PolarHBondContact O-N 2.84Å; E266-D270 WeakPolarHBondContact O-CB 3.31Å; E266-D270 PolarHBondContact O-N 3.41Å
267	E	97	Very high	95.6	Very high	23 Å²	23	59.6 Å²	59.6	11%	0.107	32%	0.322	C	S	.	.	H	α-helix	trans	-70.8	-36.1	176.8	-70	168	150.1	0	0	112.1	Y211 K242 K244 W263 T264 D270 L271	Y211-E267 HydrophobicContact CE1-CB 4.13Å; Y211-E267 HydrophobicContact CE1-CG 4.34Å; Y211-E267 PolarHBondContact OH-O 2.7Å; K242-E267 HydrophobicContact CD-CG 4.46Å; K244-E267 VanDerWaalsContact CE-CD 3.5Å; K244-E267 WeakPolarHBondContact CE-OE1 3.4Å; K244-E267 VanDerWaalsContact CE-OE2 3.23Å; K244-E267 WeakPolarHBondContact CE-OE2 3.34Å; K244-E267 IonicContact NZ-OE1 3.13Å; K244-E267 PolarHBondContact NZ-OE1 2.89Å; K244-E267 IonicContact NZ-OE2 3.58Å; K244-E267 PolarHBondContact NZ-OE2 3.04Å; W263-E267 HydrophobicContact CE3-CB 4.03Å; T264-E267 PolarHBondContact N-OE2 3.24Å; T264-E267 PolarHBondContact O-N 2.92Å; T264-E267 VanDerWaalsContact O-N 3.08Å; T264-E267 VanDerWaalsContact OG1-CG 3.27Å; T264-E267 WeakPolarHBondContact OG1-CG 3.48Å; T264-E267 PolarHBondContact OG1-N 2.81Å; T264-E267 VanDerWaalsContact OG1-N 3.17Å; T264-E267 PolarHBondContact OG1-OE2 2.79Å; E267-D270 PolarHBondContact O-N 3.39Å; E267-L271 VanDerWaalsContact O-CB 3.31Å; E267-L271 WeakPolarHBondContact O-CB 3.47Å; E267-L271 PolarHBondContact O-N 3.06Å
268	V	96.9	Very high	96.1	Very high	24 Å²	24	55.3 Å²	55.3	15%	0.145	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-45.3	173.5	174.6	0	0	0	0	110.1	L253 T255 W263 T264 E265 L271 Y272	L253-V268 HydrophobicContact CB-CG2 4.44Å; L253-V268 HydrophobicContact CD1-CG1 4.18Å; L253-V268 HydrophobicContact CD1-CG2 3.93Å; T255-V268 HydrophobicContact CG2-CG2 4.07Å; W263-V268 HydrophobicContact CB-CG2 3.7Å; W263-V268 HydrophobicContact CE3-CG2 4.44Å; W263-V268 HydrophobicContact CG-CG2 4.33Å; T264-V268 WeakPolarHBondContact O-CG2 3.42Å; T264-V268 PolarHBondContact O-N 3.43Å; E265-V268 PolarHBondContact O-N 3.42Å; V268-L271 WeakPolarHBondContact O-CB 3.29Å; V268-L271 PolarHBondContact O-N 3.5Å; V268-Y272 HydrophobicContact CG1-CD2 3.83Å; V268-Y272 HydrophobicContact CG1-CE2 3.77Å; V268-Y272 VanDerWaalsContact O-CD2 3.23Å; V268-Y272 WeakPolarHBondContact O-CD2 3.12Å; V268-Y272 PolarHBondContact O-N 3.13Å; V268-Y272 VanDerWaalsContact O-N 3.14Å
269	A	96.1	Very high	96.5	Very high	45 Å²	45	48 Å²	48	37%	0.372	25%	0.248	S	C	.	.	H	α-helix	trans	-61.4	-49	176.2	0	0	0	0	0	111.5	E265 E266 L271 Y272 D273	E265-A269 WeakPolarHBondContact O-CB 3.5Å; E265-A269 PolarHBondContact O-N 3.24Å; E266-A269 PolarHBondContact O-N 2.84Å; A269-L271 VanDerWaalsContact C-N 3.28Å; A269-L271 PolarHBondContact O-N 3.11Å; A269-Y272 PolarHBondContact O-N 3.46Å; A269-Y272 VanDerWaalsContact O-N 3.17Å; A269-D273 VanDerWaalsContact O-CB 3.32Å; A269-D273 WeakPolarHBondContact O-CB 3.44Å; A269-D273 VanDerWaalsContact O-CG 3.3Å; A269-D273 PolarHBondContact O-N 3.45Å
270	D	96.8	Very high	96.8	Very high	39 Å²	39	44.7 Å²	44.7	21%	0.209	23%	0.231	C	C	.	.	H	α-helix	trans	-58.4	-40.5	177.7	-173	68.7	0	0	0	112.2	Y211 E266 E267 D273 N274	Y211-D270 PolarHBondContact OH-OD2 3.28Å; Y211-D270 VanDerWaalsContact OH-OD2 3.08Å; E266-D270 WeakPolarHBondContact O-CB 3.31Å; E266-D270 PolarHBondContact O-N 3.41Å; E267-D270 PolarHBondContact O-N 3.39Å; D270-D273 PolarHBondContact O-N 3.28Å; D270-N274 WeakPolarHBondContact O-CB 3.4Å; D270-N274 PolarHBondContact O-N 2.9Å; D270-N274 PolarHBondContact OD1-ND2 3.44Å
271	L	96.4	Very high	96.9	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58	-50.4	175.6	-177.2	77.8	0	0	0	111.5	L190 Y211 L253 W263 E267 V268 A269 T275 L300	L190-L271 HydrophobicContact CB-CD1 4.12Å; L190-L271 HydrophobicContact CD1-CD1 3.96Å; L190-L271 HydrophobicContact CD2-CD1 4.15Å; L190-L271 HydrophobicContact CG-CD1 4.29Å; Y211-L271 HydrophobicContact CD2-CD1 3.81Å; Y211-L271 HydrophobicContact CE2-CB 4.5Å; Y211-L271 HydrophobicContact CE2-CD1 4.23Å; Y211-L271 HydrophobicContact CG-CD1 4.24Å; L253-L271 HydrophobicContact CD1-CD2 3.69Å; W263-L271 HydrophobicContact CH2-CD1 4.1Å; W263-L271 HydrophobicContact CH2-CD2 3.99Å; W263-L271 HydrophobicContact CZ3-CB 4.22Å; W263-L271 HydrophobicContact CZ3-CD1 4.22Å; W263-L271 HydrophobicContact CZ3-CD2 3.98Å; W263-L271 HydrophobicContact CZ3-CG 4.38Å; E267-L271 VanDerWaalsContact O-CB 3.31Å; E267-L271 WeakPolarHBondContact O-CB 3.47Å; E267-L271 PolarHBondContact O-N 3.06Å; V268-L271 WeakPolarHBondContact O-CB 3.29Å; V268-L271 PolarHBondContact O-N 3.5Å; A269-L271 VanDerWaalsContact C-N 3.28Å; A269-L271 PolarHBondContact O-N 3.11Å; L271-T275 WeakPolarHBondContact CD1-OG1 3.44Å; L271-T275 WeakPolarHBondContact O-CB 3.41Å; L271-T275 PolarHBondContact O-N 3.41Å; L271-T275 PolarHBondContact O-OG1 2.94Å; L271-L300 HydrophobicContact CD2-CD2 4.37Å
272	Y	95.3	Very high	96.9	Very high	53 Å²	53	40 Å²	40	21%	0.208	21%	0.211	C	C	.	.	H	α-helix	trans	-74.3	-30.2	-177.1	-76.4	-71.3	0	0	0	113.7	L253 V268 A269 L300 F304	L253-Y272 HydrophobicContact CD1-CE2 4.31Å; V268-Y272 HydrophobicContact CG1-CD2 3.83Å; V268-Y272 HydrophobicContact CG1-CE2 3.77Å; V268-Y272 VanDerWaalsContact O-CD2 3.23Å; V268-Y272 WeakPolarHBondContact O-CD2 3.12Å; V268-Y272 PolarHBondContact O-N 3.13Å; V268-Y272 VanDerWaalsContact O-N 3.14Å; A269-Y272 PolarHBondContact O-N 3.46Å; A269-Y272 VanDerWaalsContact O-N 3.17Å; Y272-L300 HydrophobicContact CE1-CD2 3.83Å; Y272-F304 AromaticContact CD1-CD1 3.93Å; Y272-F304 HydrophobicContact CD1-CD1 3.93Å; Y272-F304 AromaticContact CD1-CE1 3.77Å; Y272-F304 HydrophobicContact CD1-CE1 3.77Å; Y272-F304 HydrophobicContact CE1-CE1 4.38Å; Y272-F304 WeakPolarHBondContact O-CD1 3.45Å
273	D	95.3	Very high	96.8	Very high	87 Å²	87	39.6 Å²	39.6	47%	0.465	21%	0.208	S	C	.	.	H	α-helix	trans	-86.9	-29.2	-175	-69.8	-16.1	0	0	0	113.2	A269 D270 H306	A269-D273 VanDerWaalsContact O-CB 3.32Å; A269-D273 WeakPolarHBondContact O-CB 3.44Å; A269-D273 VanDerWaalsContact O-CG 3.3Å; A269-D273 PolarHBondContact O-N 3.45Å; D270-D273 PolarHBondContact O-N 3.28Å; D273-H306 PolarHBondContact O-CD2 2.83Å; D273-H306 PolarHBondContact O-NE2 2.92Å
274	N	96.3	Very high	96.6	Very high	73 Å²	73	40.1 Å²	40.1	39%	0.39	21%	0.212	S	C	.	.	H	α-helix	trans	-122.9	-10.2	-167.9	-62.1	-54.1	0	0	0	115.5	T188 D270 N276	T188-N274 WeakPolarHBondContact CB-O 3.44Å; D270-N274 WeakPolarHBondContact O-CB 3.4Å; D270-N274 PolarHBondContact O-N 2.9Å; D270-N274 PolarHBondContact OD1-ND2 3.44Å; N274-N276 PolarHBondContact O-N 2.91Å; N274-N276 PolarHBondContact O-OD1 3.47Å
275	T	97.5	Very high	96.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	102	-173.3	-61.8	0	0	0	0	113.3	L190 L271 F277 I278 F304 H306	L190-T275 HydrophobicContact CB-CG2 3.92Å; L271-T275 WeakPolarHBondContact CD1-OG1 3.44Å; L271-T275 WeakPolarHBondContact O-CB 3.41Å; L271-T275 PolarHBondContact O-N 3.41Å; L271-T275 PolarHBondContact O-OG1 2.94Å; T275-F277 WeakPolarHBondContact CG2-O 3.43Å; T275-I278 HydrophobicContact CG2-CG1 4.23Å; T275-F304 HydrophobicContact CG2-CZ 4.23Å; T275-H306 PolarHBondContact O-CE1 2.77Å
276	N	95.8	Very high	96.2	Very high	61 Å²	61	37.5 Å²	37.5	33%	0.326	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-26.3	179.8	-51.4	118.8	0	0	0	113	T188 N274 C308 T309	T188-N276 PolarHBondContact O-N 3.33Å; N274-N276 PolarHBondContact O-N 2.91Å; N274-N276 PolarHBondContact O-OD1 3.47Å; N276-C308 WeakPolarHBondContact O-CA 3.46Å; N276-T309 PolarHBondContact O-N 3.26Å
277	F	98.6	Very high	96	Very high	23 Å²	23	32.6 Å²	32.6	10%	0.101	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138.8	-176.4	-58.4	-81.4	0	0	0	111.9	T183 F184 A187 V189 L190 T275 T309 F311	T183-F277 HydrophobicContact CG2-CE1 4.09Å; T183-F277 HydrophobicContact CG2-CZ 3.89Å; T183-F277 WeakPolarHBondContact O-CE2 3.32Å; T183-F277 WeakPolarHBondContact O-CZ 3.28Å; F184-F277 HydrophobicContact CD1-CB 4.5Å; F184-F277 HydrophobicContact CD1-CD1 4.07Å; F184-F277 AromaticContact CD1-CD2 3.85Å; F184-F277 HydrophobicContact CD1-CD2 3.85Å; F184-F277 HydrophobicContact CD1-CE1 4.23Å; F184-F277 HydrophobicContact CD1-CE2 4.02Å; F184-F277 AromaticContact CD1-CG 3.88Å; F184-F277 HydrophobicContact CD1-CG 3.88Å; F184-F277 HydrophobicContact CD1-CZ 4.21Å; F184-F277 HydrophobicContact CE1-CB 4.47Å; F184-F277 AromaticContact CE1-CD1 3.77Å; F184-F277 HydrophobicContact CE1-CD1 3.77Å; F184-F277 HydrophobicContact CE1-CD2 4.38Å; F184-F277 HydrophobicContact CE1-CE1 4.04Å; F184-F277 AromaticContact CE1-CG 3.95Å; F184-F277 HydrophobicContact CE1-CG 3.95Å; F184-F277 HydrophobicContact CE1-CZ 4.46Å; A187-F277 HydrophobicContact CB-CD2 3.69Å; A187-F277 HydrophobicContact CB-CE2 3.73Å; V189-F277 WeakPolarHBondContact CA-O 3.3Å; V189-F277 HydrophobicContact CG1-CB 4.1Å; V189-F277 HydrophobicContact CG2-CB 4.12Å; V189-F277 HydrophobicContact CG2-CD2 4.37Å; L190-F277 PolarHBondContact N-O 2.69Å; T275-F277 WeakPolarHBondContact CG2-O 3.43Å; F277-T309 CarbonylContact C-O 3.56Å; F277-T309 VanDerWaalsContact CA-O 3.23Å; F277-T309 WeakPolarHBondContact CA-O 3.38Å; F277-T309 HydrophobicContact CD1-CG2 4.35Å; F277-T309 HydrophobicContact CE1-CG2 4.46Å; F277-F311 HydrophobicContact CD1-CD2 4.47Å; F277-F311 AromaticContact CD1-CE2 3.92Å; F277-F311 HydrophobicContact CD1-CE2 3.92Å; F277-F311 HydrophobicContact CE1-CE2 4.22Å
278	I	98.8	Very high	95.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.5	165.6	-60.5	173.1	0	0	0	107.4	L190 L192 T275 L297 L300 F304 T309 V310 F311	L190-I278 HydrophobicContact CB-CG1 4.25Å; L190-I278 HydrophobicContact CD2-CD1 4.44Å; L190-I278 HydrophobicContact CD2-CG1 4.29Å; L190-I278 CarbonylContact O-C 3.57Å; L190-I278 VanDerWaalsContact O-CA 3.23Å; L190-I278 WeakPolarHBondContact O-CA 3.24Å; L192-I278 HydrophobicContact CD1-CG2 3.66Å; L192-I278 HydrophobicContact CG-CG2 3.88Å; T275-I278 HydrophobicContact CG2-CG1 4.23Å; I278-L297 HydrophobicContact CD1-CD2 4.08Å; I278-L297 HydrophobicContact CG2-CD2 3.87Å; I278-L300 HydrophobicContact CD1-CB 4.46Å; I278-L300 HydrophobicContact CD1-CD1 4.36Å; I278-F304 HydrophobicContact CD1-CE2 4.06Å; I278-F304 HydrophobicContact CD1-CZ 4.45Å; I278-T309 PolarHBondContact N-O 3.43Å; I278-V310 HydrophobicContact CB-CB 4.35Å; I278-V310 HydrophobicContact CB-CG1 3.98Å; I278-V310 HydrophobicContact CB-CG2 4.13Å; I278-V310 HydrophobicContact CD1-CG2 4.38Å; I278-V310 HydrophobicContact CG2-CG1 4Å; I278-V310 CarbonylContact O-C 3.53Å; I278-V310 WeakPolarHBondContact O-CA 3.3Å; I278-F311 PolarHBondContact O-N 2.87Å
279	I	98.8	Very high	95.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.4	176.6	68.2	176.3	0	0	0	110.6	L173 I177 V189 L190 E191 L192 T199 M203 F311	L173-I279 HydrophobicContact CD2-CB 4.03Å; L173-I279 HydrophobicContact CD2-CD1 4.39Å; L173-I279 HydrophobicContact CD2-CG1 4.47Å; I177-I279 HydrophobicContact CD1-CD1 4.24Å; V189-I279 HydrophobicContact CG1-CD1 4.19Å; V189-I279 HydrophobicContact CG1-CG1 4.16Å; V189-I279 HydrophobicContact CG1-CG2 4.12Å; L190-I279 PolarHBondContact O-N 3.06Å; E191-I279 CarbonylContact C-O 3.49Å; E191-I279 WeakPolarHBondContact CA-O 3.36Å; E191-I279 HydrophobicContact CB-CD1 4.18Å; E191-I279 HydrophobicContact CB-CG1 3.74Å; E191-I279 HydrophobicContact CG-CD1 4.33Å; E191-I279 HydrophobicContact CG-CG1 3.92Å; L192-I279 PolarHBondContact N-O 3.47Å; T199-I279 WeakPolarHBondContact OG1-CD1 3.49Å; M203-I279 HydrophobicContact CB-CD1 4.43Å; M203-I279 HydrophobicContact CE-CD1 3.96Å; M203-I279 HydrophobicContact CE-CG2 4.02Å; I279-F311 CarbonylContact C-O 3.56Å; I279-F311 VanDerWaalsContact CA-O 3.3Å; I279-F311 WeakPolarHBondContact CA-O 3.28Å; I279-F311 HydrophobicContact CG2-CB 4.31Å; I279-F311 HydrophobicContact CG2-CD2 4.48Å
280	A	98.6	Very high	95.9	Very high	2 Å²	2	35.5 Å²	35.5	2%	0.017	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	141.9	174.4	0	0	0	0	0	110.2	L192 V283 F311 I312 S313	L192-A280 HydrophobicContact CB-CB 4.37Å; L192-A280 WeakPolarHBondContact O-CB 3.41Å; A280-V283 HydrophobicContact CB-CG1 4.17Å; A280-V283 HydrophobicContact CB-CG2 3.77Å; A280-F311 PolarHBondContact N-O 3.27Å; A280-I312 WeakPolarHBondContact O-CA 3.27Å; A280-S313 PolarHBondContact O-N 2.86Å
281	A	97.9	Very high	95.9	Very high	12 Å²	12	35.9 Å²	35.9	10%	0.099	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	124.9	-179	0	0	0	0	0	111.7	A170 L173 T199 V283 S313	A170-A281 HydrophobicContact CB-CB 4.04Å; L173-A281 HydrophobicContact CB-CB 4.45Å; L173-A281 HydrophobicContact CD2-CB 3.95Å; T199-A281 HydrophobicContact CG2-CB 4.34Å; A281-V283 PolarHBondContact O-N 3.48Å; A281-S313 WeakPolarHBondContact CA-O 3.43Å; A281-S313 WeakPolarHBondContact CB-OG 3.43Å
282	D	94.8	Very high	96	Very high	11 Å²	11	35.9 Å²	35.9	6%	0.059	18%	0.184	C	C	.	.	S	Bend	trans	53.7	34.7	176.9	-82.6	-36.1	0	0	0	115.1	W167 G169 S313 L314 E315	W167-D282 HydrophobicContact CB-CB 3.85Å; W167-D282 WeakPolarHBondContact CB-OD2 3.46Å; W167-D282 HydrophobicContact CG-CB 4.24Å; G169-D282 WeakPolarHBondContact CA-OD2 3.46Å; G169-D282 PolarHBondContact N-OD2 2.89Å; D282-S313 PolarHBondContact N-O 3.4Å; D282-L314 VanDerWaalsContact OD1-CA 3.29Å; D282-L314 WeakPolarHBondContact OD1-CA 3.47Å; D282-E315 PolarHBondContact OD1-N 3.06Å
283	V	95.3	Very high	96.1	Very high	5 Å²	5	33.4 Å²	33.4	3%	0.03	18%	0.175	C	C	.	.			trans	-86	-7.1	-178.9	-67.4	0	0	0	0	114.7	L192 W248 A280 A281 L293	L192-V283 WeakPolarHBondContact O-CG1 3.37Å; W248-V283 HydrophobicContact CH2-CB 3.63Å; W248-V283 HydrophobicContact CH2-CG1 3.68Å; W248-V283 HydrophobicContact CZ2-CB 4.46Å; W248-V283 HydrophobicContact CZ2-CG1 4.2Å; W248-V283 HydrophobicContact CZ3-CB 4.31Å; A280-V283 HydrophobicContact CB-CG1 4.17Å; A280-V283 HydrophobicContact CB-CG2 3.77Å; A281-V283 PolarHBondContact O-N 3.48Å; V283-L293 HydrophobicContact CG2-CD2 3.57Å
284	C	93.8	Very high	96.2	Very high	15 Å²	15	30 Å²	30	10%	0.101	16%	0.156	C	C	.	.			trans	-103.4	81.8	-175	-63	0	0	0	0	111.7	L314 F335	C284-L314 HydrophobicContact CB-CD1 4.39Å; C284-F335 HydrophobicContact CB-CB 4.23Å; C284-F335 HydrophobicContact CB-CD2 4.38Å; C284-F335 HydrophobicContact CB-CG 4.48Å; C284-F335 WeakPolarHBondContact SG-CD2 3.3Å
285	Y	90.9	Very high	96.3	Very high	85 Å²	85	32.9 Å²	32.9	33%	0.333	16%	0.161	S	C	.	.	S	Bend	trans	-129.2	-13.5	178.4	61.3	-91.3	0	0	0	114	L159 V162 L289	L159-Y285 HydrophobicContact CD1-CD2 4.25Å; L159-Y285 HydrophobicContact CD1-CE2 4.49Å; V162-Y285 HydrophobicContact CG2-CE1 4.24Å; V162-Y285 HydrophobicContact CG2-CE2 4.21Å; Y285-L289 HydrophobicContact CE1-CD1 4.33Å; Y285-L289 HydrophobicContact CE2-CD1 3.76Å; Y285-L289 WeakPolarHBondContact OH-CD1 3.39Å
286	D	92.4	Very high	96.3	Very high	61 Å²	61	33 Å²	33	33%	0.326	16%	0.162	S	C	.	.	S	Bend	trans	-134	140.5	176.9	175.3	-89.6	0	0	0	109.5	D288 L289 T290	D286-D288 WeakPolarHBondContact OD1-CA 3.36Å; D286-D288 WeakPolarHBondContact OD1-CB 3.35Å; D286-D288 PolarHBondContact OD1-N 3.39Å; D286-L289 HydrophobicContact CB-CB 4.14Å; D286-L289 HydrophobicContact CB-CD1 4.03Å; D286-L289 HydrophobicContact CB-CG 4.14Å; D286-L289 PolarHBondContact OD1-N 3.2Å; D286-T290 VanDerWaalsContact O-CB 3.32Å; D286-T290 WeakPolarHBondContact O-CB 3.29Å; D286-T290 PolarHBondContact O-N 3.48Å; D286-T290 PolarHBondContact O-OG1 3.44Å
287	N	93.5	Very high	96.3	Very high	65 Å²	65	30.2 Å²	30.2	35%	0.348	15%	0.147	S	C	.	.	H	α-helix	trans	-71.8	-37.4	-173.4	-70.2	-5.8	0	0	0	112.5	T290 D291 H334	N287-T290 PolarHBondContact O-N 2.96Å; N287-D291 PolarHBondContact O-N 3.34Å; N287-H334 PolarHBondContact O-NE2 3.12Å; N287-H334 WeakPolarHBondContact OD1-CB 3.2Å
288	D	94.9	Very high	96.2	Very high	112 Å²	112	32 Å²	32	60%	0.599	15%	0.153	S	C	*	.	H	α-helix	trans	-70.1	-38.8	-180	-69.1	-30.2	0	0	0	110.6	D286 D291 G292	D286-D288 WeakPolarHBondContact OD1-CA 3.36Å; D286-D288 WeakPolarHBondContact OD1-CB 3.35Å; D286-D288 PolarHBondContact OD1-N 3.39Å; D288-D291 PolarHBondContact O-N 3.5Å; D288-G292 PolarHBondContact O-N 2.82Å
289	L	95.4	Very high	96	Very high	41 Å²	41	34.4 Å²	34.4	22%	0.215	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-41.5	172.2	-67.7	-178.8	0	0	0	111.9	W248 L249 Y285 D286 D291 G292 L293	W248-L289 HydrophobicContact CE3-CB 4.39Å; W248-L289 HydrophobicContact CZ3-CB 4.38Å; L249-L289 HydrophobicContact CD1-CD2 4.34Å; L249-L289 HydrophobicContact CG-CD2 4.5Å; Y285-L289 HydrophobicContact CE1-CD1 4.33Å; Y285-L289 HydrophobicContact CE2-CD1 3.76Å; Y285-L289 WeakPolarHBondContact OH-CD1 3.39Å; D286-L289 HydrophobicContact CB-CB 4.14Å; D286-L289 HydrophobicContact CB-CD1 4.03Å; D286-L289 HydrophobicContact CB-CG 4.14Å; D286-L289 PolarHBondContact OD1-N 3.2Å; L289-D291 VanDerWaalsContact C-N 3.34Å; L289-D291 PolarHBondContact O-N 3.3Å; L289-G292 CarbonylContact O-C 3.57Å; L289-G292 WeakPolarHBondContact O-CA 3.21Å; L289-G292 PolarHBondContact O-N 3Å; L289-G292 VanDerWaalsContact O-N 3.13Å; L289-L293 PolarHBondContact O-N 2.91Å
290	T	97.1	Very high	95.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-44.8	175.5	-59	0	0	0	0	110.5	D286 N287 G292 L293 F294 F335	D286-T290 VanDerWaalsContact O-CB 3.32Å; D286-T290 WeakPolarHBondContact O-CB 3.29Å; D286-T290 PolarHBondContact O-N 3.48Å; D286-T290 PolarHBondContact O-OG1 3.44Å; N287-T290 PolarHBondContact O-N 2.96Å; T290-G292 VanDerWaalsContact C-N 3.3Å; T290-G292 PolarHBondContact O-N 3.43Å; T290-L293 WeakPolarHBondContact O-CB 3.44Å; T290-L293 PolarHBondContact O-N 3.48Å; T290-F294 HydrophobicContact CG2-CD2 4Å; T290-F294 HydrophobicContact CG2-CE2 3.99Å; T290-F294 WeakPolarHBondContact O-CD2 3.33Å; T290-F294 PolarHBondContact O-N 3.24Å; T290-F335 HydrophobicContact CG2-CB 4.38Å
291	D	97.4	Very high	95.7	Very high	48 Å²	48	34.5 Å²	34.5	26%	0.257	16%	0.163	S	C	.	.	H	α-helix	trans	-60.5	-41	173.7	-74.1	-6	0	0	0	111.8	N287 D288 L289 F294 R295 H334	N287-D291 PolarHBondContact O-N 3.34Å; D288-D291 PolarHBondContact O-N 3.5Å; L289-D291 VanDerWaalsContact C-N 3.34Å; L289-D291 PolarHBondContact O-N 3.3Å; D291-F294 PolarHBondContact O-N 3.44Å; D291-R295 WeakPolarHBondContact O-CB 3.14Å; D291-R295 VanDerWaalsContact O-CG 3.3Å; D291-R295 WeakPolarHBondContact O-CG 3.23Å; D291-R295 PolarHBondContact O-N 3.39Å; D291-R295 PolarHBondContact O-NE 3.33Å; D291-H334 IonicContact OD1-CD2 3.47Å; D291-H334 IonicContact OD1-CE1 2.59Å; D291-H334 PolarHBondContact OD1-CE1 2.78Å; D291-H334 IonicContact OD1-NE2 3.93Å; D291-H334 PolarHBondContact OD1-NE2 3.36Å
292	G	97.6	Very high	95.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.5	-45.8	173.9	0	0	0	0	0	112.7	D288 L289 T290 R295 T296	D288-G292 PolarHBondContact O-N 2.82Å; L289-G292 CarbonylContact O-C 3.57Å; L289-G292 WeakPolarHBondContact O-CA 3.21Å; L289-G292 PolarHBondContact O-N 3Å; L289-G292 VanDerWaalsContact O-N 3.13Å; T290-G292 VanDerWaalsContact C-N 3.3Å; T290-G292 PolarHBondContact O-N 3.43Å; G292-R295 PolarHBondContact O-N 3.24Å; G292-T296 WeakPolarHBondContact O-CB 3.42Å; G292-T296 PolarHBondContact O-N 2.9Å; G292-T296 PolarHBondContact O-OG1 2.95Å
293	L	97.9	Very high	95.3	Very high	1 Å²	1	38 Å²	38	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-58.1	-52.1	177.6	174.4	69.1	0	0	0	110.4	L192 W248 V283 L289 T290 R295 T296 L297	L192-L293 HydrophobicContact CB-CD1 4.17Å; L192-L293 HydrophobicContact CD1-CD1 3.71Å; W248-L293 HydrophobicContact CD2-CB 4.27Å; W248-L293 HydrophobicContact CD2-CD1 4.43Å; W248-L293 HydrophobicContact CE3-CB 4.06Å; W248-L293 HydrophobicContact CH2-CD1 4.46Å; W248-L293 HydrophobicContact CZ2-CD1 4.06Å; W248-L293 HydrophobicContact CZ3-CB 4.38Å; V283-L293 HydrophobicContact CG2-CD2 3.57Å; L289-L293 PolarHBondContact O-N 2.91Å; T290-L293 WeakPolarHBondContact O-CB 3.44Å; T290-L293 PolarHBondContact O-N 3.48Å; L293-R295 PolarHBondContact O-N 3.49Å; L293-T296 CarbonylContact O-C 3.58Å; L293-T296 WeakPolarHBondContact O-CA 3.23Å; L293-T296 WeakPolarHBondContact O-CB 3.27Å; L293-T296 PolarHBondContact O-N 2.89Å; L293-T296 VanDerWaalsContact O-N 3.12Å; L293-L297 HydrophobicContact CD1-CD1 4.41Å; L293-L297 HydrophobicContact CD1-CG 4.37Å; L293-L297 HydrophobicContact CG-CD1 4.15Å; L293-L297 HydrophobicContact CG-CG 4.48Å; L293-L297 WeakPolarHBondContact O-CG 3.35Å; L293-L297 PolarHBondContact O-N 3.38Å
294	F	97.6	Very high	95.2	Very high	15 Å²	15	38.1 Å²	38.1	7%	0.066	19%	0.188	C	C	.	.	H	α-helix	trans	-66.4	-37.8	-179	-83.2	-87.6	0	0	0	113.1	T290 D291 T296 L297 Y298 F335 C338 L339 L342	T290-F294 HydrophobicContact CG2-CD2 4Å; T290-F294 HydrophobicContact CG2-CE2 3.99Å; T290-F294 WeakPolarHBondContact O-CD2 3.33Å; T290-F294 PolarHBondContact O-N 3.24Å; D291-F294 PolarHBondContact O-N 3.44Å; F294-T296 VanDerWaalsContact C-N 3.28Å; F294-T296 PolarHBondContact O-N 2.91Å; F294-L297 PolarHBondContact O-N 3.41Å; F294-Y298 WeakPolarHBondContact O-CB 3.41Å; F294-Y298 PolarHBondContact O-N 3.26Å; F294-F335 AromaticContact CE2-CD2 3.72Å; F294-F335 HydrophobicContact CE2-CD2 3.72Å; F294-F335 HydrophobicContact CE2-CE2 4.08Å; F294-F335 AromaticContact CZ-CD2 3.83Å; F294-F335 HydrophobicContact CZ-CD2 3.83Å; F294-F335 AromaticContact CZ-CE2 3.8Å; F294-F335 HydrophobicContact CZ-CE2 3.8Å; F294-C338 HydrophobicContact CB-CB 4.42Å; F294-C338 HydrophobicContact CD1-CB 4.01Å; F294-C338 HydrophobicContact CD2-CB 3.37Å; F294-C338 HydrophobicContact CE1-CB 4.1Å; F294-C338 HydrophobicContact CE2-CB 3.48Å; F294-C338 VanDerWaalsContact CE2-CB 3.48Å; F294-C338 HydrophobicContact CG-CB 3.66Å; F294-C338 HydrophobicContact CZ-CB 3.87Å; F294-L339 HydrophobicContact CE1-CD2 3.8Å; F294-L339 HydrophobicContact CE1-CG 4.15Å; F294-L339 HydrophobicContact CZ-CD2 3.76Å; F294-L339 HydrophobicContact CZ-CG 3.79Å; F294-L342 HydrophobicContact CD1-CB 4.14Å; F294-L342 HydrophobicContact CD1-CD2 3.96Å; F294-L342 HydrophobicContact CD1-CG 4.48Å; F294-L342 HydrophobicContact CE1-CB 4.34Å; F294-L342 HydrophobicContact CE1-CD2 3.98Å
295	R	96.8	Very high	95	Very high	134 Å²	134	44 Å²	44	51%	0.506	22%	0.216	S	C	.	.	H	α-helix	trans	-60	-40.7	170.7	-75.9	-175.6	-68.2	-110.7	-0.5	111.7	D291 G292 L293 R299	D291-R295 WeakPolarHBondContact O-CB 3.14Å; D291-R295 VanDerWaalsContact O-CG 3.3Å; D291-R295 WeakPolarHBondContact O-CG 3.23Å; D291-R295 PolarHBondContact O-N 3.39Å; D291-R295 PolarHBondContact O-NE 3.33Å; G292-R295 PolarHBondContact O-N 3.24Å; L293-R295 PolarHBondContact O-N 3.49Å; R295-R299 VanDerWaalsContact O-CB 3.29Å; R295-R299 WeakPolarHBondContact O-CB 3.47Å; R295-R299 PolarHBondContact O-N 3.05Å
296	T	97.4	Very high	95.1	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-67.7	-47.1	177.2	-66.8	0	0	0	0	111.6	L192 L246 G292 L293 F294 Y298 R299 L300	L192-T296 HydrophobicContact CD2-CG2 4.39Å; L246-T296 HydrophobicContact CD2-CG2 4.02Å; G292-T296 WeakPolarHBondContact O-CB 3.42Å; G292-T296 PolarHBondContact O-N 2.9Å; G292-T296 PolarHBondContact O-OG1 2.95Å; L293-T296 CarbonylContact O-C 3.58Å; L293-T296 WeakPolarHBondContact O-CA 3.23Å; L293-T296 WeakPolarHBondContact O-CB 3.27Å; L293-T296 PolarHBondContact O-N 2.89Å; L293-T296 VanDerWaalsContact O-N 3.12Å; F294-T296 VanDerWaalsContact C-N 3.28Å; F294-T296 PolarHBondContact O-N 2.91Å; T296-Y298 PolarHBondContact O-N 2.7Å; T296-R299 PolarHBondContact O-N 3.29Å; T296-L300 HydrophobicContact CG2-CD1 3.74Å; T296-L300 HydrophobicContact CG2-CG 4.26Å; T296-L300 WeakPolarHBondContact O-CB 3.44Å; T296-L300 VanDerWaalsContact O-CG 3.31Å; T296-L300 WeakPolarHBondContact O-CG 3.49Å; T296-L300 PolarHBondContact O-N 3.18Å
297	L	96.8	Very high	95.1	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-57.1	-49.6	176	-73.8	175.5	0	0	0	111.3	L192 I278 L293 F294 R299 L300 C301 V310 I312	L192-L297 HydrophobicContact CD1-CD2 3.62Å; L192-L297 HydrophobicContact CD1-CG 4.22Å; I278-L297 HydrophobicContact CD1-CD2 4.08Å; I278-L297 HydrophobicContact CG2-CD2 3.87Å; L293-L297 HydrophobicContact CD1-CD1 4.41Å; L293-L297 HydrophobicContact CD1-CG 4.37Å; L293-L297 HydrophobicContact CG-CD1 4.15Å; L293-L297 HydrophobicContact CG-CG 4.48Å; L293-L297 WeakPolarHBondContact O-CG 3.35Å; L293-L297 PolarHBondContact O-N 3.38Å; F294-L297 PolarHBondContact O-N 3.41Å; L297-R299 PolarHBondContact O-N 2.94Å; L297-L300 PolarHBondContact O-N 3.41Å; L297-C301 WeakPolarHBondContact O-CB 3.32Å; L297-C301 PolarHBondContact O-N 2.84Å; L297-C301 PolarHBondContact O-SG 3.45Å; L297-V310 HydrophobicContact CD1-CG1 4.41Å; L297-V310 HydrophobicContact CD2-CG1 3.8Å; L297-V310 HydrophobicContact CD2-CG2 4.17Å; L297-I312 HydrophobicContact CD1-CD1 4.06Å
298	Y	96.1	Very high	95.3	Very high	60 Å²	60	39.2 Å²	39.2	24%	0.235	20%	0.201	C	C	.	.	H	α-helix	trans	-59.8	-46.7	177.5	168.5	-94.9	0	0	0	111.7	F294 T296 S302 I345 D347 F352	F294-Y298 WeakPolarHBondContact O-CB 3.41Å; F294-Y298 PolarHBondContact O-N 3.26Å; T296-Y298 PolarHBondContact O-N 2.7Å; Y298-S302 WeakPolarHBondContact CE2-OG 3.4Å; Y298-S302 WeakPolarHBondContact O-CB 3.3Å; Y298-S302 PolarHBondContact O-N 2.94Å; Y298-S302 PolarHBondContact O-OG 2.79Å; Y298-I345 HydrophobicContact CD2-CD1 3.78Å; Y298-I345 HydrophobicContact CE2-CD1 4.08Å; Y298-I345 HydrophobicContact CE2-CG2 4.17Å; Y298-D347 WeakPolarHBondContact CE2-OD2 3.44Å; Y298-D347 VanDerWaalsContact CZ-OD2 3.28Å; Y298-D347 PolarHBondContact OH-OD2 3.49Å; Y298-F352 AromaticContact CD2-CE2 3.94Å; Y298-F352 HydrophobicContact CD2-CE2 3.94Å; Y298-F352 HydrophobicContact CD2-CZ 4.08Å; Y298-F352 HydrophobicContact CE2-CE2 4.48Å
299	R	94.9	Very high	95.5	Very high	52 Å²	52	34.9 Å²	34.9	20%	0.196	18%	0.179	C	C	.	.	H	α-helix	trans	-58.3	-51.6	177.9	172.4	177.7	54.1	141.2	-2.9	111.6	Q250 H251 R295 T296 L297 S303	Q250-R299 PolarHBondContact O-NH2 3.19Å; H251-R299 PolarHBondContact O-NH1 3.25Å; R295-R299 VanDerWaalsContact O-CB 3.29Å; R295-R299 WeakPolarHBondContact O-CB 3.47Å; R295-R299 PolarHBondContact O-N 3.05Å; T296-R299 PolarHBondContact O-N 3.29Å; L297-R299 PolarHBondContact O-N 2.94Å; R299-S303 WeakPolarHBondContact O-CB 3.42Å; R299-S303 PolarHBondContact O-N 3.46Å; R299-S303 PolarHBondContact O-OG 2.76Å
300	L	95.3	Very high	95.6	Very high	1 Å²	1	33 Å²	33	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-52.8	-178.9	-68.5	172.5	0	0	0	110.8	L190 L271 Y272 I278 T296 L297 S302 S303 F304	L190-L300 HydrophobicContact CD2-CD1 3.53Å; L271-L300 HydrophobicContact CD2-CD2 4.37Å; Y272-L300 HydrophobicContact CE1-CD2 3.83Å; I278-L300 HydrophobicContact CD1-CB 4.46Å; I278-L300 HydrophobicContact CD1-CD1 4.36Å; T296-L300 HydrophobicContact CG2-CD1 3.74Å; T296-L300 HydrophobicContact CG2-CG 4.26Å; T296-L300 WeakPolarHBondContact O-CB 3.44Å; T296-L300 VanDerWaalsContact O-CG 3.31Å; T296-L300 WeakPolarHBondContact O-CG 3.49Å; T296-L300 PolarHBondContact O-N 3.18Å; L297-L300 PolarHBondContact O-N 3.41Å; L300-S302 VanDerWaalsContact C-N 3.28Å; L300-S302 PolarHBondContact O-N 3.28Å; L300-S303 PolarHBondContact O-N 2.98Å; L300-F304 HydrophobicContact CB-CE1 4.43Å; L300-F304 HydrophobicContact CB-CE2 4.2Å; L300-F304 HydrophobicContact CB-CZ 3.84Å; L300-F304 WeakPolarHBondContact O-CD1 3.36Å; L300-F304 WeakPolarHBondContact O-CD2 3.46Å; L300-F304 VanDerWaalsContact O-CG 3.31Å; L300-F304 WeakPolarHBondContact O-CG 3.48Å; L300-F304 PolarHBondContact O-N 3.37Å
301	C	94.9	Very high	95.7	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-64.7	-30.3	-176.8	-66.5	0	0	0	0	113.6	L297 S303 F352 A380	L297-C301 WeakPolarHBondContact O-CB 3.32Å; L297-C301 PolarHBondContact O-N 2.84Å; L297-C301 PolarHBondContact O-SG 3.45Å; C301-S303 VanDerWaalsContact C-N 3.3Å; C301-F352 HydrophobicContact CB-CE1 3.7Å; C301-F352 HydrophobicContact CB-CZ 3.95Å; C301-A380 HydrophobicContact CB-CB 3.67Å
302	S	93	Very high	95.8	Very high	29 Å²	29	31.2 Å²	31.2	20%	0.203	16%	0.159	C	C	.	.	H	α-helix	trans	-80.2	-13.9	176.5	-56.1	0	0	0	0	113.1	Y298 L300	Y298-S302 WeakPolarHBondContact CE2-OG 3.4Å; Y298-S302 WeakPolarHBondContact O-CB 3.3Å; Y298-S302 PolarHBondContact O-N 2.94Å; Y298-S302 PolarHBondContact O-OG 2.79Å; L300-S302 VanDerWaalsContact C-N 3.28Å; L300-S302 PolarHBondContact O-N 3.28Å
303	S	92.6	Very high	95.8	Very high	68 Å²	68	31.2 Å²	31.2	48%	0.476	16%	0.159	S	C	.	.	H	α-helix	trans	-95.8	-15.7	176.7	-70.8	0	0	0	0	113	R299 L300 C301	R299-S303 WeakPolarHBondContact O-CB 3.42Å; R299-S303 PolarHBondContact O-N 3.46Å; R299-S303 PolarHBondContact O-OG 2.76Å; L300-S303 PolarHBondContact O-N 2.98Å; C301-S303 VanDerWaalsContact C-N 3.3Å
304	F	93.1	Very high	95.7	Very high	6 Å²	6	31.4 Å²	31.4	3%	0.026	16%	0.16	C	C	.	.			trans	-73.9	140.8	176.6	-59.2	-30.7	0	0	0	112	Y272 T275 I278 L300 H306 C308	Y272-F304 AromaticContact CD1-CD1 3.93Å; Y272-F304 HydrophobicContact CD1-CD1 3.93Å; Y272-F304 AromaticContact CD1-CE1 3.77Å; Y272-F304 HydrophobicContact CD1-CE1 3.77Å; Y272-F304 HydrophobicContact CE1-CE1 4.38Å; Y272-F304 WeakPolarHBondContact O-CD1 3.45Å; T275-F304 HydrophobicContact CG2-CZ 4.23Å; I278-F304 HydrophobicContact CD1-CE2 4.06Å; I278-F304 HydrophobicContact CD1-CZ 4.45Å; L300-F304 HydrophobicContact CB-CE1 4.43Å; L300-F304 HydrophobicContact CB-CE2 4.2Å; L300-F304 HydrophobicContact CB-CZ 3.84Å; L300-F304 WeakPolarHBondContact O-CD1 3.36Å; L300-F304 WeakPolarHBondContact O-CD2 3.46Å; L300-F304 VanDerWaalsContact O-CG 3.31Å; L300-F304 WeakPolarHBondContact O-CG 3.48Å; L300-F304 PolarHBondContact O-N 3.37Å; F304-H306 VanDerWaalsContact C-N 3.33Å; F304-C308 HydrophobicContact CD2-CB 3.64Å; F304-C308 HydrophobicContact CE2-CB 3.98Å
305	I	89.1	Confident	95.5	Very high	138 Å²	138	32 Å²	32	71%	0.708	16%	0.163	S	C	*	.	S	Bend	trans	-81.8	-14.9	176	60.3	170.1	0	0	0	113
306	H	92.3	Very high	95.2	Very high	40 Å²	40	28.1 Å²	28.1	19%	0.185	15%	0.15	C	C	.	.	S	Bend	trans	-119.6	164.8	-177.4	55.8	50.5	0	0	0	111.1	D273 T275 F304	D273-H306 PolarHBondContact O-CD2 2.83Å; D273-H306 PolarHBondContact O-NE2 2.92Å; T275-H306 PolarHBondContact O-CE1 2.77Å; F304-H306 VanDerWaalsContact C-N 3.33Å
307	S	94.3	Very high	94.8	Very high	70 Å²	70	31.4 Å²	31.4	49%	0.49	16%	0.162	S	C	.	.			trans	-62	139.1	170.7	57.6	0	0	0	0	111.2	A380	S307-A380 CarbonylContact C-O 3.59Å; S307-A380 VanDerWaalsContact CA-O 3.23Å; S307-A380 WeakPolarHBondContact CA-O 3.45Å
308	C	97.1	Very high	94.2	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.5	175.8	-175.8	0	0	0	0	109.9	N276 F304 A380	N276-C308 WeakPolarHBondContact O-CA 3.46Å; F304-C308 HydrophobicContact CD2-CB 3.64Å; F304-C308 HydrophobicContact CE2-CB 3.98Å; C308-A380 PolarHBondContact N-O 3.21Å; C308-A380 PolarHBondContact O-N 3.22Å
309	T	98.3	Very high	93.5	Very high	22 Å²	22	38.7 Å²	38.7	14%	0.135	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.6	175.9	-58.7	0	0	0	0	110.2	N276 F277 I278 F311 K377 I378	N276-T309 PolarHBondContact O-N 3.26Å; F277-T309 CarbonylContact C-O 3.56Å; F277-T309 VanDerWaalsContact CA-O 3.23Å; F277-T309 WeakPolarHBondContact CA-O 3.38Å; F277-T309 HydrophobicContact CD1-CG2 4.35Å; F277-T309 HydrophobicContact CE1-CG2 4.46Å; I278-T309 PolarHBondContact N-O 3.43Å; T309-F311 HydrophobicContact CG2-CD2 4.2Å; T309-F311 HydrophobicContact CG2-CE1 4.31Å; T309-F311 HydrophobicContact CG2-CE2 3.58Å; T309-F311 HydrophobicContact CG2-CZ 3.65Å; T309-K377 HydrophobicContact CG2-CD 4.27Å; T309-K377 HydrophobicContact CG2-CG 3.88Å; T309-I378 CarbonylContact C-O 3.56Å; T309-I378 WeakPolarHBondContact CA-O 3.11Å
310	V	98.6	Very high	92.9	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.7	177	-167.4	0	0	0	0	109.6	I278 L297 I312 K377 I378	I278-V310 HydrophobicContact CB-CB 4.35Å; I278-V310 HydrophobicContact CB-CG1 3.98Å; I278-V310 HydrophobicContact CB-CG2 4.13Å; I278-V310 HydrophobicContact CD1-CG2 4.38Å; I278-V310 HydrophobicContact CG2-CG1 4Å; I278-V310 CarbonylContact O-C 3.53Å; I278-V310 WeakPolarHBondContact O-CA 3.3Å; L297-V310 HydrophobicContact CD1-CG1 4.41Å; L297-V310 HydrophobicContact CD2-CG1 3.8Å; L297-V310 HydrophobicContact CD2-CG2 4.17Å; V310-I312 HydrophobicContact CG1-CD1 4.28Å; V310-I312 HydrophobicContact CG1-CG1 3.93Å; V310-K377 CarbonylContact O-C 3.56Å; V310-K377 WeakPolarHBondContact O-CA 3.49Å; V310-I378 HydrophobicContact CB-CB 4.02Å; V310-I378 HydrophobicContact CB-CD1 4.47Å; V310-I378 HydrophobicContact CG2-CB 4.35Å; V310-I378 PolarHBondContact N-O 3.43Å; V310-I378 PolarHBondContact O-N 2.8Å
311	F	98.8	Very high	92	Very high	8 Å²	8	42.3 Å²	42.3	4%	0.035	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.9	169.6	-65.9	-76.8	0	0	0	110.1	L173 F176 F184 F277 I278 I279 A280 T309 L375 W376 K377	L173-F311 HydrophobicContact CD1-CB 4.25Å; F176-F311 AromaticContact CE1-CD1 3.6Å; F176-F311 HydrophobicContact CE1-CD1 3.6Å; F176-F311 HydrophobicContact CE1-CD2 4.17Å; F176-F311 AromaticContact CE1-CE1 3.5Å; F176-F311 HydrophobicContact CE1-CE1 3.5Å; F176-F311 VanDerWaalsContact CE1-CE1 3.5Å; F176-F311 HydrophobicContact CE1-CE2 4.08Å; F176-F311 AromaticContact CE1-CG 3.93Å; F176-F311 HydrophobicContact CE1-CG 3.93Å; F176-F311 AromaticContact CE1-CZ 3.75Å; F176-F311 HydrophobicContact CE1-CZ 3.75Å; F176-F311 HydrophobicContact CZ-CD1 4.01Å; F176-F311 AromaticContact CZ-CE1 3.51Å; F176-F311 HydrophobicContact CZ-CE1 3.51Å; F176-F311 AromaticContact CZ-CZ 3.83Å; F176-F311 HydrophobicContact CZ-CZ 3.83Å; F184-F311 HydrophobicContact CE1-CD2 4.09Å; F184-F311 AromaticContact CE1-CE2 3.75Å; F184-F311 HydrophobicContact CE1-CE2 3.75Å; F184-F311 HydrophobicContact CZ-CD2 4.13Å; F184-F311 AromaticContact CZ-CE2 3.79Å; F184-F311 HydrophobicContact CZ-CE2 3.79Å; F184-F311 HydrophobicContact CZ-CZ 4.47Å; F277-F311 HydrophobicContact CD1-CD2 4.47Å; F277-F311 AromaticContact CD1-CE2 3.92Å; F277-F311 HydrophobicContact CD1-CE2 3.92Å; F277-F311 HydrophobicContact CE1-CE2 4.22Å; I278-F311 PolarHBondContact O-N 2.87Å; I279-F311 CarbonylContact C-O 3.56Å; I279-F311 VanDerWaalsContact CA-O 3.3Å; I279-F311 WeakPolarHBondContact CA-O 3.28Å; I279-F311 HydrophobicContact CG2-CB 4.31Å; I279-F311 HydrophobicContact CG2-CD2 4.48Å; A280-F311 PolarHBondContact N-O 3.27Å; T309-F311 HydrophobicContact CG2-CD2 4.2Å; T309-F311 HydrophobicContact CG2-CE1 4.31Å; T309-F311 HydrophobicContact CG2-CE2 3.58Å; T309-F311 HydrophobicContact CG2-CZ 3.65Å; F311-L375 HydrophobicContact CB-CD1 4.41Å; F311-W376 CarbonylContact C-O 3.59Å; F311-W376 WeakPolarHBondContact CA-O 3.46Å; F311-K377 HydrophobicContact CD1-CB 4.12Å; F311-K377 HydrophobicContact CD1-CG 4.31Å; F311-K377 HydrophobicContact CE1-CB 3.95Å; F311-K377 HydrophobicContact CE1-CD 3.95Å; F311-K377 HydrophobicContact CE1-CG 3.81Å; F311-K377 HydrophobicContact CZ-CD 4.33Å; F311-K377 HydrophobicContact CZ-CG 4.37Å
312	I	98.6	Very high	91.3	Very high	1 Å²	1	49 Å²	49	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.3	177.7	-53.8	179.1	0	0	0	108.2	A280 L297 V310 F335 W376 I378	A280-I312 WeakPolarHBondContact O-CA 3.27Å; L297-I312 HydrophobicContact CD1-CD1 4.06Å; V310-I312 HydrophobicContact CG1-CD1 4.28Å; V310-I312 HydrophobicContact CG1-CG1 3.93Å; I312-F335 HydrophobicContact CD1-CE2 4.06Å; I312-F335 HydrophobicContact CG2-CE2 4.03Å; I312-F335 HydrophobicContact CG2-CZ 4.18Å; I312-W376 PolarHBondContact N-O 3.4Å; I312-W376 PolarHBondContact O-N 3.4Å; I312-I378 HydrophobicContact CD1-CD1 3.91Å
313	S	98.1	Very high	90.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	144.5	170	90.1	0	0	0	0	110.3	G169 A280 A281 D282 E374	G169-S313 WeakPolarHBondContact CA-OG 3.04Å; G169-S313 PolarHBondContact O-OG 3.12Å; A280-S313 PolarHBondContact O-N 2.86Å; A281-S313 WeakPolarHBondContact CA-O 3.43Å; A281-S313 WeakPolarHBondContact CB-OG 3.43Å; D282-S313 PolarHBondContact N-O 3.4Å; S313-E374 WeakPolarHBondContact CA-O 3.45Å
314	L	95.3	Very high	89.9	Confident	5 Å²	5	60.5 Å²	60.5	3%	0.026	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	154.7	177.6	66.6	168.7	0	0	0	112.2	D282 C284 Y332 F335 E374	D282-L314 VanDerWaalsContact OD1-CA 3.29Å; D282-L314 WeakPolarHBondContact OD1-CA 3.47Å; C284-L314 HydrophobicContact CB-CD1 4.39Å; L314-Y332 HydrophobicContact CD1-CD2 3.7Å; L314-Y332 HydrophobicContact CD1-CE2 4.18Å; L314-Y332 HydrophobicContact CG-CD2 4.5Å; L314-F335 HydrophobicContact CD1-CD1 3.65Å; L314-F335 HydrophobicContact CD1-CE1 3.77Å; L314-F335 HydrophobicContact CD1-CG 4.09Å; L314-F335 HydrophobicContact CD1-CZ 4.33Å; L314-F335 HydrophobicContact CD2-CE1 3.88Å; L314-F335 HydrophobicContact CD2-CZ 4.08Å; L314-E374 HydrophobicContact CD2-CB 4.31Å; L314-E374 PolarHBondContact N-O 2.99Å; L314-E374 PolarHBondContact O-N 3.27Å
315	E	93.8	Very high	89.4	Confident	29 Å²	29	66.6 Å²	66.6	14%	0.136	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.5	169	-173.5	-172.9	174.6	0	0	111.1	D282 R317 I370 Q372 L373	D282-E315 PolarHBondContact OD1-N 3.06Å; E315-R317 PolarHBondContact O-N 2.8Å; E315-R317 VanDerWaalsContact O-N 3.13Å; E315-R317 IonicContact OE2-NH2 3.41Å; E315-R317 PolarHBondContact OE2-NH2 3.48Å; E315-I370 HydrophobicContact CG-CD1 4.18Å; E315-Q372 HydrophobicContact CG-CB 4.38Å; E315-L373 HydrophobicContact CB-CD2 3.95Å; E315-L373 HydrophobicContact CG-CD2 4.36Å
316	K	91.7	Very high	89.1	Confident	52 Å²	52	64.9 Å²	64.9	23%	0.226	31%	0.312	C	S	.	.			trans	-71.2	105.5	171.9	-63.4	173.3	-169.9	162.1	0	110.8	M318 Y332 Q372 E374	K316-M318 PolarHBondContact O-N 2.64Å; K316-Y332 HydrophobicContact CD-CE1 4.42Å; K316-Y332 HydrophobicContact CD-CE2 4.35Å; K316-Y332 VanDerWaalsContact CE-CZ 3.49Å; K316-Y332 HydrophobicContact CG-CD1 4.41Å; K316-Y332 HydrophobicContact CG-CD2 3.73Å; K316-Y332 HydrophobicContact CG-CE2 3.93Å; K316-Y332 HydrophobicContact CG-CG 4Å; K316-Q372 HydrophobicContact CB-CB 3.97Å; K316-Q372 HydrophobicContact CB-CG 4.3Å; K316-Q372 WeakPolarHBondContact CG-O 3.2Å; K316-Q372 PolarHBondContact N-O 3.11Å; K316-E374 WeakPolarHBondContact CE-OE1 3.27Å; K316-E374 IonicContact NZ-OE1 2.77Å; K316-E374 PolarHBondContact NZ-OE1 2.87Å
317	R	87.1	Confident	88.7	Confident	71 Å²	71	67.8 Å²	67.8	27%	0.268	33%	0.328	S	S	.	.			trans	-88.7	106.4	173.8	-63.1	-166.5	178.5	104.8	21.5	111.6	E315 C329	E315-R317 PolarHBondContact O-N 2.8Å; E315-R317 VanDerWaalsContact O-N 3.13Å; E315-R317 IonicContact OE2-NH2 3.41Å; E315-R317 PolarHBondContact OE2-NH2 3.48Å; R317-C329 PolarHBondContact N-SG 3.32Å; R317-C329 PolarHBondContact O-SG 3.24Å
318	M	84.8	Confident	88.2	Confident	109 Å²	109	65.3 Å²	65.3	54%	0.537	31%	0.311	S	S	.	.			trans	-80.9	118.1	177.7	-57.5	-61	-71.7	0	0	109.6	K316 I327 C329	K316-M318 PolarHBondContact O-N 2.64Å; M318-I327 HydrophobicContact CB-CG2 3.75Å; M318-I327 HydrophobicContact CE-CG2 3.63Å; M318-C329 HydrophobicContact SD-CB 3.74Å
319	N	81.8	Confident	87.7	Confident	106 Å²	106	65.7 Å²	65.7	57%	0.567	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.2	178.6	-68.1	-51	0	0	0	109.8	S321 C328	N319-S321 PolarHBondContact O-N 2.92Å; N319-C328 PolarHBondContact N-O 2.82Å; N319-C328 PolarHBondContact O-N 3.3Å
320	F	81.5	Confident	87.2	Confident	117 Å²	117	68.2 Å²	68.2	51%	0.513	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	114.2	170.5	-170.7	-93.4	0	0	0	109.5	L322 M325 I327	F320-L322 HydrophobicContact CD1-CD2 4.25Å; F320-L322 HydrophobicContact CE1-CD2 4.21Å; F320-M325 HydrophobicContact CE1-SD 4.37Å; F320-M325 HydrophobicContact CZ-CB 4.41Å; F320-M325 WeakPolarHBondContact CZ-O 3.43Å; F320-I327 HydrophobicContact CD2-CG1 4.29Å
321	S	77.1	Confident	86.8	Confident	12 Å²	12	69.4 Å²	69.4	8%	0.084	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	118.3	177.7	-176.9	0	0	0	0	109.7	N319 R323 H324 M325 D326 C328 E330	N319-S321 PolarHBondContact O-N 2.92Å; S321-R323 PolarHBondContact O-N 2.8Å; S321-R323 PolarHBondContact OG-N 2.97Å; S321-H324 PolarHBondContact O-N 2.83Å; S321-H324 PolarHBondContact OG-ND1 3.24Å; S321-H324 VanDerWaalsContact OG-ND1 3.12Å; S321-M325 VanDerWaalsContact O-CA 3.31Å; S321-M325 WeakPolarHBondContact O-CA 3.43Å; S321-M325 PolarHBondContact O-N 2.81Å; S321-D326 PolarHBondContact N-O 3.21Å; S321-D326 PolarHBondContact O-N 3.22Å; S321-C328 WeakPolarHBondContact CB-SG 3.41Å; S321-E330 VanDerWaalsContact CB-OE1 3.27Å; S321-E330 WeakPolarHBondContact CB-OE1 3.45Å; S321-E330 PolarHBondContact OG-OE1 2.74Å
322	L	80.1	Confident	86.6	Confident	143 Å²	143	70.5 Å²	70.5	75%	0.749	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.2	172.6	-63.9	178.4	0	0	0	112.7	F320	F320-L322 HydrophobicContact CD1-CD2 4.25Å; F320-L322 HydrophobicContact CE1-CD2 4.21Å
323	R	78.2	Confident	86.3	Confident	215 Å²	215	75 Å²	75	81%	0.811	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-43	178.4	-64.7	-179.4	178.6	178.8	2.2	111.5	S321	S321-R323 PolarHBondContact O-N 2.8Å; S321-R323 PolarHBondContact OG-N 2.97Å
324	H	77.5	Confident	86.2	Confident	123 Å²	123	76.8 Å²	76.8	57%	0.569	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-10.7	-176.8	-53.5	105.4	0	0	0	112.6	S321 D326 E330	S321-H324 PolarHBondContact O-N 2.83Å; S321-H324 PolarHBondContact OG-ND1 3.24Å; S321-H324 VanDerWaalsContact OG-ND1 3.12Å; H324-D326 PolarHBondContact O-N 3.18Å; H324-E330 IonicContact CE1-OE1 2.93Å; H324-E330 IonicContact ND1-OE1 2.99Å; H324-E330 PolarHBondContact ND1-OE1 2.96Å
325	M	83.1	Confident	86.3	Confident	135 Å²	135	76.6 Å²	76.6	67%	0.665	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	36.7	-173.3	-64.4	-69.6	-69.7	0	0	112.1	F320 S321	F320-M325 HydrophobicContact CE1-SD 4.37Å; F320-M325 HydrophobicContact CZ-CB 4.41Å; F320-M325 WeakPolarHBondContact CZ-O 3.43Å; S321-M325 VanDerWaalsContact O-CA 3.31Å; S321-M325 WeakPolarHBondContact O-CA 3.43Å; S321-M325 PolarHBondContact O-N 2.81Å
326	D	83.9	Confident	86.4	Confident	101 Å²	101	78.5 Å²	78.5	54%	0.54	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	165.1	-175.3	-159.9	2.8	0	0	0	111.1	S321 H324 C328	S321-D326 PolarHBondContact N-O 3.21Å; S321-D326 PolarHBondContact O-N 3.22Å; H324-D326 PolarHBondContact O-N 3.18Å; D326-C328 PolarHBondContact O-N 2.85Å; D326-C328 PolarHBondContact O-SG 3.41Å
327	I	83.9	Confident	86.7	Confident	102 Å²	102	80.9 Å²	80.9	52%	0.523	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	118.2	173.7	-56.2	176.4	0	0	0	108.4	M318 F320	M318-I327 HydrophobicContact CB-CG2 3.75Å; M318-I327 HydrophobicContact CE-CG2 3.63Å; F320-I327 HydrophobicContact CD2-CG1 4.29Å
328	C	83.2	Confident	87.2	Confident	17 Å²	17	77.7 Å²	77.7	12%	0.115	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	151.8	-176.7	-49.3	0	0	0	0	110.8	N319 S321 D326 E330	N319-C328 PolarHBondContact N-O 2.82Å; N319-C328 PolarHBondContact O-N 3.3Å; S321-C328 WeakPolarHBondContact CB-SG 3.41Å; D326-C328 PolarHBondContact O-N 2.85Å; D326-C328 PolarHBondContact O-SG 3.41Å; C328-E330 HydrophobicContact CB-CG 3.9Å
329	C	87.3	Confident	87.7	Confident	10 Å²	10	72.6 Å²	72.6	7%	0.068	35%	0.352	C	S	.	.			trans	-110.7	70.9	165.7	-156.4	0	0	0	0	108.6	R317 M318 A331 Y332 N333	R317-C329 PolarHBondContact N-SG 3.32Å; R317-C329 PolarHBondContact O-SG 3.24Å; M318-C329 HydrophobicContact SD-CB 3.74Å; C329-A331 PolarHBondContact O-N 2.79Å; C329-Y332 PolarHBondContact O-N 3.23Å; C329-Y332 WeakPolarHBondContact SG-CB 3.41Å; C329-N333 WeakPolarHBondContact O-CB 3.4Å; C329-N333 PolarHBondContact O-N 3.46Å; C329-N333 PolarHBondContact O-ND2 3.34Å
330	E	87.4	Confident	88.5	Confident	75 Å²	75	70.3 Å²	70.3	35%	0.35	34%	0.344	S	S	.	.	H	α-helix	trans	-59.1	-46.6	-169.4	-66.3	-169	173.6	0	0	112.6	S321 H324 C328 Y332 N333 H334	S321-E330 VanDerWaalsContact CB-OE1 3.27Å; S321-E330 WeakPolarHBondContact CB-OE1 3.45Å; S321-E330 PolarHBondContact OG-OE1 2.74Å; H324-E330 IonicContact CE1-OE1 2.93Å; H324-E330 IonicContact ND1-OE1 2.99Å; H324-E330 PolarHBondContact ND1-OE1 2.96Å; C328-E330 HydrophobicContact CB-CG 3.9Å; E330-Y332 PolarHBondContact O-N 3.41Å; E330-N333 PolarHBondContact O-N 2.96Å; E330-H334 WeakPolarHBondContact O-CB 3.49Å; E330-H334 PolarHBondContact O-N 2.96Å
331	A	90.4	Very high	89.2	Confident	26 Å²	26	69.6 Å²	69.6	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-62.1	-41.6	177.9	0	0	0	0	0	112.3	C329 H334 F335	C329-A331 PolarHBondContact O-N 2.79Å; A331-H334 PolarHBondContact O-N 2.91Å; A331-F335 WeakPolarHBondContact O-CB 3.42Å; A331-F335 PolarHBondContact O-N 3.23Å
332	Y	93.3	Very high	90	Very high	31 Å²	31	69.3 Å²	69.3	12%	0.122	34%	0.34	C	S	.	.	H	α-helix	trans	-67.2	-41.3	176	177.3	-97.4	0	0	0	112.3	L314 K316 C329 E330 H334 F335 K336 E374	L314-Y332 HydrophobicContact CD1-CD2 3.7Å; L314-Y332 HydrophobicContact CD1-CE2 4.18Å; L314-Y332 HydrophobicContact CG-CD2 4.5Å; K316-Y332 HydrophobicContact CD-CE1 4.42Å; K316-Y332 HydrophobicContact CD-CE2 4.35Å; K316-Y332 VanDerWaalsContact CE-CZ 3.49Å; K316-Y332 HydrophobicContact CG-CD1 4.41Å; K316-Y332 HydrophobicContact CG-CD2 3.73Å; K316-Y332 HydrophobicContact CG-CE2 3.93Å; K316-Y332 HydrophobicContact CG-CG 4Å; C329-Y332 PolarHBondContact O-N 3.23Å; C329-Y332 WeakPolarHBondContact SG-CB 3.41Å; E330-Y332 PolarHBondContact O-N 3.41Å; Y332-H334 VanDerWaalsContact C-N 3.29Å; Y332-H334 PolarHBondContact O-N 2.9Å; Y332-F335 HydrophobicContact CD2-CD1 4.27Å; Y332-F335 HydrophobicContact CE2-CD1 4.32Å; Y332-F335 WeakPolarHBondContact O-CB 3.4Å; Y332-F335 PolarHBondContact O-N 3.41Å; Y332-K336 HydrophobicContact CD1-CG 4.05Å; Y332-K336 HydrophobicContact CE1-CD 4.2Å; Y332-K336 HydrophobicContact CE1-CG 3.56Å; Y332-K336 HydrophobicContact CE2-CD 4.32Å; Y332-K336 HydrophobicContact CE2-CG 4.2Å; Y332-K336 WeakPolarHBondContact O-CB 3.42Å; Y332-K336 WeakPolarHBondContact O-CG 3.47Å; Y332-K336 PolarHBondContact O-N 3.06Å; Y332-E374 WeakPolarHBondContact CE2-OE2 3.41Å; Y332-E374 PolarHBondContact OH-OE1 3.36Å; Y332-E374 PolarHBondContact OH-OE2 2.91Å
333	N	93.6	Very high	90.7	Very high	95 Å²	95	67.1 Å²	67.1	51%	0.508	33%	0.326	S	S	.	.	H	α-helix	trans	-61.9	-40.9	176.7	-71.6	-17.7	0	0	0	110.9	C329 E330 K336 H337	C329-N333 WeakPolarHBondContact O-CB 3.4Å; C329-N333 PolarHBondContact O-N 3.46Å; C329-N333 PolarHBondContact O-ND2 3.34Å; E330-N333 PolarHBondContact O-N 2.96Å; N333-K336 PolarHBondContact O-N 3.13Å; N333-H337 PolarHBondContact O-N 3Å
334	H	95.6	Very high	91.5	Very high	39 Å²	39	62 Å²	62	18%	0.181	32%	0.315	C	S	.	.	H	α-helix	trans	-64.1	-47.2	174.1	-169.4	67.6	0	0	0	111.6	N287 D291 E330 A331 Y332 K336 H337 C338	N287-H334 PolarHBondContact O-NE2 3.12Å; N287-H334 WeakPolarHBondContact OD1-CB 3.2Å; D291-H334 IonicContact OD1-CD2 3.47Å; D291-H334 IonicContact OD1-CE1 2.59Å; D291-H334 PolarHBondContact OD1-CE1 2.78Å; D291-H334 IonicContact OD1-NE2 3.93Å; D291-H334 PolarHBondContact OD1-NE2 3.36Å; E330-H334 WeakPolarHBondContact O-CB 3.49Å; E330-H334 PolarHBondContact O-N 2.96Å; A331-H334 PolarHBondContact O-N 2.91Å; Y332-H334 VanDerWaalsContact C-N 3.29Å; Y332-H334 PolarHBondContact O-N 2.9Å; H334-K336 VanDerWaalsContact C-N 3.33Å; H334-K336 PolarHBondContact O-N 3.43Å; H334-H337 WeakPolarHBondContact O-CA 3.43Å; H334-H337 WeakPolarHBondContact O-CB 3.37Å; H334-H337 PolarHBondContact O-N 3.18Å; H334-C338 PolarHBondContact O-N 3.27Å; H334-C338 PolarHBondContact O-SG 3.48Å; H334-C338 VanDerWaalsContact O-SG 3.33Å
335	F	97	Very high	92.2	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-53.4	-46.7	172.2	165.5	-103.7	0	0	0	112.7	C284 T290 F294 I312 L314 A331 Y332 H337 C338 L339 W376	C284-F335 HydrophobicContact CB-CB 4.23Å; C284-F335 HydrophobicContact CB-CD2 4.38Å; C284-F335 HydrophobicContact CB-CG 4.48Å; C284-F335 WeakPolarHBondContact SG-CD2 3.3Å; T290-F335 HydrophobicContact CG2-CB 4.38Å; F294-F335 AromaticContact CE2-CD2 3.72Å; F294-F335 HydrophobicContact CE2-CD2 3.72Å; F294-F335 HydrophobicContact CE2-CE2 4.08Å; F294-F335 AromaticContact CZ-CD2 3.83Å; F294-F335 HydrophobicContact CZ-CD2 3.83Å; F294-F335 AromaticContact CZ-CE2 3.8Å; F294-F335 HydrophobicContact CZ-CE2 3.8Å; I312-F335 HydrophobicContact CD1-CE2 4.06Å; I312-F335 HydrophobicContact CG2-CE2 4.03Å; I312-F335 HydrophobicContact CG2-CZ 4.18Å; L314-F335 HydrophobicContact CD1-CD1 3.65Å; L314-F335 HydrophobicContact CD1-CE1 3.77Å; L314-F335 HydrophobicContact CD1-CG 4.09Å; L314-F335 HydrophobicContact CD1-CZ 4.33Å; L314-F335 HydrophobicContact CD2-CE1 3.88Å; L314-F335 HydrophobicContact CD2-CZ 4.08Å; A331-F335 WeakPolarHBondContact O-CB 3.42Å; A331-F335 PolarHBondContact O-N 3.23Å; Y332-F335 HydrophobicContact CD2-CD1 4.27Å; Y332-F335 HydrophobicContact CE2-CD1 4.32Å; Y332-F335 WeakPolarHBondContact O-CB 3.4Å; Y332-F335 PolarHBondContact O-N 3.41Å; F335-H337 VanDerWaalsContact C-N 3.3Å; F335-H337 PolarHBondContact O-N 3.34Å; F335-C338 PolarHBondContact O-N 2.93Å; F335-L339 HydrophobicContact CD1-CD1 3.98Å; F335-L339 HydrophobicContact CD2-CG 4.46Å; F335-L339 HydrophobicContact CE1-CD1 3.33Å; F335-L339 HydrophobicContact CE1-CG 4.15Å; F335-L339 HydrophobicContact CE2-CD1 4.04Å; F335-L339 HydrophobicContact CE2-CD2 4.31Å; F335-L339 HydrophobicContact CE2-CG 4.01Å; F335-L339 HydrophobicContact CZ-CD1 3.37Å; F335-L339 HydrophobicContact CZ-CD2 4.21Å; F335-L339 HydrophobicContact CZ-CG 3.86Å; F335-L339 PolarHBondContact O-N 2.84Å; F335-W376 AromaticContact CE1-CD1 3.79Å; F335-W376 HydrophobicContact CE1-CG 4.2Å; F335-W376 AromaticContact CE1-NE1 3.83Å; F335-W376 HydrophobicContact CZ-CB 4.49Å; F335-W376 AromaticContact CZ-CD1 3.95Å; F335-W376 HydrophobicContact CZ-CG 4.11Å
336	K	96.5	Very high	92.4	Very high	70 Å²	70	61.6 Å²	61.6	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-37.2	176.3	-75	-61.6	-60.4	169.1	0	112.5	Y332 N333 H334 L339 S340 W376	Y332-K336 HydrophobicContact CD1-CG 4.05Å; Y332-K336 HydrophobicContact CE1-CD 4.2Å; Y332-K336 HydrophobicContact CE1-CG 3.56Å; Y332-K336 HydrophobicContact CE2-CD 4.32Å; Y332-K336 HydrophobicContact CE2-CG 4.2Å; Y332-K336 WeakPolarHBondContact O-CB 3.42Å; Y332-K336 WeakPolarHBondContact O-CG 3.47Å; Y332-K336 PolarHBondContact O-N 3.06Å; N333-K336 PolarHBondContact O-N 3.13Å; H334-K336 VanDerWaalsContact C-N 3.33Å; H334-K336 PolarHBondContact O-N 3.43Å; K336-L339 HydrophobicContact CD-CD1 4.2Å; K336-S340 PolarHBondContact O-N 2.91Å; K336-S340 VanDerWaalsContact O-N 3.11Å; K336-W376 HydrophobicContact CD-CH2 4.32Å; K336-W376 HydrophobicContact CD-CZ2 3.92Å
337	H	97.1	Very high	92.6	Very high	101 Å²	101	59.6 Å²	59.6	47%	0.468	30%	0.302	S	S	.	.	H	α-helix	trans	-64.6	-48.4	174.4	-175.3	65	0	0	0	111.3	N333 H334 F335 L339 S340 Q341	N333-H337 PolarHBondContact O-N 3Å; H334-H337 WeakPolarHBondContact O-CA 3.43Å; H334-H337 WeakPolarHBondContact O-CB 3.37Å; H334-H337 PolarHBondContact O-N 3.18Å; F335-H337 VanDerWaalsContact C-N 3.3Å; F335-H337 PolarHBondContact O-N 3.34Å; H337-L339 VanDerWaalsContact C-N 3.32Å; H337-L339 PolarHBondContact O-N 2.83Å; H337-S340 WeakPolarHBondContact O-CB 3.5Å; H337-S340 PolarHBondContact O-N 2.83Å; H337-S340 VanDerWaalsContact O-N 3.17Å; H337-Q341 PolarHBondContact NE2-NE2 3.06Å; H337-Q341 WeakPolarHBondContact O-CG 3.33Å; H337-Q341 PolarHBondContact O-N 2.81Å
338	C	97.6	Very high	92.5	Very high	4 Å²	4	57.2 Å²	57.2	3%	0.027	30%	0.303	C	S	.	.	H	α-helix	trans	-60.8	-38.3	176.4	-61.1	0	0	0	0	112.5	F294 H334 F335 Q341 L342	F294-C338 HydrophobicContact CB-CB 4.42Å; F294-C338 HydrophobicContact CD1-CB 4.01Å; F294-C338 HydrophobicContact CD2-CB 3.37Å; F294-C338 HydrophobicContact CE1-CB 4.1Å; F294-C338 HydrophobicContact CE2-CB 3.48Å; F294-C338 VanDerWaalsContact CE2-CB 3.48Å; F294-C338 HydrophobicContact CG-CB 3.66Å; F294-C338 HydrophobicContact CZ-CB 3.87Å; H334-C338 PolarHBondContact O-N 3.27Å; H334-C338 PolarHBondContact O-SG 3.48Å; H334-C338 VanDerWaalsContact O-SG 3.33Å; F335-C338 PolarHBondContact O-N 2.93Å; C338-Q341 PolarHBondContact O-N 3.48Å; C338-L342 WeakPolarHBondContact O-CB 3.37Å; C338-L342 PolarHBondContact O-N 3.25Å
339	L	96.6	Very high	92.7	Very high	3 Å²	3	64 Å²	64	2%	0.016	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-46.1	173.2	-81.1	176.8	0	0	0	112.2	F294 F335 K336 H337 L342 Q343 V354 W376 I378	F294-L339 HydrophobicContact CE1-CD2 3.8Å; F294-L339 HydrophobicContact CE1-CG 4.15Å; F294-L339 HydrophobicContact CZ-CD2 3.76Å; F294-L339 HydrophobicContact CZ-CG 3.79Å; F335-L339 HydrophobicContact CD1-CD1 3.98Å; F335-L339 HydrophobicContact CD2-CG 4.46Å; F335-L339 HydrophobicContact CE1-CD1 3.33Å; F335-L339 HydrophobicContact CE1-CG 4.15Å; F335-L339 HydrophobicContact CE2-CD1 4.04Å; F335-L339 HydrophobicContact CE2-CD2 4.31Å; F335-L339 HydrophobicContact CE2-CG 4.01Å; F335-L339 HydrophobicContact CZ-CD1 3.37Å; F335-L339 HydrophobicContact CZ-CD2 4.21Å; F335-L339 HydrophobicContact CZ-CG 3.86Å; F335-L339 PolarHBondContact O-N 2.84Å; K336-L339 HydrophobicContact CD-CD1 4.2Å; H337-L339 VanDerWaalsContact C-N 3.32Å; H337-L339 PolarHBondContact O-N 2.83Å; L339-L342 PolarHBondContact O-N 3.14Å; L339-Q343 PolarHBondContact O-N 2.9Å; L339-V354 HydrophobicContact CD1-CG1 4.34Å; L339-V354 HydrophobicContact CD2-CG1 4.03Å; L339-V354 HydrophobicContact CD2-CG2 4.3Å; L339-W376 HydrophobicContact CD1-CD2 3.95Å; L339-W376 HydrophobicContact CD1-CE3 3.99Å; L339-W376 HydrophobicContact CD1-CG 4.35Å; L339-I378 HydrophobicContact CD2-CD1 3.56Å; L339-I378 HydrophobicContact CD2-CG1 4.08Å
340	S	96.8	Very high	92.8	Very high	57 Å²	57	63.6 Å²	63.6	40%	0.399	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-47.4	176.9	-168.9	0	0	0	0	110.5	K336 H337 L342 Q343 D344	K336-S340 PolarHBondContact O-N 2.91Å; K336-S340 VanDerWaalsContact O-N 3.11Å; H337-S340 WeakPolarHBondContact O-CB 3.5Å; H337-S340 PolarHBondContact O-N 2.83Å; H337-S340 VanDerWaalsContact O-N 3.17Å; S340-L342 VanDerWaalsContact C-N 3.31Å; S340-L342 PolarHBondContact O-N 3.38Å; S340-Q343 WeakPolarHBondContact O-CB 3.46Å; S340-Q343 PolarHBondContact O-N 2.96Å; S340-Q343 VanDerWaalsContact O-N 3.12Å; S340-D344 WeakPolarHBondContact O-CB 3.39Å; S340-D344 PolarHBondContact O-N 3.03Å; S340-D344 VanDerWaalsContact O-OD2 3.13Å; S340-D344 PolarHBondContact OG-OD2 3.22Å
341	Q	96.3	Very high	93.2	Very high	102 Å²	102	67.5 Å²	67.5	48%	0.477	33%	0.334	S	S	.	.	H	α-helix	trans	-57.5	-44.7	177.8	-72.7	-178.4	-36	0	0	111.6	H337 C338 Q343 D344 I345	H337-Q341 PolarHBondContact NE2-NE2 3.06Å; H337-Q341 WeakPolarHBondContact O-CG 3.33Å; H337-Q341 PolarHBondContact O-N 2.81Å; C338-Q341 PolarHBondContact O-N 3.48Å; Q341-Q343 VanDerWaalsContact C-N 3.31Å; Q341-Q343 PolarHBondContact O-N 3.13Å; Q341-D344 PolarHBondContact O-N 3.09Å; Q341-I345 WeakPolarHBondContact O-CG1 2.97Å; Q341-I345 PolarHBondContact O-N 3.3Å
342	L	95.4	Very high	93.5	Very high	6 Å²	6	66.7 Å²	66.7	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-61.2	-40	177.8	-173.5	71.8	0	0	0	112	F294 C338 L339 S340 D344 I345 F352 I378	F294-L342 HydrophobicContact CD1-CB 4.14Å; F294-L342 HydrophobicContact CD1-CD2 3.96Å; F294-L342 HydrophobicContact CD1-CG 4.48Å; F294-L342 HydrophobicContact CE1-CB 4.34Å; F294-L342 HydrophobicContact CE1-CD2 3.98Å; C338-L342 WeakPolarHBondContact O-CB 3.37Å; C338-L342 PolarHBondContact O-N 3.25Å; L339-L342 PolarHBondContact O-N 3.14Å; S340-L342 VanDerWaalsContact C-N 3.31Å; S340-L342 PolarHBondContact O-N 3.38Å; L342-D344 VanDerWaalsContact C-N 3.34Å; L342-I345 HydrophobicContact CD1-CD1 4.11Å; L342-F352 HydrophobicContact CD1-CD1 4.14Å; L342-F352 HydrophobicContact CD1-CD2 4.03Å; L342-F352 HydrophobicContact CD1-CE1 4.06Å; L342-F352 HydrophobicContact CD1-CE2 3.97Å; L342-F352 HydrophobicContact CD1-CG 4.12Å; L342-F352 HydrophobicContact CD1-CZ 3.99Å; L342-F352 HydrophobicContact CD2-CD1 3.92Å; L342-F352 HydrophobicContact CD2-CE1 4.35Å; L342-F352 HydrophobicContact CD2-CG 4.23Å; L342-F352 HydrophobicContact CG-CB 4.17Å; L342-F352 HydrophobicContact CG-CD1 3.93Å; L342-F352 HydrophobicContact CG-CD2 4.08Å; L342-F352 HydrophobicContact CG-CE1 4.35Å; L342-F352 HydrophobicContact CG-CG 3.78Å; L342-F352 WeakPolarHBondContact O-CD2 3.38Å; L342-I378 HydrophobicContact CD2-CD1 4.14Å; L342-I378 HydrophobicContact CD2-CG2 4.1Å
343	Q	94.7	Very high	93.6	Very high	98 Å²	98	70.3 Å²	70.3	46%	0.458	34%	0.343	S	S	.	.	H	α-helix	trans	-68.5	-33.2	177.6	-176	173.1	-13.2	0	0	112.7	L339 S340 Q341 I345 V354	L339-Q343 PolarHBondContact O-N 2.9Å; S340-Q343 WeakPolarHBondContact O-CB 3.46Å; S340-Q343 PolarHBondContact O-N 2.96Å; S340-Q343 VanDerWaalsContact O-N 3.12Å; Q341-Q343 VanDerWaalsContact C-N 3.31Å; Q341-Q343 PolarHBondContact O-N 3.13Å; Q343-I345 VanDerWaalsContact C-N 3.3Å; Q343-I345 PolarHBondContact O-N 2.82Å; Q343-V354 HydrophobicContact CB-CG2 4.13Å
344	D	94.4	Very high	93.8	Very high	108 Å²	108	66.9 Å²	66.9	58%	0.578	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	2.1	-177.9	-62.1	-30.1	0	0	0	113.1	S340 Q341 L342 E346	S340-D344 WeakPolarHBondContact O-CB 3.39Å; S340-D344 PolarHBondContact O-N 3.03Å; S340-D344 VanDerWaalsContact O-OD2 3.13Å; S340-D344 PolarHBondContact OG-OD2 3.22Å; Q341-D344 PolarHBondContact O-N 3.09Å; L342-D344 VanDerWaalsContact C-N 3.34Å; D344-E346 PolarHBondContact O-N 3.09Å
345	I	92.9	Very high	93.9	Very high	56 Å²	56	68.4 Å²	68.4	29%	0.287	33%	0.332	S	S	.	.			trans	-68.9	120.1	176.4	-69.7	174.1	0	0	0	110.2	Y298 Q341 L342 Q343 D347	Y298-I345 HydrophobicContact CD2-CD1 3.78Å; Y298-I345 HydrophobicContact CE2-CD1 4.08Å; Y298-I345 HydrophobicContact CE2-CG2 4.17Å; Q341-I345 WeakPolarHBondContact O-CG1 2.97Å; Q341-I345 PolarHBondContact O-N 3.3Å; L342-I345 HydrophobicContact CD1-CD1 4.11Å; Q343-I345 VanDerWaalsContact C-N 3.3Å; Q343-I345 PolarHBondContact O-N 2.82Å; I345-D347 HydrophobicContact CG2-CB 3.98Å
346	E	87.3	Confident	93.9	Very high	192 Å²	192	72.4 Å²	72.4	90%	0.897	35%	0.35	S	S	*	.			trans	-122	60.4	174.9	-64.3	-174.7	170	0	0	110.6	D344	D344-E346 PolarHBondContact O-N 3.09Å
347	D	87.6	Confident	94	Very high	60 Å²	60	70.1 Å²	70.1	32%	0.321	34%	0.342	S	S	.	.	S	Bend	trans	-96.4	0.2	-178.3	71.3	-7.9	0	0	0	114.1	Y298 I345 R349	Y298-D347 WeakPolarHBondContact CE2-OD2 3.44Å; Y298-D347 VanDerWaalsContact CZ-OD2 3.28Å; Y298-D347 PolarHBondContact OH-OD2 3.49Å; I345-D347 HydrophobicContact CG2-CB 3.98Å; D347-R349 VanDerWaalsContact C-N 3.26Å; D347-R349 PolarHBondContact O-N 2.79Å; D347-R349 WeakPolarHBondContact OD1-CB 3.48Å; D347-R349 PolarHBondContact OD1-N 3.22Å
348	G	82.4	Confident	93.9	Very high	52 Å²	52	69 Å²	69	54%	0.536	35%	0.345	S	S	.	.	S	Bend	trans	73.5	7.9	-178.6	0	0	0	0	0	115.1
349	R	86.7	Confident	93.8	Very high	160 Å²	160	71 Å²	71	60%	0.604	36%	0.355	S	S	*	.	S	Bend	trans	-96.4	-50.4	179.5	-59.8	-175.1	-179	-163.7	-0.8	112.1	D347 L383	D347-R349 VanDerWaalsContact C-N 3.26Å; D347-R349 PolarHBondContact O-N 2.79Å; D347-R349 WeakPolarHBondContact OD1-CB 3.48Å; D347-R349 PolarHBondContact OD1-N 3.22Å; R349-L383 PolarHBondContact O-N 3.22Å
350	C	90.2	Very high	93.6	Very high	1 Å²	1	77.8 Å²	77.8	1%	0.007	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	139.7	-173.6	-168.7	0	0	0	0	110	F352 S381	C350-F352 HydrophobicContact CB-CE2 3.91Å; C350-F352 HydrophobicContact CB-CZ 4.03Å; C350-S381 WeakPolarHBondContact CA-O 3.43Å; C350-S381 PolarHBondContact SG-O 3.4Å
351	R	94.4	Very high	93.5	Very high	156 Å²	156	76.3 Å²	76.3	59%	0.589	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.7	173.9	-177.7	176.3	63	-162.5	-3.8	109.6	S381 L383	R351-S381 PolarHBondContact N-O 3.02Å; R351-S381 PolarHBondContact O-N 3.07Å; R351-L383 HydrophobicContact CB-CD1 4.38Å; R351-L383 HydrophobicContact CB-CD2 4.17Å; R351-L383 HydrophobicContact CB-CG 4.3Å
352	F	96.4	Very high	93.4	Very high	10 Å²	10	73.2 Å²	73.2	4%	0.044	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133	177.5	-61.5	-87	0	0	0	111	Y298 C301 L342 C350 I378 T379 A380	Y298-F352 AromaticContact CD2-CE2 3.94Å; Y298-F352 HydrophobicContact CD2-CE2 3.94Å; Y298-F352 HydrophobicContact CD2-CZ 4.08Å; Y298-F352 HydrophobicContact CE2-CE2 4.48Å; C301-F352 HydrophobicContact CB-CE1 3.7Å; C301-F352 HydrophobicContact CB-CZ 3.95Å; L342-F352 HydrophobicContact CD1-CD1 4.14Å; L342-F352 HydrophobicContact CD1-CD2 4.03Å; L342-F352 HydrophobicContact CD1-CE1 4.06Å; L342-F352 HydrophobicContact CD1-CE2 3.97Å; L342-F352 HydrophobicContact CD1-CG 4.12Å; L342-F352 HydrophobicContact CD1-CZ 3.99Å; L342-F352 HydrophobicContact CD2-CD1 3.92Å; L342-F352 HydrophobicContact CD2-CE1 4.35Å; L342-F352 HydrophobicContact CD2-CG 4.23Å; L342-F352 HydrophobicContact CG-CB 4.17Å; L342-F352 HydrophobicContact CG-CD1 3.93Å; L342-F352 HydrophobicContact CG-CD2 4.08Å; L342-F352 HydrophobicContact CG-CE1 4.35Å; L342-F352 HydrophobicContact CG-CG 3.78Å; L342-F352 WeakPolarHBondContact O-CD2 3.38Å; C350-F352 HydrophobicContact CB-CE2 3.91Å; C350-F352 HydrophobicContact CB-CZ 4.03Å; F352-I378 HydrophobicContact CB-CG2 4.42Å; F352-I378 HydrophobicContact CD1-CG2 4.08Å; F352-T379 CarbonylContact C-O 3.57Å; F352-T379 WeakPolarHBondContact CA-O 3.32Å; F352-A380 HydrophobicContact CD1-CB 3.8Å; F352-A380 HydrophobicContact CE1-CB 3.62Å
353	K	97	Very high	93.3	Very high	107 Å²	107	76.6 Å²	76.6	47%	0.465	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.4	170.8	-175	-169.3	177.4	-149.8	0	108.7	E355 I378 T379	K353-E355 HydrophobicContact CD-CG 4.44Å; K353-E355 WeakPolarHBondContact CE-OE1 3.42Å; K353-E355 WeakPolarHBondContact CE-OE2 3.26Å; K353-E355 HydrophobicContact CG-CG 4.39Å; K353-E355 IonicContact NZ-OE1 2.83Å; K353-E355 PolarHBondContact NZ-OE1 3Å; K353-E355 IonicContact NZ-OE2 3.01Å; K353-E355 PolarHBondContact NZ-OE2 2.61Å; K353-I378 CarbonylContact O-C 3.49Å; K353-I378 VanDerWaalsContact O-CA 3.28Å; K353-I378 WeakPolarHBondContact O-CA 3.48Å; K353-T379 PolarHBondContact N-O 3.31Å; K353-T379 PolarHBondContact O-N 2.9Å
354	V	97.7	Very high	93.3	Very high	22 Å²	22	72.4 Å²	72.4	13%	0.133	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.5	-178.9	-177.7	0	0	0	0	109.9	L339 Q343 W376 I378	L339-V354 HydrophobicContact CD1-CG1 4.34Å; L339-V354 HydrophobicContact CD2-CG1 4.03Å; L339-V354 HydrophobicContact CD2-CG2 4.3Å; Q343-V354 HydrophobicContact CB-CG2 4.13Å; V354-W376 HydrophobicContact CG1-CE3 3.68Å; V354-W376 HydrophobicContact CG1-CZ3 4.02Å; V354-I378 HydrophobicContact CG2-CG1 4.36Å; V354-I378 HydrophobicContact CG2-CG2 4.22Å
355	E	97.6	Very high	93.2	Very high	71 Å²	71	67.3 Å²	67.3	33%	0.332	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	142.8	-179	-62.8	-179.3	102.2	0	0	110.2	K353 K377	K353-E355 HydrophobicContact CD-CG 4.44Å; K353-E355 WeakPolarHBondContact CE-OE1 3.42Å; K353-E355 WeakPolarHBondContact CE-OE2 3.26Å; K353-E355 HydrophobicContact CG-CG 4.39Å; K353-E355 IonicContact NZ-OE1 2.83Å; K353-E355 PolarHBondContact NZ-OE1 3Å; K353-E355 IonicContact NZ-OE2 3.01Å; K353-E355 PolarHBondContact NZ-OE2 2.61Å; E355-K377 PolarHBondContact N-O 3.42Å; E355-K377 PolarHBondContact O-N 3.12Å
356	H	97	Very high	93	Very high	84 Å²	84	70.1 Å²	70.1	39%	0.389	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.3	169.7	-177.4	-84.5	0	0	0	109.2	W376	H356-W376 HydrophobicContact CB-CE3 4.42Å; H356-W376 HydrophobicContact CB-CH2 4.13Å; H356-W376 HydrophobicContact CB-CZ3 4.07Å; H356-W376 AromaticContact CD2-CE2 3.97Å; H356-W376 AromaticContact CD2-CZ2 3.84Å
357	V	97.1	Very high	93.2	Very high	22 Å²	22	62.4 Å²	62.4	13%	0.133	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-91.6	120.2	178.6	-175.4	0	0	0	0	108.9	F176 L375 K377	F176-V357 HydrophobicContact CE2-CG1 4.07Å; V357-L375 HydrophobicContact CB-CB 4.07Å; V357-L375 HydrophobicContact CB-CD2 3.89Å; V357-L375 HydrophobicContact CB-CG 3.86Å; V357-L375 WeakPolarHBondContact CB-O 3.43Å; V357-L375 HydrophobicContact CG1-CD2 3.79Å; V357-L375 HydrophobicContact CG1-CG 4.34Å; V357-L375 HydrophobicContact CG2-CD2 4.31Å; V357-L375 HydrophobicContact CG2-CG 4.08Å; V357-L375 PolarHBondContact N-O 3.04Å; V357-K377 HydrophobicContact CG2-CB 3.62Å
358	P	95.8	Very high	93.3	Very high	79 Å²	79	64.7 Å²	64.7	51%	0.513	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-61.1	140.1	173.8	-21.3	33.5	0	0	0	111.4	N360	P358-N360 PolarHBondContact O-N 2.87Å; P358-N360 VanDerWaalsContact O-N 3.15Å; P358-N360 PolarHBondContact O-OD1 2.77Å
359	L	94.8	Very high	93.7	Very high	46 Å²	46	65 Å²	65	24%	0.241	31%	0.307	C	S	.	.	S	Bend	trans	-87.4	33.4	-177.8	-52.9	-173	0	0	0	113.2	L172 F361 R369 L373 L375	L172-L359 HydrophobicContact CD1-CD1 4.14Å; L172-L359 HydrophobicContact CD1-CD2 4.17Å; L172-L359 HydrophobicContact CD2-CD1 4.3Å; L172-L359 HydrophobicContact CD2-CD2 4.07Å; L172-L359 HydrophobicContact CG-CD2 4.48Å; L359-F361 VanDerWaalsContact C-N 3.28Å; L359-F361 HydrophobicContact CB-CE1 4.34Å; L359-F361 HydrophobicContact CD2-CE1 3.78Å; L359-F361 HydrophobicContact CD2-CZ 4.02Å; L359-F361 PolarHBondContact O-N 3.23Å; L359-R369 PolarHBondContact O-NH1 3.42Å; L359-L373 HydrophobicContact CD1-CB 4.42Å; L359-L373 WeakPolarHBondContact CD1-O 3.47Å; L359-L375 HydrophobicContact CD2-CB 3.8Å
360	N	93.6	Very high	93.9	Very high	145 Å²	145	58.9 Å²	58.9	78%	0.775	29%	0.286	S	S	*	.			trans	-89.1	16.1	-176.5	67.6	-33.4	0	0	0	113.9	P358	P358-N360 PolarHBondContact O-N 2.87Å; P358-N360 VanDerWaalsContact O-N 3.15Å; P358-N360 PolarHBondContact O-OD1 2.77Å
361	F	94.3	Very high	94	Very high	25 Å²	25	67.2 Å²	67.2	11%	0.11	33%	0.325	C	S	.	.	S	Bend	trans	-87.8	155.5	173.4	53.1	-95.1	0	0	0	111.8	L172 D175 F176 S179 L359 R369 L375	L172-F361 HydrophobicContact CD1-CE2 4.23Å; L172-F361 HydrophobicContact CD1-CZ 3.8Å; L172-F361 HydrophobicContact CG-CZ 4.22Å; D175-F361 HydrophobicContact CB-CD2 4.1Å; D175-F361 HydrophobicContact CB-CE2 3.69Å; F176-F361 HydrophobicContact CB-CD2 4.42Å; F176-F361 HydrophobicContact CB-CE1 4.24Å; F176-F361 HydrophobicContact CB-CE2 3.96Å; F176-F361 HydrophobicContact CB-CZ 3.85Å; F176-F361 AromaticContact CD2-CD1 3.97Å; F176-F361 HydrophobicContact CD2-CD1 3.97Å; F176-F361 AromaticContact CD2-CE1 3.96Å; F176-F361 HydrophobicContact CD2-CE1 3.96Å; F176-F361 HydrophobicContact CD2-CG 4.43Å; F176-F361 HydrophobicContact CD2-CZ 4.43Å; S179-F361 WeakPolarHBondContact OG-CB 3.21Å; L359-F361 VanDerWaalsContact C-N 3.28Å; L359-F361 HydrophobicContact CB-CE1 4.34Å; L359-F361 HydrophobicContact CD2-CE1 3.78Å; L359-F361 HydrophobicContact CD2-CZ 4.02Å; L359-F361 PolarHBondContact O-N 3.23Å; F361-R369 PolarHBondContact O-NH1 3.49Å; F361-L375 HydrophobicContact CE1-CD2 4.11Å; F361-L375 HydrophobicContact CZ-CD2 4.4Å
362	S	94.3	Very high	94	Very high	38 Å²	38	63.2 Å²	63.2	27%	0.266	31%	0.313	S	S	.	.			trans	-54.2	148.7	-179.5	-65.1	0	0	0	0	112.6	D46 R369	D46-S362 WeakPolarHBondContact OD1-CB 3.31Å; D46-S362 PolarHBondContact OD1-OG 3.25Å; S362-R369 PolarHBondContact O-NH2 3.03Å
363	Q	93.9	Very high	93.9	Very high	76 Å²	76	63 Å²	63	36%	0.355	31%	0.312	S	S	.	.			trans	-102.7	113.1	175.4	175.7	166.2	-0.1	0	0	109.2	D175 L365 Y367	D175-Q363 WeakPolarHBondContact OD2-CA 3.37Å; D175-Q363 WeakPolarHBondContact OD2-CG 3.42Å; Q363-L365 VanDerWaalsContact CG-O 3.26Å; Q363-L365 WeakPolarHBondContact CG-O 3.31Å; Q363-L365 PolarHBondContact NE2-O 2.8Å; Q363-Y367 HydrophobicContact CG-CE1 4.29Å; Q363-Y367 PolarHBondContact NE2-O 2.95Å
364	F	93.5	Very high	93.9	Very high	11 Å²	11	58.8 Å²	58.8	5%	0.048	29%	0.294	C	S	.	.			trans	-98.8	-25.5	-175.9	-62.7	-91.5	0	0	0	111.9	I43 L44 D46 D175 L178	I43-F364 HydrophobicContact CG2-CB 4.29Å; I43-F364 HydrophobicContact CG2-CD1 4.4Å; L44-F364 WeakPolarHBondContact CB-O 3.5Å; L44-F364 WeakPolarHBondContact CG-O 3.49Å; L44-F364 PolarHBondContact N-O 3.36Å; L44-F364 VanDerWaalsContact O-CD1 3.3Å; L44-F364 WeakPolarHBondContact O-CD1 3.44Å; D46-F364 HydrophobicContact CB-CE1 3.96Å; D46-F364 HydrophobicContact CB-CZ 4.4Å; D175-F364 HydrophobicContact CB-CD2 4.42Å; D175-F364 WeakPolarHBondContact OD1-CA 3.33Å; D175-F364 WeakPolarHBondContact OD1-CB 3.47Å; D175-F364 PolarHBondContact OD1-N 2.74Å; L178-F364 HydrophobicContact CB-CB 4.42Å; L178-F364 HydrophobicContact CB-CD1 4.21Å; L178-F364 HydrophobicContact CB-CD2 3.54Å; L178-F364 HydrophobicContact CB-CE1 4.41Å; L178-F364 HydrophobicContact CB-CE2 3.76Å; L178-F364 HydrophobicContact CB-CG 3.8Å; L178-F364 HydrophobicContact CB-CZ 4.21Å; L178-F364 HydrophobicContact CD1-CB 3.57Å; L178-F364 HydrophobicContact CD1-CD1 4.46Å; L178-F364 HydrophobicContact CD1-CD2 4.26Å; L178-F364 HydrophobicContact CD1-CG 3.87Å; L178-F364 HydrophobicContact CG-CG 4.48Å
365	L	92.1	Very high	94	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	29%	0.288	C	S	.	.	S	Bend	trans	-105.7	142.8	179.1	-61.4	178.9	0	0	0	111.3	F41 I43 L171 A174 D175 I202 Q363 Y367	F41-L365 HydrophobicContact CB-CD2 4.23Å; I43-L365 HydrophobicContact CG1-CD2 4.24Å; L171-L365 HydrophobicContact CB-CD1 4.49Å; L171-L365 HydrophobicContact CD2-CD1 3.66Å; A174-L365 HydrophobicContact CB-CD1 3.65Å; D175-L365 PolarHBondContact OD1-N 2.74Å; I202-L365 HydrophobicContact CD1-CD1 4.28Å; Q363-L365 VanDerWaalsContact CG-O 3.26Å; Q363-L365 WeakPolarHBondContact CG-O 3.31Å; Q363-L365 PolarHBondContact NE2-O 2.8Å; L365-Y367 HydrophobicContact CB-CD1 4.1Å; L365-Y367 HydrophobicContact CB-CE1 4.35Å; L365-Y367 VanDerWaalsContact O-CD1 3.27Å; L365-Y367 WeakPolarHBondContact O-CD1 3.27Å; L365-Y367 PolarHBondContact O-N 2.96Å
366	L	89.7	Confident	94	Very high	115 Å²	115	55.5 Å²	55.5	60%	0.602	28%	0.276	S	S	*	.			trans	-80.6	103.9	176.5	-169.9	77.5	0	0	0	111
367	Y	90.3	Very high	94.1	Very high	29 Å²	29	54.8 Å²	54.8	11%	0.114	27%	0.272	C	S	.	.	S	Bend	trans	-157.5	172.3	170	70.9	-73.8	0	0	0	109.1	L171 L172 D175 Q363 L365 R369 L373	L171-Y367 HydrophobicContact CB-CD1 3.79Å; L171-Y367 HydrophobicContact CB-CD2 4.15Å; L171-Y367 HydrophobicContact CB-CE1 3.86Å; L171-Y367 HydrophobicContact CB-CE2 4.19Å; L171-Y367 HydrophobicContact CB-CG 3.97Å; L171-Y367 HydrophobicContact CD1-CD1 4.21Å; L171-Y367 HydrophobicContact CD1-CD2 4.23Å; L171-Y367 HydrophobicContact CD1-CG 3.79Å; L172-Y367 VanDerWaalsContact CA-OH 3.31Å; L172-Y367 WeakPolarHBondContact CA-OH 3.42Å; L172-Y367 WeakPolarHBondContact CD1-OH 3.41Å; D175-Y367 VanDerWaalsContact OD2-CE1 3.26Å; D175-Y367 WeakPolarHBondContact OD2-CE1 3.36Å; D175-Y367 PolarHBondContact OD2-OH 3.32Å; Q363-Y367 HydrophobicContact CG-CE1 4.29Å; Q363-Y367 PolarHBondContact NE2-O 2.95Å; L365-Y367 HydrophobicContact CB-CD1 4.1Å; L365-Y367 HydrophobicContact CB-CE1 4.35Å; L365-Y367 VanDerWaalsContact O-CD1 3.27Å; L365-Y367 WeakPolarHBondContact O-CD1 3.27Å; L365-Y367 PolarHBondContact O-N 2.96Å; Y367-R369 HydrophobicContact CE2-CB 4.2Å; Y367-R369 PolarHBondContact OH-NE 2.57Å; Y367-L373 HydrophobicContact CE2-CD1 3.89Å
368	E	89.7	Confident	94.1	Very high	108 Å²	108	53.8 Å²	53.8	51%	0.505	27%	0.266	S	S	.	.			trans	-89.7	112.4	176.9	-175.5	-167.6	-154.6	0	0	110.2	R168 I370	R168-E368 IonicContact CZ-OE2 2.74Å; R168-E368 PolarHBondContact NH1-O 3.1Å; R168-E368 VanDerWaalsContact NH1-O 3.15Å; R168-E368 IonicContact NH1-OE2 3.92Å; R168-E368 PolarHBondContact NH1-OE2 3.06Å; R168-E368 IonicContact NH2-OE2 3.36Å; R168-E368 PolarHBondContact NH2-OE2 2.83Å; E368-I370 HydrophobicContact CB-CG2 4.47Å; E368-I370 VanDerWaalsContact CD-CG2 3.5Å; E368-I370 HydrophobicContact CG-CG2 3.67Å; E368-I370 PolarHBondContact O-N 2.66Å; E368-I370 VanDerWaalsContact O-N 3.16Å
369	R	90.8	Very high	94.2	Very high	60 Å²	60	51.4 Å²	51.4	23%	0.226	25%	0.25	C	S	.	.			trans	-81.6	89.4	174.3	-167.8	-178	-69.8	-178.5	2	109.6	L172 D175 L359 F361 S362 Y367 L373	L172-R369 HydrophobicContact CD1-CG 4.09Å; D175-R369 IonicContact OD2-CZ 2.79Å; D175-R369 IonicContact OD2-NH2 2.73Å; D175-R369 PolarHBondContact OD2-NH2 3.47Å; L359-R369 PolarHBondContact O-NH1 3.42Å; F361-R369 PolarHBondContact O-NH1 3.49Å; S362-R369 PolarHBondContact O-NH2 3.03Å; Y367-R369 HydrophobicContact CE2-CB 4.2Å; Y367-R369 PolarHBondContact OH-NE 2.57Å; R369-L373 HydrophobicContact CG-CD1 4.24Å
370	I	92	Very high	94.3	Very high	30 Å²	30	49.3 Å²	49.3	15%	0.154	24%	0.239	C	C	.	.			trans	-80.1	160.9	-178.9	60.3	175.9	0	0	0	112.8	E315 E368 Q372 L373	E315-I370 HydrophobicContact CG-CD1 4.18Å; E368-I370 HydrophobicContact CB-CG2 4.47Å; E368-I370 VanDerWaalsContact CD-CG2 3.5Å; E368-I370 HydrophobicContact CG-CG2 3.67Å; E368-I370 PolarHBondContact O-N 2.66Å; E368-I370 VanDerWaalsContact O-N 3.16Å; I370-Q372 HydrophobicContact CD1-CB 3.92Å; I370-Q372 HydrophobicContact CG1-CB 4.19Å; I370-Q372 PolarHBondContact O-N 2.9Å; I370-L373 HydrophobicContact CG1-CD1 4.08Å; I370-L373 HydrophobicContact CG1-CG 3.88Å; I370-L373 WeakPolarHBondContact O-CB 3.33Å; I370-L373 PolarHBondContact O-N 3.48Å; I370-L373 VanDerWaalsContact O-N 3.16Å
371	E	91.8	Very high	94.4	Very high	176 Å²	176	44 Å²	44	82%	0.822	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.3	-179.8	-61.1	-177.4	169.9	0	0	113.9	L373	E371-L373 VanDerWaalsContact C-N 3.29Å
372	Q	94.1	Very high	94.2	Very high	73 Å²	73	45.1 Å²	45.1	34%	0.341	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.6	179.3	-68.1	72.7	21.9	0	0	112.7	E315 K316 I370	E315-Q372 HydrophobicContact CG-CB 4.38Å; K316-Q372 HydrophobicContact CB-CB 3.97Å; K316-Q372 HydrophobicContact CB-CG 4.3Å; K316-Q372 WeakPolarHBondContact CG-O 3.2Å; K316-Q372 PolarHBondContact N-O 3.11Å; I370-Q372 HydrophobicContact CD1-CB 3.92Å; I370-Q372 HydrophobicContact CG1-CB 4.19Å; I370-Q372 PolarHBondContact O-N 2.9Å
373	L	95.5	Very high	93.8	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	133.7	174.8	-75.2	169.6	0	0	0	110.3	R168 L172 E315 L359 Y367 R369 I370 E371	R168-L373 HydrophobicContact CB-CD1 4.4Å; R168-L373 HydrophobicContact CB-CD2 3.94Å; L172-L373 HydrophobicContact CD2-CB 3.94Å; L172-L373 HydrophobicContact CD2-CD2 4.44Å; E315-L373 HydrophobicContact CB-CD2 3.95Å; E315-L373 HydrophobicContact CG-CD2 4.36Å; L359-L373 HydrophobicContact CD1-CB 4.42Å; L359-L373 WeakPolarHBondContact CD1-O 3.47Å; Y367-L373 HydrophobicContact CE2-CD1 3.89Å; R369-L373 HydrophobicContact CG-CD1 4.24Å; I370-L373 HydrophobicContact CG1-CD1 4.08Å; I370-L373 HydrophobicContact CG1-CG 3.88Å; I370-L373 WeakPolarHBondContact O-CB 3.33Å; I370-L373 PolarHBondContact O-N 3.48Å; I370-L373 VanDerWaalsContact O-N 3.16Å; E371-L373 VanDerWaalsContact C-N 3.29Å
374	E	97.3	Very high	92.8	Very high	20 Å²	20	52.3 Å²	52.3	9%	0.093	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	155.3	175.1	-69.6	-165.9	167.5	0	0	111.5	S313 L314 K316 Y332 W376	S313-E374 WeakPolarHBondContact CA-O 3.45Å; L314-E374 HydrophobicContact CD2-CB 4.31Å; L314-E374 PolarHBondContact N-O 2.99Å; L314-E374 PolarHBondContact O-N 3.27Å; K316-E374 WeakPolarHBondContact CE-OE1 3.27Å; K316-E374 IonicContact NZ-OE1 2.77Å; K316-E374 PolarHBondContact NZ-OE1 2.87Å; Y332-E374 WeakPolarHBondContact CE2-OE2 3.41Å; Y332-E374 PolarHBondContact OH-OE1 3.36Å; Y332-E374 PolarHBondContact OH-OE2 2.91Å; E374-W376 WeakPolarHBondContact OE2-CZ2 3.5Å; E374-W376 PolarHBondContact OE2-NE1 3.05Å
375	L	98.3	Very high	91	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	124.2	172.7	-178.8	63.6	0	0	0	109.1	L172 L173 F176 F311 V357 L359 F361	L172-L375 HydrophobicContact CD2-CB 4.37Å; L173-L375 HydrophobicContact CD1-CD1 4.18Å; F176-L375 HydrophobicContact CB-CD2 3.91Å; F176-L375 HydrophobicContact CD1-CD2 3.85Å; F176-L375 HydrophobicContact CD2-CD2 3.63Å; F176-L375 HydrophobicContact CE1-CD2 4.26Å; F176-L375 HydrophobicContact CE2-CD2 4.08Å; F176-L375 HydrophobicContact CG-CD2 3.5Å; F176-L375 HydrophobicContact CZ-CD2 4.38Å; F311-L375 HydrophobicContact CB-CD1 4.41Å; V357-L375 HydrophobicContact CB-CB 4.07Å; V357-L375 HydrophobicContact CB-CD2 3.89Å; V357-L375 HydrophobicContact CB-CG 3.86Å; V357-L375 WeakPolarHBondContact CB-O 3.43Å; V357-L375 HydrophobicContact CG1-CD2 3.79Å; V357-L375 HydrophobicContact CG1-CG 4.34Å; V357-L375 HydrophobicContact CG2-CD2 4.31Å; V357-L375 HydrophobicContact CG2-CG 4.08Å; V357-L375 PolarHBondContact N-O 3.04Å; L359-L375 HydrophobicContact CD2-CB 3.8Å; F361-L375 HydrophobicContact CE1-CD2 4.11Å; F361-L375 HydrophobicContact CZ-CD2 4.4Å
376	W	98.5	Very high	88.7	Confident	24 Å²	24	65.4 Å²	65.4	9%	0.091	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.1	-180	-69.5	82.9	0	0	0	110.2	F311 I312 F335 K336 L339 V354 H356 E374	F311-W376 CarbonylContact C-O 3.59Å; F311-W376 WeakPolarHBondContact CA-O 3.46Å; I312-W376 PolarHBondContact N-O 3.4Å; I312-W376 PolarHBondContact O-N 3.4Å; F335-W376 AromaticContact CE1-CD1 3.79Å; F335-W376 HydrophobicContact CE1-CG 4.2Å; F335-W376 AromaticContact CE1-NE1 3.83Å; F335-W376 HydrophobicContact CZ-CB 4.49Å; F335-W376 AromaticContact CZ-CD1 3.95Å; F335-W376 HydrophobicContact CZ-CG 4.11Å; K336-W376 HydrophobicContact CD-CH2 4.32Å; K336-W376 HydrophobicContact CD-CZ2 3.92Å; L339-W376 HydrophobicContact CD1-CD2 3.95Å; L339-W376 HydrophobicContact CD1-CE3 3.99Å; L339-W376 HydrophobicContact CD1-CG 4.35Å; V354-W376 HydrophobicContact CG1-CE3 3.68Å; V354-W376 HydrophobicContact CG1-CZ3 4.02Å; H356-W376 HydrophobicContact CB-CE3 4.42Å; H356-W376 HydrophobicContact CB-CH2 4.13Å; H356-W376 HydrophobicContact CB-CZ3 4.07Å; H356-W376 AromaticContact CD2-CE2 3.97Å; H356-W376 AromaticContact CD2-CZ2 3.84Å; E374-W376 WeakPolarHBondContact OE2-CZ2 3.5Å; E374-W376 PolarHBondContact OE2-NE1 3.05Å
377	K	98.5	Very high	86.5	Confident	69 Å²	69	68.3 Å²	68.3	30%	0.3	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.5	172.3	178.4	-179.1	178.3	176.8	0	109.2	T309 V310 F311 E355 V357	T309-K377 HydrophobicContact CG2-CD 4.27Å; T309-K377 HydrophobicContact CG2-CG 3.88Å; V310-K377 CarbonylContact O-C 3.56Å; V310-K377 WeakPolarHBondContact O-CA 3.49Å; F311-K377 HydrophobicContact CD1-CB 4.12Å; F311-K377 HydrophobicContact CD1-CG 4.31Å; F311-K377 HydrophobicContact CE1-CB 3.95Å; F311-K377 HydrophobicContact CE1-CD 3.95Å; F311-K377 HydrophobicContact CE1-CG 3.81Å; F311-K377 HydrophobicContact CZ-CD 4.33Å; F311-K377 HydrophobicContact CZ-CG 4.37Å; E355-K377 PolarHBondContact N-O 3.42Å; E355-K377 PolarHBondContact O-N 3.12Å; V357-K377 HydrophobicContact CG2-CB 3.62Å
378	I	98.4	Very high	84	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.6	172.8	-46.4	170.5	0	0	0	107.6	T309 V310 I312 L339 L342 F352 K353 V354	T309-I378 CarbonylContact C-O 3.56Å; T309-I378 WeakPolarHBondContact CA-O 3.11Å; V310-I378 HydrophobicContact CB-CB 4.02Å; V310-I378 HydrophobicContact CB-CD1 4.47Å; V310-I378 HydrophobicContact CG2-CB 4.35Å; V310-I378 PolarHBondContact N-O 3.43Å; V310-I378 PolarHBondContact O-N 2.8Å; I312-I378 HydrophobicContact CD1-CD1 3.91Å; L339-I378 HydrophobicContact CD2-CD1 3.56Å; L339-I378 HydrophobicContact CD2-CG1 4.08Å; L342-I378 HydrophobicContact CD2-CD1 4.14Å; L342-I378 HydrophobicContact CD2-CG2 4.1Å; F352-I378 HydrophobicContact CB-CG2 4.42Å; F352-I378 HydrophobicContact CD1-CG2 4.08Å; K353-I378 CarbonylContact O-C 3.49Å; K353-I378 VanDerWaalsContact O-CA 3.28Å; K353-I378 WeakPolarHBondContact O-CA 3.48Å; V354-I378 HydrophobicContact CG2-CG1 4.36Å; V354-I378 HydrophobicContact CG2-CG2 4.22Å
379	T	97.6	Very high	81.8	Confident	29 Å²	29	75.8 Å²	75.8	18%	0.178	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.5	173.8	-51.2	0	0	0	0	108.6	F352 K353	F352-T379 CarbonylContact C-O 3.57Å; F352-T379 WeakPolarHBondContact CA-O 3.32Å; K353-T379 PolarHBondContact N-O 3.31Å; K353-T379 PolarHBondContact O-N 2.9Å
380	A	96.6	Very high	79.5	Confident	1 Å²	1	78 Å²	78	1%	0.008	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.8	173.9	0	0	0	0	0	109	C301 S307 C308 F352	C301-A380 HydrophobicContact CB-CB 3.67Å; S307-A380 CarbonylContact C-O 3.59Å; S307-A380 VanDerWaalsContact CA-O 3.23Å; S307-A380 WeakPolarHBondContact CA-O 3.45Å; C308-A380 PolarHBondContact N-O 3.21Å; C308-A380 PolarHBondContact O-N 3.22Å; F352-A380 HydrophobicContact CD1-CB 3.8Å; F352-A380 HydrophobicContact CE1-CB 3.62Å
381	S	94.4	Very high	77.3	Confident	33 Å²	33	82.3 Å²	82.3	23%	0.231	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.8	177.1	-58.1	0	0	0	0	109.6	C350 R351 L383	C350-S381 WeakPolarHBondContact CA-O 3.43Å; C350-S381 PolarHBondContact SG-O 3.4Å; R351-S381 PolarHBondContact N-O 3.02Å; R351-S381 PolarHBondContact O-N 3.07Å; S381-L383 PolarHBondContact O-N 2.93Å
382	P	91.4	Very high	75	Confident	50 Å²	50	78.7 Å²	78.7	33%	0.325	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	139.6	174.2	25.6	-32	0	0	0	109.5
383	L	86.2	Confident	72.5	Confident	73 Å²	73	86.7 Å²	86.7	38%	0.382	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-93.7	119.9	173.3	-67	170.5	0	0	0	107.3	R349 R351 S381 S385	R349-L383 PolarHBondContact O-N 3.22Å; R351-L383 HydrophobicContact CB-CD1 4.38Å; R351-L383 HydrophobicContact CB-CD2 4.17Å; R351-L383 HydrophobicContact CB-CG 4.3Å; S381-L383 PolarHBondContact O-N 2.93Å; L383-S385 PolarHBondContact O-N 2.83Å
384	E	71.3	Confident	71.3	Confident	191 Å²	191	90.8 Å²	90.8	89%	0.893	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-60.2	124.2	171.5	-69.1	-177	176.7	0	0	107.9	E386	E384-E386 PolarHBondContact O-N 3.19Å; E384-E386 VanDerWaalsContact O-N 3.1Å
385	S	57.1	Low	70	Confident	101 Å²	101	94.5 Å²	94.5	71%	0.706	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-60.9	118.9	166.1	53.2	0	0	0	0	106.4	L383 Q387	L383-S385 PolarHBondContact O-N 2.83Å; S385-Q387 VanDerWaalsContact C-N 3.25Å; S385-Q387 PolarHBondContact O-N 3.08Å
386	E	44.3	Very low	68.4	Low	186 Å²	186	99.8 Å²	99.8	87%	0.869	54%	0.541	S	S	*	.			trans	-53.9	101.4	165.4	-73.9	-176.2	161	0	0	106.1	E384 T388	E384-E386 PolarHBondContact O-N 3.19Å; E384-E386 VanDerWaalsContact O-N 3.1Å; E386-T388 VanDerWaalsContact C-N 3.28Å; E386-T388 PolarHBondContact O-N 3.2Å
387	Q	42.2	Very low	66.6	Low	177 Å²	177	104.2 Å²	104.2	83%	0.827	57%	0.568	S	S	*	*			trans	-57.4	106.4	163.4	-81.6	178.8	-2	0	0	104.3	S385 Q389	S385-Q387 VanDerWaalsContact C-N 3.25Å; S385-Q387 PolarHBondContact O-N 3.08Å; Q387-Q389 PolarHBondContact O-N 3.44Å
388	T	39	Very low	64.6	Low	124 Å²	124	106.4 Å²	106.4	76%	0.761	58%	0.584	S	S	*	*			trans	-53.5	94.3	164.5	39.8	0	0	0	0	107.2	E386 S390	E386-T388 VanDerWaalsContact C-N 3.28Å; E386-T388 PolarHBondContact O-N 3.2Å; T388-S390 PolarHBondContact O-N 3.23Å
389	Q	42.7	Very low	62.4	Low	169 Å²	169	113.5 Å²	113.5	79%	0.79	62%	0.623	S	S	*	*			trans	-58.7	77.4	143.8	-91	177.6	-38.4	0	0	106.4	Q387 D391	Q387-Q389 PolarHBondContact O-N 3.44Å; Q389-D391 PolarHBondContact O-N 2.82Å
390	S	42.1	Very low	59.9	Low	106 Å²	106	119.5 Å²	119.5	74%	0.741	66%	0.655	S	S	*	*			trans	-84	74.7	146	64.1	0	0	0	0	105.5	T388 S392	T388-S390 PolarHBondContact O-N 3.23Å; S390-S392 PolarHBondContact O-N 2.93Å
391	D	45.8	Very low	57.1	Low	122 Å²	122	128.6 Å²	128.6	65%	0.652	70%	0.704	S	S	*	*			trans	-54.6	129.5	158.1	-86.2	-34.3	0	0	0	107.2	Q389	Q389-D391 PolarHBondContact O-N 2.82Å
392	S	44	Very low	53.9	Low	99 Å²	99	136.6 Å²	136.6	69%	0.692	74%	0.744	S	S	*	*			trans	-30.7	130	160.8	41.2	0	0	0	0	114.1	S390	S390-S392 PolarHBondContact O-N 2.93Å
393	D	41.4	Very low	50.5	Low	241 Å²	241	144.5 Å²	144.5	100%	1.289	78%	0.782	S	S	*	*			trans	-157	0	130.2	-93.8	-21.7	0	0	0	111.1

Retrieved 393 of 393 residues in 100 ms (Link to these results)

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