X5M5V2_CAEEL Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession X5M5V2, Species CAEEL (Caenorhabditis elegans), Gene iglr-3, Length 353 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	80.1	Confident	90.4	Very high	131 Å²	131	90.7 Å²	90.7	65%	0.645	47%	0.47	S	S	*	.				0	-3.5	0	-67.8	169.9	177.1	0	0	112.4	H3 L4 M24 P26	M1-H3 VanDerWaalsContact C-N 3.25Å; M1-H3 PolarHBondContact O-N 2.9Å; M1-H3 VanDerWaalsContact O-N 3.09Å; M1-L4 HydrophobicContact CB-CD1 4.18Å; M1-L4 HydrophobicContact CG-CD1 4.38Å; M1-L4 WeakPolarHBondContact O-CB 3.46Å; M1-L4 WeakPolarHBondContact O-CG 3.46Å; M1-L4 PolarHBondContact O-N 3.26Å; M1-L4 VanDerWaalsContact O-N 3.09Å; M1-M24 CarbonylContact C-O 3.3Å; M1-M24 PolarHBondContact N-O 3.44Å; M1-P26 WeakPolarHBondContact O-CG 3.39Å
2	S	80.6	Confident	90.9	Very high	48 Å²	48	87.3 Å²	87.3	34%	0.336	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-28.3	-174.5	45.1	0	0	0	0	116	L4 M24	S2-L4 VanDerWaalsContact C-N 3.26Å; S2-L4 PolarHBondContact O-N 2.72Å; S2-M24 PolarHBondContact N-O 3.29Å; S2-M24 VanDerWaalsContact N-O 3.1Å
3	H	86.9	Confident	91.3	Very high	167 Å²	167	81.7 Å²	81.7	77%	0.773	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-4.1	-179.5	-55.2	-67.5	0	0	0	114.3	M1 E5	M1-H3 VanDerWaalsContact C-N 3.25Å; M1-H3 PolarHBondContact O-N 2.9Å; M1-H3 VanDerWaalsContact O-N 3.09Å; H3-E5 VanDerWaalsContact C-N 3.32Å; H3-E5 PolarHBondContact O-N 3.08Å
4	L	87.8	Confident	91.8	Very high	90 Å²	90	87 Å²	87	47%	0.471	45%	0.447	S	S	.	.			trans	-84.9	72.7	-177.9	-59.1	175.3	0	0	0	110.5	M1 S2 S6 L7 P26	M1-L4 HydrophobicContact CB-CD1 4.18Å; M1-L4 HydrophobicContact CG-CD1 4.38Å; M1-L4 WeakPolarHBondContact O-CB 3.46Å; M1-L4 WeakPolarHBondContact O-CG 3.46Å; M1-L4 PolarHBondContact O-N 3.26Å; M1-L4 VanDerWaalsContact O-N 3.09Å; S2-L4 VanDerWaalsContact C-N 3.26Å; S2-L4 PolarHBondContact O-N 2.72Å; L4-S6 VanDerWaalsContact C-N 3.28Å; L4-S6 PolarHBondContact O-N 3.39Å; L4-L7 HydrophobicContact CB-CB 3.96Å; L4-L7 HydrophobicContact CB-CD2 4.36Å; L4-L7 HydrophobicContact CD1-CD2 4.13Å; L4-L7 VanDerWaalsContact O-CB 3.27Å; L4-L7 WeakPolarHBondContact O-CB 3.32Å; L4-L7 PolarHBondContact O-N 3.07Å; L4-L7 VanDerWaalsContact O-N 3.09Å; L4-P26 HydrophobicContact CB-CG 4.25Å; L4-P26 WeakPolarHBondContact O-CB 3.4Å
5	E	88.1	Confident	92.1	Very high	123 Å²	123	86.9 Å²	86.9	58%	0.575	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.8	-172	-61.2	-175.7	177	0	0	114.2	H3 L7 R8 F27 N28	H3-E5 VanDerWaalsContact C-N 3.32Å; H3-E5 PolarHBondContact O-N 3.08Å; E5-L7 VanDerWaalsContact C-N 3.33Å; E5-R8 PolarHBondContact O-NH1 3.15Å; E5-F27 HydrophobicContact CG-CE1 4.17Å; E5-F27 HydrophobicContact CG-CZ 4.44Å; E5-N28 PolarHBondContact O-ND2 3.29Å
6	S	93	Very high	92.4	Very high	109 Å²	109	93.9 Å²	93.9	76%	0.762	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-12.1	176.5	-53.3	0	0	0	0	113.3	L4 R8	L4-S6 VanDerWaalsContact C-N 3.28Å; L4-S6 PolarHBondContact O-N 3.39Å; S6-R8 PolarHBondContact O-N 3.22Å; S6-R8 PolarHBondContact O-NH1 3.07Å
7	L	94.6	Very high	92.6	Very high	56 Å²	56	91.9 Å²	91.9	29%	0.293	46%	0.457	S	S	.	.			trans	-67.7	133.1	-176.2	-159.8	69.4	0	0	0	110.2	L4 E5 V10 P26 L29	L4-L7 HydrophobicContact CB-CB 3.96Å; L4-L7 HydrophobicContact CB-CD2 4.36Å; L4-L7 HydrophobicContact CD1-CD2 4.13Å; L4-L7 VanDerWaalsContact O-CB 3.27Å; L4-L7 WeakPolarHBondContact O-CB 3.32Å; L4-L7 PolarHBondContact O-N 3.07Å; L4-L7 VanDerWaalsContact O-N 3.09Å; E5-L7 VanDerWaalsContact C-N 3.33Å; L7-V10 HydrophobicContact CD2-CG2 3.44Å; L7-V10 VanDerWaalsContact CD2-CG2 3.44Å; L7-V10 HydrophobicContact CG-CG2 4.23Å; L7-P26 HydrophobicContact CB-CG 4.25Å; L7-P26 HydrophobicContact CD2-CG 4.01Å; L7-L29 HydrophobicContact CB-CD2 4.39Å; L7-L29 HydrophobicContact CD2-CD2 4.22Å; L7-L29 HydrophobicContact CG-CD2 4.1Å
8	R	95.7	Very high	92.7	Very high	95 Å²	95	93.4 Å²	93.4	36%	0.358	47%	0.466	S	S	.	.			trans	-118.6	-33.3	179.9	-62.1	-57	-172.7	-102.6	-0.9	112.9	E5 S6 N28 E30 V31	E5-R8 PolarHBondContact O-NH1 3.15Å; S6-R8 PolarHBondContact O-N 3.22Å; S6-R8 PolarHBondContact O-NH1 3.07Å; R8-N28 WeakPolarHBondContact CD-O 3.47Å; R8-E30 VanDerWaalsContact CD-OE1 3.31Å; R8-E30 WeakPolarHBondContact CD-OE1 3.37Å; R8-E30 IonicContact NE-OE1 3.87Å; R8-E30 PolarHBondContact NE-OE1 2.82Å; R8-E30 PolarHBondContact O-N 3.02Å; R8-V31 PolarHBondContact O-N 3.31Å
9	L	96.5	Very high	92.7	Very high	86 Å²	86	92.6 Å²	92.6	45%	0.45	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134	-178.2	-177	150.9	0	0	0	110.1	D11 V31	L9-D11 HydrophobicContact CD2-CB 4.18Å; L9-V31 WeakPolarHBondContact CA-O 3.37Å; L9-V31 HydrophobicContact CB-CB 4.17Å; L9-V31 HydrophobicContact CD1-CB 3.93Å; L9-V31 HydrophobicContact CD1-CG1 3.82Å; L9-V31 HydrophobicContact CD1-CG2 4.33Å; L9-V31 HydrophobicContact CG-CB 3.88Å; L9-V31 HydrophobicContact CG-CG1 3.94Å
10	V	95.1	Very high	92.6	Very high	11 Å²	11	89.4 Å²	89.4	7%	0.067	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	120.2	168.5	168.8	0	0	0	0	108.3	L7 L12 L29 V31 V32 R33	L7-V10 HydrophobicContact CD2-CG2 3.44Å; L7-V10 VanDerWaalsContact CD2-CG2 3.44Å; L7-V10 HydrophobicContact CG-CG2 4.23Å; V10-L12 HydrophobicContact CG1-CD1 3.82Å; V10-L12 HydrophobicContact CG1-CD2 4.37Å; V10-L12 HydrophobicContact CG1-CG 3.68Å; V10-L29 HydrophobicContact CB-CD2 4.37Å; V10-L29 HydrophobicContact CG2-CD1 4.09Å; V10-L29 HydrophobicContact CG2-CD2 3.64Å; V10-V31 PolarHBondContact N-O 3.05Å; V10-V32 WeakPolarHBondContact O-CA 3.5Å; V10-R33 PolarHBondContact O-N 3.45Å
11	D	96.4	Very high	92.4	Very high	82 Å²	82	93.5 Å²	93.5	44%	0.439	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	114	171.2	-165.1	-16.9	0	0	0	109.3	L9 S13 R33	L9-D11 HydrophobicContact CD2-CB 4.18Å; D11-S13 WeakPolarHBondContact OD1-CB 3.29Å; D11-S13 PolarHBondContact OD1-N 2.99Å; D11-S13 PolarHBondContact OD1-OG 3.06Å; D11-R33 HydrophobicContact CB-CB 4.31Å
12	L	95.6	Very high	92.7	Very high	49 Å²	49	88.8 Å²	88.8	26%	0.257	44%	0.444	S	S	.	.			trans	-121.8	22.4	175.6	-57	171.4	0	0	0	110.5	V10 N15 L17 R33 L34 N37	V10-L12 HydrophobicContact CG1-CD1 3.82Å; V10-L12 HydrophobicContact CG1-CD2 4.37Å; V10-L12 HydrophobicContact CG1-CG 3.68Å; L12-N15 PolarHBondContact O-ND2 3.42Å; L12-L17 HydrophobicContact CB-CD1 3.8Å; L12-L17 HydrophobicContact CD1-CD1 4.02Å; L12-L17 HydrophobicContact CG-CD1 4.46Å; L12-R33 PolarHBondContact N-O 3.19Å; L12-L34 HydrophobicContact CB-CD2 3.96Å; L12-L34 HydrophobicContact CD1-CD2 4.08Å; L12-L34 HydrophobicContact CG-CD2 4.47Å; L12-N37 PolarHBondContact O-ND2 2.92Å
13	S	97	Very high	93	Very high	15 Å²	15	97.6 Å²	97.6	11%	0.105	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	158.7	-179.1	-48.9	0	0	0	0	111.7	D11 N15 R33 A35	D11-S13 WeakPolarHBondContact OD1-CB 3.29Å; D11-S13 PolarHBondContact OD1-N 2.99Å; D11-S13 PolarHBondContact OD1-OG 3.06Å; S13-N15 VanDerWaalsContact C-N 3.27Å; S13-N15 PolarHBondContact O-N 3.16Å; S13-N15 PolarHBondContact O-ND2 3.05Å; S13-R33 PolarHBondContact N-O 3.32Å; S13-R33 WeakPolarHBondContact OG-CB 3.39Å; S13-A35 CarbonylContact C-O 3.53Å; S13-A35 WeakPolarHBondContact CA-O 3.33Å; S13-A35 WeakPolarHBondContact CB-O 3.44Å; S13-A35 PolarHBondContact OG-N 2.97Å
14	H	97.3	Very high	93	Very high	156 Å²	156	94.1 Å²	94.1	72%	0.722	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	32.4	176.3	-52	87.8	0	0	0	114.4	A35 A36	H14-A35 PolarHBondContact N-O 3.43Å; H14-A36 VanDerWaalsContact CA-O 3.32Å; H14-A36 WeakPolarHBondContact CA-O 3.33Å; H14-A36 PolarHBondContact N-O 3.43Å
15	N	96.9	Very high	93.1	Very high	86 Å²	86	90.7 Å²	90.7	46%	0.46	44%	0.437	S	S	.	.	S	Bend	trans	-108.5	-165.7	175.9	-78.1	-78	0	0	0	110.7	L12 S13 L17 A36 N37	L12-N15 PolarHBondContact O-ND2 3.42Å; S13-N15 VanDerWaalsContact C-N 3.27Å; S13-N15 PolarHBondContact O-N 3.16Å; S13-N15 PolarHBondContact O-ND2 3.05Å; N15-L17 HydrophobicContact CB-CD1 4.49Å; N15-L17 HydrophobicContact CB-CG 4.07Å; N15-A36 PolarHBondContact N-O 3.28Å; N15-N37 VanDerWaalsContact CA-OD1 3.31Å; N15-N37 WeakPolarHBondContact CA-OD1 3.31Å; N15-N37 WeakPolarHBondContact CB-OD1 3.32Å; N15-N37 PolarHBondContact N-OD1 2.92Å; N15-N37 PolarHBondContact O-OD1 3.04Å
16	R	96.8	Very high	93.3	Very high	199 Å²	199	84.9 Å²	84.9	75%	0.751	41%	0.41	S	S	*	.			trans	-118.7	30.6	177.7	-58.5	179	-175.5	179.1	1.5	111.4	N37	R16-N37 PolarHBondContact N-OD1 2.85Å
17	L	95.6	Very high	93.3	Very high	59 Å²	59	84.4 Å²	84.4	31%	0.309	40%	0.395	S	S	.	.			trans	-69.9	140.8	-177.4	-58.9	176	0	0	0	110.5	L12 N15 N37 R38 F39	L12-L17 HydrophobicContact CB-CD1 3.8Å; L12-L17 HydrophobicContact CD1-CD1 4.02Å; L12-L17 HydrophobicContact CG-CD1 4.46Å; N15-L17 HydrophobicContact CB-CD1 4.49Å; N15-L17 HydrophobicContact CB-CG 4.07Å; L17-N37 HydrophobicContact CB-CB 4.41Å; L17-N37 WeakPolarHBondContact CB-OD1 3.42Å; L17-N37 WeakPolarHBondContact CG-OD1 3.49Å; L17-N37 PolarHBondContact N-OD1 2.94Å; L17-R38 CarbonylContact O-C 3.47Å; L17-R38 VanDerWaalsContact O-C 3.3Å; L17-R38 VanDerWaalsContact O-CA 3.31Å; L17-R38 WeakPolarHBondContact O-CA 3.38Å; L17-R38 WeakPolarHBondContact O-CB 3.39Å; L17-R38 PolarHBondContact O-N 2.9Å; L17-F39 HydrophobicContact CB-CE1 3.96Å; L17-F39 HydrophobicContact CB-CE2 4.18Å; L17-F39 HydrophobicContact CB-CZ 3.46Å; L17-F39 VanDerWaalsContact CB-CZ 3.46Å; L17-F39 HydrophobicContact CD1-CZ 4.19Å; L17-F39 HydrophobicContact CG-CZ 4.49Å
18	I	94.6	Very high	93.2	Very high	120 Å²	120	82.4 Å²	82.4	62%	0.615	38%	0.384	S	S	*	.			trans	-112.5	-24.5	-179.8	57.1	170.6	0	0	0	112.8	R38 F39	I18-R38 HydrophobicContact CG2-CB 4.03Å; I18-F39 VanDerWaalsContact C-CD1 3.45Å; I18-F39 WeakPolarHBondContact O-CD1 3.16Å
19	S	92.6	Very high	93.2	Very high	78 Å²	78	77.9 Å²	77.9	55%	0.545	37%	0.367	S	S	.	.			trans	-151.8	150.3	177.6	63.6	0	0	0	0	111.3	F39	S19-F39 VanDerWaalsContact C-CE1 3.49Å
20	V	90.8	Very high	93.1	Very high	28 Å²	28	77 Å²	77	17%	0.17	36%	0.361	C	S	.	.			trans	-122	120.8	169.3	172.9	0	0	0	0	106.9	P22 L25 L34 F39	V20-P22 WeakPolarHBondContact O-CD 3.33Å; V20-L25 HydrophobicContact CG1-CD1 3.87Å; V20-L25 HydrophobicContact CG1-CD2 4.09Å; V20-L25 HydrophobicContact CG1-CG 3.99Å; V20-L34 HydrophobicContact CG2-CD1 4.18Å; V20-L34 HydrophobicContact CG2-CD2 4.28Å; V20-F39 HydrophobicContact CG2-CE1 3.73Å; V20-F39 HydrophobicContact CG2-CZ 3.62Å
21	R	88.8	Confident	93.2	Very high	176 Å²	176	77.5 Å²	77.5	66%	0.664	36%	0.364	S	S	*	.			trans	-77.2	120.1	174	-67.2	-177	-173.7	152	0.3	108.6	R23 M24	R21-R23 VanDerWaalsContact C-N 3.26Å; R21-R23 PolarHBondContact O-N 3.45Å; R21-M24 HydrophobicContact CB-CE 4.13Å; R21-M24 HydrophobicContact CB-CG 3.98Å; R21-M24 HydrophobicContact CB-SD 4.32Å; R21-M24 PolarHBondContact O-N 3.4Å
22	P	86.5	Confident	93.1	Very high	32 Å²	32	73.7 Å²	73.7	21%	0.208	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-55	-42.9	-175.7	-25.1	32.8	0	0	0	112.2	V20 M24 L25 W45 F47	V20-P22 WeakPolarHBondContact O-CD 3.33Å; P22-M24 PolarHBondContact O-N 3.49Å; P22-L25 WeakPolarHBondContact O-CB 3.28Å; P22-L25 PolarHBondContact O-N 2.93Å; P22-W45 HydrophobicContact CB-CG 4.44Å; P22-F47 HydrophobicContact CB-CE1 3.49Å; P22-F47 VanDerWaalsContact CB-CE1 3.49Å; P22-F47 HydrophobicContact CB-CZ 3.64Å; P22-F47 WeakPolarHBondContact O-CZ 3.41Å
23	R	85.7	Confident	93.1	Very high	232 Å²	232	75.3 Å²	75.3	88%	0.875	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-57.2	-17.9	-179.5	-61.9	-174.7	-177.5	-131.4	1.9	115	R21	R21-R23 VanDerWaalsContact C-N 3.26Å; R21-R23 PolarHBondContact O-N 3.45Å
24	M	87.8	Confident	93	Very high	94 Å²	94	74.8 Å²	74.8	46%	0.463	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-88.7	-13.4	-179.4	-60	-164.7	-43.1	0	0	113.6	M1 S2 R21 P22	M1-M24 CarbonylContact C-O 3.3Å; M1-M24 PolarHBondContact N-O 3.44Å; S2-M24 PolarHBondContact N-O 3.29Å; S2-M24 VanDerWaalsContact N-O 3.1Å; R21-M24 HydrophobicContact CB-CE 4.13Å; R21-M24 HydrophobicContact CB-CG 3.98Å; R21-M24 HydrophobicContact CB-SD 4.32Å; R21-M24 PolarHBondContact O-N 3.4Å; P22-M24 PolarHBondContact O-N 3.49Å
25	L	90.8	Very high	92.9	Very high	18 Å²	18	67.6 Å²	67.6	9%	0.094	31%	0.31	C	S	.	.	S	Bend	trans	-82.2	133.6	179.6	-65.4	175.4	0	0	0	110.4	V20 P22 L29 W45 F47 L48	V20-L25 HydrophobicContact CG1-CD1 3.87Å; V20-L25 HydrophobicContact CG1-CD2 4.09Å; V20-L25 HydrophobicContact CG1-CG 3.99Å; P22-L25 WeakPolarHBondContact O-CB 3.28Å; P22-L25 PolarHBondContact O-N 2.93Å; L25-L29 HydrophobicContact CB-CD1 4.21Å; L25-L29 HydrophobicContact CD2-CD1 4.21Å; L25-W45 HydrophobicContact CD1-CD2 4.08Å; L25-W45 HydrophobicContact CD1-CE3 4.35Å; L25-W45 HydrophobicContact CD1-CG 4.46Å; L25-F47 HydrophobicContact CB-CE2 4.17Å; L25-F47 HydrophobicContact CB-CZ 4.47Å; L25-L48 HydrophobicContact CD1-CD1 3.98Å
26	P	92.3	Very high	92.8	Very high	1 Å²	1	65 Å²	65	1%	0.006	30%	0.3	C	S	.	.			trans	-59.2	140.4	170	-20.8	29.3	0	0	0	112.1	M1 L4 L7 N28 L29 L48	M1-P26 WeakPolarHBondContact O-CG 3.39Å; L4-P26 HydrophobicContact CB-CG 4.25Å; L4-P26 WeakPolarHBondContact O-CB 3.4Å; L7-P26 HydrophobicContact CB-CG 4.25Å; L7-P26 HydrophobicContact CD2-CG 4.01Å; P26-N28 VanDerWaalsContact C-N 3.27Å; P26-N28 PolarHBondContact O-N 2.94Å; P26-L29 HydrophobicContact CB-CG 4.23Å; P26-L29 HydrophobicContact CG-CG 4.45Å; P26-L29 WeakPolarHBondContact O-CG 3.34Å; P26-L48 WeakPolarHBondContact O-CD2 3.44Å
27	F	91.7	Very high	92.8	Very high	99 Å²	99	56 Å²	56	43%	0.434	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-18.6	-177.5	62.5	-88.6	0	0	0	114.4	E5	E5-F27 HydrophobicContact CG-CE1 4.17Å; E5-F27 HydrophobicContact CG-CZ 4.44Å
28	N	92.5	Very high	92.8	Very high	15 Å²	15	60 Å²	60	8%	0.08	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	12.2	-177.5	-70.2	-45.8	0	0	0	114.4	E5 R8 P26 K50	E5-N28 PolarHBondContact O-ND2 3.29Å; R8-N28 WeakPolarHBondContact CD-O 3.47Å; P26-N28 VanDerWaalsContact C-N 3.27Å; P26-N28 PolarHBondContact O-N 2.94Å; N28-K50 PolarHBondContact OD1-NZ 3.26Å
29	L	95.4	Very high	92.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.249	C	C	.	.			trans	-65.8	137.2	179.9	-69.3	173.6	0	0	0	111.8	L7 V10 L25 P26 V32 L48 K50 L51	L7-L29 HydrophobicContact CB-CD2 4.39Å; L7-L29 HydrophobicContact CD2-CD2 4.22Å; L7-L29 HydrophobicContact CG-CD2 4.1Å; V10-L29 HydrophobicContact CB-CD2 4.37Å; V10-L29 HydrophobicContact CG2-CD1 4.09Å; V10-L29 HydrophobicContact CG2-CD2 3.64Å; L25-L29 HydrophobicContact CB-CD1 4.21Å; L25-L29 HydrophobicContact CD2-CD1 4.21Å; P26-L29 HydrophobicContact CB-CG 4.23Å; P26-L29 HydrophobicContact CG-CG 4.45Å; P26-L29 WeakPolarHBondContact O-CG 3.34Å; L29-V32 HydrophobicContact CB-CG2 4.2Å; L29-V32 HydrophobicContact CD1-CG2 3.78Å; L29-L48 HydrophobicContact CB-CD2 4.27Å; L29-K50 CarbonylContact O-C 3.57Å; L29-L51 HydrophobicContact CB-CD1 4.5Å; L29-L51 WeakPolarHBondContact O-CA 3.29Å; L29-L51 PolarHBondContact O-N 3.24Å
30	E	96	Very high	92.6	Very high	66 Å²	66	54.6 Å²	54.6	31%	0.308	24%	0.242	S	C	.	.	S	Bend	trans	-108.3	-32.4	176	-68.7	170	-163.9	0	0	110.7	R8 Q52 E53	R8-E30 VanDerWaalsContact CD-OE1 3.31Å; R8-E30 WeakPolarHBondContact CD-OE1 3.37Å; R8-E30 IonicContact NE-OE1 3.87Å; R8-E30 PolarHBondContact NE-OE1 2.82Å; R8-E30 PolarHBondContact O-N 3.02Å; E30-Q52 PolarHBondContact O-N 2.89Å; E30-E53 PolarHBondContact O-N 2.86Å
31	V	95.9	Very high	92.5	Very high	23 Å²	23	57.7 Å²	57.7	14%	0.139	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	126.6	-179.1	-179.5	0	0	0	0	110.5	R8 L9 V10 R33 E53	R8-V31 PolarHBondContact O-N 3.31Å; L9-V31 WeakPolarHBondContact CA-O 3.37Å; L9-V31 HydrophobicContact CB-CB 4.17Å; L9-V31 HydrophobicContact CD1-CB 3.93Å; L9-V31 HydrophobicContact CD1-CG1 3.82Å; L9-V31 HydrophobicContact CD1-CG2 4.33Å; L9-V31 HydrophobicContact CG-CB 3.88Å; L9-V31 HydrophobicContact CG-CG1 3.94Å; V10-V31 PolarHBondContact N-O 3.05Å; V31-R33 HydrophobicContact CG1-CG 4.15Å; V31-E53 HydrophobicContact CB-CB 4.38Å; V31-E53 HydrophobicContact CG1-CB 4.09Å; V31-E53 HydrophobicContact CG1-CG 4.25Å; V31-E53 HydrophobicContact CG2-CB 4.09Å
32	V	95.3	Very high	92.5	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	116.7	173.8	173	0	0	0	0	109.8	V10 L29 L34 W45 L51 E53 L54 D55	V10-V32 WeakPolarHBondContact O-CA 3.5Å; L29-V32 HydrophobicContact CB-CG2 4.2Å; L29-V32 HydrophobicContact CD1-CG2 3.78Å; V32-L34 HydrophobicContact CG1-CD1 4.12Å; V32-L34 HydrophobicContact CG1-CD2 4.34Å; V32-L34 HydrophobicContact CG1-CG 3.85Å; V32-W45 HydrophobicContact CG1-CH2 4.44Å; V32-W45 HydrophobicContact CG1-CZ3 4.16Å; V32-L51 HydrophobicContact CB-CD1 4.06Å; V32-L51 HydrophobicContact CG2-CD1 3.64Å; V32-E53 PolarHBondContact N-O 3.36Å; V32-L54 HydrophobicContact CB-CD1 4.03Å; V32-L54 HydrophobicContact CG1-CD1 3.93Å; V32-L54 WeakPolarHBondContact O-CA 3.37Å; V32-D55 PolarHBondContact O-N 3.34Å
33	R	95.8	Very high	92.6	Very high	84 Å²	84	50.8 Å²	50.8	32%	0.317	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	121.4	176.2	-60.1	-178.5	178.9	156.1	0.9	110.6	V10 D11 L12 S13 V31 E53 D55	V10-R33 PolarHBondContact O-N 3.45Å; D11-R33 HydrophobicContact CB-CB 4.31Å; L12-R33 PolarHBondContact N-O 3.19Å; S13-R33 PolarHBondContact N-O 3.32Å; S13-R33 WeakPolarHBondContact OG-CB 3.39Å; V31-R33 HydrophobicContact CG1-CG 4.15Å; R33-E53 IonicContact CZ-OE1 3.04Å; R33-E53 VanDerWaalsContact CZ-OE1 3.25Å; R33-E53 IonicContact NE-OE1 2.75Å; R33-E53 PolarHBondContact NE-OE1 3.41Å; R33-E53 IonicContact NH2-OE1 3.24Å; R33-E53 PolarHBondContact NH2-OE1 3.37Å; R33-E53 IonicContact NH2-OE2 3.14Å; R33-D55 HydrophobicContact CB-CB 4.43Å; R33-D55 HydrophobicContact CG-CB 4.22Å
34	L	95.1	Very high	92.9	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	21%	0.205	C	C	.	.			trans	-129.7	15.8	-176.3	-63.9	-176.6	0	0	0	111.1	L12 V20 V32 N37 F39 W45 D55 V56 N59	L12-L34 HydrophobicContact CB-CD2 3.96Å; L12-L34 HydrophobicContact CD1-CD2 4.08Å; L12-L34 HydrophobicContact CG-CD2 4.47Å; V20-L34 HydrophobicContact CG2-CD1 4.18Å; V20-L34 HydrophobicContact CG2-CD2 4.28Å; V32-L34 HydrophobicContact CG1-CD1 4.12Å; V32-L34 HydrophobicContact CG1-CD2 4.34Å; V32-L34 HydrophobicContact CG1-CG 3.85Å; L34-N37 PolarHBondContact O-ND2 3.22Å; L34-F39 HydrophobicContact CB-CD2 4.41Å; L34-F39 HydrophobicContact CB-CE2 3.82Å; L34-F39 HydrophobicContact CD1-CE2 4.16Å; L34-F39 HydrophobicContact CD1-CZ 4.37Å; L34-F39 HydrophobicContact CD2-CE2 4.34Å; L34-F39 HydrophobicContact CD2-CZ 4.42Å; L34-F39 HydrophobicContact CG-CE2 4.34Å; L34-W45 HydrophobicContact CD1-CH2 3.58Å; L34-W45 HydrophobicContact CD1-CZ2 4.16Å; L34-D55 CarbonylContact C-O 3.58Å; L34-D55 WeakPolarHBondContact CA-O 3.32Å; L34-D55 PolarHBondContact N-O 3.48Å; L34-V56 HydrophobicContact CB-CG1 4.22Å; L34-V56 HydrophobicContact CD1-CG1 4.27Å; L34-N59 PolarHBondContact O-ND2 2.9Å
35	A	94.4	Very high	93.1	Very high	6 Å²	6	37.4 Å²	37.4	5%	0.05	18%	0.183	C	C	.	.			trans	-60.1	152.9	-175.7	0	0	0	0	0	112.1	S13 H14 N37 D55 T57	S13-A35 CarbonylContact C-O 3.53Å; S13-A35 WeakPolarHBondContact CA-O 3.33Å; S13-A35 WeakPolarHBondContact CB-O 3.44Å; S13-A35 PolarHBondContact OG-N 2.97Å; H14-A35 PolarHBondContact N-O 3.43Å; A35-N37 PolarHBondContact O-N 3.35Å; A35-N37 PolarHBondContact O-ND2 3.4Å; A35-D55 WeakPolarHBondContact CB-OD2 3.4Å; A35-D55 PolarHBondContact N-O 3.27Å; A35-T57 CarbonylContact C-O 3.4Å; A35-T57 WeakPolarHBondContact CA-O 3.23Å
36	A	95.3	Very high	93.1	Very high	30 Å²	30	40.4 Å²	40.4	25%	0.248	20%	0.203	C	C	.	.	S	Bend	trans	54.1	50.7	174.9	0	0	0	0	0	113.3	H14 N15 T57 F58	H14-A36 VanDerWaalsContact CA-O 3.32Å; H14-A36 WeakPolarHBondContact CA-O 3.33Å; H14-A36 PolarHBondContact N-O 3.43Å; N15-A36 PolarHBondContact N-O 3.28Å; A36-T57 PolarHBondContact N-O 2.97Å; A36-F58 WeakPolarHBondContact CA-O 3.48Å; A36-F58 HydrophobicContact CB-CB 4.2Å
37	N	95.9	Very high	93	Very high	12 Å²	12	43.2 Å²	43.2	6%	0.064	22%	0.215	C	C	.	.	S	Bend	trans	-116.6	-157.2	172.9	-86.4	-76.7	0	0	0	110	L12 N15 R16 L17 L34 A35 F39 N59	L12-N37 PolarHBondContact O-ND2 2.92Å; N15-N37 VanDerWaalsContact CA-OD1 3.31Å; N15-N37 WeakPolarHBondContact CA-OD1 3.31Å; N15-N37 WeakPolarHBondContact CB-OD1 3.32Å; N15-N37 PolarHBondContact N-OD1 2.92Å; N15-N37 PolarHBondContact O-OD1 3.04Å; R16-N37 PolarHBondContact N-OD1 2.85Å; L17-N37 HydrophobicContact CB-CB 4.41Å; L17-N37 WeakPolarHBondContact CB-OD1 3.42Å; L17-N37 WeakPolarHBondContact CG-OD1 3.49Å; L17-N37 PolarHBondContact N-OD1 2.94Å; L34-N37 PolarHBondContact O-ND2 3.22Å; A35-N37 PolarHBondContact O-N 3.35Å; A35-N37 PolarHBondContact O-ND2 3.4Å; N37-F39 HydrophobicContact CB-CD2 3.67Å; N37-F39 HydrophobicContact CB-CE2 3.45Å; N37-F39 VanDerWaalsContact CB-CE2 3.45Å; N37-F39 HydrophobicContact CB-CZ 4.32Å; N37-N59 WeakPolarHBondContact CA-OD1 3.34Å; N37-N59 WeakPolarHBondContact CB-OD1 3.15Å; N37-N59 PolarHBondContact N-OD1 3.31Å; N37-N59 PolarHBondContact O-OD1 3.37Å
38	R	95.1	Very high	93.1	Very high	143 Å²	143	38.5 Å²	38.5	54%	0.54	20%	0.195	S	C	.	.			trans	-123.7	33.4	179.3	-59.6	-177.7	-178.1	-171.3	-1.8	112	L17 I18 Q40 N59	L17-R38 CarbonylContact O-C 3.47Å; L17-R38 VanDerWaalsContact O-C 3.3Å; L17-R38 VanDerWaalsContact O-CA 3.31Å; L17-R38 WeakPolarHBondContact O-CA 3.38Å; L17-R38 WeakPolarHBondContact O-CB 3.39Å; L17-R38 PolarHBondContact O-N 2.9Å; I18-R38 HydrophobicContact CG2-CB 4.03Å; R38-Q40 PolarHBondContact O-N 2.94Å; R38-N59 PolarHBondContact N-OD1 3.4Å
39	F	92.8	Very high	93	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.			trans	-67.7	128.6	176.2	-62.6	-65.6	0	0	0	110.2	L17 I18 S19 V20 L34 N37 L42 N59 D60 L61	L17-F39 HydrophobicContact CB-CE1 3.96Å; L17-F39 HydrophobicContact CB-CE2 4.18Å; L17-F39 HydrophobicContact CB-CZ 3.46Å; L17-F39 VanDerWaalsContact CB-CZ 3.46Å; L17-F39 HydrophobicContact CD1-CZ 4.19Å; L17-F39 HydrophobicContact CG-CZ 4.49Å; I18-F39 VanDerWaalsContact C-CD1 3.45Å; I18-F39 WeakPolarHBondContact O-CD1 3.16Å; S19-F39 VanDerWaalsContact C-CE1 3.49Å; V20-F39 HydrophobicContact CG2-CE1 3.73Å; V20-F39 HydrophobicContact CG2-CZ 3.62Å; L34-F39 HydrophobicContact CB-CD2 4.41Å; L34-F39 HydrophobicContact CB-CE2 3.82Å; L34-F39 HydrophobicContact CD1-CE2 4.16Å; L34-F39 HydrophobicContact CD1-CZ 4.37Å; L34-F39 HydrophobicContact CD2-CE2 4.34Å; L34-F39 HydrophobicContact CD2-CZ 4.42Å; L34-F39 HydrophobicContact CG-CE2 4.34Å; N37-F39 HydrophobicContact CB-CD2 3.67Å; N37-F39 HydrophobicContact CB-CE2 3.45Å; N37-F39 VanDerWaalsContact CB-CE2 3.45Å; N37-F39 HydrophobicContact CB-CZ 4.32Å; F39-L42 HydrophobicContact CB-CD2 4.24Å; F39-L42 HydrophobicContact CB-CG 4.46Å; F39-L42 HydrophobicContact CD1-CD2 4.24Å; F39-L42 HydrophobicContact CG-CD2 4.15Å; F39-N59 HydrophobicContact CB-CB 4.15Å; F39-N59 WeakPolarHBondContact CD2-OD1 3.1Å; F39-N59 PolarHBondContact N-OD1 2.96Å; F39-N59 VanDerWaalsContact N-OD1 3.08Å; F39-D60 CarbonylContact O-C 3.56Å; F39-D60 PolarHBondContact O-N 3.23Å; F39-L61 HydrophobicContact CB-CD2 3.96Å; F39-L61 WeakPolarHBondContact O-CD2 3.5Å; F39-L61 PolarHBondContact O-N 3.35Å
40	Q	91.1	Very high	92.8	Very high	84 Å²	84	49.7 Å²	49.7	39%	0.393	25%	0.245	S	C	.	.			trans	-105.5	-40.3	172.1	-68.1	-179.5	-9.9	0	0	110.9	R38 L61 E62	R38-Q40 PolarHBondContact O-N 2.94Å; Q40-L61 CarbonylContact O-C 3.44Å; Q40-L61 WeakPolarHBondContact O-CA 3.31Å; Q40-E62 PolarHBondContact O-N 3.27Å
41	H	88.4	Confident	92.8	Very high	93 Å²	93	47 Å²	47	43%	0.431	23%	0.232	S	C	.	.			trans	-121.9	138.6	177.5	-49.3	-82.2	0	0	0	110.3	E62 D64	H41-E62 IonicContact CE1-OE2 3.02Å; H41-E62 PolarHBondContact CE1-OE2 2.93Å; H41-E62 IonicContact NE2-OE2 3.55Å; H41-D64 IonicContact CE1-OD2 2.61Å; H41-D64 PolarHBondContact CE1-OD2 3.06Å; H41-D64 IonicContact ND1-OD2 3.42Å; H41-D64 PolarHBondContact ND1-OD2 3.11Å
42	L	88.9	Confident	92.7	Very high	8 Å²	8	52.7 Å²	52.7	4%	0.042	26%	0.258	C	S	.	.			trans	-127.3	139.4	172.1	-68.6	172.7	0	0	0	108.7	F39 W45 V56 L61 F70	F39-L42 HydrophobicContact CB-CD2 4.24Å; F39-L42 HydrophobicContact CB-CG 4.46Å; F39-L42 HydrophobicContact CD1-CD2 4.24Å; F39-L42 HydrophobicContact CG-CD2 4.15Å; L42-W45 HydrophobicContact CD2-CZ2 4.41Å; L42-V56 HydrophobicContact CD1-CB 4.04Å; L42-V56 HydrophobicContact CD1-CG1 4Å; L42-V56 HydrophobicContact CD1-CG2 4.2Å; L42-L61 HydrophobicContact CD1-CD1 4.15Å; L42-L61 HydrophobicContact CD1-CD2 3.61Å; L42-L61 HydrophobicContact CG-CD2 3.75Å; L42-F70 HydrophobicContact CB-CB 4.3Å; L42-F70 HydrophobicContact CB-CD1 3.91Å; L42-F70 HydrophobicContact CB-CD2 3.9Å; L42-F70 HydrophobicContact CB-CE1 4.13Å; L42-F70 HydrophobicContact CB-CE2 4.09Å; L42-F70 HydrophobicContact CB-CG 3.77Å; L42-F70 HydrophobicContact CB-CZ 4.19Å; L42-F70 HydrophobicContact CD1-CD1 4.2Å; L42-F70 HydrophobicContact CD1-CE1 3.67Å; L42-F70 HydrophobicContact CD1-CE2 4.43Å; L42-F70 HydrophobicContact CD1-CZ 3.77Å; L42-F70 WeakPolarHBondContact O-CB 3.38Å
43	S	89.3	Confident	92.6	Very high	55 Å²	55	56.2 Å²	56.2	39%	0.385	27%	0.274	S	S	.	.			trans	-114.2	148.7	176.4	64.2	0	0	0	0	109.8	W45 F70	S43-W45 VanDerWaalsContact O-CD1 3.27Å; S43-W45 PolarHBondContact O-NE1 2.9Å; S43-F70 WeakPolarHBondContact O-CD2 3.24Å
44	P	90.8	Very high	92.5	Very high	43 Å²	43	52.7 Å²	52.7	28%	0.279	26%	0.261	S	S	.	.			trans	-48.4	145.5	173.8	-28.7	34.8	0	0	0	113.8	P46 H69 W73	P44-P46 VanDerWaalsContact C-CD 3.47Å; P44-P46 WeakPolarHBondContact O-CD 3.26Å; P44-H69 HydrophobicContact CG-CB 4.07Å; P44-H69 WeakPolarHBondContact CG-O 3.5Å; P44-W73 HydrophobicContact CB-CB 3.83Å; P44-W73 HydrophobicContact CB-CD2 4.21Å; P44-W73 HydrophobicContact CB-CG 3.79Å; P44-W73 HydrophobicContact CG-CB 4.08Å
45	W	92.6	Very high	92.3	Very high	1 Å²	1	54.8 Å²	54.8	0%	0.004	27%	0.272	C	S	.	.			trans	-112.4	75.2	172.7	-56.6	-31	0	0	0	110.2	P22 L25 V32 L34 L42 S43 F47 L48 L54 F70 W73	P22-W45 HydrophobicContact CB-CG 4.44Å; L25-W45 HydrophobicContact CD1-CD2 4.08Å; L25-W45 HydrophobicContact CD1-CE3 4.35Å; L25-W45 HydrophobicContact CD1-CG 4.46Å; V32-W45 HydrophobicContact CG1-CH2 4.44Å; V32-W45 HydrophobicContact CG1-CZ3 4.16Å; L34-W45 HydrophobicContact CD1-CH2 3.58Å; L34-W45 HydrophobicContact CD1-CZ2 4.16Å; L42-W45 HydrophobicContact CD2-CZ2 4.41Å; S43-W45 VanDerWaalsContact O-CD1 3.27Å; S43-W45 PolarHBondContact O-NE1 2.9Å; W45-F47 HydrophobicContact CB-CE1 4.34Å; W45-F47 HydrophobicContact CB-CZ 4.14Å; W45-F47 PolarHBondContact O-N 2.99Å; W45-L48 HydrophobicContact CB-CB 4.41Å; W45-L48 HydrophobicContact CB-CD1 3.8Å; W45-L48 HydrophobicContact CB-CG 4.06Å; W45-L48 HydrophobicContact CD2-CD1 4.2Å; W45-L48 HydrophobicContact CE3-CD1 3.79Å; W45-L48 HydrophobicContact CG-CD1 4.25Å; W45-L48 PolarHBondContact O-N 2.88Å; W45-L54 HydrophobicContact CH2-CD1 4.09Å; W45-L54 HydrophobicContact CZ3-CD1 3.6Å; W45-L54 HydrophobicContact CZ3-CD2 4.04Å; W45-L54 HydrophobicContact CZ3-CG 4.5Å; W45-F70 HydrophobicContact CE3-CE2 4.5Å; W45-F70 HydrophobicContact CH2-CE2 4.23Å; W45-F70 HydrophobicContact CZ2-CE2 4.29Å; W45-F70 HydrophobicContact CZ3-CE2 4.35Å; W45-W73 HydrophobicContact CB-CH2 3.94Å; W45-W73 HydrophobicContact CB-CZ2 3.82Å; W45-W73 HydrophobicContact CD2-CH2 4.26Å; W45-W73 AromaticContact CE3-CH2 3.69Å; W45-W73 HydrophobicContact CE3-CH2 3.69Å; W45-W73 HydrophobicContact CE3-CZ3 4.12Å; W45-W73 HydrophobicContact CG-CH2 4.42Å; W45-W73 HydrophobicContact CZ3-CH2 4.49Å; W45-W73 VanDerWaalsContact O-CZ2 3.23Å; W45-W73 WeakPolarHBondContact O-CZ2 3.22Å; W45-W73 PolarHBondContact O-NE1 3.47Å
46	P	89.9	Confident	92.2	Very high	81 Å²	81	54.5 Å²	54.5	53%	0.526	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.7	-165.5	24.7	-35.2	0	0	0	113.8	P44 H49	P44-P46 VanDerWaalsContact C-CD 3.47Å; P44-P46 WeakPolarHBondContact O-CD 3.26Å; P46-H49 PolarHBondContact O-CE1 2.82Å; P46-H49 PolarHBondContact O-ND1 3.44Å; P46-H49 PolarHBondContact O-NE2 2.98Å; P46-H49 VanDerWaalsContact O-NE2 3.16Å
47	F	91.5	Very high	91.9	Very high	60 Å²	60	55.4 Å²	55.4	26%	0.263	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-10	-179.1	53.9	-89	0	0	0	114.1	P22 L25 W45 H49	P22-F47 HydrophobicContact CB-CE1 3.49Å; P22-F47 VanDerWaalsContact CB-CE1 3.49Å; P22-F47 HydrophobicContact CB-CZ 3.64Å; P22-F47 WeakPolarHBondContact O-CZ 3.41Å; L25-F47 HydrophobicContact CB-CE2 4.17Å; L25-F47 HydrophobicContact CB-CZ 4.47Å; W45-F47 HydrophobicContact CB-CE1 4.34Å; W45-F47 HydrophobicContact CB-CZ 4.14Å; W45-F47 PolarHBondContact O-N 2.99Å; F47-H49 VanDerWaalsContact C-N 3.27Å; F47-H49 PolarHBondContact O-CD2 3.4Å; F47-H49 PolarHBondContact O-N 3.24Å; F47-H49 VanDerWaalsContact O-N 3.1Å
48	L	92.5	Very high	91.6	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.305	C	S	.	.			trans	-87.4	60.5	-179.6	-65.1	-176.9	0	0	0	111.7	L25 P26 L29 W45 K50 L51	L25-L48 HydrophobicContact CD1-CD1 3.98Å; P26-L48 WeakPolarHBondContact O-CD2 3.44Å; L29-L48 HydrophobicContact CB-CD2 4.27Å; W45-L48 HydrophobicContact CB-CB 4.41Å; W45-L48 HydrophobicContact CB-CD1 3.8Å; W45-L48 HydrophobicContact CB-CG 4.06Å; W45-L48 HydrophobicContact CD2-CD1 4.2Å; W45-L48 HydrophobicContact CE3-CD1 3.79Å; W45-L48 HydrophobicContact CG-CD1 4.25Å; W45-L48 PolarHBondContact O-N 2.88Å; L48-K50 PolarHBondContact O-N 3.46Å; L48-L51 HydrophobicContact CB-CB 4.24Å; L48-L51 HydrophobicContact CD1-CD2 4.4Å; L48-L51 WeakPolarHBondContact O-CB 3.43Å; L48-L51 PolarHBondContact O-N 3.19Å
49	H	90.2	Very high	91.4	Very high	146 Å²	146	56.9 Å²	56.9	68%	0.676	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-16.8	-176.8	-54.5	-69.3	0	0	0	114.3	P46 F47	P46-H49 PolarHBondContact O-CE1 2.82Å; P46-H49 PolarHBondContact O-ND1 3.44Å; P46-H49 PolarHBondContact O-NE2 2.98Å; P46-H49 VanDerWaalsContact O-NE2 3.16Å; F47-H49 VanDerWaalsContact C-N 3.27Å; F47-H49 PolarHBondContact O-CD2 3.4Å; F47-H49 PolarHBondContact O-N 3.24Å; F47-H49 VanDerWaalsContact O-N 3.1Å
50	K	92.7	Very high	91.3	Very high	105 Å²	105	58 Å²	58	46%	0.457	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-0.5	179.9	-64.2	-176.9	-178.2	173.6	0	113.4	N28 L29 L48 Q52	N28-K50 PolarHBondContact OD1-NZ 3.26Å; L29-K50 CarbonylContact O-C 3.57Å; L48-K50 PolarHBondContact O-N 3.46Å; K50-Q52 PolarHBondContact O-N 2.95Å
51	L	94.8	Very high	91.2	Very high	8 Å²	8	54.4 Å²	54.4	4%	0.042	27%	0.273	C	S	.	.			trans	-65.7	130.1	-177.4	-163.6	67.1	0	0	0	109.4	L29 V32 L48 L54 W73 L79	L29-L51 HydrophobicContact CB-CD1 4.5Å; L29-L51 WeakPolarHBondContact O-CA 3.29Å; L29-L51 PolarHBondContact O-N 3.24Å; V32-L51 HydrophobicContact CB-CD1 4.06Å; V32-L51 HydrophobicContact CG2-CD1 3.64Å; L48-L51 HydrophobicContact CB-CB 4.24Å; L48-L51 HydrophobicContact CD1-CD2 4.4Å; L48-L51 WeakPolarHBondContact O-CB 3.43Å; L48-L51 PolarHBondContact O-N 3.19Å; L51-L54 HydrophobicContact CD2-CB 4.2Å; L51-L54 HydrophobicContact CD2-CD2 4.28Å; L51-W73 HydrophobicContact CD2-CH2 3.95Å; L51-L79 HydrophobicContact CB-CD1 4.48Å; L51-L79 HydrophobicContact CD2-CD1 3.74Å; L51-L79 HydrophobicContact CG-CD1 4.19Å; L51-L79 HydrophobicContact CG-CD2 4.2Å
52	Q	94.2	Very high	91.1	Very high	144 Å²	144	53.1 Å²	53.1	67%	0.673	27%	0.267	S	S	*	.			trans	-117.8	-30.1	-179.1	-64	174.8	25.1	0	0	111.5	E30 K50 L79	E30-Q52 PolarHBondContact O-N 2.89Å; K50-Q52 PolarHBondContact O-N 2.95Å; Q52-L79 WeakPolarHBondContact O-CD2 3.3Å
53	E	93.1	Very high	90.6	Very high	75 Å²	75	52.9 Å²	52.9	35%	0.35	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	130.4	179	-174.2	-175.7	135.7	0	0	110.2	E30 V31 V32 R33	E30-E53 PolarHBondContact O-N 2.86Å; V31-E53 HydrophobicContact CB-CB 4.38Å; V31-E53 HydrophobicContact CG1-CB 4.09Å; V31-E53 HydrophobicContact CG1-CG 4.25Å; V31-E53 HydrophobicContact CG2-CB 4.09Å; V32-E53 PolarHBondContact N-O 3.36Å; R33-E53 IonicContact CZ-OE1 3.04Å; R33-E53 VanDerWaalsContact CZ-OE1 3.25Å; R33-E53 IonicContact NE-OE1 2.75Å; R33-E53 PolarHBondContact NE-OE1 3.41Å; R33-E53 IonicContact NH2-OE1 3.24Å; R33-E53 PolarHBondContact NH2-OE1 3.37Å; R33-E53 IonicContact NH2-OE2 3.14Å
54	L	93	Very high	90.2	Very high	10 Å²	10	51.3 Å²	51.3	5%	0.052	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	113.7	174.9	178.2	53.6	0	0	0	110	V32 W45 L51 V56 F70 W73 L79 F80	V32-L54 HydrophobicContact CB-CD1 4.03Å; V32-L54 HydrophobicContact CG1-CD1 3.93Å; V32-L54 WeakPolarHBondContact O-CA 3.37Å; W45-L54 HydrophobicContact CH2-CD1 4.09Å; W45-L54 HydrophobicContact CZ3-CD1 3.6Å; W45-L54 HydrophobicContact CZ3-CD2 4.04Å; W45-L54 HydrophobicContact CZ3-CG 4.5Å; L51-L54 HydrophobicContact CD2-CB 4.2Å; L51-L54 HydrophobicContact CD2-CD2 4.28Å; L54-V56 HydrophobicContact CD1-CG1 3.71Å; L54-V56 HydrophobicContact CG-CG1 4.07Å; L54-F70 HydrophobicContact CD2-CE2 4.26Å; L54-F70 HydrophobicContact CD2-CZ 3.74Å; L54-W73 HydrophobicContact CD2-CH2 4.19Å; L54-W73 HydrophobicContact CD2-CZ3 3.85Å; L54-L79 HydrophobicContact CB-CB 4.35Å; L54-L79 HydrophobicContact CB-CD1 4.16Å; L54-L79 HydrophobicContact CB-CD2 4.44Å; L54-L79 HydrophobicContact CD2-CD1 4.14Å; L54-F80 HydrophobicContact CB-CZ 4.47Å; L54-F80 HydrophobicContact CD2-CE2 4.29Å; L54-F80 HydrophobicContact CD2-CZ 3.87Å; L54-F80 HydrophobicContact CG-CE1 4.45Å; L54-F80 HydrophobicContact CG-CZ 3.95Å; L54-F80 WeakPolarHBondContact O-CE1 3.45Å
55	D	91.9	Very high	89.6	Confident	46 Å²	46	50.2 Å²	50.2	25%	0.246	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	112.2	173.6	-172.1	-2.4	0	0	0	110.4	V32 R33 L34 A35 T57	V32-D55 PolarHBondContact O-N 3.34Å; R33-D55 HydrophobicContact CB-CB 4.43Å; R33-D55 HydrophobicContact CG-CB 4.22Å; L34-D55 CarbonylContact C-O 3.58Å; L34-D55 WeakPolarHBondContact CA-O 3.32Å; L34-D55 PolarHBondContact N-O 3.48Å; A35-D55 WeakPolarHBondContact CB-OD2 3.4Å; A35-D55 PolarHBondContact N-O 3.27Å; D55-T57 VanDerWaalsContact OD1-CB 3.29Å; D55-T57 WeakPolarHBondContact OD1-CB 3.46Å; D55-T57 VanDerWaalsContact OD1-CG2 3.3Å; D55-T57 WeakPolarHBondContact OD1-CG2 3.39Å; D55-T57 PolarHBondContact OD1-N 3.3Å; D55-T57 PolarHBondContact OD1-OG1 3.4Å
56	V	91.6	Very high	89	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.006	27%	0.269	C	S	.	.			trans	-121.5	17.8	174.4	-61.1	0	0	0	0	111.5	L34 L42 L54 N59 F70 F80 L85	L34-V56 HydrophobicContact CB-CG1 4.22Å; L34-V56 HydrophobicContact CD1-CG1 4.27Å; L42-V56 HydrophobicContact CD1-CB 4.04Å; L42-V56 HydrophobicContact CD1-CG1 4Å; L42-V56 HydrophobicContact CD1-CG2 4.2Å; L54-V56 HydrophobicContact CD1-CG1 3.71Å; L54-V56 HydrophobicContact CG-CG1 4.07Å; V56-N59 PolarHBondContact O-ND2 3.41Å; V56-F70 HydrophobicContact CG1-CZ 4.28Å; V56-F70 HydrophobicContact CG2-CE1 4.29Å; V56-F80 HydrophobicContact CG2-CE1 4.36Å; V56-F80 HydrophobicContact CG2-CZ 3.81Å; V56-L85 HydrophobicContact CG2-CD1 3.54Å; V56-L85 HydrophobicContact CG2-CD2 3.44Å; V56-L85 VanDerWaalsContact CG2-CD2 3.44Å; V56-L85 HydrophobicContact CG2-CG 4.13Å
57	T	89	Confident	88.7	Confident	48 Å²	48	49.6 Å²	49.6	29%	0.294	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	163.4	-178.2	61.3	0	0	0	0	112.2	A35 A36 D55 N59 L85	A35-T57 CarbonylContact C-O 3.4Å; A35-T57 WeakPolarHBondContact CA-O 3.23Å; A36-T57 PolarHBondContact N-O 2.97Å; D55-T57 VanDerWaalsContact OD1-CB 3.29Å; D55-T57 WeakPolarHBondContact OD1-CB 3.46Å; D55-T57 VanDerWaalsContact OD1-CG2 3.3Å; D55-T57 WeakPolarHBondContact OD1-CG2 3.39Å; D55-T57 PolarHBondContact OD1-N 3.3Å; D55-T57 PolarHBondContact OD1-OG1 3.4Å; T57-N59 PolarHBondContact O-N 3.49Å; T57-N59 VanDerWaalsContact O-N 3.09Å; T57-N59 PolarHBondContact O-ND2 2.88Å; T57-N59 VanDerWaalsContact O-ND2 3.17Å; T57-L85 HydrophobicContact CG2-CD1 4.46Å
58	F	90.6	Very high	88.2	Confident	172 Å²	172	48.6 Å²	48.6	75%	0.754	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	29.7	179.4	-52.2	-75.4	0	0	0	114.4	A36	A36-F58 WeakPolarHBondContact CA-O 3.48Å; A36-F58 HydrophobicContact CB-CB 4.2Å
59	N	90.9	Very high	87.8	Confident	14 Å²	14	54.4 Å²	54.4	8%	0.075	27%	0.265	C	S	.	.			trans	-100.2	172.4	167.2	-78.3	-76.6	0	0	0	110.8	L34 N37 R38 F39 V56 T57 L61	L34-N59 PolarHBondContact O-ND2 2.9Å; N37-N59 WeakPolarHBondContact CA-OD1 3.34Å; N37-N59 WeakPolarHBondContact CB-OD1 3.15Å; N37-N59 PolarHBondContact N-OD1 3.31Å; N37-N59 PolarHBondContact O-OD1 3.37Å; R38-N59 PolarHBondContact N-OD1 3.4Å; F39-N59 HydrophobicContact CB-CB 4.15Å; F39-N59 WeakPolarHBondContact CD2-OD1 3.1Å; F39-N59 PolarHBondContact N-OD1 2.96Å; F39-N59 VanDerWaalsContact N-OD1 3.08Å; V56-N59 PolarHBondContact O-ND2 3.41Å; T57-N59 PolarHBondContact O-N 3.49Å; T57-N59 VanDerWaalsContact O-N 3.09Å; T57-N59 PolarHBondContact O-ND2 2.88Å; T57-N59 VanDerWaalsContact O-ND2 3.17Å; N59-L61 HydrophobicContact CB-CD2 4.35Å; N59-L61 HydrophobicContact CB-CG 4.02Å
60	D	89.4	Confident	87.7	Confident	25 Å²	25	47.4 Å²	47.4	13%	0.134	23%	0.233	C	C	.	.			trans	-106.6	48.3	-173.6	-173.6	46.3	0	0	0	111.2	F39 R89	F39-D60 CarbonylContact O-C 3.56Å; F39-D60 PolarHBondContact O-N 3.23Å; D60-R89 VanDerWaalsContact CG-CZ 3.45Å; D60-R89 IonicContact OD1-CZ 2.62Å; D60-R89 IonicContact OD1-NE 3.62Å; D60-R89 IonicContact OD1-NH1 3.9Å; D60-R89 PolarHBondContact OD1-NH1 3.19Å; D60-R89 IonicContact OD1-NH2 3.2Å; D60-R89 PolarHBondContact OD1-NH2 3.05Å; D60-R89 IonicContact OD2-CZ 3.6Å; D60-R89 IonicContact OD2-NH1 2.84Å; D60-R89 PolarHBondContact OD2-NH1 3.07Å; D60-R89 IonicContact OD2-NH2 3.05Å; D60-R89 PolarHBondContact OD2-NH2 2.91Å
61	L	89.3	Confident	87.3	Confident	7 Å²	7	42.6 Å²	42.6	4%	0.037	21%	0.212	C	C	.	.			trans	-66.4	136.7	-168.1	-62.5	170.1	0	0	0	112.3	F39 Q40 L42 N59 L67 L85 R88 R89	F39-L61 HydrophobicContact CB-CD2 3.96Å; F39-L61 WeakPolarHBondContact O-CD2 3.5Å; F39-L61 PolarHBondContact O-N 3.35Å; Q40-L61 CarbonylContact O-C 3.44Å; Q40-L61 WeakPolarHBondContact O-CA 3.31Å; L42-L61 HydrophobicContact CD1-CD1 4.15Å; L42-L61 HydrophobicContact CD1-CD2 3.61Å; L42-L61 HydrophobicContact CG-CD2 3.75Å; N59-L61 HydrophobicContact CB-CD2 4.35Å; N59-L61 HydrophobicContact CB-CG 4.02Å; L61-L67 HydrophobicContact CB-CD1 4.42Å; L61-L67 HydrophobicContact CB-CD2 4.26Å; L61-L67 HydrophobicContact CD1-CD1 4.23Å; L61-L67 HydrophobicContact CD2-CD1 4.49Å; L61-L85 HydrophobicContact CD1-CD2 3.4Å; L61-L85 VanDerWaalsContact CD1-CD2 3.4Å; L61-L85 HydrophobicContact CD1-CG 4.06Å; L61-R88 PolarHBondContact O-N 3.34Å; L61-R89 PolarHBondContact O-N 2.93Å
62	E	86.4	Confident	86.7	Confident	66 Å²	66	44.7 Å²	44.7	31%	0.308	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-85.8	132.9	177.5	-166.9	165.6	175.3	0	0	111	Q40 H41 D64 L67 R89	Q40-E62 PolarHBondContact O-N 3.27Å; H41-E62 IonicContact CE1-OE2 3.02Å; H41-E62 PolarHBondContact CE1-OE2 2.93Å; H41-E62 IonicContact NE2-OE2 3.55Å; E62-D64 HydrophobicContact CG-CB 4.48Å; E62-D64 PolarHBondContact O-N 3.43Å; E62-L67 WeakPolarHBondContact O-CB 3.45Å; E62-L67 VanDerWaalsContact O-CD2 3.24Å; E62-L67 WeakPolarHBondContact O-CD2 3.03Å; E62-R89 CarbonylContact C-O 3.56Å; E62-R89 VanDerWaalsContact CA-O 3.25Å; E62-R89 WeakPolarHBondContact CA-O 3.07Å
63	C	79.6	Confident	86.5	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.02	20%	0.199	C	C	.	.			trans	-77.5	50.2	179.8	-52.7	0	0	0	0	111.1	C87 R89 P90 L93	C63-C87 WeakPolarHBondContact CA-SG 3.3Å; C63-C87 HydrophobicContact CB-CB 3.71Å; C63-C87 WeakPolarHBondContact CB-SG 3.41Å; C63-C87 WeakPolarHBondContact SG-CB 3.34Å; C63-C87 CovalentContact SG-SG 1.98Å; C63-C87 PolarHBondContact SG-SG 3.29Å; C63-R89 WeakPolarHBondContact CB-O 3.24Å; C63-R89 PolarHBondContact N-O 3.07Å; C63-R89 PolarHBondContact SG-O 3.28Å; C63-P90 PolarHBondContact SG-O 2.88Å; C63-L93 HydrophobicContact CB-CB 3.45Å; C63-L93 VanDerWaalsContact CB-CB 3.45Å; C63-L93 HydrophobicContact CB-CD1 3.75Å; C63-L93 HydrophobicContact CB-CG 4.24Å; C63-L93 WeakPolarHBondContact O-CD1 3.48Å
64	D	79.8	Confident	86.3	Confident	22 Å²	22	35.7 Å²	35.7	12%	0.118	18%	0.182	C	C	.	.	S	Bend	trans	-93	175.8	176.8	66.9	22.3	0	0	0	111	H41 E62 S66 L67	H41-D64 IonicContact CE1-OD2 2.61Å; H41-D64 PolarHBondContact CE1-OD2 3.06Å; H41-D64 IonicContact ND1-OD2 3.42Å; H41-D64 PolarHBondContact ND1-OD2 3.11Å; E62-D64 HydrophobicContact CG-CB 4.48Å; E62-D64 PolarHBondContact O-N 3.43Å; D64-S66 PolarHBondContact O-N 3.49Å; D64-S66 VanDerWaalsContact OD1-CA 3.31Å; D64-S66 WeakPolarHBondContact OD1-CA 3.44Å; D64-S66 VanDerWaalsContact OD1-CB 3.26Å; D64-S66 WeakPolarHBondContact OD1-CB 3.4Å; D64-S66 PolarHBondContact OD1-N 3.37Å; D64-L67 PolarHBondContact OD1-N 3.37Å
65	C	78.3	Confident	85.9	Confident	21 Å²	21	39.6 Å²	39.6	14%	0.142	20%	0.2	C	C	.	.	H	α-helix	trans	-68.7	-24.2	175.6	-59	0	0	0	0	112.6	W68 H69 C104	C65-W68 PolarHBondContact O-N 3.42Å; C65-H69 PolarHBondContact O-CD2 3Å; C65-H69 PolarHBondContact O-N 3.45Å; C65-C104 WeakPolarHBondContact CA-SG 3.35Å; C65-C104 HydrophobicContact CB-CB 3.96Å; C65-C104 WeakPolarHBondContact CB-SG 3Å; C65-C104 WeakPolarHBondContact SG-CB 3.47Å; C65-C104 CovalentContact SG-SG 2.04Å; C65-C104 PolarHBondContact SG-SG 2.94Å
66	S	80.3	Confident	85.7	Confident	67 Å²	67	46 Å²	46	47%	0.469	23%	0.226	S	C	.	.	H	α-helix	trans	-66.4	-40.8	178	-63.3	0	0	0	0	112.3	D64 W68 H69 F70	D64-S66 PolarHBondContact O-N 3.49Å; D64-S66 VanDerWaalsContact OD1-CA 3.31Å; D64-S66 WeakPolarHBondContact OD1-CA 3.44Å; D64-S66 VanDerWaalsContact OD1-CB 3.26Å; D64-S66 WeakPolarHBondContact OD1-CB 3.4Å; D64-S66 PolarHBondContact OD1-N 3.37Å; S66-W68 VanDerWaalsContact C-N 3.31Å; S66-W68 PolarHBondContact O-N 2.98Å; S66-H69 WeakPolarHBondContact O-CB 3.41Å; S66-H69 PolarHBondContact O-N 3.39Å; S66-F70 PolarHBondContact O-N 3.06Å
67	L	83.8	Confident	85.7	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-60.7	-40.5	175.3	-179.9	66.6	0	0	0	111.5	L61 E62 D64 H69 F70 V71 C87	L61-L67 HydrophobicContact CB-CD1 4.42Å; L61-L67 HydrophobicContact CB-CD2 4.26Å; L61-L67 HydrophobicContact CD1-CD1 4.23Å; L61-L67 HydrophobicContact CD2-CD1 4.49Å; E62-L67 WeakPolarHBondContact O-CB 3.45Å; E62-L67 VanDerWaalsContact O-CD2 3.24Å; E62-L67 WeakPolarHBondContact O-CD2 3.03Å; D64-L67 PolarHBondContact OD1-N 3.37Å; L67-H69 VanDerWaalsContact C-N 3.29Å; L67-H69 PolarHBondContact O-N 2.99Å; L67-F70 HydrophobicContact CD1-CD1 4.29Å; L67-F70 CarbonylContact O-C 3.41Å; L67-F70 WeakPolarHBondContact O-CA 3.36Å; L67-F70 WeakPolarHBondContact O-CB 3.37Å; L67-F70 PolarHBondContact O-N 3.01Å; L67-V71 HydrophobicContact CD1-CG2 4.47Å; L67-V71 HydrophobicContact CG-CG2 4.25Å; L67-V71 WeakPolarHBondContact O-CG2 3.48Å; L67-V71 PolarHBondContact O-N 3.26Å; L67-C87 HydrophobicContact CD2-CB 3.46Å; L67-C87 VanDerWaalsContact CD2-CB 3.46Å
68	W	81.2	Confident	85.7	Confident	40 Å²	40	50.5 Å²	50.5	15%	0.152	26%	0.26	C	S	.	.	H	α-helix	trans	-67.4	-29.4	179.6	-66	112.2	0	0	0	113.2	C65 S66 F70 V71 T72 T102 V103 C104	C65-W68 PolarHBondContact O-N 3.42Å; S66-W68 VanDerWaalsContact C-N 3.31Å; S66-W68 PolarHBondContact O-N 2.98Å; W68-F70 VanDerWaalsContact C-N 3.29Å; W68-F70 PolarHBondContact O-N 3.17Å; W68-V71 HydrophobicContact CE3-CB 4.04Å; W68-V71 HydrophobicContact CE3-CG1 4.13Å; W68-V71 HydrophobicContact CE3-CG2 4.16Å; W68-V71 HydrophobicContact CZ3-CB 4.5Å; W68-V71 HydrophobicContact CZ3-CG1 4.2Å; W68-V71 HydrophobicContact CZ3-CG2 4.43Å; W68-V71 PolarHBondContact O-N 3.18Å; W68-T72 WeakPolarHBondContact O-CB 3.32Å; W68-T72 VanDerWaalsContact O-CG2 3.25Å; W68-T72 WeakPolarHBondContact O-CG2 3.38Å; W68-T72 PolarHBondContact O-N 3.08Å; W68-T72 PolarHBondContact O-OG1 3.26Å; W68-T102 HydrophobicContact CB-CG2 4.22Å; W68-T102 HydrophobicContact CD2-CG2 3.27Å; W68-T102 HydrophobicContact CE3-CG2 3.51Å; W68-T102 HydrophobicContact CG-CG2 3.61Å; W68-T102 HydrophobicContact CH2-CG2 4.32Å; W68-T102 HydrophobicContact CZ2-CG2 4.13Å; W68-T102 HydrophobicContact CZ3-CG2 4.04Å; W68-V103 PolarHBondContact NE1-O 3.13Å; W68-C104 HydrophobicContact CG-CB 4.38Å
69	H	84.2	Confident	85.6	Confident	121 Å²	121	43 Å²	43	56%	0.56	23%	0.228	S	C	*	.	H	α-helix	trans	-61.3	-40.5	168.4	-67.9	-68	0	0	0	111.5	P44 C65 S66 L67 T72 W73	P44-H69 HydrophobicContact CG-CB 4.07Å; P44-H69 WeakPolarHBondContact CG-O 3.5Å; C65-H69 PolarHBondContact O-CD2 3Å; C65-H69 PolarHBondContact O-N 3.45Å; S66-H69 WeakPolarHBondContact O-CB 3.41Å; S66-H69 PolarHBondContact O-N 3.39Å; L67-H69 VanDerWaalsContact C-N 3.29Å; L67-H69 PolarHBondContact O-N 2.99Å; H69-T72 WeakPolarHBondContact CA-OG1 3.01Å; H69-T72 PolarHBondContact O-OG1 3.43Å; H69-W73 WeakPolarHBondContact O-CB 3.33Å; H69-W73 PolarHBondContact O-N 3.1Å; H69-W73 VanDerWaalsContact O-N 3.11Å
70	F	88.1	Confident	84.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.4	-46.3	175.5	172.1	-95.9	0	0	0	112.4	L42 S43 W45 L54 V56 S66 L67 W68 T72 W73 A74 F80 L85	L42-F70 HydrophobicContact CB-CB 4.3Å; L42-F70 HydrophobicContact CB-CD1 3.91Å; L42-F70 HydrophobicContact CB-CD2 3.9Å; L42-F70 HydrophobicContact CB-CE1 4.13Å; L42-F70 HydrophobicContact CB-CE2 4.09Å; L42-F70 HydrophobicContact CB-CG 3.77Å; L42-F70 HydrophobicContact CB-CZ 4.19Å; L42-F70 HydrophobicContact CD1-CD1 4.2Å; L42-F70 HydrophobicContact CD1-CE1 3.67Å; L42-F70 HydrophobicContact CD1-CE2 4.43Å; L42-F70 HydrophobicContact CD1-CZ 3.77Å; L42-F70 WeakPolarHBondContact O-CB 3.38Å; S43-F70 WeakPolarHBondContact O-CD2 3.24Å; W45-F70 HydrophobicContact CE3-CE2 4.5Å; W45-F70 HydrophobicContact CH2-CE2 4.23Å; W45-F70 HydrophobicContact CZ2-CE2 4.29Å; W45-F70 HydrophobicContact CZ3-CE2 4.35Å; L54-F70 HydrophobicContact CD2-CE2 4.26Å; L54-F70 HydrophobicContact CD2-CZ 3.74Å; V56-F70 HydrophobicContact CG1-CZ 4.28Å; V56-F70 HydrophobicContact CG2-CE1 4.29Å; S66-F70 PolarHBondContact O-N 3.06Å; L67-F70 HydrophobicContact CD1-CD1 4.29Å; L67-F70 CarbonylContact O-C 3.41Å; L67-F70 WeakPolarHBondContact O-CA 3.36Å; L67-F70 WeakPolarHBondContact O-CB 3.37Å; L67-F70 PolarHBondContact O-N 3.01Å; W68-F70 VanDerWaalsContact C-N 3.29Å; W68-F70 PolarHBondContact O-N 3.17Å; F70-T72 PolarHBondContact O-N 3.31Å; F70-W73 AromaticContact CD2-CE3 3.81Å; F70-W73 HydrophobicContact CD2-CE3 3.81Å; F70-W73 AromaticContact CD2-CZ3 3.92Å; F70-W73 HydrophobicContact CD2-CZ3 3.92Å; F70-W73 AromaticContact CE2-CE3 3.92Å; F70-W73 HydrophobicContact CE2-CE3 3.92Å; F70-W73 AromaticContact CE2-CZ3 3.53Å; F70-W73 HydrophobicContact CE2-CZ3 3.53Å; F70-W73 HydrophobicContact CZ-CZ3 4.22Å; F70-W73 WeakPolarHBondContact O-CB 3.43Å; F70-W73 PolarHBondContact O-N 3.47Å; F70-A74 PolarHBondContact O-N 3.21Å; F70-F80 AromaticContact CE1-CE2 3.92Å; F70-F80 HydrophobicContact CE1-CE2 3.92Å; F70-F80 HydrophobicContact CE1-CZ 4.25Å; F70-F80 HydrophobicContact CZ-CE2 4.46Å; F70-L85 HydrophobicContact CE1-CD2 4.48Å
71	V	84.1	Confident	83.8	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-49.9	177.7	174	0	0	0	0	110.6	L67 W68 W73 A74 E75	L67-V71 HydrophobicContact CD1-CG2 4.47Å; L67-V71 HydrophobicContact CG-CG2 4.25Å; L67-V71 WeakPolarHBondContact O-CG2 3.48Å; L67-V71 PolarHBondContact O-N 3.26Å; W68-V71 HydrophobicContact CE3-CB 4.04Å; W68-V71 HydrophobicContact CE3-CG1 4.13Å; W68-V71 HydrophobicContact CE3-CG2 4.16Å; W68-V71 HydrophobicContact CZ3-CB 4.5Å; W68-V71 HydrophobicContact CZ3-CG1 4.2Å; W68-V71 HydrophobicContact CZ3-CG2 4.43Å; W68-V71 PolarHBondContact O-N 3.18Å; V71-W73 VanDerWaalsContact C-N 3.29Å; V71-W73 PolarHBondContact O-N 3.49Å; V71-A74 PolarHBondContact O-N 3.43Å; V71-E75 HydrophobicContact CG1-CG 4.24Å; V71-E75 WeakPolarHBondContact O-CG 3.43Å; V71-E75 PolarHBondContact O-N 3.44Å
72	T	82.9	Confident	82.3	Confident	53 Å²	53	50.8 Å²	50.8	33%	0.325	28%	0.276	S	S	.	.	H	α-helix	trans	-63.7	-31.2	179	53.1	0	0	0	0	113.4	W68 H69 F70 K76	W68-T72 WeakPolarHBondContact O-CB 3.32Å; W68-T72 VanDerWaalsContact O-CG2 3.25Å; W68-T72 WeakPolarHBondContact O-CG2 3.38Å; W68-T72 PolarHBondContact O-N 3.08Å; W68-T72 PolarHBondContact O-OG1 3.26Å; H69-T72 WeakPolarHBondContact CA-OG1 3.01Å; H69-T72 PolarHBondContact O-OG1 3.43Å; F70-T72 PolarHBondContact O-N 3.31Å; T72-K76 WeakPolarHBondContact O-CG 3.35Å; T72-K76 PolarHBondContact O-N 3.34Å
73	W	89.7	Confident	81.2	Confident	30 Å²	30	52.8 Å²	52.8	11%	0.114	29%	0.294	C	S	.	.	H	α-helix	trans	-66.6	-45.4	170.8	160.7	77.4	0	0	0	111.6	P44 W45 L51 L54 H69 F70 V71 K76 L77 L79	P44-W73 HydrophobicContact CB-CB 3.83Å; P44-W73 HydrophobicContact CB-CD2 4.21Å; P44-W73 HydrophobicContact CB-CG 3.79Å; P44-W73 HydrophobicContact CG-CB 4.08Å; W45-W73 HydrophobicContact CB-CH2 3.94Å; W45-W73 HydrophobicContact CB-CZ2 3.82Å; W45-W73 HydrophobicContact CD2-CH2 4.26Å; W45-W73 AromaticContact CE3-CH2 3.69Å; W45-W73 HydrophobicContact CE3-CH2 3.69Å; W45-W73 HydrophobicContact CE3-CZ3 4.12Å; W45-W73 HydrophobicContact CG-CH2 4.42Å; W45-W73 HydrophobicContact CZ3-CH2 4.49Å; W45-W73 VanDerWaalsContact O-CZ2 3.23Å; W45-W73 WeakPolarHBondContact O-CZ2 3.22Å; W45-W73 PolarHBondContact O-NE1 3.47Å; L51-W73 HydrophobicContact CD2-CH2 3.95Å; L54-W73 HydrophobicContact CD2-CH2 4.19Å; L54-W73 HydrophobicContact CD2-CZ3 3.85Å; H69-W73 WeakPolarHBondContact O-CB 3.33Å; H69-W73 PolarHBondContact O-N 3.1Å; H69-W73 VanDerWaalsContact O-N 3.11Å; F70-W73 AromaticContact CD2-CE3 3.81Å; F70-W73 HydrophobicContact CD2-CE3 3.81Å; F70-W73 AromaticContact CD2-CZ3 3.92Å; F70-W73 HydrophobicContact CD2-CZ3 3.92Å; F70-W73 AromaticContact CE2-CE3 3.92Å; F70-W73 HydrophobicContact CE2-CE3 3.92Å; F70-W73 AromaticContact CE2-CZ3 3.53Å; F70-W73 HydrophobicContact CE2-CZ3 3.53Å; F70-W73 HydrophobicContact CZ-CZ3 4.22Å; F70-W73 WeakPolarHBondContact O-CB 3.43Å; F70-W73 PolarHBondContact O-N 3.47Å; V71-W73 VanDerWaalsContact C-N 3.29Å; V71-W73 PolarHBondContact O-N 3.49Å; W73-K76 WeakPolarHBondContact O-CB 3.43Å; W73-K76 PolarHBondContact O-N 3.08Å; W73-L77 HydrophobicContact CH2-CD1 4.39Å; W73-L77 HydrophobicContact CZ2-CD1 3.59Å; W73-L79 HydrophobicContact CH2-CD1 4.24Å
74	A	88.6	Confident	80.4	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-70.5	-35.6	-178.3	0	0	0	0	0	112.7	F70 V71 K76 L77 A78 L79 F80	F70-A74 PolarHBondContact O-N 3.21Å; V71-A74 PolarHBondContact O-N 3.43Å; A74-K76 VanDerWaalsContact C-N 3.34Å; A74-K76 PolarHBondContact O-N 3.16Å; A74-L77 CarbonylContact O-C 3.19Å; A74-L77 PolarHBondContact O-N 3.36Å; A74-L77 VanDerWaalsContact O-N 3.12Å; A74-A78 PolarHBondContact O-N 3.48Å; A74-L79 HydrophobicContact CB-CB 4.27Å; A74-L79 HydrophobicContact CB-CD1 4.25Å; A74-L79 PolarHBondContact O-N 3.15Å; A74-F80 HydrophobicContact CB-CD2 3.27Å; A74-F80 HydrophobicContact CB-CE2 3.27Å; A74-F80 HydrophobicContact CB-CG 4.34Å; A74-F80 HydrophobicContact CB-CZ 4.34Å
75	E	84.6	Confident	79.9	Confident	92 Å²	92	57.3 Å²	57.3	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-60.2	-40.5	171.8	-75.2	175.7	162.1	0	0	112.1	V71 L77 A78	V71-E75 HydrophobicContact CG1-CG 4.24Å; V71-E75 WeakPolarHBondContact O-CG 3.43Å; V71-E75 PolarHBondContact O-N 3.44Å; E75-L77 PolarHBondContact O-N 3.41Å; E75-A78 WeakPolarHBondContact O-CA 3.29Å; E75-A78 PolarHBondContact O-N 3Å
76	K	87.9	Confident	79.5	Confident	181 Å²	181	60 Å²	60	79%	0.787	33%	0.333	S	S	*	.	H	α-helix	trans	-61.7	-24.9	175.5	-75.8	172.6	-178	179	0	113.2	T72 W73 A74	T72-K76 WeakPolarHBondContact O-CG 3.35Å; T72-K76 PolarHBondContact O-N 3.34Å; W73-K76 WeakPolarHBondContact O-CB 3.43Å; W73-K76 PolarHBondContact O-N 3.08Å; A74-K76 VanDerWaalsContact C-N 3.34Å; A74-K76 PolarHBondContact O-N 3.16Å
77	L	90.2	Very high	79.5	Confident	55 Å²	55	57 Å²	57	29%	0.288	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	4.8	175	-64.5	177.7	0	0	0	112.4	W73 A74 E75 L79	W73-L77 HydrophobicContact CH2-CD1 4.39Å; W73-L77 HydrophobicContact CZ2-CD1 3.59Å; A74-L77 CarbonylContact O-C 3.19Å; A74-L77 PolarHBondContact O-N 3.36Å; A74-L77 VanDerWaalsContact O-N 3.12Å; E75-L77 PolarHBondContact O-N 3.41Å; L77-L79 HydrophobicContact CB-CD1 3.81Å; L77-L79 HydrophobicContact CB-CG 3.72Å; L77-L79 HydrophobicContact CD1-CD1 3.89Å; L77-L79 PolarHBondContact O-N 3.07Å
78	A	88.8	Confident	79.5	Confident	88 Å²	88	64.6 Å²	64.6	73%	0.727	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	29.9	-175	0	0	0	0	0	113.9	A74 E75	A74-A78 PolarHBondContact O-N 3.48Å; E75-A78 WeakPolarHBondContact O-CA 3.29Å; E75-A78 PolarHBondContact O-N 3Å
79	L	88.6	Confident	79.3	Confident	14 Å²	14	68.4 Å²	68.4	7%	0.073	35%	0.354	C	S	.	.			trans	-79.5	-24.2	179.9	-64.2	171	0	0	0	112.9	L51 Q52 L54 W73 A74 L77	L51-L79 HydrophobicContact CB-CD1 4.48Å; L51-L79 HydrophobicContact CD2-CD1 3.74Å; L51-L79 HydrophobicContact CG-CD1 4.19Å; L51-L79 HydrophobicContact CG-CD2 4.2Å; Q52-L79 WeakPolarHBondContact O-CD2 3.3Å; L54-L79 HydrophobicContact CB-CB 4.35Å; L54-L79 HydrophobicContact CB-CD1 4.16Å; L54-L79 HydrophobicContact CB-CD2 4.44Å; L54-L79 HydrophobicContact CD2-CD1 4.14Å; W73-L79 HydrophobicContact CH2-CD1 4.24Å; A74-L79 HydrophobicContact CB-CB 4.27Å; A74-L79 HydrophobicContact CB-CD1 4.25Å; A74-L79 PolarHBondContact O-N 3.15Å; L77-L79 HydrophobicContact CB-CD1 3.81Å; L77-L79 HydrophobicContact CB-CG 3.72Å; L77-L79 HydrophobicContact CD1-CD1 3.89Å; L77-L79 PolarHBondContact O-N 3.07Å
80	F	77.5	Confident	78.9	Confident	17 Å²	17	65 Å²	65	8%	0.075	34%	0.343	C	S	.	.	S	Bend	trans	-125.1	141	178.4	-63.6	-43.4	0	0	0	109	L54 V56 F70 A74 M84	L54-F80 HydrophobicContact CB-CZ 4.47Å; L54-F80 HydrophobicContact CD2-CE2 4.29Å; L54-F80 HydrophobicContact CD2-CZ 3.87Å; L54-F80 HydrophobicContact CG-CE1 4.45Å; L54-F80 HydrophobicContact CG-CZ 3.95Å; L54-F80 WeakPolarHBondContact O-CE1 3.45Å; V56-F80 HydrophobicContact CG2-CE1 4.36Å; V56-F80 HydrophobicContact CG2-CZ 3.81Å; F70-F80 AromaticContact CE1-CE2 3.92Å; F70-F80 HydrophobicContact CE1-CE2 3.92Å; F70-F80 HydrophobicContact CE1-CZ 4.25Å; F70-F80 HydrophobicContact CZ-CE2 4.46Å; A74-F80 HydrophobicContact CB-CD2 3.27Å; A74-F80 HydrophobicContact CB-CE2 3.27Å; A74-F80 HydrophobicContact CB-CG 4.34Å; A74-F80 HydrophobicContact CB-CZ 4.34Å; F80-M84 HydrophobicContact CB-CB 3.93Å; F80-M84 HydrophobicContact CD1-CB 4.15Å; F80-M84 HydrophobicContact CD1-CE 4.21Å; F80-M84 HydrophobicContact CG-CB 4.33Å
81	D	66.4	Low	78.2	Confident	90 Å²	90	68.7 Å²	68.7	48%	0.481	37%	0.369	S	S	.	.			trans	-78.3	158.9	162	179.7	24.2	0	0	0	109.3	T83 M84	D81-T83 PolarHBondContact O-N 3.1Å; D81-T83 PolarHBondContact OD2-OG1 2.74Å; D81-M84 HydrophobicContact CB-CG 4.12Å; D81-M84 WeakPolarHBondContact O-CB 3.24Å; D81-M84 PolarHBondContact O-N 2.78Å
82	S	57.5	Low	77.6	Confident	102 Å²	102	74 Å²	74	71%	0.713	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-14.7	172.2	57.4	0	0	0	0	115
83	T	62.1	Low	76.9	Confident	109 Å²	109	72.2 Å²	72.2	67%	0.669	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-7.4	176.1	60.4	0	0	0	0	113.8	D81	D81-T83 PolarHBondContact O-N 3.1Å; D81-T83 PolarHBondContact OD2-OG1 2.74Å
84	M	64.1	Low	75.9	Confident	96 Å²	96	78.7 Å²	78.7	47%	0.473	41%	0.406	S	S	.	.	S	Bend	trans	-95.3	139.9	-173.4	-66.9	-115.3	-92.3	0	0	112.3	F80 D81	F80-M84 HydrophobicContact CB-CB 3.93Å; F80-M84 HydrophobicContact CD1-CB 4.15Å; F80-M84 HydrophobicContact CD1-CE 4.21Å; F80-M84 HydrophobicContact CG-CB 4.33Å; D81-M84 HydrophobicContact CB-CG 4.12Å; D81-M84 WeakPolarHBondContact O-CB 3.24Å; D81-M84 PolarHBondContact O-N 2.78Å
85	L	69.5	Low	74.2	Confident	24 Å²	24	86.9 Å²	86.9	13%	0.126	44%	0.442	C	S	.	.			trans	61	65	175.3	-131.2	85.8	0	0	0	118.7	V56 T57 L61 F70	V56-L85 HydrophobicContact CG2-CD1 3.54Å; V56-L85 HydrophobicContact CG2-CD2 3.44Å; V56-L85 VanDerWaalsContact CG2-CD2 3.44Å; V56-L85 HydrophobicContact CG2-CG 4.13Å; T57-L85 HydrophobicContact CG2-CD1 4.46Å; L61-L85 HydrophobicContact CD1-CD2 3.4Å; L61-L85 VanDerWaalsContact CD1-CD2 3.4Å; L61-L85 HydrophobicContact CD1-CG 4.06Å; F70-L85 HydrophobicContact CE1-CD2 4.48Å
86	P	68.9	Low	73.1	Confident	78 Å²	78	86.5 Å²	86.5	51%	0.506	45%	0.449	S	S	.	.			trans	-72.9	131.9	154.2	30.5	-30.1	0	0	0	110.2
87	C	80.8	Confident	71.6	Confident	2 Å²	2	80.9 Å²	80.9	1%	0.014	43%	0.431	C	S	.	.			trans	-58.3	161.2	173.3	54.5	0	0	0	0	113.7	C63 L67 R94	C63-C87 WeakPolarHBondContact CA-SG 3.3Å; C63-C87 HydrophobicContact CB-CB 3.71Å; C63-C87 WeakPolarHBondContact CB-SG 3.41Å; C63-C87 WeakPolarHBondContact SG-CB 3.34Å; C63-C87 CovalentContact SG-SG 1.98Å; C63-C87 PolarHBondContact SG-SG 3.29Å; L67-C87 HydrophobicContact CD2-CB 3.46Å; L67-C87 VanDerWaalsContact CD2-CB 3.46Å; C87-R94 WeakPolarHBondContact O-CG 2.77Å
88	R	82.8	Confident	70	Confident	162 Å²	162	82.6 Å²	82.6	61%	0.611	44%	0.44	S	S	*	.			trans	-96.4	-31.8	-175.5	-163.6	173.9	-170.6	178.4	3.4	113.8	L61	L61-R88 PolarHBondContact O-N 3.34Å
89	R	79	Confident	68.5	Low	120 Å²	120	85.8 Å²	85.8	45%	0.453	44%	0.444	S	S	.	.	B	Isolated β-bridge	trans	-141.3	146.4	-178.8	-63.8	-159.5	-142.5	85.1	-0.2	112.5	D60 L61 E62 C63	D60-R89 VanDerWaalsContact CG-CZ 3.45Å; D60-R89 IonicContact OD1-CZ 2.62Å; D60-R89 IonicContact OD1-NE 3.62Å; D60-R89 IonicContact OD1-NH1 3.9Å; D60-R89 PolarHBondContact OD1-NH1 3.19Å; D60-R89 IonicContact OD1-NH2 3.2Å; D60-R89 PolarHBondContact OD1-NH2 3.05Å; D60-R89 IonicContact OD2-CZ 3.6Å; D60-R89 IonicContact OD2-NH1 2.84Å; D60-R89 PolarHBondContact OD2-NH1 3.07Å; D60-R89 IonicContact OD2-NH2 3.05Å; D60-R89 PolarHBondContact OD2-NH2 2.91Å; L61-R89 PolarHBondContact O-N 2.93Å; E62-R89 CarbonylContact C-O 3.56Å; E62-R89 VanDerWaalsContact CA-O 3.25Å; E62-R89 WeakPolarHBondContact CA-O 3.07Å; C63-R89 WeakPolarHBondContact CB-O 3.24Å; C63-R89 PolarHBondContact N-O 3.07Å; C63-R89 PolarHBondContact SG-O 3.28Å
90	P	75.3	Confident	67.3	Low	50 Å²	50	88.4 Å²	88.4	33%	0.325	48%	0.475	S	S	.	.	S	Bend	cis	-62.4	142.5	-12.1	23	-34.2	0	0	0	111.8	C63 E92 L93	C63-P90 PolarHBondContact SG-O 2.88Å; P90-E92 WeakPolarHBondContact CB-OE2 3.21Å; P90-E92 PolarHBondContact O-N 3.31Å; P90-E92 VanDerWaalsContact O-N 3.1Å; P90-L93 HydrophobicContact CG-CB 4.31Å; P90-L93 HydrophobicContact CG-CD1 3.79Å; P90-L93 HydrophobicContact CG-CG 4.14Å; P90-L93 PolarHBondContact O-N 3.1Å
91	S	72.3	Confident	66.8	Low	76 Å²	76	94.5 Å²	94.5	53%	0.531	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-58.4	-24.3	-177.7	39.5	0	0	0	0	113.5	L93 R94	S91-L93 VanDerWaalsContact C-N 3.29Å; S91-L93 PolarHBondContact O-N 2.94Å; S91-R94 WeakPolarHBondContact O-CB 3.47Å; S91-R94 PolarHBondContact O-N 3.07Å
92	E	71.1	Confident	67	Low	116 Å²	116	93 Å²	93	54%	0.542	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-65.5	-32.2	177.8	-63.6	76.6	-173.2	0	0	111.8	P90 L188	P90-E92 WeakPolarHBondContact CB-OE2 3.21Å; P90-E92 PolarHBondContact O-N 3.31Å; P90-E92 VanDerWaalsContact O-N 3.1Å; E92-L188 HydrophobicContact CB-CD2 3.35Å; E92-L188 HydrophobicContact CB-CG 4.48Å; E92-L188 HydrophobicContact CG-CD2 3.92Å
93	L	68.7	Low	67.8	Low	14 Å²	14	89 Å²	89	7%	0.073	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-90.8	2.1	176.2	-74.9	176.3	0	0	0	113.3	C63 P90 S91 K95 V103 L188	C63-L93 HydrophobicContact CB-CB 3.45Å; C63-L93 VanDerWaalsContact CB-CB 3.45Å; C63-L93 HydrophobicContact CB-CD1 3.75Å; C63-L93 HydrophobicContact CB-CG 4.24Å; C63-L93 WeakPolarHBondContact O-CD1 3.48Å; P90-L93 HydrophobicContact CG-CB 4.31Å; P90-L93 HydrophobicContact CG-CD1 3.79Å; P90-L93 HydrophobicContact CG-CG 4.14Å; P90-L93 PolarHBondContact O-N 3.1Å; S91-L93 VanDerWaalsContact C-N 3.29Å; S91-L93 PolarHBondContact O-N 2.94Å; L93-K95 PolarHBondContact O-N 3.2Å; L93-K95 VanDerWaalsContact O-N 3.09Å; L93-V103 HydrophobicContact CD2-CG1 4.27Å; L93-L188 HydrophobicContact CD1-CD1 4.07Å; L93-L188 HydrophobicContact CD2-CD1 3.11Å; L93-L188 HydrophobicContact CG-CD1 3.37Å
94	R	68.4	Low	68.5	Low	166 Å²	166	84 Å²	84	63%	0.626	44%	0.436	S	S	*	.			trans	-67.1	-7.4	175.4	-159.4	175.6	80.6	176.7	5.5	112.8	C87 S91	C87-R94 WeakPolarHBondContact O-CG 2.77Å; S91-R94 WeakPolarHBondContact O-CB 3.47Å; S91-R94 PolarHBondContact O-N 3.07Å
95	K	54.7	Low	69.3	Low	173 Å²	173	79.7 Å²	79.7	75%	0.752	42%	0.416	S	S	*	.	S	Bend	trans	-82.9	114.6	173.2	-65.5	-175.8	-178	178.8	0	109	L93	L93-K95 PolarHBondContact O-N 3.2Å; L93-K95 VanDerWaalsContact O-N 3.09Å
96	S	60.1	Low	70	Confident	84 Å²	84	79 Å²	79	59%	0.587	41%	0.413	S	S	*	.			trans	-58.7	170.1	170.1	73.5	0	0	0	0	110.7	I98	S96-I98 PolarHBondContact O-N 2.82Å
97	P	57.3	Low	70.8	Confident	62 Å²	62	78.1 Å²	78.1	40%	0.403	41%	0.407	S	S	.	.			trans	-45.9	123.8	-146.8	17.8	-30.8	0	0	0	114.4	D99 G100 K101	P97-D99 PolarHBondContact O-N 2.91Å; P97-D99 VanDerWaalsContact O-N 3.07Å; P97-G100 PolarHBondContact O-N 3.43Å; P97-K101 VanDerWaalsContact CA-O 3.24Å; P97-K101 WeakPolarHBondContact CA-O 3.49Å; P97-K101 WeakPolarHBondContact CB-O 3.48Å
98	I	56.4	Low	71.2	Confident	92 Å²	92	78.7 Å²	78.7	47%	0.472	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-66.7	111.8	170	-57.1	177.8	0	0	0	105.8	S96 G100 K101 V103 A186	S96-I98 PolarHBondContact O-N 2.82Å; I98-G100 PolarHBondContact O-N 2.94Å; I98-K101 PolarHBondContact N-O 3.41Å; I98-K101 PolarHBondContact O-N 3.12Å; I98-V103 HydrophobicContact CB-CG2 4.1Å; I98-V103 HydrophobicContact CD1-CG2 4.15Å; I98-V103 HydrophobicContact CG1-CG2 4.18Å; I98-A186 HydrophobicContact CD1-CB 3.55Å
99	D	57	Low	71.6	Confident	154 Å²	154	74.2 Å²	74.2	82%	0.824	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	38.8	179.6	-159.5	35.1	0	0	0	113.9	P97 K101	P97-D99 PolarHBondContact O-N 2.91Å; P97-D99 VanDerWaalsContact O-N 3.07Å; D99-K101 PolarHBondContact O-N 3.45Å; D99-K101 VanDerWaalsContact O-N 3.16Å
100	G	63.1	Low	72	Confident	69 Å²	69	70.4 Å²	70.4	71%	0.711	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	5.9	178.1	0	0	0	0	0	115	P97 I98	P97-G100 PolarHBondContact O-N 3.43Å; I98-G100 PolarHBondContact O-N 2.94Å
101	K	66.8	Low	72.2	Confident	145 Å²	145	72.5 Å²	72.5	63%	0.63	41%	0.406	S	S	*	.	B	Isolated β-bridge	trans	-110	131.8	174.4	-69.5	176.9	-178.5	170	0	112	P97 I98 D99 V103	P97-K101 VanDerWaalsContact CA-O 3.24Å; P97-K101 WeakPolarHBondContact CA-O 3.49Å; P97-K101 WeakPolarHBondContact CB-O 3.48Å; I98-K101 PolarHBondContact N-O 3.41Å; I98-K101 PolarHBondContact O-N 3.12Å; D99-K101 PolarHBondContact O-N 3.45Å; D99-K101 VanDerWaalsContact O-N 3.16Å; K101-V103 PolarHBondContact O-N 2.92Å
102	T	71.1	Confident	72.9	Confident	60 Å²	60	69.9 Å²	69.9	37%	0.368	39%	0.388	S	S	.	.			trans	-62.8	124.8	175.1	-49.7	0	0	0	0	110.2	W68	W68-T102 HydrophobicContact CB-CG2 4.22Å; W68-T102 HydrophobicContact CD2-CG2 3.27Å; W68-T102 HydrophobicContact CE3-CG2 3.51Å; W68-T102 HydrophobicContact CG-CG2 3.61Å; W68-T102 HydrophobicContact CH2-CG2 4.32Å; W68-T102 HydrophobicContact CZ2-CG2 4.13Å; W68-T102 HydrophobicContact CZ3-CG2 4.04Å
103	V	74.3	Confident	73.7	Confident	18 Å²	18	68.5 Å²	68.5	11%	0.109	39%	0.389	C	S	.	.			trans	-111	129.9	177.1	-179.4	0	0	0	0	109.7	W68 L93 I98 K101 T133 L185 A186	W68-V103 PolarHBondContact NE1-O 3.13Å; L93-V103 HydrophobicContact CD2-CG1 4.27Å; I98-V103 HydrophobicContact CB-CG2 4.1Å; I98-V103 HydrophobicContact CD1-CG2 4.15Å; I98-V103 HydrophobicContact CG1-CG2 4.18Å; K101-V103 PolarHBondContact O-N 2.92Å; V103-T133 CarbonylContact C-O 3.41Å; V103-T133 WeakPolarHBondContact CA-O 3.47Å; V103-L185 HydrophobicContact CG1-CD2 3.84Å; V103-L185 HydrophobicContact CG1-CG 4.16Å; V103-A186 HydrophobicContact CG1-CB 4.38Å
104	C	77.8	Confident	74.7	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.02	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	147.1	175.8	74.4	0	0	0	0	111.9	C65 W68 A132 T133 L185	C65-C104 WeakPolarHBondContact CA-SG 3.35Å; C65-C104 HydrophobicContact CB-CB 3.96Å; C65-C104 WeakPolarHBondContact CB-SG 3Å; C65-C104 WeakPolarHBondContact SG-CB 3.47Å; C65-C104 CovalentContact SG-SG 2.04Å; C65-C104 PolarHBondContact SG-SG 2.94Å; W68-C104 HydrophobicContact CG-CB 4.38Å; C104-A132 VanDerWaalsContact O-CA 3.22Å; C104-A132 WeakPolarHBondContact O-CA 3.26Å; C104-A132 WeakPolarHBondContact O-CB 3.21Å; C104-T133 PolarHBondContact N-O 2.87Å; C104-T133 PolarHBondContact O-N 3.25Å; C104-T133 VanDerWaalsContact O-N 3.13Å; C104-T133 WeakPolarHBondContact SG-CB 3.14Å; C104-T133 PolarHBondContact SG-N 2.9Å; C104-T133 PolarHBondContact SG-OG1 3.07Å; C104-L185 WeakPolarHBondContact O-CD2 3.34Å
105	G	79.9	Confident	75.8	Confident	5 Å²	5	69.2 Å²	69.2	5%	0.052	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.4	-156.9	-179	0	0	0	0	0	113.5	L188	G105-L188 WeakPolarHBondContact O-CD1 3.14Å
106	P	84.5	Confident	77.5	Confident	11 Å²	11	61.7 Å²	61.7	7%	0.071	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	cis	-83.9	142.4	10	32.5	-30.6	0	0	0	112.4	L131 A132 P136 A183 L185 L188 S190	P106-L131 WeakPolarHBondContact CA-O 3.49Å; P106-A132 HydrophobicContact CB-CB 3.98Å; P106-P136 HydrophobicContact CB-CB 4.29Å; P106-A183 HydrophobicContact CB-CB 3.78Å; P106-A183 HydrophobicContact CG-CB 4.28Å; P106-A183 WeakPolarHBondContact CG-O 3.39Å; P106-L185 HydrophobicContact CG-CB 4.3Å; P106-L188 HydrophobicContact CG-CB 4.48Å; P106-S190 WeakPolarHBondContact O-CB 3.46Å
107	T	86.2	Confident	78.9	Confident	59 Å²	59	62 Å²	62	36%	0.362	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.9	168.7	-56.4	0	0	0	0	109.1	V109 A130 L131	T107-V109 HydrophobicContact CG2-CG1 4.43Å; T107-A130 CarbonylContact O-C 3.59Å; T107-A130 WeakPolarHBondContact O-CA 3.24Å; T107-L131 PolarHBondContact N-O 2.8Å; T107-L131 PolarHBondContact O-N 3.47Å
108	V	89.4	Confident	80.6	Confident	13 Å²	13	59.6 Å²	59.6	8%	0.079	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120.1	178.1	-179	0	0	0	0	109.5	C128 T129 A130 A183 S190 K192	V108-C128 HydrophobicContact CG1-CB 3.82Å; V108-T129 WeakPolarHBondContact CA-O 3.44Å; V108-A130 HydrophobicContact CG2-CB 4.47Å; V108-A183 HydrophobicContact CG2-CB 3.47Å; V108-A183 VanDerWaalsContact CG2-CB 3.47Å; V108-S190 WeakPolarHBondContact CG2-O 3.32Å; V108-S190 PolarHBondContact N-OG 2.98Å; V108-K192 HydrophobicContact CG1-CB 3.82Å
109	V	89.9	Confident	82.2	Confident	68 Å²	68	57.6 Å²	57.6	41%	0.412	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	160.4	170.9	-59.6	0	0	0	0	109.5	T107 C128 T129	T107-V109 HydrophobicContact CG2-CG1 4.43Å; V109-C128 CarbonylContact O-C 3.53Å; V109-C128 WeakPolarHBondContact O-CA 3.29Å; V109-T129 PolarHBondContact N-O 3.28Å; V109-T129 PolarHBondContact O-N 3.39Å
110	T	87.9	Confident	83.7	Confident	40 Å²	40	53.4 Å²	53.4	25%	0.245	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	145.2	177.9	-176.8	0	0	0	0	111	S112 C127 K192 F194	T110-S112 WeakPolarHBondContact CG2-O 3.2Å; T110-S112 PolarHBondContact OG1-N 3.26Å; T110-S112 PolarHBondContact OG1-O 2.88Å; T110-C127 PolarHBondContact OG1-O 2.84Å; T110-K192 HydrophobicContact CG2-CD 4.21Å; T110-K192 HydrophobicContact CG2-CG 3.74Å; T110-F194 HydrophobicContact CG2-CE1 4.05Å; T110-F194 HydrophobicContact CG2-CZ 4.2Å; T110-F194 WeakPolarHBondContact OG1-CE1 3.3Å; T110-F194 VanDerWaalsContact OG1-CZ 3.26Å; T110-F194 WeakPolarHBondContact OG1-CZ 3.29Å
111	S	79.4	Confident	85	Confident	94 Å²	94	54.8 Å²	54.8	66%	0.657	32%	0.323	S	S	*	.	S	Bend	trans	-94.7	-11.8	167.3	50.6	0	0	0	0	112.4
112	S	86.1	Confident	86.1	Confident	22 Å²	22	52.3 Å²	52.3	15%	0.154	32%	0.317	C	S	.	.	S	Bend	trans	-89.7	147.9	-179.6	-56	0	0	0	0	111.1	T110 C127	T110-S112 WeakPolarHBondContact CG2-O 3.2Å; T110-S112 PolarHBondContact OG1-N 3.26Å; T110-S112 PolarHBondContact OG1-O 2.88Å; S112-C127 PolarHBondContact OG-N 2.74Å
113	P	88.6	Confident	87.1	Confident	87 Å²	87	52.6 Å²	52.6	57%	0.565	33%	0.325	S	S	*	.			trans	-65	142	176.4	26.9	-33.6	0	0	0	111.4	S115 F194	P113-S115 PolarHBondContact O-N 3.17Å; P113-F194 WeakPolarHBondContact O-CD1 2.93Å
114	E	90.4	Very high	87.9	Confident	110 Å²	110	53.1 Å²	53.1	51%	0.514	33%	0.327	S	S	.	.	S	Bend	trans	-66.4	-19.9	178.9	-66.7	-175.4	-178.6	0	0	113	K192 F194 H195	E114-K192 WeakPolarHBondContact OE1-CE 3.41Å; E114-K192 IonicContact OE1-NZ 3.02Å; E114-K192 PolarHBondContact OE1-NZ 3.28Å; E114-F194 CarbonylContact O-C 3.5Å; E114-F194 WeakPolarHBondContact O-CA 3.09Å; E114-H195 PolarHBondContact O-N 3.2Å
115	S	90.4	Very high	88.5	Confident	85 Å²	85	56.3 Å²	56.3	59%	0.594	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.3	174.4	-61.4	0	0	0	0	108.9	P113 H195	P113-S115 PolarHBondContact O-N 3.17Å; S115-H195 CarbonylContact C-O 3.58Å; S115-H195 WeakPolarHBondContact CA-O 3.26Å
116	A	90.3	Very high	89	Confident	15 Å²	15	56.2 Å²	56.2	12%	0.124	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.3	-179	0	0	0	0	0	109.7	V118 H195 E197	A116-V118 HydrophobicContact CB-CG1 4.46Å; A116-H195 PolarHBondContact N-O 2.93Å; A116-E197 PolarHBondContact O-N 2.67Å
117	V	90.6	Very high	89.3	Confident	91 Å²	91	56.4 Å²	56.4	55%	0.552	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	124.4	170.9	-179.2	0	0	0	0	107.4	E197 D199	V117-E197 CarbonylContact C-O 3.58Å; V117-E197 WeakPolarHBondContact CA-O 3.04Å; V117-D199 HydrophobicContact CG1-CB 3.76Å
118	V	91.7	Very high	89.5	Confident	11 Å²	11	53.6 Å²	53.6	7%	0.067	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.6	-173.3	-61.4	0	0	0	0	112.1	A116 H124 V171 M176 V196 E197 D199	A116-V118 HydrophobicContact CB-CG1 4.46Å; V118-H124 HydrophobicContact CG1-CB 4.19Å; V118-H124 WeakPolarHBondContact CG1-ND1 3.08Å; V118-V171 HydrophobicContact CB-CG1 4.46Å; V118-V171 HydrophobicContact CG2-CG1 3.75Å; V118-V171 HydrophobicContact CG2-CG2 4.49Å; V118-M176 HydrophobicContact CG2-CE 3.66Å; V118-M176 HydrophobicContact CG2-SD 4.16Å; V118-V196 HydrophobicContact CG1-CG1 4.27Å; V118-V196 HydrophobicContact CG2-CG1 3.47Å; V118-V196 VanDerWaalsContact CG2-CG1 3.47Å; V118-E197 WeakPolarHBondContact CG2-O 3.44Å; V118-E197 PolarHBondContact N-O 2.04Å; V118-D199 PolarHBondContact O-N 3.24Å
119	S	90.3	Very high	89.5	Confident	49 Å²	49	54.1 Å²	54.1	34%	0.343	33%	0.332	S	S	.	.			trans	-81.2	154.1	171.5	-62.1	0	0	0	0	110.7	D122	S119-D122 WeakPolarHBondContact CB-OD2 3Å
120	L	89.7	Confident	89.3	Confident	67 Å²	67	51 Å²	51	35%	0.351	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	152.2	171.5	-63.5	176.1	0	0	0	110	D122 L173	L120-D122 PolarHBondContact O-N 2.62Å; L120-L173 HydrophobicContact CD2-CG 4.37Å
121	D	89.6	Confident	89.1	Confident	98 Å²	98	51.8 Å²	51.8	52%	0.524	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	-10.4	178.1	-60.8	-24.6	0	0	0	116.4	K170 V171	D121-K170 HydrophobicContact CB-CG 4.34Å; D121-K170 WeakPolarHBondContact OD1-CE 3.44Å; D121-K170 IonicContact OD1-NZ 2.77Å; D121-K170 IonicContact OD2-NZ 2.82Å; D121-V171 PolarHBondContact N-O 2.76Å
122	D	90.2	Very high	89.2	Confident	92 Å²	92	47.9 Å²	47.9	49%	0.492	29%	0.289	S	S	.	.	S	Bend	trans	-74.2	159.6	171.4	-75.5	-8.9	0	0	0	112.1	S119 L120 V171	S119-D122 WeakPolarHBondContact CB-OD2 3Å; L120-D122 PolarHBondContact O-N 2.62Å; D122-V171 WeakPolarHBondContact O-CB 3.08Å; D122-V171 VanDerWaalsContact O-CG2 3.24Å; D122-V171 WeakPolarHBondContact O-CG2 3.07Å; D122-V171 PolarHBondContact O-N 2.83Å
123	A	91.1	Very high	88.9	Confident	66 Å²	66	50.5 Å²	50.5	55%	0.545	30%	0.304	S	S	.	.			trans	-84.8	139.6	170	0	0	0	0	0	110.5	I168	A123-I168 CarbonylContact C-O 3.59Å; A123-I168 VanDerWaalsContact CA-O 3.29Å; A123-I168 WeakPolarHBondContact CA-O 3.16Å
124	H	91.2	Very high	88.4	Confident	30 Å²	30	49.5 Å²	49.5	14%	0.139	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.9	175.9	-173.8	61.3	0	0	0	111.3	V118 M126 I168 V171	V118-H124 HydrophobicContact CG1-CB 4.19Å; V118-H124 WeakPolarHBondContact CG1-ND1 3.08Å; H124-M126 VanDerWaalsContact NE2-CG 3.34Å; H124-M126 WeakPolarHBondContact NE2-CG 3.34Å; H124-I168 HydrophobicContact CB-CB 4.48Å; H124-I168 PolarHBondContact N-O 3.25Å; H124-I168 PolarHBondContact O-N 2.88Å; H124-V171 HydrophobicContact CB-CG2 3.74Å
125	V	90.7	Very high	88	Confident	70 Å²	70	47.9 Å²	47.9	42%	0.424	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.6	-179.1	-176.5	0	0	0	0	109.6	C165 L166 E167	V125-C165 HydrophobicContact CG1-CB 4.1Å; V125-L166 WeakPolarHBondContact CA-O 3.44Å; V125-E167 HydrophobicContact CG2-CB 4.25Å; V125-E167 HydrophobicContact CG2-CG 3.99Å
126	M	91.1	Very high	87.8	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.015	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.9	172.9	-63.9	170.8	-73.5	0	0	109.1	H124 W140 C165 L166 I168 Y179 F194 V196	H124-M126 VanDerWaalsContact NE2-CG 3.34Å; H124-M126 WeakPolarHBondContact NE2-CG 3.34Å; M126-W140 HydrophobicContact CB-CH2 3.89Å; M126-W140 WeakPolarHBondContact O-CZ2 3.31Å; M126-C165 CarbonylContact O-C 3.53Å; M126-C165 WeakPolarHBondContact O-CA 3.24Å; M126-L166 HydrophobicContact CE-CD2 4.02Å; M126-L166 PolarHBondContact N-O 2.86Å; M126-L166 PolarHBondContact O-N 3.49Å; M126-I168 HydrophobicContact CE-CD1 4.17Å; M126-Y179 HydrophobicContact CE-CD1 3.77Å; M126-Y179 HydrophobicContact CE-CD2 3.86Å; M126-Y179 HydrophobicContact CE-CE1 4.2Å; M126-Y179 HydrophobicContact CE-CE2 4.29Å; M126-Y179 HydrophobicContact CE-CG 3.57Å; M126-Y179 HydrophobicContact SD-CD2 4.25Å; M126-Y179 HydrophobicContact SD-CG 4.14Å; M126-F194 HydrophobicContact SD-CB 3.67Å; M126-F194 HydrophobicContact SD-CG 4.06Å; M126-V196 HydrophobicContact CE-CG2 4.22Å; M126-V196 HydrophobicContact SD-CG2 3.74Å
127	C	90	Very high	87.6	Confident	15 Å²	15	50.6 Å²	50.6	10%	0.101	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.9	-177.4	-63.9	0	0	0	0	111.8	T110 S112 C165	T110-C127 PolarHBondContact OG1-O 2.84Å; S112-C127 PolarHBondContact OG-N 2.74Å; C127-C165 HydrophobicContact CB-CB 4.16Å; C127-C165 WeakPolarHBondContact CB-SG 3.28Å; C127-C165 WeakPolarHBondContact SG-CB 3.29Å; C127-C165 CovalentContact SG-SG 2.04Å; C127-C165 PolarHBondContact SG-SG 2.9Å
128	C	90.4	Very high	87.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	149.7	168.4	58.5	0	0	0	0	109.5	V108 V109 E163 F164 C181	V108-C128 HydrophobicContact CG1-CB 3.82Å; V109-C128 CarbonylContact O-C 3.53Å; V109-C128 WeakPolarHBondContact O-CA 3.29Å; C128-E163 CarbonylContact O-C 3.55Å; C128-E163 WeakPolarHBondContact O-CA 3.37Å; C128-F164 PolarHBondContact N-O 2.02Å; C128-F164 PolarHBondContact O-N 3.04Å; C128-F164 PolarHBondContact SG-O 2.8Å; C128-C181 HydrophobicContact CB-CB 3.6Å; C128-C181 WeakPolarHBondContact CB-SG 3.43Å; C128-C181 WeakPolarHBondContact SG-CB 3.42Å; C128-C181 CovalentContact SG-SG 2.02Å; C128-C181 PolarHBondContact SG-SG 3.41Å
129	T	89.4	Confident	87.4	Confident	24 Å²	24	49.5 Å²	49.5	15%	0.147	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	128	171.3	-48.7	0	0	0	0	108.5	V108 V109 K161 L162	V108-T129 WeakPolarHBondContact CA-O 3.44Å; V109-T129 PolarHBondContact N-O 3.28Å; V109-T129 PolarHBondContact O-N 3.39Å; T129-K161 HydrophobicContact CG2-CB 3.83Å; T129-L162 WeakPolarHBondContact CA-O 3.42Å
130	A	86.9	Confident	87.5	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.017	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.7	174.4	0	0	0	0	0	110.9	T107 V108 P136 L138 L162 A183	T107-A130 CarbonylContact O-C 3.59Å; T107-A130 WeakPolarHBondContact O-CA 3.24Å; V108-A130 HydrophobicContact CG2-CB 4.47Å; A130-P136 HydrophobicContact CB-CG 3.87Å; A130-L138 HydrophobicContact CB-CD1 4.25Å; A130-L138 HydrophobicContact CB-CD2 3.56Å; A130-L138 HydrophobicContact CB-CG 4.45Å; A130-L162 PolarHBondContact N-O 2.91Å; A130-A183 HydrophobicContact CB-CB 3.91Å
131	L	84.1	Confident	87.7	Confident	57 Å²	57	46.1 Å²	46.1	30%	0.298	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	109.4	174.2	-58.5	176.4	0	0	0	108.3	P106 T107 K161	P106-L131 WeakPolarHBondContact CA-O 3.49Å; T107-L131 PolarHBondContact N-O 2.8Å; T107-L131 PolarHBondContact O-N 3.47Å; L131-K161 HydrophobicContact CD2-CB 4.36Å; L131-K161 HydrophobicContact CD2-CD 4.02Å; L131-K161 HydrophobicContact CD2-CG 3.61Å
132	A	81.2	Confident	87.9	Confident	12 Å²	12	43.9 Å²	43.9	10%	0.099	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	153.6	174.6	0	0	0	0	0	110.6	C104 P106 P134 P136 L185	C104-A132 VanDerWaalsContact O-CA 3.22Å; C104-A132 WeakPolarHBondContact O-CA 3.26Å; C104-A132 WeakPolarHBondContact O-CB 3.21Å; P106-A132 HydrophobicContact CB-CB 3.98Å; A132-P134 CarbonylContact C-O 3.51Å; A132-P136 HydrophobicContact CB-CB 3.97Å; A132-P136 HydrophobicContact CB-CG 3.81Å; A132-L185 HydrophobicContact CB-CD2 3.59Å
133	T	78.4	Confident	88.1	Confident	77 Å²	77	43.7 Å²	43.7	47%	0.472	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.1	170.5	-60.4	0	0	0	0	108	V103 C104	V103-T133 CarbonylContact C-O 3.41Å; V103-T133 WeakPolarHBondContact CA-O 3.47Å; C104-T133 PolarHBondContact N-O 2.87Å; C104-T133 PolarHBondContact O-N 3.25Å; C104-T133 VanDerWaalsContact O-N 3.13Å; C104-T133 WeakPolarHBondContact SG-CB 3.14Å; C104-T133 PolarHBondContact SG-N 2.9Å; C104-T133 PolarHBondContact SG-OG1 3.07Å
134	P	79.8	Confident	88.1	Confident	65 Å²	65	43.4 Å²	43.4	42%	0.422	25%	0.251	S	S	.	.	S	Bend	cis	-63.6	176.1	-11.6	30.5	-35.1	0	0	0	112.1	A132 L185	A132-P134 CarbonylContact C-O 3.51Å; P134-L185 HydrophobicContact CG-CD1 4.03Å; P134-L185 WeakPolarHBondContact O-CD2 3.32Å
135	S	81.1	Confident	88.2	Confident	76 Å²	76	49.9 Å²	49.9	53%	0.531	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-54.1	131.2	-177.3	-170.4	0	0	0	0	112
136	P	85.8	Confident	88.2	Confident	11 Å²	11	51.6 Å²	51.6	7%	0.071	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-80	160.9	-176	33.7	-33.1	0	0	0	111.8	P106 A130 A132 L138 A183 L185	P106-P136 HydrophobicContact CB-CB 4.29Å; A130-P136 HydrophobicContact CB-CG 3.87Å; A132-P136 HydrophobicContact CB-CB 3.97Å; A132-P136 HydrophobicContact CB-CG 3.81Å; P136-L138 HydrophobicContact CG-CD2 4.22Å; P136-L138 HydrophobicContact CG-CG 4.44Å; P136-L138 PolarHBondContact O-N 3.49Å; P136-A183 HydrophobicContact CB-CB 4.3Å; P136-A183 HydrophobicContact CG-CB 4.35Å; P136-L185 HydrophobicContact CB-CB 4.07Å
137	Q	86.7	Confident	88	Confident	147 Å²	147	53.4 Å²	53.4	69%	0.687	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	123.5	165.3	-67.1	-172.2	-8.2	0	0	109.8	A183 S184	Q137-A183 CarbonylContact O-C 3.43Å; Q137-A183 WeakPolarHBondContact O-CA 3.22Å; Q137-S184 PolarHBondContact N-O 3.28Å; Q137-S184 PolarHBondContact O-N 2.98Å
138	L	87.7	Confident	87	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.068	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.8	179.1	-64	179.6	0	0	0	112.2	A130 P136 L162 F164 V182 A183	A130-L138 HydrophobicContact CB-CD1 4.25Å; A130-L138 HydrophobicContact CB-CD2 3.56Å; A130-L138 HydrophobicContact CB-CG 4.45Å; P136-L138 HydrophobicContact CG-CD2 4.22Å; P136-L138 HydrophobicContact CG-CG 4.44Å; P136-L138 PolarHBondContact O-N 3.49Å; L138-L162 HydrophobicContact CD1-CB 4.19Å; L138-L162 HydrophobicContact CD1-CD2 3.33Å; L138-L162 HydrophobicContact CD1-CG 3.53Å; L138-L162 HydrophobicContact CG-CD2 4.09Å; L138-F164 HydrophobicContact CB-CD1 3.82Å; L138-F164 HydrophobicContact CB-CE1 3.97Å; L138-F164 HydrophobicContact CB-CG 4.15Å; L138-F164 HydrophobicContact CB-CZ 4.42Å; L138-F164 HydrophobicContact CD1-CB 3.71Å; L138-F164 HydrophobicContact CD1-CD1 4.37Å; L138-F164 HydrophobicContact CD1-CG 4.07Å; L138-V182 WeakPolarHBondContact CA-O 3.22Å; L138-A183 HydrophobicContact CD2-CB 3.44Å; L138-A183 VanDerWaalsContact CD2-CB 3.44Å
139	Y	90.2	Very high	85.4	Confident	66 Å²	66	63 Å²	63	26%	0.259	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	154.7	175.4	59.6	-85.7	0	0	0	111.6	Q141 V182	Y139-Q141 HydrophobicContact CD2-CG 4.17Å; Y139-Q141 HydrophobicContact CE2-CG 4.06Å; Y139-V182 HydrophobicContact CD1-CB 4.44Å; Y139-V182 HydrophobicContact CD2-CB 4.11Å; Y139-V182 HydrophobicContact CD2-CG2 4.43Å; Y139-V182 HydrophobicContact CE1-CB 4.01Å; Y139-V182 HydrophobicContact CE1-CG1 3.91Å; Y139-V182 HydrophobicContact CE2-CB 3.63Å; Y139-V182 HydrophobicContact CE2-CG1 4.01Å; Y139-V182 HydrophobicContact CE2-CG2 3.88Å; Y139-V182 HydrophobicContact CG-CB 4.49Å; Y139-V182 VanDerWaalsContact CZ-CG1 3.47Å; Y139-V182 PolarHBondContact N-O 3.25Å; Y139-V182 VanDerWaalsContact N-O 3.13Å; Y139-V182 PolarHBondContact O-N 3.37Å; Y139-V182 VanDerWaalsContact OH-CG1 3.3Å; Y139-V182 WeakPolarHBondContact OH-CG1 3.5Å
140	W	92.3	Very high	83.7	Confident	5 Å²	5	65.3 Å²	65.3	2%	0.019	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	146.2	175	-76.3	98.3	0	0	0	110.8	M126 N146 I147 F164 L166 K180 C181 F194	M126-W140 HydrophobicContact CB-CH2 3.89Å; M126-W140 WeakPolarHBondContact O-CZ2 3.31Å; W140-N146 WeakPolarHBondContact O-CA 3.32Å; W140-I147 HydrophobicContact CB-CB 4.22Å; W140-I147 HydrophobicContact CB-CD1 3.72Å; W140-I147 HydrophobicContact CB-CG1 4.11Å; W140-I147 PolarHBondContact O-N 2.8Å; W140-F164 AromaticContact CD1-CD1 3.64Å; W140-F164 AromaticContact CD1-CE1 3.04Å; W140-F164 AromaticContact CD1-CZ 3.51Å; W140-F164 AromaticContact CG-CE1 3.95Å; W140-F164 HydrophobicContact CG-CE1 3.95Å; W140-F164 AromaticContact NE1-CD1 3.24Å; W140-F164 AromaticContact NE1-CE1 3.21Å; W140-F164 AromaticContact NE1-CG 3.9Å; W140-F164 AromaticContact NE1-CZ 3.85Å; W140-L166 HydrophobicContact CB-CD2 4.45Å; W140-L166 HydrophobicContact CD2-CB 3.87Å; W140-L166 HydrophobicContact CD2-CD2 4.09Å; W140-L166 HydrophobicContact CE3-CB 4.47Å; W140-L166 HydrophobicContact CE3-CD2 4.23Å; W140-L166 HydrophobicContact CG-CB 4.14Å; W140-L166 HydrophobicContact CG-CD1 4.49Å; W140-L166 HydrophobicContact CG-CD2 4.17Å; W140-L166 HydrophobicContact CH2-CB 4.47Å; W140-L166 HydrophobicContact CZ2-CB 3.89Å; W140-K180 CarbonylContact C-O 3.56Å; W140-K180 WeakPolarHBondContact CA-O 3.48Å; W140-C181 HydrophobicContact CD2-CB 4.17Å; W140-C181 HydrophobicContact CE3-CB 3.95Å; W140-C181 HydrophobicContact CH2-CB 3.69Å; W140-C181 HydrophobicContact CZ2-CB 3.89Å; W140-C181 HydrophobicContact CZ3-CB 3.72Å; W140-F194 AromaticContact CH2-CD2 3.89Å; W140-F194 HydrophobicContact CH2-CD2 3.89Å; W140-F194 AromaticContact CH2-CE2 3.52Å; W140-F194 HydrophobicContact CH2-CE2 3.52Å; W140-F194 HydrophobicContact CH2-CZ 4.29Å; W140-F194 AromaticContact CZ3-CD2 3.62Å; W140-F194 HydrophobicContact CZ3-CD2 3.62Å; W140-F194 AromaticContact CZ3-CE2 3.66Å; W140-F194 HydrophobicContact CZ3-CE2 3.66Å
141	Q	94.2	Very high	82.2	Confident	39 Å²	39	69.9 Å²	69.9	18%	0.182	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.3	168.4	-70.1	-177.7	-21.2	0	0	110.1	Y139 K145 N146 Y179 K180 V182	Y139-Q141 HydrophobicContact CD2-CG 4.17Å; Y139-Q141 HydrophobicContact CE2-CG 4.06Å; Q141-K145 CarbonylContact C-O 3.48Å; Q141-K145 WeakPolarHBondContact CA-O 3.46Å; Q141-N146 VanDerWaalsContact CG-OD1 3.24Å; Q141-N146 WeakPolarHBondContact CG-OD1 3.31Å; Q141-N146 PolarHBondContact NE2-OD1 2.99Å; Q141-Y179 CarbonylContact O-C 3.56Å; Q141-Y179 VanDerWaalsContact O-CA 3.3Å; Q141-Y179 WeakPolarHBondContact O-CA 3.44Å; Q141-K180 HydrophobicContact CB-CB 4.23Å; Q141-K180 PolarHBondContact N-O 3.29Å; Q141-K180 PolarHBondContact O-N 2.85Å; Q141-V182 HydrophobicContact CG-CG2 4.38Å
142	F	93.3	Very high	81.4	Confident	51 Å²	51	68.8 Å²	68.8	22%	0.224	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.3	169	176.8	-119.4	0	0	0	109.1	G144 K145 I147 K174 M176 K178 Y179	F142-G144 PolarHBondContact O-N 2.86Å; F142-G144 VanDerWaalsContact O-N 3.13Å; F142-K145 PolarHBondContact N-O 2.61Å; F142-K145 PolarHBondContact O-N 2.8Å; F142-I147 HydrophobicContact CB-CD1 3.83Å; F142-I147 HydrophobicContact CB-CG1 3.84Å; F142-K174 WeakPolarHBondContact CZ-O 2.87Å; F142-M176 WeakPolarHBondContact CZ-O 3.49Å; F142-K178 WeakPolarHBondContact CA-O 3.16Å; F142-Y179 HydrophobicContact CB-CD1 4.29Å; F142-Y179 HydrophobicContact CB-CE1 4.12Å; F142-Y179 AromaticContact CD2-CD1 3.89Å; F142-Y179 HydrophobicContact CD2-CD1 3.89Å; F142-Y179 AromaticContact CD2-CD2 3.97Å; F142-Y179 HydrophobicContact CD2-CD2 3.97Å; F142-Y179 AromaticContact CD2-CE1 3.48Å; F142-Y179 HydrophobicContact CD2-CE1 3.48Å; F142-Y179 VanDerWaalsContact CD2-CE1 3.48Å; F142-Y179 AromaticContact CD2-CE2 3.56Å; F142-Y179 HydrophobicContact CD2-CE2 3.56Å; F142-Y179 HydrophobicContact CD2-CG 4.13Å; F142-Y179 AromaticContact CD2-CZ 3.29Å; F142-Y179 HydrophobicContact CE2-CD2 4.24Å; F142-Y179 HydrophobicContact CE2-CE1 4.15Å; F142-Y179 AromaticContact CE2-CE2 3.52Å; F142-Y179 HydrophobicContact CE2-CE2 3.52Å; F142-Y179 AromaticContact CE2-CZ 3.48Å; F142-Y179 VanDerWaalsContact CE2-CZ 3.48Å; F142-Y179 HydrophobicContact CG-CE1 4.04Å
143	N	93.7	Very high	80.7	Confident	89 Å²	89	74.6 Å²	74.6	48%	0.476	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	41.3	-176.8	-65.1	-29.4	0	0	0	112.7	K145 K178	N143-K145 VanDerWaalsContact C-N 3.33Å; N143-K145 PolarHBondContact O-N 3.39Å; N143-K178 PolarHBondContact N-O 3.32Å; N143-K178 PolarHBondContact OD1-N 3.45Å
144	G	92.1	Very high	80.3	Confident	59 Å²	59	76.8 Å²	76.8	61%	0.608	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-1.1	179.7	0	0	0	0	0	115.9	F142	F142-G144 PolarHBondContact O-N 2.86Å; F142-G144 VanDerWaalsContact O-N 3.13Å
145	K	92.6	Very high	80	Confident	166 Å²	166	79.3 Å²	79.3	72%	0.722	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	137	177.3	-64.2	-177.6	-179	179.5	0	111.1	Q141 F142 N143 I147	Q141-K145 CarbonylContact C-O 3.48Å; Q141-K145 WeakPolarHBondContact CA-O 3.46Å; F142-K145 PolarHBondContact N-O 2.61Å; F142-K145 PolarHBondContact O-N 2.8Å; N143-K145 VanDerWaalsContact C-N 3.33Å; N143-K145 PolarHBondContact O-N 3.39Å; K145-I147 PolarHBondContact O-N 3.02Å
146	N	90.3	Very high	79.1	Confident	107 Å²	107	80.8 Å²	80.8	57%	0.572	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.9	131.2	177.4	-68	-3.4	0	0	0	110.5	W140 Q141	W140-N146 WeakPolarHBondContact O-CA 3.32Å; Q141-N146 VanDerWaalsContact CG-OD1 3.24Å; Q141-N146 WeakPolarHBondContact CG-OD1 3.31Å; Q141-N146 PolarHBondContact NE2-OD1 2.99Å
147	I	87.4	Confident	78	Confident	40 Å²	40	82.4 Å²	82.4	21%	0.205	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-78.2	133.1	172.5	-53.5	-178	0	0	0	107.6	W140 F142 K145 L151 L166 Y179	W140-I147 HydrophobicContact CB-CB 4.22Å; W140-I147 HydrophobicContact CB-CD1 3.72Å; W140-I147 HydrophobicContact CB-CG1 4.11Å; W140-I147 PolarHBondContact O-N 2.8Å; F142-I147 HydrophobicContact CB-CD1 3.83Å; F142-I147 HydrophobicContact CB-CG1 3.84Å; K145-I147 PolarHBondContact O-N 3.02Å; I147-L151 HydrophobicContact CG2-CD1 4.26Å; I147-L166 HydrophobicContact CD1-CD1 4.41Å; I147-L166 HydrophobicContact CD1-CD2 3.61Å; I147-Y179 HydrophobicContact CD1-CD1 4.03Å; I147-Y179 HydrophobicContact CD1-CE1 4.05Å
148	S	70.4	Confident	76.3	Confident	96 Å²	96	85.3 Å²	85.3	67%	0.671	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-59	137.3	178	49	0	0	0	0	111.4	G150	S148-G150 PolarHBondContact O-N 2.75Å
149	S	55.9	Low	74.8	Confident	122 Å²	122	88.4 Å²	88.4	85%	0.853	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	121.4	178.6	49.4	0	0	0	0	111.6
150	G	53.5	Low	73.3	Confident	72 Å²	72	87.6 Å²	87.6	74%	0.742	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	149	-21	174.6	0	0	0	0	0	116	S148	S148-G150 PolarHBondContact O-N 2.75Å
151	L	56.3	Low	72.3	Confident	98 Å²	98	92.2 Å²	92.2	51%	0.513	53%	0.526	S	S	.	.	S	Bend	trans	-93	2.6	178.5	-70.8	167.7	0	0	0	114	I147 L166 E167	I147-L151 HydrophobicContact CG2-CD1 4.26Å; L151-L166 HydrophobicContact CB-CD1 3.9Å; L151-E167 PolarHBondContact O-N 2.94Å
152	S	65.6	Low	71.4	Confident	34 Å²	34	91.2 Å²	91.2	24%	0.238	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122.7	-168.1	60.5	0	0	0	0	110.9	F164 C165	S152-F164 VanDerWaalsContact CB-CZ 3.46Å; S152-F164 WeakPolarHBondContact OG-CE2 3.37Å; S152-F164 VanDerWaalsContact OG-CZ 3.32Å; S152-F164 WeakPolarHBondContact OG-CZ 3.39Å; S152-C165 CarbonylContact C-O 3.6Å; S152-C165 WeakPolarHBondContact CA-O 3.25Å
153	Q	67.2	Low	71	Confident	133 Å²	133	91.8 Å²	91.8	62%	0.621	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.4	175	-64.1	-173.7	5.1	0	0	109.5	F164 C165	Q153-F164 WeakPolarHBondContact O-CA 3.49Å; Q153-C165 PolarHBondContact N-O 3.2Å; Q153-C165 PolarHBondContact O-N 3.23Å
154	K	70.9	Confident	70.8	Confident	124 Å²	124	87.8 Å²	87.8	54%	0.539	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.7	174.2	-74.4	178	-177.7	-174.6	0	107.9	L162 E163 F164	K154-L162 HydrophobicContact CB-CD1 4.28Å; K154-E163 WeakPolarHBondContact CA-O 3.15Å; K154-F164 HydrophobicContact CB-CD2 4.46Å; K154-F164 HydrophobicContact CD-CD2 4.21Å; K154-F164 HydrophobicContact CD-CE2 4.08Å; K154-F164 HydrophobicContact CG-CD2 3.32Å; K154-F164 HydrophobicContact CG-CE2 3.55Å; K154-F164 HydrophobicContact CG-CG 4.43Å
155	H	72.1	Confident	70.7	Confident	117 Å²	117	85.9 Å²	85.9	54%	0.542	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115.6	172.8	-173.7	-94.6	0	0	0	109.2	E163	H155-E163 HydrophobicContact CB-CB 4.37Å; H155-E163 PolarHBondContact N-O 2.83Å; H155-E163 PolarHBondContact O-N 2.98Å
156	L	63.9	Low	70.5	Confident	108 Å²	108	78.2 Å²	78.2	57%	0.565	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	112.7	174.2	-169.9	74	0	0	0	108	L162	L156-L162 HydrophobicContact CB-CD1 4.13Å; L156-L162 HydrophobicContact CD1-CB 4Å; L156-L162 HydrophobicContact CD1-CD1 3.85Å; L156-L162 HydrophobicContact CD1-CG 4.46Å
157	S	61	Low	70.5	Confident	44 Å²	44	76.7 Å²	76.7	31%	0.308	44%	0.437	S	S	.	.			trans	-65.4	149.1	170.4	175.7	0	0	0	0	110.3	S159 G160 K161	S157-S159 PolarHBondContact O-N 3.24Å; S157-S159 PolarHBondContact OG-N 3.38Å; S157-S159 PolarHBondContact OG-OG 2.87Å; S157-G160 PolarHBondContact O-N 3.02Å; S157-K161 WeakPolarHBondContact CB-O 3.47Å; S157-K161 PolarHBondContact N-O 3.43Å
158	E	52.7	Low	70.6	Confident	208 Å²	208	75.6 Å²	75.6	97%	0.972	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-25.3	169.8	-65.8	-178.7	170.9	0	0	113	G160	E158-G160 PolarHBondContact O-N 3.1Å
159	S	54.6	Low	71.5	Confident	78 Å²	78	75.1 Å²	75.1	55%	0.545	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	4.3	176	62.6	0	0	0	0	114.9	S157 K161	S157-S159 PolarHBondContact O-N 3.24Å; S157-S159 PolarHBondContact OG-N 3.38Å; S157-S159 PolarHBondContact OG-OG 2.87Å; S159-K161 PolarHBondContact O-N 2.91Å; S159-K161 WeakPolarHBondContact OG-CG 3.21Å
160	G	59.8	Low	73.1	Confident	49 Å²	49	75 Å²	75	51%	0.505	41%	0.41	S	S	.	.	S	Bend	trans	78.1	2.7	-176.5	0	0	0	0	0	114.3	S157 E158 L162	S157-G160 PolarHBondContact O-N 3.02Å; E158-G160 PolarHBondContact O-N 3.1Å; G160-L162 PolarHBondContact O-N 3.06Å
161	K	70.3	Confident	74.9	Confident	103 Å²	103	71.5 Å²	71.5	45%	0.448	38%	0.375	S	S	.	.			trans	-75.3	121.3	174.4	-61.5	-175.2	-179.8	177.8	0	109.6	T129 L131 S157 S159	T129-K161 HydrophobicContact CG2-CB 3.83Å; L131-K161 HydrophobicContact CD2-CB 4.36Å; L131-K161 HydrophobicContact CD2-CD 4.02Å; L131-K161 HydrophobicContact CD2-CG 3.61Å; S157-K161 WeakPolarHBondContact CB-O 3.47Å; S157-K161 PolarHBondContact N-O 3.43Å; S159-K161 PolarHBondContact O-N 2.91Å; S159-K161 WeakPolarHBondContact OG-CG 3.21Å
162	L	76	Confident	76.6	Confident	17 Å²	17	72.9 Å²	72.9	9%	0.089	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	107	176.6	-173.2	59.3	0	0	0	109.1	T129 A130 L138 K154 L156 G160	T129-L162 WeakPolarHBondContact CA-O 3.42Å; A130-L162 PolarHBondContact N-O 2.91Å; L138-L162 HydrophobicContact CD1-CB 4.19Å; L138-L162 HydrophobicContact CD1-CD2 3.33Å; L138-L162 HydrophobicContact CD1-CG 3.53Å; L138-L162 HydrophobicContact CG-CD2 4.09Å; K154-L162 HydrophobicContact CB-CD1 4.28Å; L156-L162 HydrophobicContact CB-CD1 4.13Å; L156-L162 HydrophobicContact CD1-CB 4Å; L156-L162 HydrophobicContact CD1-CD1 3.85Å; L156-L162 HydrophobicContact CD1-CG 4.46Å; G160-L162 PolarHBondContact O-N 3.06Å
163	E	85.7	Confident	77.8	Confident	64 Å²	64	76.2 Å²	76.2	30%	0.299	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	137	170.1	-175.9	172.5	-129.7	0	0	109.7	C128 K154 H155	C128-E163 CarbonylContact O-C 3.55Å; C128-E163 WeakPolarHBondContact O-CA 3.37Å; K154-E163 WeakPolarHBondContact CA-O 3.15Å; H155-E163 HydrophobicContact CB-CB 4.37Å; H155-E163 PolarHBondContact N-O 2.83Å; H155-E163 PolarHBondContact O-N 2.98Å
164	F	88.2	Confident	78.9	Confident	4 Å²	4	76 Å²	76	2%	0.018	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	108.3	-174.9	-172.7	-131.5	0	0	0	109.2	C128 L138 W140 S152 Q153 K154	C128-F164 PolarHBondContact N-O 2.02Å; C128-F164 PolarHBondContact O-N 3.04Å; C128-F164 PolarHBondContact SG-O 2.8Å; L138-F164 HydrophobicContact CB-CD1 3.82Å; L138-F164 HydrophobicContact CB-CE1 3.97Å; L138-F164 HydrophobicContact CB-CG 4.15Å; L138-F164 HydrophobicContact CB-CZ 4.42Å; L138-F164 HydrophobicContact CD1-CB 3.71Å; L138-F164 HydrophobicContact CD1-CD1 4.37Å; L138-F164 HydrophobicContact CD1-CG 4.07Å; W140-F164 AromaticContact CD1-CD1 3.64Å; W140-F164 AromaticContact CD1-CE1 3.04Å; W140-F164 AromaticContact CD1-CZ 3.51Å; W140-F164 AromaticContact CG-CE1 3.95Å; W140-F164 HydrophobicContact CG-CE1 3.95Å; W140-F164 AromaticContact NE1-CD1 3.24Å; W140-F164 AromaticContact NE1-CE1 3.21Å; W140-F164 AromaticContact NE1-CG 3.9Å; W140-F164 AromaticContact NE1-CZ 3.85Å; S152-F164 VanDerWaalsContact CB-CZ 3.46Å; S152-F164 WeakPolarHBondContact OG-CE2 3.37Å; S152-F164 VanDerWaalsContact OG-CZ 3.32Å; S152-F164 WeakPolarHBondContact OG-CZ 3.39Å; Q153-F164 WeakPolarHBondContact O-CA 3.49Å; K154-F164 HydrophobicContact CB-CD2 4.46Å; K154-F164 HydrophobicContact CD-CD2 4.21Å; K154-F164 HydrophobicContact CD-CE2 4.08Å; K154-F164 HydrophobicContact CG-CD2 3.32Å; K154-F164 HydrophobicContact CG-CE2 3.55Å; K154-F164 HydrophobicContact CG-CG 4.43Å
165	C	89.3	Confident	79.9	Confident	20 Å²	20	71.2 Å²	71.2	14%	0.135	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137.3	-176.3	-60.2	0	0	0	0	110.4	V125 M126 C127 S152 Q153	V125-C165 HydrophobicContact CG1-CB 4.1Å; M126-C165 CarbonylContact O-C 3.53Å; M126-C165 WeakPolarHBondContact O-CA 3.24Å; C127-C165 HydrophobicContact CB-CB 4.16Å; C127-C165 WeakPolarHBondContact CB-SG 3.28Å; C127-C165 WeakPolarHBondContact SG-CB 3.29Å; C127-C165 CovalentContact SG-SG 2.04Å; C127-C165 PolarHBondContact SG-SG 2.9Å; S152-C165 CarbonylContact C-O 3.6Å; S152-C165 WeakPolarHBondContact CA-O 3.25Å; Q153-C165 PolarHBondContact N-O 3.2Å; Q153-C165 PolarHBondContact O-N 3.23Å
166	L	90	Very high	80.9	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.026	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.7	168	-177.6	66.9	0	0	0	108.3	V125 M126 W140 I147 L151 Y179	V125-L166 WeakPolarHBondContact CA-O 3.44Å; M126-L166 HydrophobicContact CE-CD2 4.02Å; M126-L166 PolarHBondContact N-O 2.86Å; M126-L166 PolarHBondContact O-N 3.49Å; W140-L166 HydrophobicContact CB-CD2 4.45Å; W140-L166 HydrophobicContact CD2-CB 3.87Å; W140-L166 HydrophobicContact CD2-CD2 4.09Å; W140-L166 HydrophobicContact CE3-CB 4.47Å; W140-L166 HydrophobicContact CE3-CD2 4.23Å; W140-L166 HydrophobicContact CG-CB 4.14Å; W140-L166 HydrophobicContact CG-CD1 4.49Å; W140-L166 HydrophobicContact CG-CD2 4.17Å; W140-L166 HydrophobicContact CH2-CB 4.47Å; W140-L166 HydrophobicContact CZ2-CB 3.89Å; I147-L166 HydrophobicContact CD1-CD1 4.41Å; I147-L166 HydrophobicContact CD1-CD2 3.61Å; L151-L166 HydrophobicContact CB-CD1 3.9Å; L166-Y179 HydrophobicContact CD2-CD1 3.51Å; L166-Y179 HydrophobicContact CD2-CE1 3.7Å
167	E	89.3	Confident	82.3	Confident	75 Å²	75	62.9 Å²	62.9	35%	0.35	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132	175.4	-178.3	174.9	-178.5	0	0	109.9	V125 L151 P169	V125-E167 HydrophobicContact CG2-CB 4.25Å; V125-E167 HydrophobicContact CG2-CG 3.99Å; L151-E167 PolarHBondContact O-N 2.94Å; E167-P169 HydrophobicContact CG-CG 4.36Å; E167-P169 WeakPolarHBondContact O-CD 3.4Å
168	I	89.9	Confident	84	Confident	16 Å²	16	65.8 Å²	65.8	8%	0.082	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	96.8	169.9	-55.7	172.3	0	0	0	105.3	A123 H124 M126 K170 V171 D175 Y179	A123-I168 CarbonylContact C-O 3.59Å; A123-I168 VanDerWaalsContact CA-O 3.29Å; A123-I168 WeakPolarHBondContact CA-O 3.16Å; H124-I168 HydrophobicContact CB-CB 4.48Å; H124-I168 PolarHBondContact N-O 3.25Å; H124-I168 PolarHBondContact O-N 2.88Å; M126-I168 HydrophobicContact CE-CD1 4.17Å; I168-K170 PolarHBondContact O-N 2.84Å; I168-V171 HydrophobicContact CB-CG2 4.32Å; I168-V171 HydrophobicContact CG2-CG2 3.84Å; I168-D175 HydrophobicContact CG2-CB 4.44Å; I168-Y179 HydrophobicContact CD1-CE1 4.27Å; I168-Y179 HydrophobicContact CD1-CE2 4.38Å
169	P	89.1	Confident	86	Confident	86 Å²	86	56.3 Å²	56.3	56%	0.558	29%	0.29	S	S	*	.	S	Bend	trans	-64.4	-29.1	-171.7	-24.3	33.9	0	0	0	113.5	E167	E167-P169 HydrophobicContact CG-CG 4.36Å; E167-P169 WeakPolarHBondContact O-CD 3.4Å
170	K	90.1	Very high	87.9	Confident	119 Å²	119	55.4 Å²	55.4	52%	0.517	28%	0.276	S	S	.	.	S	Bend	trans	-144.8	100.5	-179.1	-168.8	170	179.5	163.7	0	109.6	D121 I168 R172	D121-K170 HydrophobicContact CB-CG 4.34Å; D121-K170 WeakPolarHBondContact OD1-CE 3.44Å; D121-K170 IonicContact OD1-NZ 2.77Å; D121-K170 IonicContact OD2-NZ 2.82Å; I168-K170 PolarHBondContact O-N 2.84Å; K170-R172 PolarHBondContact O-N 3.13Å
171	V	91.3	Very high	89.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.252	C	S	.	.			trans	-66.8	127.9	-176.4	169.8	0	0	0	0	111.1	V118 D121 D122 H124 I168 M176	V118-V171 HydrophobicContact CB-CG1 4.46Å; V118-V171 HydrophobicContact CG2-CG1 3.75Å; V118-V171 HydrophobicContact CG2-CG2 4.49Å; D121-V171 PolarHBondContact N-O 2.76Å; D122-V171 WeakPolarHBondContact O-CB 3.08Å; D122-V171 VanDerWaalsContact O-CG2 3.24Å; D122-V171 WeakPolarHBondContact O-CG2 3.07Å; D122-V171 PolarHBondContact O-N 2.83Å; H124-V171 HydrophobicContact CB-CG2 3.74Å; I168-V171 HydrophobicContact CB-CG2 4.32Å; I168-V171 HydrophobicContact CG2-CG2 3.84Å; V171-M176 HydrophobicContact CG1-CE 3.3Å
172	R	92.1	Very high	90.5	Very high	127 Å²	127	48.6 Å²	48.6	48%	0.479	23%	0.233	S	C	.	.			trans	-120.8	167.6	172.9	-61.8	172.9	-69.1	-162.8	-11.6	111.1	K170 K174 D175 M176	K170-R172 PolarHBondContact O-N 3.13Å; R172-K174 HydrophobicContact CB-CG 4.27Å; R172-K174 VanDerWaalsContact NE-CE 3.31Å; R172-K174 VanDerWaalsContact NH2-NZ 3.17Å; R172-K174 PolarHBondContact O-N 2.92Å; R172-K174 VanDerWaalsContact O-N 3.12Å; R172-D175 WeakPolarHBondContact CB-OD2 3.44Å; R172-D175 PolarHBondContact N-OD2 2.64Å; R172-D175 IonicContact NE-OD2 3.25Å; R172-D175 WeakPolarHBondContact O-CB 3.41Å; R172-D175 PolarHBondContact O-N 2.87Å; R172-M176 WeakPolarHBondContact O-CE 3.43Å
173	L	90.3	Very high	91.2	Very high	104 Å²	104	47.8 Å²	47.8	55%	0.545	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-52	-35.6	175.6	-87.8	177.2	0	0	0	114.8	L120 D175 M176 R198	L120-L173 HydrophobicContact CD2-CG 4.37Å; L173-D175 PolarHBondContact O-N 3.07Å; L173-M176 WeakPolarHBondContact O-CG 2.91Å; L173-M176 PolarHBondContact O-N 3.29Å; L173-R198 VanDerWaalsContact CG-NH2 3.31Å
174	K	90.2	Very high	91.3	Very high	129 Å²	129	46 Å²	46	56%	0.561	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-75.8	-12.1	-179.8	66.1	171.2	-175.9	176.2	0	114	F142 R172 M176	F142-K174 WeakPolarHBondContact CZ-O 2.87Å; R172-K174 HydrophobicContact CB-CG 4.27Å; R172-K174 VanDerWaalsContact NE-CE 3.31Å; R172-K174 VanDerWaalsContact NH2-NZ 3.17Å; R172-K174 PolarHBondContact O-N 2.92Å; R172-K174 VanDerWaalsContact O-N 3.12Å; K174-M176 VanDerWaalsContact C-N 3.28Å
175	D	91.5	Very high	91.1	Very high	23 Å²	23	46.7 Å²	46.7	12%	0.123	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-90.3	1.8	179.5	-51.5	-45.3	0	0	0	110.5	I168 R172 L173 Y179	I168-D175 HydrophobicContact CG2-CB 4.44Å; R172-D175 WeakPolarHBondContact CB-OD2 3.44Å; R172-D175 PolarHBondContact N-OD2 2.64Å; R172-D175 IonicContact NE-OD2 3.25Å; R172-D175 WeakPolarHBondContact O-CB 3.41Å; R172-D175 PolarHBondContact O-N 2.87Å; L173-D175 PolarHBondContact O-N 3.07Å; D175-Y179 VanDerWaalsContact O-CE2 3.24Å; D175-Y179 WeakPolarHBondContact O-CE2 3.38Å; D175-Y179 PolarHBondContact O-OH 3.45Å
176	M	93.9	Very high	90.6	Very high	37 Å²	37	48.7 Å²	48.7	18%	0.182	25%	0.245	C	C	.	.			trans	-75.6	139.6	172.2	-58.3	-59.1	115	0	0	110.7	V118 F142 V171 R172 L173 K174 V196 R198	V118-M176 HydrophobicContact CG2-CE 3.66Å; V118-M176 HydrophobicContact CG2-SD 4.16Å; F142-M176 WeakPolarHBondContact CZ-O 3.49Å; V171-M176 HydrophobicContact CG1-CE 3.3Å; R172-M176 WeakPolarHBondContact O-CE 3.43Å; L173-M176 WeakPolarHBondContact O-CG 2.91Å; L173-M176 PolarHBondContact O-N 3.29Å; K174-M176 VanDerWaalsContact C-N 3.28Å; M176-V196 HydrophobicContact CE-CG1 4.12Å; M176-V196 HydrophobicContact SD-CG1 4.12Å; M176-R198 HydrophobicContact SD-CB 3.97Å; M176-R198 PolarHBondContact SD-N 1.98Å
177	G	93.9	Very high	90	Very high	13 Å²	13	51.8 Å²	51.8	13%	0.134	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.5	-148.1	174.9	0	0	0	0	0	114.2	H195 V196	G177-H195 PolarHBondContact O-ND1 2.8Å; G177-H195 VanDerWaalsContact O-ND1 3.1Å; G177-V196 PolarHBondContact N-O 2.88Å; G177-V196 VanDerWaalsContact N-O 3.07Å; G177-V196 PolarHBondContact O-N 3.48Å
178	K	95.9	Very high	89.6	Confident	105 Å²	105	49.7 Å²	49.7	46%	0.457	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116.1	-174	-66.1	-178.8	169.3	-148.2	0	110.4	F142 N143 E193	F142-K178 WeakPolarHBondContact CA-O 3.16Å; N143-K178 PolarHBondContact N-O 3.32Å; N143-K178 PolarHBondContact OD1-N 3.45Å; K178-E193 WeakPolarHBondContact CD-OE1 3.46Å; K178-E193 IonicContact NZ-OE1 3.31Å; K178-E193 PolarHBondContact NZ-OE1 3.31Å
179	Y	94.3	Very high	89.5	Confident	8 Å²	8	53.9 Å²	53.9	3%	0.031	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	140.2	172.6	-69.6	-95.1	0	0	0	109.5	M126 Q141 F142 I147 L166 I168 D175 E193 F194 V196	M126-Y179 HydrophobicContact CE-CD1 3.77Å; M126-Y179 HydrophobicContact CE-CD2 3.86Å; M126-Y179 HydrophobicContact CE-CE1 4.2Å; M126-Y179 HydrophobicContact CE-CE2 4.29Å; M126-Y179 HydrophobicContact CE-CG 3.57Å; M126-Y179 HydrophobicContact SD-CD2 4.25Å; M126-Y179 HydrophobicContact SD-CG 4.14Å; Q141-Y179 CarbonylContact O-C 3.56Å; Q141-Y179 VanDerWaalsContact O-CA 3.3Å; Q141-Y179 WeakPolarHBondContact O-CA 3.44Å; F142-Y179 HydrophobicContact CB-CD1 4.29Å; F142-Y179 HydrophobicContact CB-CE1 4.12Å; F142-Y179 AromaticContact CD2-CD1 3.89Å; F142-Y179 HydrophobicContact CD2-CD1 3.89Å; F142-Y179 AromaticContact CD2-CD2 3.97Å; F142-Y179 HydrophobicContact CD2-CD2 3.97Å; F142-Y179 AromaticContact CD2-CE1 3.48Å; F142-Y179 HydrophobicContact CD2-CE1 3.48Å; F142-Y179 VanDerWaalsContact CD2-CE1 3.48Å; F142-Y179 AromaticContact CD2-CE2 3.56Å; F142-Y179 HydrophobicContact CD2-CE2 3.56Å; F142-Y179 HydrophobicContact CD2-CG 4.13Å; F142-Y179 AromaticContact CD2-CZ 3.29Å; F142-Y179 HydrophobicContact CE2-CD2 4.24Å; F142-Y179 HydrophobicContact CE2-CE1 4.15Å; F142-Y179 AromaticContact CE2-CE2 3.52Å; F142-Y179 HydrophobicContact CE2-CE2 3.52Å; F142-Y179 AromaticContact CE2-CZ 3.48Å; F142-Y179 VanDerWaalsContact CE2-CZ 3.48Å; F142-Y179 HydrophobicContact CG-CE1 4.04Å; I147-Y179 HydrophobicContact CD1-CD1 4.03Å; I147-Y179 HydrophobicContact CD1-CE1 4.05Å; L166-Y179 HydrophobicContact CD2-CD1 3.51Å; L166-Y179 HydrophobicContact CD2-CE1 3.7Å; I168-Y179 HydrophobicContact CD1-CE1 4.27Å; I168-Y179 HydrophobicContact CD1-CE2 4.38Å; D175-Y179 VanDerWaalsContact O-CE2 3.24Å; D175-Y179 WeakPolarHBondContact O-CE2 3.38Å; D175-Y179 PolarHBondContact O-OH 3.45Å; Y179-E193 CarbonylContact O-C 3.42Å; Y179-E193 WeakPolarHBondContact O-CA 3.39Å; Y179-F194 PolarHBondContact N-O 3.37Å; Y179-F194 PolarHBondContact O-N 2.85Å; Y179-V196 HydrophobicContact CD2-CB 4.23Å; Y179-V196 HydrophobicContact CD2-CG2 3.59Å; Y179-V196 HydrophobicContact CE2-CB 4.06Å; Y179-V196 HydrophobicContact CE2-CG2 3.74Å
180	K	94.5	Very high	89.5	Confident	60 Å²	60	51.2 Å²	51.2	26%	0.261	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	121.2	179.1	-176.8	179.3	-64.1	-177.1	0	110.3	W140 Q141 V182 K192 E193	W140-K180 CarbonylContact C-O 3.56Å; W140-K180 WeakPolarHBondContact CA-O 3.48Å; Q141-K180 HydrophobicContact CB-CB 4.23Å; Q141-K180 PolarHBondContact N-O 3.29Å; Q141-K180 PolarHBondContact O-N 2.85Å; K180-V182 HydrophobicContact CD-CG2 4.07Å; K180-V182 HydrophobicContact CG-CG2 3.86Å; K180-K192 CarbonylContact C-O 3.49Å; K180-K192 VanDerWaalsContact CA-O 3.29Å; K180-K192 WeakPolarHBondContact CA-O 3.33Å; K180-E193 WeakPolarHBondContact CE-OE2 3.22Å; K180-E193 IonicContact NZ-OE2 3.19Å; K180-E193 PolarHBondContact NZ-OE2 2.99Å
181	C	92.6	Very high	89.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	124.3	169.6	166.7	0	0	0	0	108.5	C128 W140 S191 K192 F194	C128-C181 HydrophobicContact CB-CB 3.6Å; C128-C181 WeakPolarHBondContact CB-SG 3.43Å; C128-C181 WeakPolarHBondContact SG-CB 3.42Å; C128-C181 CovalentContact SG-SG 2.02Å; C128-C181 PolarHBondContact SG-SG 3.41Å; W140-C181 HydrophobicContact CD2-CB 4.17Å; W140-C181 HydrophobicContact CE3-CB 3.95Å; W140-C181 HydrophobicContact CH2-CB 3.69Å; W140-C181 HydrophobicContact CZ2-CB 3.89Å; W140-C181 HydrophobicContact CZ3-CB 3.72Å; C181-S191 CarbonylContact O-C 3.58Å; C181-S191 WeakPolarHBondContact O-CA 3.13Å; C181-S191 VanDerWaalsContact O-CB 3.22Å; C181-S191 WeakPolarHBondContact O-CB 3.39Å; C181-K192 PolarHBondContact N-O 2.8Å; C181-K192 PolarHBondContact O-N 3.09Å; C181-F194 HydrophobicContact CB-CE2 4.28Å
182	V	92.1	Very high	89.8	Confident	8 Å²	8	51.1 Å²	51.1	5%	0.048	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.1	-177.8	-171.4	0	0	0	0	109.9	L138 Y139 Q141 K180	L138-V182 WeakPolarHBondContact CA-O 3.22Å; Y139-V182 HydrophobicContact CD1-CB 4.44Å; Y139-V182 HydrophobicContact CD2-CB 4.11Å; Y139-V182 HydrophobicContact CD2-CG2 4.43Å; Y139-V182 HydrophobicContact CE1-CB 4.01Å; Y139-V182 HydrophobicContact CE1-CG1 3.91Å; Y139-V182 HydrophobicContact CE2-CB 3.63Å; Y139-V182 HydrophobicContact CE2-CG1 4.01Å; Y139-V182 HydrophobicContact CE2-CG2 3.88Å; Y139-V182 HydrophobicContact CG-CB 4.49Å; Y139-V182 VanDerWaalsContact CZ-CG1 3.47Å; Y139-V182 PolarHBondContact N-O 3.25Å; Y139-V182 VanDerWaalsContact N-O 3.13Å; Y139-V182 PolarHBondContact O-N 3.37Å; Y139-V182 VanDerWaalsContact OH-CG1 3.3Å; Y139-V182 WeakPolarHBondContact OH-CG1 3.5Å; Q141-V182 HydrophobicContact CG-CG2 4.38Å; K180-V182 HydrophobicContact CD-CG2 4.07Å; K180-V182 HydrophobicContact CG-CG2 3.86Å
183	A	90.6	Very high	89.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.6	170.8	0	0	0	0	0	109.9	P106 V108 A130 P136 Q137 L138 N189 S190	P106-A183 HydrophobicContact CB-CB 3.78Å; P106-A183 HydrophobicContact CG-CB 4.28Å; P106-A183 WeakPolarHBondContact CG-O 3.39Å; V108-A183 HydrophobicContact CG2-CB 3.47Å; V108-A183 VanDerWaalsContact CG2-CB 3.47Å; A130-A183 HydrophobicContact CB-CB 3.91Å; P136-A183 HydrophobicContact CB-CB 4.3Å; P136-A183 HydrophobicContact CG-CB 4.35Å; Q137-A183 CarbonylContact O-C 3.43Å; Q137-A183 WeakPolarHBondContact O-CA 3.22Å; L138-A183 HydrophobicContact CD2-CB 3.44Å; L138-A183 VanDerWaalsContact CD2-CB 3.44Å; A183-N189 CarbonylContact O-C 3.49Å; A183-N189 VanDerWaalsContact O-CA 3.28Å; A183-N189 WeakPolarHBondContact O-CA 3.37Å; A183-S190 PolarHBondContact N-O 3.02Å; A183-S190 PolarHBondContact O-N 3.36Å
184	S	88.1	Confident	90.2	Very high	26 Å²	26	43.7 Å²	43.7	18%	0.182	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.4	-179.8	-167.7	0	0	0	0	111.4	Q137 L188 N189	Q137-S184 PolarHBondContact N-O 3.28Å; Q137-S184 PolarHBondContact O-N 2.98Å; S184-L188 CarbonylContact C-O 3.54Å; S184-L188 VanDerWaalsContact CA-O 3.29Å; S184-L188 WeakPolarHBondContact CA-O 3.46Å; S184-N189 WeakPolarHBondContact CA-OD1 3.15Å; S184-N189 WeakPolarHBondContact CB-OD1 3.1Å; S184-N189 PolarHBondContact OG-OD1 3.05Å
185	L	84.6	Confident	90.4	Very high	19 Å²	19	40.4 Å²	40.4	10%	0.099	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	123.4	177.3	178.7	64.9	0	0	0	110.2	V103 C104 P106 A132 P134 P136 G187 L188	V103-L185 HydrophobicContact CG1-CD2 3.84Å; V103-L185 HydrophobicContact CG1-CG 4.16Å; C104-L185 WeakPolarHBondContact O-CD2 3.34Å; P106-L185 HydrophobicContact CG-CB 4.3Å; A132-L185 HydrophobicContact CB-CD2 3.59Å; P134-L185 HydrophobicContact CG-CD1 4.03Å; P134-L185 WeakPolarHBondContact O-CD2 3.32Å; P136-L185 HydrophobicContact CB-CB 4.07Å; L185-G187 PolarHBondContact O-N 3.08Å; L185-G187 VanDerWaalsContact O-N 3.07Å; L185-L188 PolarHBondContact N-O 3.37Å; L185-L188 WeakPolarHBondContact O-CB 3.1Å; L185-L188 PolarHBondContact O-N 3.4Å
186	A	79.1	Confident	90.5	Very high	62 Å²	62	39.4 Å²	39.4	51%	0.512	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	36.3	175.3	0	0	0	0	0	115	I98 V103 L188	I98-A186 HydrophobicContact CD1-CB 3.55Å; V103-A186 HydrophobicContact CG1-CB 4.38Å; A186-L188 VanDerWaalsContact C-N 3.33Å
187	G	77.1	Confident	90.5	Very high	70 Å²	70	41.8 Å²	41.8	72%	0.722	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.2	-5.4	-178.8	0	0	0	0	0	115	L185	L185-G187 PolarHBondContact O-N 3.08Å; L185-G187 VanDerWaalsContact O-N 3.07Å
188	L	80.3	Confident	90.2	Very high	32 Å²	32	46.2 Å²	46.2	17%	0.168	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	141.4	172.4	-66.7	164.3	0	0	0	110.8	E92 L93 G105 P106 S184 L185 A186	E92-L188 HydrophobicContact CB-CD2 3.35Å; E92-L188 HydrophobicContact CB-CG 4.48Å; E92-L188 HydrophobicContact CG-CD2 3.92Å; L93-L188 HydrophobicContact CD1-CD1 4.07Å; L93-L188 HydrophobicContact CD2-CD1 3.11Å; L93-L188 HydrophobicContact CG-CD1 3.37Å; G105-L188 WeakPolarHBondContact O-CD1 3.14Å; P106-L188 HydrophobicContact CG-CB 4.48Å; S184-L188 CarbonylContact C-O 3.54Å; S184-L188 VanDerWaalsContact CA-O 3.29Å; S184-L188 WeakPolarHBondContact CA-O 3.46Å; L185-L188 PolarHBondContact N-O 3.37Å; L185-L188 WeakPolarHBondContact O-CB 3.1Å; L185-L188 PolarHBondContact O-N 3.4Å; A186-L188 VanDerWaalsContact C-N 3.33Å
189	N	87.6	Confident	89.7	Confident	103 Å²	103	44.6 Å²	44.6	55%	0.551	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	135	179.5	-61.9	-36.1	0	0	0	110.5	A183 S184	A183-N189 CarbonylContact O-C 3.49Å; A183-N189 VanDerWaalsContact O-CA 3.28Å; A183-N189 WeakPolarHBondContact O-CA 3.37Å; S184-N189 WeakPolarHBondContact CA-OD1 3.15Å; S184-N189 WeakPolarHBondContact CB-OD1 3.1Å; S184-N189 PolarHBondContact OG-OD1 3.05Å
190	S	89.9	Confident	88.7	Confident	30 Å²	30	52.5 Å²	52.5	21%	0.21	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.3	166.2	171.6	0	0	0	0	108.7	P106 V108 A183	P106-S190 WeakPolarHBondContact O-CB 3.46Å; V108-S190 WeakPolarHBondContact CG2-O 3.32Å; V108-S190 PolarHBondContact N-OG 2.98Å; A183-S190 PolarHBondContact N-O 3.02Å; A183-S190 PolarHBondContact O-N 3.36Å
191	S	93.1	Very high	87.2	Confident	58 Å²	58	56.2 Å²	56.2	41%	0.406	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	157.3	-177.9	67.2	0	0	0	0	112.9	C181	C181-S191 CarbonylContact O-C 3.58Å; C181-S191 WeakPolarHBondContact O-CA 3.13Å; C181-S191 VanDerWaalsContact O-CB 3.22Å; C181-S191 WeakPolarHBondContact O-CB 3.39Å
192	K	94.6	Very high	85.6	Confident	60 Å²	60	60.3 Å²	60.3	26%	0.261	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.7	171.8	-161.9	73.6	-178.6	177.6	0	109.6	V108 T110 E114 K180 C181 F194	V108-K192 HydrophobicContact CG1-CB 3.82Å; T110-K192 HydrophobicContact CG2-CD 4.21Å; T110-K192 HydrophobicContact CG2-CG 3.74Å; E114-K192 WeakPolarHBondContact OE1-CE 3.41Å; E114-K192 IonicContact OE1-NZ 3.02Å; E114-K192 PolarHBondContact OE1-NZ 3.28Å; K180-K192 CarbonylContact C-O 3.49Å; K180-K192 VanDerWaalsContact CA-O 3.29Å; K180-K192 WeakPolarHBondContact CA-O 3.33Å; C181-K192 PolarHBondContact N-O 2.8Å; C181-K192 PolarHBondContact O-N 3.09Å; K192-F194 HydrophobicContact CB-CE2 4.31Å; K192-F194 HydrophobicContact CB-CZ 4.42Å; K192-F194 HydrophobicContact CG-CE2 4.45Å; K192-F194 HydrophobicContact CG-CZ 4.2Å
193	E	94.7	Very high	83.8	Confident	73 Å²	73	67.1 Å²	67.1	34%	0.341	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	143.3	-179.1	-169.9	164.8	124.1	0	0	110.1	K178 Y179 K180	K178-E193 WeakPolarHBondContact CD-OE1 3.46Å; K178-E193 IonicContact NZ-OE1 3.31Å; K178-E193 PolarHBondContact NZ-OE1 3.31Å; Y179-E193 CarbonylContact O-C 3.42Å; Y179-E193 WeakPolarHBondContact O-CA 3.39Å; K180-E193 WeakPolarHBondContact CE-OE2 3.22Å; K180-E193 IonicContact NZ-OE2 3.19Å; K180-E193 PolarHBondContact NZ-OE2 2.99Å
194	F	94.6	Very high	82.1	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.009	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	136.6	178.2	-55	-90.3	0	0	0	108.2	T110 P113 E114 M126 W140 Y179 C181 K192	T110-F194 HydrophobicContact CG2-CE1 4.05Å; T110-F194 HydrophobicContact CG2-CZ 4.2Å; T110-F194 WeakPolarHBondContact OG1-CE1 3.3Å; T110-F194 VanDerWaalsContact OG1-CZ 3.26Å; T110-F194 WeakPolarHBondContact OG1-CZ 3.29Å; P113-F194 WeakPolarHBondContact O-CD1 2.93Å; E114-F194 CarbonylContact O-C 3.5Å; E114-F194 WeakPolarHBondContact O-CA 3.09Å; M126-F194 HydrophobicContact SD-CB 3.67Å; M126-F194 HydrophobicContact SD-CG 4.06Å; W140-F194 AromaticContact CH2-CD2 3.89Å; W140-F194 HydrophobicContact CH2-CD2 3.89Å; W140-F194 AromaticContact CH2-CE2 3.52Å; W140-F194 HydrophobicContact CH2-CE2 3.52Å; W140-F194 HydrophobicContact CH2-CZ 4.29Å; W140-F194 AromaticContact CZ3-CD2 3.62Å; W140-F194 HydrophobicContact CZ3-CD2 3.62Å; W140-F194 AromaticContact CZ3-CE2 3.66Å; W140-F194 HydrophobicContact CZ3-CE2 3.66Å; Y179-F194 PolarHBondContact N-O 3.37Å; Y179-F194 PolarHBondContact O-N 2.85Å; C181-F194 HydrophobicContact CB-CE2 4.28Å; K192-F194 HydrophobicContact CB-CE2 4.31Å; K192-F194 HydrophobicContact CB-CZ 4.42Å; K192-F194 HydrophobicContact CG-CE2 4.45Å; K192-F194 HydrophobicContact CG-CZ 4.2Å
195	H	95.3	Very high	80.5	Confident	59 Å²	59	73.8 Å²	73.8	27%	0.273	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121	175.9	-161.7	41.5	0	0	0	110.2	E114 S115 A116 G177 E197	E114-H195 PolarHBondContact O-N 3.2Å; S115-H195 CarbonylContact C-O 3.58Å; S115-H195 WeakPolarHBondContact CA-O 3.26Å; A116-H195 PolarHBondContact N-O 2.93Å; G177-H195 PolarHBondContact O-ND1 2.8Å; G177-H195 VanDerWaalsContact O-ND1 3.1Å; H195-E197 VanDerWaalsContact CD2-CG 3.44Å; H195-E197 WeakPolarHBondContact CD2-CG 3.31Å; H195-E197 IonicContact CD2-OE1 3.36Å; H195-E197 PolarHBondContact CD2-OE1 2.99Å; H195-E197 WeakPolarHBondContact NE2-CG 3.14Å; H195-E197 IonicContact NE2-OE1 3.5Å; H195-E197 PolarHBondContact NE2-OE1 3Å
196	V	93.9	Very high	78.9	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.012	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	112.4	178.3	-179.3	0	0	0	0	107.9	V118 M126 M176 G177 Y179	V118-V196 HydrophobicContact CG1-CG1 4.27Å; V118-V196 HydrophobicContact CG2-CG1 3.47Å; V118-V196 VanDerWaalsContact CG2-CG1 3.47Å; M126-V196 HydrophobicContact CE-CG2 4.22Å; M126-V196 HydrophobicContact SD-CG2 3.74Å; M176-V196 HydrophobicContact CE-CG1 4.12Å; M176-V196 HydrophobicContact SD-CG1 4.12Å; G177-V196 PolarHBondContact N-O 2.88Å; G177-V196 VanDerWaalsContact N-O 3.07Å; G177-V196 PolarHBondContact O-N 3.48Å; Y179-V196 HydrophobicContact CD2-CB 4.23Å; Y179-V196 HydrophobicContact CD2-CG2 3.59Å; Y179-V196 HydrophobicContact CE2-CB 4.06Å; Y179-V196 HydrophobicContact CE2-CG2 3.74Å
197	E	93.1	Very high	78.2	Confident	87 Å²	87	78.9 Å²	78.9	41%	0.407	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	150.4	177.8	-65.6	-171.9	-174.5	0	0	110.8	A116 V117 V118 H195	A116-E197 PolarHBondContact O-N 2.67Å; V117-E197 CarbonylContact C-O 3.58Å; V117-E197 WeakPolarHBondContact CA-O 3.04Å; V118-E197 WeakPolarHBondContact CG2-O 3.44Å; V118-E197 PolarHBondContact N-O 2.04Å; H195-E197 VanDerWaalsContact CD2-CG 3.44Å; H195-E197 WeakPolarHBondContact CD2-CG 3.31Å; H195-E197 IonicContact CD2-OE1 3.36Å; H195-E197 PolarHBondContact CD2-OE1 2.99Å; H195-E197 WeakPolarHBondContact NE2-CG 3.14Å; H195-E197 IonicContact NE2-OE1 3.5Å; H195-E197 PolarHBondContact NE2-OE1 3Å
198	R	89	Confident	77.6	Confident	106 Å²	106	79.2 Å²	79.2	40%	0.4	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.9	175.1	-172.1	-156.1	-110.8	174.5	-9	109.3	L173 M176 K200	L173-R198 VanDerWaalsContact CG-NH2 3.31Å; M176-R198 HydrophobicContact SD-CB 3.97Å; M176-R198 PolarHBondContact SD-N 1.98Å; R198-K200 PolarHBondContact O-N 2.67Å
199	D	85.1	Confident	77.1	Confident	71 Å²	71	84.7 Å²	84.7	38%	0.38	45%	0.448	S	S	.	.			trans	-54.2	129.3	164.4	-165.3	16.8	0	0	0	111.3	V117 V118 I201	V117-D199 HydrophobicContact CG1-CB 3.76Å; V118-D199 PolarHBondContact O-N 3.24Å; D199-I201 PolarHBondContact O-N 2.93Å
200	K	73.4	Confident	76.1	Confident	175 Å²	175	80.8 Å²	80.8	76%	0.761	43%	0.432	S	S	*	.			trans	-77.6	99.4	175.1	-69.2	179.6	-174.3	172.4	0	104.9	R198 P202	R198-K200 PolarHBondContact O-N 2.67Å; K200-P202 WeakPolarHBondContact O-CD 3.39Å
201	I	63.3	Low	75.5	Confident	137 Å²	137	83.2 Å²	83.2	70%	0.703	44%	0.442	S	S	*	.			trans	-52	111.6	168.5	-57.5	169.1	0	0	0	105.9	D199 I203	D199-I201 PolarHBondContact O-N 2.93Å; I201-I203 PolarHBondContact O-N 2.97Å
202	P	57.3	Low	74.6	Confident	86 Å²	86	86.7 Å²	86.7	56%	0.558	45%	0.453	S	S	*	.			trans	-60.2	132.4	172.5	23.4	-28.7	0	0	0	106.1	K200 V204	K200-P202 WeakPolarHBondContact O-CD 3.39Å; P202-V204 HydrophobicContact CB-CG2 4.03Å; P202-V204 HydrophobicContact CG-CG2 3.78Å; P202-V204 WeakPolarHBondContact O-CG2 3.21Å; P202-V204 PolarHBondContact O-N 2.84Å
203	I	55.9	Low	73.9	Confident	152 Å²	152	88.6 Å²	88.6	78%	0.779	47%	0.465	S	S	*	.			trans	-67	89.1	165.4	-56.1	173.2	0	0	0	104.5	I201 L205	I201-I203 PolarHBondContact O-N 2.97Å; I203-L205 HydrophobicContact CG2-CD2 4.28Å; I203-L205 HydrophobicContact CG2-CG 4.15Å; I203-L205 PolarHBondContact O-N 3Å
204	V	53.7	Low	73.3	Confident	87 Å²	87	92 Å²	92	53%	0.527	48%	0.476	S	S	.	.			trans	-77.5	107.3	170.9	-158.2	0	0	0	0	104.4	P202 N206	P202-V204 HydrophobicContact CB-CG2 4.03Å; P202-V204 HydrophobicContact CG-CG2 3.78Å; P202-V204 WeakPolarHBondContact O-CG2 3.21Å; P202-V204 PolarHBondContact O-N 2.84Å; V204-N206 HydrophobicContact CB-CB 4.46Å; V204-N206 WeakPolarHBondContact CB-OD1 3.45Å; V204-N206 HydrophobicContact CG1-CB 3.61Å; V204-N206 VanDerWaalsContact CG1-ND2 3.31Å; V204-N206 WeakPolarHBondContact CG1-ND2 3.15Å; V204-N206 WeakPolarHBondContact CG1-OD1 3.24Å; V204-N206 PolarHBondContact O-N 2.79Å; V204-N206 VanDerWaalsContact O-N 3.1Å; V204-N206 PolarHBondContact O-OD1 3.3Å
205	L	54.4	Low	72.7	Confident	78 Å²	78	94.4 Å²	94.4	41%	0.408	49%	0.492	S	S	.	.			trans	-80.7	58.8	167.6	-71.6	168.8	0	0	0	107.8	I203 G210 I211	I203-L205 HydrophobicContact CG2-CD2 4.28Å; I203-L205 HydrophobicContact CG2-CG 4.15Å; I203-L205 PolarHBondContact O-N 3Å; L205-G210 VanDerWaalsContact CD2-C 3.46Å; L205-G210 WeakPolarHBondContact CD2-O 3.17Å; L205-I211 HydrophobicContact CB-CD1 4.48Å; L205-I211 HydrophobicContact CB-CG1 3.77Å; L205-I211 HydrophobicContact CD1-CG1 4.45Å; L205-I211 HydrophobicContact CD2-CG1 4.32Å; L205-I211 HydrophobicContact CG-CG1 4.41Å
206	N	52.2	Low	72.3	Confident	134 Å²	134	97 Å²	97	72%	0.717	50%	0.504	S	S	*	.			trans	-93.6	3.7	-178	39.7	-16.6	0	0	0	112.9	V204	V204-N206 HydrophobicContact CB-CB 4.46Å; V204-N206 WeakPolarHBondContact CB-OD1 3.45Å; V204-N206 HydrophobicContact CG1-CB 3.61Å; V204-N206 VanDerWaalsContact CG1-ND2 3.31Å; V204-N206 WeakPolarHBondContact CG1-ND2 3.15Å; V204-N206 WeakPolarHBondContact CG1-OD1 3.24Å; V204-N206 PolarHBondContact O-N 2.79Å; V204-N206 VanDerWaalsContact O-N 3.1Å; V204-N206 PolarHBondContact O-OD1 3.3Å
207	S	63.4	Low	72.1	Confident	55 Å²	55	103.8 Å²	103.8	39%	0.385	53%	0.534	S	S	.	.	S	Bend	trans	-115	139.2	164.3	74	0	0	0	0	110.6	E209 G210 I211	S207-E209 PolarHBondContact O-N 2.82Å; S207-G210 PolarHBondContact O-N 2.94Å; S207-G210 PolarHBondContact OG-N 3.46Å; S207-G210 VanDerWaalsContact OG-N 3.08Å; S207-I211 PolarHBondContact O-N 3.09Å
208	A	64.4	Low	71.9	Confident	76 Å²	76	102.3 Å²	102.3	63%	0.628	53%	0.531	S	S	*	.	H	α-helix	trans	-53	-34	171.1	0	0	0	0	0	110.8	I211 M212	A208-I211 PolarHBondContact O-N 3.13Å; A208-M212 WeakPolarHBondContact O-CB 3.38Å; A208-M212 WeakPolarHBondContact O-CG 3.36Å; A208-M212 PolarHBondContact O-N 2.79Å
209	E	70.1	Confident	72.1	Confident	148 Å²	148	101.5 Å²	101.5	69%	0.692	53%	0.534	S	S	*	.	H	α-helix	trans	-61.5	-42.9	175.1	-62.4	179.8	166	0	0	113	S207 I211 M212 I213	S207-E209 PolarHBondContact O-N 2.82Å; E209-I211 PolarHBondContact O-N 2.9Å; E209-M212 PolarHBondContact O-N 3.48Å; E209-I213 WeakPolarHBondContact O-CD1 3.47Å; E209-I213 VanDerWaalsContact O-CG1 3.24Å; E209-I213 WeakPolarHBondContact O-CG1 3.32Å; E209-I213 PolarHBondContact O-N 2.99Å
210	G	67.4	Low	72.5	Confident	21 Å²	21	101.1 Å²	101.1	22%	0.216	54%	0.536	C	S	.	.	H	α-helix	trans	-65.1	-39	177.9	0	0	0	0	0	112.7	L205 S207 Y214	L205-G210 VanDerWaalsContact CD2-C 3.46Å; L205-G210 WeakPolarHBondContact CD2-O 3.17Å; S207-G210 PolarHBondContact O-N 2.94Å; S207-G210 PolarHBondContact OG-N 3.46Å; S207-G210 VanDerWaalsContact OG-N 3.08Å; G210-Y214 WeakPolarHBondContact O-CB 3.44Å; G210-Y214 PolarHBondContact O-N 2.97Å; G210-Y214 VanDerWaalsContact O-N 3.11Å
211	I	76.7	Confident	73.4	Confident	81 Å²	81	97 Å²	97	42%	0.415	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-46.6	175.2	-61.8	172.6	0	0	0	109.9	L205 S207 A208 E209 I213 Y214 C215	L205-I211 HydrophobicContact CB-CD1 4.48Å; L205-I211 HydrophobicContact CB-CG1 3.77Å; L205-I211 HydrophobicContact CD1-CG1 4.45Å; L205-I211 HydrophobicContact CD2-CG1 4.32Å; L205-I211 HydrophobicContact CG-CG1 4.41Å; S207-I211 PolarHBondContact O-N 3.09Å; A208-I211 PolarHBondContact O-N 3.13Å; E209-I211 PolarHBondContact O-N 2.9Å; I211-I213 PolarHBondContact O-N 3.33Å; I211-Y214 PolarHBondContact O-N 3.35Å; I211-C215 WeakPolarHBondContact O-CB 3.45Å; I211-C215 PolarHBondContact O-N 2.88Å; I211-C215 PolarHBondContact O-SG 2.86Å; I211-C215 VanDerWaalsContact O-SG 3.4Å
212	M	74.7	Confident	74.9	Confident	131 Å²	131	97.2 Å²	97.2	65%	0.645	52%	0.522	S	S	*	.	H	α-helix	trans	-61.2	-42.4	179.7	-71.3	-64.8	-71.5	0	0	111.9	A208 E209 Q216	A208-M212 WeakPolarHBondContact O-CB 3.38Å; A208-M212 WeakPolarHBondContact O-CG 3.36Å; A208-M212 PolarHBondContact O-N 2.79Å; E209-M212 PolarHBondContact O-N 3.48Å; M212-Q216 VanDerWaalsContact O-CB 3.23Å; M212-Q216 WeakPolarHBondContact O-CB 3.4Å; M212-Q216 PolarHBondContact O-N 3.49Å
213	I	79.9	Confident	76.6	Confident	100 Å²	100	97.5 Å²	97.5	51%	0.513	52%	0.518	S	S	.	.	H	α-helix	trans	-64.2	-45.7	177.1	-68.1	164.9	0	0	0	110.7	E209 I211 Q216 F217	E209-I213 WeakPolarHBondContact O-CD1 3.47Å; E209-I213 VanDerWaalsContact O-CG1 3.24Å; E209-I213 WeakPolarHBondContact O-CG1 3.32Å; E209-I213 PolarHBondContact O-N 2.99Å; I211-I213 PolarHBondContact O-N 3.33Å; I213-Q216 PolarHBondContact O-N 2.93Å; I213-F217 HydrophobicContact CG2-CD2 3.78Å; I213-F217 HydrophobicContact CG2-CE2 3.87Å; I213-F217 WeakPolarHBondContact O-CD2 3.43Å; I213-F217 PolarHBondContact O-N 3.37Å
214	Y	81.4	Confident	78.4	Confident	144 Å²	144	92 Å²	92	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-64.4	-44.7	179.2	-176.5	-95.1	0	0	0	112.4	G210 I211 Q216 F217 T218	G210-Y214 WeakPolarHBondContact O-CB 3.44Å; G210-Y214 PolarHBondContact O-N 2.97Å; G210-Y214 VanDerWaalsContact O-N 3.11Å; I211-Y214 PolarHBondContact O-N 3.35Å; Y214-Q216 VanDerWaalsContact C-N 3.33Å; Y214-Q216 PolarHBondContact O-N 3.43Å; Y214-F217 PolarHBondContact O-N 2.99Å; Y214-T218 HydrophobicContact CD1-CG2 4.21Å; Y214-T218 HydrophobicContact CE1-CG2 3.78Å; Y214-T218 HydrophobicContact CE2-CG2 4.37Å; Y214-T218 WeakPolarHBondContact O-CG2 3.42Å; Y214-T218 PolarHBondContact O-N 2.9Å; Y214-T218 PolarHBondContact O-OG1 2.92Å
215	C	82.5	Confident	80.3	Confident	53 Å²	53	91.8 Å²	91.8	36%	0.358	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-42.4	173.8	-73.9	0	0	0	0	111.4	I211 F217 T218 I219	I211-C215 WeakPolarHBondContact O-CB 3.45Å; I211-C215 PolarHBondContact O-N 2.88Å; I211-C215 PolarHBondContact O-SG 2.86Å; I211-C215 VanDerWaalsContact O-SG 3.4Å; C215-F217 PolarHBondContact O-N 3.24Å; C215-T218 WeakPolarHBondContact CA-OG1 3.48Å; C215-T218 PolarHBondContact O-N 2.97Å; C215-T218 PolarHBondContact O-OG1 2.74Å; C215-I219 WeakPolarHBondContact O-CB 3.25Å; C215-I219 WeakPolarHBondContact O-CD1 3.38Å; C215-I219 WeakPolarHBondContact O-CG1 3.38Å; C215-I219 PolarHBondContact O-N 2.82Å
216	Q	87.3	Confident	82.2	Confident	112 Å²	112	90.4 Å²	90.4	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-61.9	-46.5	177.4	-171.5	64.8	21.9	0	0	111.7	M212 I213 Y214 I219 C220	M212-Q216 VanDerWaalsContact O-CB 3.23Å; M212-Q216 WeakPolarHBondContact O-CB 3.4Å; M212-Q216 PolarHBondContact O-N 3.49Å; I213-Q216 PolarHBondContact O-N 2.93Å; Y214-Q216 VanDerWaalsContact C-N 3.33Å; Y214-Q216 PolarHBondContact O-N 3.43Å; Q216-I219 PolarHBondContact O-N 2.91Å; Q216-C220 PolarHBondContact NE2-SG 2.81Å; Q216-C220 VanDerWaalsContact NE2-SG 3.4Å; Q216-C220 VanDerWaalsContact O-CB 3.29Å; Q216-C220 WeakPolarHBondContact O-CB 3.41Å; Q216-C220 PolarHBondContact O-N 3.48Å; Q216-C220 PolarHBondContact O-SG 2.81Å
217	F	88.8	Confident	84.1	Confident	145 Å²	145	87.4 Å²	87.4	64%	0.636	48%	0.482	S	S	*	.	H	α-helix	trans	-63.9	-42.4	178.2	-91.3	-76.7	0	0	0	112.7	I213 Y214 C215 T221	I213-F217 HydrophobicContact CG2-CD2 3.78Å; I213-F217 HydrophobicContact CG2-CE2 3.87Å; I213-F217 WeakPolarHBondContact O-CD2 3.43Å; I213-F217 PolarHBondContact O-N 3.37Å; Y214-F217 PolarHBondContact O-N 2.99Å; C215-F217 PolarHBondContact O-N 3.24Å; F217-T221 WeakPolarHBondContact O-CB 3.34Å; F217-T221 VanDerWaalsContact O-CG2 3.28Å; F217-T221 WeakPolarHBondContact O-CG2 3.43Å; F217-T221 PolarHBondContact O-N 2.8Å; F217-T221 PolarHBondContact O-OG1 2.92Å
218	T	89.2	Confident	85.5	Confident	56 Å²	56	89.1 Å²	89.1	34%	0.344	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-38.9	178.1	49.6	0	0	0	0	112.4	Y214 C215 T221 F222	Y214-T218 HydrophobicContact CD1-CG2 4.21Å; Y214-T218 HydrophobicContact CE1-CG2 3.78Å; Y214-T218 HydrophobicContact CE2-CG2 4.37Å; Y214-T218 WeakPolarHBondContact O-CG2 3.42Å; Y214-T218 PolarHBondContact O-N 2.9Å; Y214-T218 PolarHBondContact O-OG1 2.92Å; C215-T218 WeakPolarHBondContact CA-OG1 3.48Å; C215-T218 PolarHBondContact O-N 2.97Å; C215-T218 PolarHBondContact O-OG1 2.74Å; T218-T221 WeakPolarHBondContact CA-OG1 3.49Å; T218-T221 PolarHBondContact O-OG1 3.17Å; T218-F222 WeakPolarHBondContact O-CB 2.97Å; T218-F222 PolarHBondContact O-N 2.63Å
219	I	93.8	Very high	86.6	Confident	90 Å²	90	90.2 Å²	90.2	46%	0.462	48%	0.484	S	S	.	.	H	α-helix	trans	-68.2	-46.9	175.2	-67.9	165.2	0	0	0	110.8	C215 Q216 T221 F222 I223	C215-I219 WeakPolarHBondContact O-CB 3.25Å; C215-I219 WeakPolarHBondContact O-CD1 3.38Å; C215-I219 WeakPolarHBondContact O-CG1 3.38Å; C215-I219 PolarHBondContact O-N 2.82Å; Q216-I219 PolarHBondContact O-N 2.91Å; I219-T221 VanDerWaalsContact C-N 3.33Å; I219-T221 PolarHBondContact O-N 3.41Å; I219-F222 PolarHBondContact O-N 2.04Å; I219-I223 HydrophobicContact CG2-CD1 3.64Å; I219-I223 HydrophobicContact CG2-CG1 4.3Å; I219-I223 VanDerWaalsContact O-CG1 3.31Å; I219-I223 WeakPolarHBondContact O-CG1 3.41Å; I219-I223 PolarHBondContact O-N 3.36Å
220	C	93.4	Very high	87.3	Confident	63 Å²	63	86.3 Å²	86.3	43%	0.426	47%	0.473	S	S	.	.	H	α-helix	trans	-60.7	-41.8	178.9	-74.4	0	0	0	0	112.3	Q216 G224	Q216-C220 PolarHBondContact NE2-SG 2.81Å; Q216-C220 VanDerWaalsContact NE2-SG 3.4Å; Q216-C220 VanDerWaalsContact O-CB 3.29Å; Q216-C220 WeakPolarHBondContact O-CB 3.41Å; Q216-C220 PolarHBondContact O-N 3.48Å; Q216-C220 PolarHBondContact O-SG 2.81Å; C220-G224 PolarHBondContact O-N 3.44Å
221	T	91.8	Very high	88.1	Confident	88 Å²	88	89.2 Å²	89.2	54%	0.54	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-41.5	176.2	48.4	0	0	0	0	111.9	F217 T218 I219 G224 V225	F217-T221 WeakPolarHBondContact O-CB 3.34Å; F217-T221 VanDerWaalsContact O-CG2 3.28Å; F217-T221 WeakPolarHBondContact O-CG2 3.43Å; F217-T221 PolarHBondContact O-N 2.8Å; F217-T221 PolarHBondContact O-OG1 2.92Å; T218-T221 WeakPolarHBondContact CA-OG1 3.49Å; T218-T221 PolarHBondContact O-OG1 3.17Å; I219-T221 VanDerWaalsContact C-N 3.33Å; I219-T221 PolarHBondContact O-N 3.41Å; T221-G224 PolarHBondContact O-N 3.26Å; T221-V225 WeakPolarHBondContact O-CG2 3.23Å; T221-V225 PolarHBondContact O-N 3.07Å
222	F	94.3	Very high	88.2	Confident	142 Å²	142	88.8 Å²	88.8	62%	0.623	49%	0.493	S	S	*	.	H	α-helix	trans	-61.4	-49	175.5	-176.1	-99.1	0	0	0	112.2	T218 I219 G224 V225 C226	T218-F222 WeakPolarHBondContact O-CB 2.97Å; T218-F222 PolarHBondContact O-N 2.63Å; I219-F222 PolarHBondContact O-N 2.04Å; F222-G224 VanDerWaalsContact C-N 3.31Å; F222-G224 PolarHBondContact O-N 3.22Å; F222-V225 PolarHBondContact O-N 3.43Å; F222-C226 VanDerWaalsContact CE1-SG 3.59Å; F222-C226 PolarHBondContact O-N 2.84Å; F222-C226 PolarHBondContact O-SG 2.65Å; F222-C226 VanDerWaalsContact O-SG 3.34Å
223	I	94.2	Very high	88.4	Confident	91 Å²	91	86.9 Å²	86.9	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-58.5	-45.4	176.6	-66.9	169	0	0	0	110.3	I219 V225 C226 C227	I219-I223 HydrophobicContact CG2-CD1 3.64Å; I219-I223 HydrophobicContact CG2-CG1 4.3Å; I219-I223 VanDerWaalsContact O-CG1 3.31Å; I219-I223 WeakPolarHBondContact O-CG1 3.41Å; I219-I223 PolarHBondContact O-N 3.36Å; I223-V225 PolarHBondContact O-N 3.16Å; I223-C226 PolarHBondContact O-N 3.35Å; I223-C227 WeakPolarHBondContact O-CB 3.38Å; I223-C227 PolarHBondContact O-N 2.82Å; I223-C227 PolarHBondContact O-SG 3.38Å
224	G	92.6	Very high	88.1	Confident	36 Å²	36	88.8 Å²	88.8	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-57.4	-46.5	177.1	0	0	0	0	0	112.6	C220 T221 F222 C227 V228	C220-G224 PolarHBondContact O-N 3.44Å; T221-G224 PolarHBondContact O-N 3.26Å; F222-G224 VanDerWaalsContact C-N 3.31Å; F222-G224 PolarHBondContact O-N 3.22Å; G224-C227 PolarHBondContact O-N 2.77Å; G224-V228 WeakPolarHBondContact O-CG2 3.19Å; G224-V228 PolarHBondContact O-N 3.24Å
225	V	94.4	Very high	87.3	Confident	84 Å²	84	92.8 Å²	92.8	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-45.7	177	171.1	0	0	0	0	111.2	T221 F222 I223 C227 V228 I229	T221-V225 WeakPolarHBondContact O-CG2 3.23Å; T221-V225 PolarHBondContact O-N 3.07Å; F222-V225 PolarHBondContact O-N 3.43Å; I223-V225 PolarHBondContact O-N 3.16Å; V225-C227 VanDerWaalsContact C-N 3.33Å; V225-C227 PolarHBondContact O-N 2.73Å; V225-V228 PolarHBondContact O-N 3.41Å; V225-I229 HydrophobicContact CG1-CD1 3.68Å; V225-I229 HydrophobicContact CG1-CG1 4.37Å; V225-I229 VanDerWaalsContact O-CG1 3.29Å; V225-I229 WeakPolarHBondContact O-CG1 3.36Å; V225-I229 PolarHBondContact O-N 2.91Å
226	C	92.8	Very high	86.2	Confident	48 Å²	48	96 Å²	96	32%	0.324	53%	0.531	S	S	.	.	H	α-helix	trans	-60.6	-40.4	177.2	-70.7	0	0	0	0	112.7	F222 I223 I229 S230	F222-C226 VanDerWaalsContact CE1-SG 3.59Å; F222-C226 PolarHBondContact O-N 2.84Å; F222-C226 PolarHBondContact O-SG 2.65Å; F222-C226 VanDerWaalsContact O-SG 3.34Å; I223-C226 PolarHBondContact O-N 3.35Å; C226-I229 PolarHBondContact O-N 3.45Å; C226-S230 WeakPolarHBondContact O-CB 3.49Å; C226-S230 PolarHBondContact O-N 3.45Å; C226-S230 PolarHBondContact O-OG 3Å
227	C	92.4	Very high	84.6	Confident	71 Å²	71	93.8 Å²	93.8	48%	0.48	54%	0.538	S	S	.	.	H	α-helix	trans	-63.9	-44.2	175.6	-73.9	0	0	0	0	111.6	I223 G224 V225 S230 C231	I223-C227 WeakPolarHBondContact O-CB 3.38Å; I223-C227 PolarHBondContact O-N 2.82Å; I223-C227 PolarHBondContact O-SG 3.38Å; G224-C227 PolarHBondContact O-N 2.77Å; V225-C227 VanDerWaalsContact C-N 3.33Å; V225-C227 PolarHBondContact O-N 2.73Å; C227-S230 PolarHBondContact O-N 2.86Å; C227-C231 WeakPolarHBondContact O-CB 3.5Å; C227-C231 PolarHBondContact O-N 3.37Å; C227-C231 PolarHBondContact O-SG 2.97Å
228	V	92.3	Very high	82.6	Confident	92 Å²	92	90.5 Å²	90.5	56%	0.558	55%	0.545	S	S	*	.	H	α-helix	trans	-62.5	-46.8	177.1	172.3	0	0	0	0	110.9	G224 V225 S230 C231 C232	G224-V228 WeakPolarHBondContact O-CG2 3.19Å; G224-V228 PolarHBondContact O-N 3.24Å; V225-V228 PolarHBondContact O-N 3.41Å; V228-S230 PolarHBondContact O-N 3.47Å; V228-C231 PolarHBondContact O-N 3.37Å; V228-C232 PolarHBondContact O-N 3.37Å; V228-C232 PolarHBondContact O-SG 3.49Å
229	I	88.6	Confident	80.6	Confident	99 Å²	99	91.5 Å²	91.5	51%	0.508	57%	0.567	S	S	.	*	H	α-helix	trans	-59.7	-46.9	177.9	-67	167.8	0	0	0	110.6	V225 C226 C231 C232 V233	V225-I229 HydrophobicContact CG1-CD1 3.68Å; V225-I229 HydrophobicContact CG1-CG1 4.37Å; V225-I229 VanDerWaalsContact O-CG1 3.29Å; V225-I229 WeakPolarHBondContact O-CG1 3.36Å; V225-I229 PolarHBondContact O-N 2.91Å; C226-I229 PolarHBondContact O-N 3.45Å; I229-C231 PolarHBondContact O-N 2.77Å; I229-C232 WeakPolarHBondContact O-CB 3.43Å; I229-C232 PolarHBondContact O-N 3.07Å; I229-C232 VanDerWaalsContact O-N 3.16Å; I229-V233 WeakPolarHBondContact O-CG2 3.38Å; I229-V233 PolarHBondContact O-N 2.84Å
230	S	85.6	Confident	78	Confident	66 Å²	66	91 Å²	91	46%	0.462	58%	0.583	S	S	.	*	H	α-helix	trans	-61.2	-43.7	178.7	-60.2	0	0	0	0	111.8	C226 C227 V228 C232 V233 L234	C226-S230 WeakPolarHBondContact O-CB 3.49Å; C226-S230 PolarHBondContact O-N 3.45Å; C226-S230 PolarHBondContact O-OG 3Å; C227-S230 PolarHBondContact O-N 2.86Å; V228-S230 PolarHBondContact O-N 3.47Å; S230-C232 VanDerWaalsContact C-N 3.33Å; S230-C232 PolarHBondContact O-N 3.38Å; S230-V233 PolarHBondContact O-N 3.33Å; S230-L234 VanDerWaalsContact O-CG 3.32Å; S230-L234 WeakPolarHBondContact O-CG 3.48Å; S230-L234 PolarHBondContact O-N 3.5Å
231	C	83.7	Confident	75.8	Confident	81 Å²	81	100.5 Å²	100.5	55%	0.547	61%	0.61	S	S	.	*	H	α-helix	trans	-61.1	-39.6	174.4	-76.6	0	0	0	0	112.5	C227 V228 I229 R235	C227-C231 WeakPolarHBondContact O-CB 3.5Å; C227-C231 PolarHBondContact O-N 3.37Å; C227-C231 PolarHBondContact O-SG 2.97Å; V228-C231 PolarHBondContact O-N 3.37Å; I229-C231 PolarHBondContact O-N 2.77Å; C231-R235 WeakPolarHBondContact O-CB 3.27Å; C231-R235 PolarHBondContact O-N 3.1Å
232	C	78.8	Confident	73.2	Confident	73 Å²	73	100 Å²	100	49%	0.493	62%	0.623	S	S	.	*	H	α-helix	trans	-66.6	-40.5	176.8	-71.4	0	0	0	0	112.5	V228 I229 S230 R235 T236	V228-C232 PolarHBondContact O-N 3.37Å; V228-C232 PolarHBondContact O-SG 3.49Å; I229-C232 WeakPolarHBondContact O-CB 3.43Å; I229-C232 PolarHBondContact O-N 3.07Å; I229-C232 VanDerWaalsContact O-N 3.16Å; S230-C232 VanDerWaalsContact C-N 3.33Å; S230-C232 PolarHBondContact O-N 3.38Å; C232-R235 PolarHBondContact O-N 2.93Å; C232-T236 WeakPolarHBondContact O-CG2 3.42Å; C232-T236 PolarHBondContact O-N 3.02Å; C232-T236 VanDerWaalsContact O-N 3.15Å; C232-T236 PolarHBondContact O-OG1 2.88Å
233	V	78.6	Confident	70.9	Confident	91 Å²	91	103.2 Å²	103.2	55%	0.552	64%	0.636	S	S	*	*	H	α-helix	trans	-66.2	-43.8	176.4	176.1	0	0	0	0	110.9	I229 S230 R235 T236 G237	I229-V233 WeakPolarHBondContact O-CG2 3.38Å; I229-V233 PolarHBondContact O-N 2.84Å; S230-V233 PolarHBondContact O-N 3.33Å; V233-R235 VanDerWaalsContact C-N 3.31Å; V233-R235 PolarHBondContact O-N 2.89Å; V233-T236 WeakPolarHBondContact CA-OG1 3.32Å; V233-T236 PolarHBondContact O-N 2.85Å; V233-T236 PolarHBondContact O-OG1 3.29Å; V233-T236 VanDerWaalsContact O-OG1 3.07Å; V233-G237 PolarHBondContact O-N 2.92Å; V233-G237 VanDerWaalsContact O-N 3.07Å
234	L	73.6	Confident	68.2	Low	140 Å²	140	105.3 Å²	105.3	73%	0.733	65%	0.654	S	S	*	*	H	α-helix	trans	-65.6	-33.2	178.5	-69.3	172.8	0	0	0	112.7	S230	S230-L234 VanDerWaalsContact O-CG 3.32Å; S230-L234 WeakPolarHBondContact O-CG 3.48Å; S230-L234 PolarHBondContact O-N 3.5Å
235	R	65.3	Low	65.7	Low	228 Å²	228	115.5 Å²	115.5	86%	0.86	68%	0.681	S	S	*	*	H	α-helix	trans	-73.9	-26.8	175.4	-114.1	176.9	168.2	148	-2.9	113.8	C231 C232 V233	C231-R235 WeakPolarHBondContact O-CB 3.27Å; C231-R235 PolarHBondContact O-N 3.1Å; C232-R235 PolarHBondContact O-N 2.93Å; V233-R235 VanDerWaalsContact C-N 3.31Å; V233-R235 PolarHBondContact O-N 2.89Å
236	T	58.1	Low	63.1	Low	121 Å²	121	117.2 Å²	117.2	74%	0.742	69%	0.694	S	S	*	*	H	α-helix	trans	-90.5	-17.5	-179	48.7	0	0	0	0	113.1	C232 V233	C232-T236 WeakPolarHBondContact O-CG2 3.42Å; C232-T236 PolarHBondContact O-N 3.02Å; C232-T236 VanDerWaalsContact O-N 3.15Å; C232-T236 PolarHBondContact O-OG1 2.88Å; V233-T236 WeakPolarHBondContact CA-OG1 3.32Å; V233-T236 PolarHBondContact O-N 2.85Å; V233-T236 PolarHBondContact O-OG1 3.29Å; V233-T236 VanDerWaalsContact O-OG1 3.07Å
237	G	54.6	Low	60.1	Low	65 Å²	65	123 Å²	123	67%	0.67	72%	0.721	S	S	*	*	S	Bend	trans	-86	0.6	177	0	0	0	0	0	116.5	V233 G239	V233-G237 PolarHBondContact O-N 2.92Å; V233-G237 VanDerWaalsContact O-N 3.07Å; G237-G239 VanDerWaalsContact C-N 3.31Å; G237-G239 PolarHBondContact O-N 2.95Å; G237-G239 VanDerWaalsContact O-N 3.08Å
238	G	46.5	Very low	57.7	Low	76 Å²	76	128.7 Å²	128.7	78%	0.784	73%	0.733	S	S	*	*			trans	-83.1	42.3	-172.6	0	0	0	0	0	116.4
239	G	47.3	Very low	54.8	Low	77 Å²	77	133.5 Å²	133.5	79%	0.794	75%	0.749	S	S	*	*			trans	-140.7	77.6	-179.6	0	0	0	0	0	113.9	G237	G237-G239 VanDerWaalsContact C-N 3.31Å; G237-G239 PolarHBondContact O-N 2.95Å; G237-G239 VanDerWaalsContact O-N 3.08Å
240	G	39.5	Very low	52.2	Low	78 Å²	78	136.5 Å²	136.5	80%	0.804	76%	0.755	S	S	*	*			trans	174.2	111.7	170.8	0	0	0	0	0	114.6
241	R	47.4	Very low	49.7	Very low	263 Å²	263	141.1 Å²	141.1	99%	0.992	77%	0.774	S	S	*	*			trans	-67.4	146.5	176.3	-76.3	171.4	168.8	151.9	-3.8	112.4
242	G	37.5	Very low	47.2	Very low	78 Å²	78	145.5 Å²	145.5	80%	0.804	79%	0.786	S	S	*	*			trans	169	98.1	158.2	0	0	0	0	0	114.6
243	K	46	Very low	44.9	Very low	209 Å²	209	148.1 Å²	148.1	91%	0.909	80%	0.8	S	S	*	*			trans	-67.7	127.7	171.4	-75.1	174.2	174	173	0	110.6
244	T	36.3	Very low	42.6	Very low	136 Å²	136	153.3 Å²	153.3	83%	0.834	82%	0.815	S	S	*	*			trans	-150.6	126.4	142	38.9	0	0	0	0	109.2
245	R	40.6	Very low	40.6	Very low	249 Å²	249	152.3 Å²	152.3	94%	0.94	82%	0.815	S	S	*	*			trans	-79	144.7	160.6	-85.5	-179.3	169.7	175.5	-3.1	107.1
246	P	40.7	Very low	38.9	Very low	121 Å²	121	149.2 Å²	149.2	79%	0.786	81%	0.814	S	S	*	*				-144.7	156.9	107.5	33.5	-15.9	0	0	0	115.8
247	N	28	Very low	37.4	Very low	168 Å²	168	151.4 Å²	151.4	90%	0.898	82%	0.816	S	S	*	*			trans	54.7	129.7	151.8	-125.9	1.9	0	0	0	122.7
248	R	42.6	Very low	36.3	Very low	191 Å²	191	155.6 Å²	155.6	72%	0.721	82%	0.822	S	S	*	*			trans	-102.6	97.6	-174.3	-172.1	179.1	-175.5	-165	-6	107.5	Y250	R248-Y250 HydrophobicContact CG-CD2 4.06Å; R248-Y250 HydrophobicContact CG-CE2 3.6Å; R248-Y250 VanDerWaalsContact NE-CZ 3.32Å; R248-Y250 PolarHBondContact NE-OH 2.84Å; R248-Y250 PolarHBondContact NH2-OH 2.97Å
249	E	31.5	Very low	35.5	Very low	194 Å²	194	157.4 Å²	157.4	91%	0.907	82%	0.82	S	S	*	*			trans	-110.9	113.1	164.8	-121.6	173.5	-174.7	0	0	107.4	L251	E249-L251 PolarHBondContact O-N 3.01Å
250	Y	34.6	Very low	35.1	Very low	161 Å²	161	162.6 Å²	162.6	63%	0.631	82%	0.823	S	S	*	*			trans	-78.5	101.5	177.5	-81.2	-79.9	0	0	0	109.2	R248 H252	R248-Y250 HydrophobicContact CG-CD2 4.06Å; R248-Y250 HydrophobicContact CG-CE2 3.6Å; R248-Y250 VanDerWaalsContact NE-CZ 3.32Å; R248-Y250 PolarHBondContact NE-OH 2.84Å; R248-Y250 PolarHBondContact NH2-OH 2.97Å; Y250-H252 PolarHBondContact O-N 3.18Å
251	L	32.8	Very low	34.8	Very low	163 Å²	163	166 Å²	166	85%	0.853	82%	0.823	S	S	*	*			trans	-77.4	103.3	160.5	-151	78.6	0	0	0	107.3	E249 T253	E249-L251 PolarHBondContact O-N 3.01Å; L251-T253 PolarHBondContact O-N 3.06Å
252	H	31.4	Very low	33.9	Very low	174 Å²	174	158.8 Å²	158.8	81%	0.806	81%	0.812	S	S	*	*			trans	-63.1	103.4	166.5	-88.5	-89.2	0	0	0	108.6	Y250 K254	Y250-H252 PolarHBondContact O-N 3.18Å; H252-K254 PolarHBondContact O-N 3.24Å
253	T	30.7	Very low	33.6	Very low	127 Å²	127	161.8 Å²	161.8	78%	0.779	82%	0.819	S	S	*	*			trans	-67	109.9	160.2	-14.5	0	0	0	0	106.9	L251 V255	L251-T253 PolarHBondContact O-N 3.06Å; T253-V255 PolarHBondContact O-N 3.21Å
254	K	29.5	Very low	32.8	Very low	200 Å²	200	160.1 Å²	160.1	87%	0.87	82%	0.815	S	S	*	*			trans	-61.9	107.3	165.5	-86.9	-178.5	173.4	-178.5	0	107.6	H252 L256	H252-K254 PolarHBondContact O-N 3.24Å; K254-L256 PolarHBondContact O-N 3.04Å
255	V	32.5	Very low	32.5	Very low	119 Å²	119	162.8 Å²	162.8	72%	0.721	81%	0.811	S	S	*	*			trans	-62.7	120.9	155.4	176.9	0	0	0	0	105.6	T253 E257	T253-V255 PolarHBondContact O-N 3.21Å; V255-E257 VanDerWaalsContact C-N 3.25Å; V255-E257 HydrophobicContact CG1-CG 4.31Å; V255-E257 PolarHBondContact O-N 2.85Å
256	L	28.2	Very low	31.9	Very low	163 Å²	163	156.8 Å²	156.8	85%	0.853	81%	0.806	S	S	*	*			trans	-70.9	94	161	-95.6	152.4	0	0	0	105.9	K254 I258	K254-L256 PolarHBondContact O-N 3.04Å; L256-I258 PolarHBondContact O-N 3.12Å
257	E	27.1	Very low	31.6	Very low	167 Å²	167	158.1 Å²	158.1	78%	0.78	80%	0.801	S	S	*	*			trans	-63.6	116.5	161.5	-73.9	175.4	160.4	0	0	107.2	V255 P259	V255-E257 VanDerWaalsContact C-N 3.25Å; V255-E257 HydrophobicContact CG1-CG 4.31Å; V255-E257 PolarHBondContact O-N 2.85Å; E257-P259 WeakPolarHBondContact O-CD 3.41Å
258	I	31.6	Very low	31.9	Very low	154 Å²	154	156.6 Å²	156.6	79%	0.79	80%	0.798	S	S	*	*			trans	-87.1	115.9	162.4	-59.5	174.3	0	0	0	105.1	L256 H260	L256-I258 PolarHBondContact O-N 3.12Å; I258-H260 PolarHBondContact O-N 3.48Å
259	P	30.2	Very low	31.6	Very low	114 Å²	114	154.4 Å²	154.4	74%	0.74	80%	0.801	S	S	*	*			trans	-61.9	129.5	175.3	-17.3	30.3	0	0	0	109.6	E257 D261	E257-P259 WeakPolarHBondContact O-CD 3.41Å; P259-D261 PolarHBondContact O-N 3.24Å
260	H	37.4	Very low	32.5	Very low	185 Å²	185	152.3 Å²	152.3	86%	0.856	80%	0.796	S	S	*	*			trans	-84.8	88.6	167.8	-149.6	-72.8	0	0	0	106.1	I258	I258-H260 PolarHBondContact O-N 3.48Å
261	D	33.7	Very low	33.2	Very low	150 Å²	150	151.9 Å²	151.9	80%	0.802	80%	0.804	S	S	*	*			trans	-173.4	113.9	158.8	-96.3	-19.7	0	0	0	110.3	P259	P259-D261 PolarHBondContact O-N 3.24Å
262	S	29.1	Very low	33.5	Very low	111 Å²	111	152 Å²	152	78%	0.776	81%	0.806	S	S	*	*			trans	134.3	55.1	157.7	76.7	0	0	0	0	112.7	E264	S262-E264 PolarHBondContact O-N 3.06Å
263	C	30.6	Very low	34.4	Very low	141 Å²	141	150 Å²	150	95%	0.953	81%	0.805	S	S	*	*			trans	-77.4	81	149.5	-72.8	0	0	0	0	106.6
264	E	29.3	Very low	34.6	Very low	175 Å²	175	151 Å²	151	82%	0.818	81%	0.806	S	S	*	*			trans	-88.8	124.4	166.1	-163.1	156.5	-158.9	0	0	108.1	S262	S262-E264 PolarHBondContact O-N 3.06Å
265	Y	30.6	Very low	35.6	Very low	191 Å²	191	148.2 Å²	148.2	75%	0.749	80%	0.801	S	S	*	*			trans	-76.9	116	-176.5	-160.6	-104.1	0	0	0	107.3	E267	Y265-E267 VanDerWaalsContact C-N 3.3Å; Y265-E267 HydrophobicContact CD1-CB 4.35Å; Y265-E267 HydrophobicContact CD1-CG 3.66Å; Y265-E267 HydrophobicContact CE1-CG 3.68Å; Y265-E267 WeakPolarHBondContact CE1-OE1 3.39Å; Y265-E267 PolarHBondContact O-N 2.98Å
266	C	27.7	Very low	36.1	Very low	123 Å²	123	148 Å²	148	83%	0.831	80%	0.8	S	S	*	*			trans	-79.2	88.3	167.7	-59.8	0	0	0	0	107.9
267	E	34.8	Very low	36.4	Very low	149 Å²	149	147 Å²	147	70%	0.696	81%	0.805	S	S	*	*			trans	-67.9	127.8	157.8	-102.7	160.4	-159.7	0	0	108.4	Y265	Y265-E267 VanDerWaalsContact C-N 3.3Å; Y265-E267 HydrophobicContact CD1-CB 4.35Å; Y265-E267 HydrophobicContact CD1-CG 3.66Å; Y265-E267 HydrophobicContact CE1-CG 3.68Å; Y265-E267 WeakPolarHBondContact CE1-OE1 3.39Å; Y265-E267 PolarHBondContact O-N 2.98Å
268	V	34.6	Very low	37	Very low	136 Å²	136	147.4 Å²	147.4	82%	0.824	81%	0.807	S	S	*	*			trans	-101.1	105.9	169	-177.1	0	0	0	0	105.8
269	D	36.4	Very low	37.8	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	81%	0.805	S	S	*	*			trans	-111.3	149.4	155.6	-85.9	-34.3	0	0	0	108.4
270	D	50.5	Low	37.9	Very low	151 Å²	151	153.8 Å²	153.8	81%	0.807	82%	0.817	S	S	*	*	S	Bend	trans	-50.9	154.1	-165.9	-72.9	-64.8	0	0	0	116.6
271	D	48.6	Very low	38.3	Very low	151 Å²	151	147 Å²	147	81%	0.807	80%	0.797	S	S	*	*			trans	95.2	122.2	168.9	-58.4	-37.8	0	0	0	117.8
272	D	38.8	Very low	39	Very low	166 Å²	166	147.1 Å²	147.1	89%	0.888	80%	0.798	S	S	*	*			trans	91	116.9	169.3	-63.9	-36.5	0	0	0	119.7
273	V	51.3	Low	39.6	Very low	131 Å²	131	146.1 Å²	146.1	79%	0.794	80%	0.796	S	S	*	*			trans	-67.2	126	172.8	174	0	0	0	0	109.7
274	D	34.6	Very low	40.2	Very low	149 Å²	149	147.5 Å²	147.5	80%	0.797	79%	0.788	S	S	*	*			trans	-137.7	109.4	151.9	-159.7	17	0	0	0	110.6	T276	D274-T276 PolarHBondContact O-N 3.35Å
275	D	49.3	Very low	41.2	Very low	142 Å²	142	142 Å²	142	76%	0.759	77%	0.767	S	S	*	*			trans	-70.9	106.5	169.8	-86.9	-43.4	0	0	0	108.1
276	T	43.5	Very low	41.9	Very low	114 Å²	114	136.1 Å²	136.1	70%	0.699	76%	0.758	S	S	*	*			trans	178.4	82.1	145.9	34.9	0	0	0	0	111.5	D274	D274-T276 PolarHBondContact O-N 3.35Å
277	C	35.7	Very low	42.6	Very low	141 Å²	141	133.3 Å²	133.3	95%	0.953	74%	0.743	S	S	*	*			trans	-119.8	92.5	152.9	-110.9	0	0	0	0	107.9	D279	C277-D279 PolarHBondContact O-N 3.3Å
278	E	39.4	Very low	43.3	Very low	177 Å²	177	130.2 Å²	130.2	83%	0.827	73%	0.734	S	S	*	*			trans	-72.4	115.2	174.2	-74.5	-176.8	146.7	0	0	110.8
279	D	47.1	Very low	44.1	Very low	140 Å²	140	131.7 Å²	131.7	75%	0.749	73%	0.725	S	S	*	*			trans	41.8	106	132.4	-158.3	15.6	0	0	0	119.6	C277 G281	C277-D279 PolarHBondContact O-N 3.3Å; D279-G281 PolarHBondContact OD1-N 3.25Å
280	W	33.8	Very low	44.7	Very low	261 Å²	261	131.6 Å²	131.6	99%	0.989	72%	0.72	S	S	*	*			trans	-126.9	71	149.7	-74.9	82	0	0	0	109.7
281	G	44.6	Very low	44.7	Very low	43 Å²	43	131 Å²	131	44%	0.443	71%	0.707	S	S	.	*			trans	-67.3	164.5	159	0	0	0	0	0	113.5	D279	D279-G281 PolarHBondContact OD1-N 3.25Å
282	D	49.6	Very low	45	Very low	153 Å²	153	128 Å²	128	82%	0.818	69%	0.691	S	S	*	*	S	Bend	trans	105.9	24.2	155.1	-55.4	-17.8	0	0	0	121
283	A	41.3	Very low	45.7	Very low	89 Å²	89	125.8 Å²	125.8	74%	0.736	68%	0.675	S	S	*	*	S	Bend	trans	-116.4	-32.8	161.5	0	0	0	0	0	114.4
284	E	42.5	Very low	46.1	Very low	170 Å²	170	126.2 Å²	126.2	79%	0.794	66%	0.663	S	S	*	*	H	α-helix	trans	-80.6	-18.5	-176.2	-79.5	-173.4	137.2	0	0	114.4	V288	E284-V288 WeakPolarHBondContact O-CG2 3.39Å
285	T	51	Low	47.2	Very low	61 Å²	61	126 Å²	126	37%	0.374	65%	0.651	S	S	.	*	H	α-helix	trans	-83.3	-24	-169.6	-21.7	0	0	0	0	113.8	R289	T285-R289 WeakPolarHBondContact O-CB 3.39Å; T285-R289 VanDerWaalsContact O-CG 3.26Å; T285-R289 WeakPolarHBondContact O-CG 3.13Å; T285-R289 PolarHBondContact O-N 3.11Å
286	A	44.9	Very low	47.6	Very low	67 Å²	67	125.8 Å²	125.8	55%	0.554	65%	0.645	S	S	*	*	H	α-helix	trans	-77.1	-40.6	-178	0	0	0	0	0	112.6	R289 Q290	A286-R289 PolarHBondContact O-N 3.34Å; A286-Q290 PolarHBondContact O-N 3.01Å
287	A	42.9	Very low	48.4	Very low	63 Å²	63	125.5 Å²	125.5	52%	0.521	64%	0.637	S	S	.	*	H	α-helix	trans	-67.5	-40.5	178.1	0	0	0	0	0	111.7	Q290 Y291	A287-Q290 PolarHBondContact O-N 2.89Å; A287-Y291 WeakPolarHBondContact O-CB 3.5Å; A287-Y291 PolarHBondContact O-N 3.09Å
288	V	49.9	Very low	49.2	Very low	84 Å²	84	122.1 Å²	122.1	51%	0.509	61%	0.607	S	S	.	*	H	α-helix	trans	-66	-38.5	176.9	176.7	0	0	0	0	111.3	E284 Y291 L292	E284-V288 WeakPolarHBondContact O-CG2 3.39Å; V288-Y291 PolarHBondContact O-N 3.44Å; V288-L292 HydrophobicContact CG1-CD1 4.11Å; V288-L292 WeakPolarHBondContact O-CG 3.15Å; V288-L292 PolarHBondContact O-N 3.32Å; V288-L292 VanDerWaalsContact O-N 3.07Å
289	R	49.8	Very low	49.9	Very low	168 Å²	168	119.6 Å²	119.6	63%	0.634	60%	0.597	S	S	*	*	H	α-helix	trans	-66.8	-40.6	175.1	-75.5	176.5	-169.1	161.8	6.4	112.7	T285 A286 L292 Q293	T285-R289 WeakPolarHBondContact O-CB 3.39Å; T285-R289 VanDerWaalsContact O-CG 3.26Å; T285-R289 WeakPolarHBondContact O-CG 3.13Å; T285-R289 PolarHBondContact O-N 3.11Å; A286-R289 PolarHBondContact O-N 3.34Å; R289-L292 PolarHBondContact O-N 3.02Å; R289-Q293 PolarHBondContact O-N 2.77Å; R289-Q293 VanDerWaalsContact O-N 3.1Å
290	Q	49.3	Very low	50.2	Low	143 Å²	143	119.9 Å²	119.9	67%	0.668	59%	0.594	S	S	*	*	H	α-helix	trans	-65	-39.8	175.3	-83.3	-177.3	-12.6	0	0	112.3	A286 A287 Q293 W294	A286-Q290 PolarHBondContact O-N 3.01Å; A287-Q290 PolarHBondContact O-N 2.89Å; Q290-Q293 PolarHBondContact O-N 3.33Å; Q290-W294 WeakPolarHBondContact O-CB 3.4Å; Q290-W294 PolarHBondContact O-N 3.09Å
291	Y	51.7	Low	50.9	Low	137 Å²	137	113.5 Å²	113.5	54%	0.537	58%	0.575	S	S	.	*	H	α-helix	trans	-64.9	-42.6	177.3	179.2	-105.7	0	0	0	112.5	A287 V288 W294 R295	A287-Y291 WeakPolarHBondContact O-CB 3.5Å; A287-Y291 PolarHBondContact O-N 3.09Å; V288-Y291 PolarHBondContact O-N 3.44Å; Y291-W294 HydrophobicContact CD2-CE3 4.47Å; Y291-W294 HydrophobicContact CE2-CE3 4.37Å; Y291-W294 HydrophobicContact CE2-CZ3 4.36Å; Y291-W294 PolarHBondContact O-N 2.8Å; Y291-R295 WeakPolarHBondContact O-CB 3.49Å; Y291-R295 PolarHBondContact O-N 3.43Å
292	L	53.3	Low	51	Low	89 Å²	89	119 Å²	119	47%	0.466	59%	0.589	S	S	.	*	H	α-helix	trans	-68.4	-36.3	178	-69.7	172	0	0	0	112.7	V288 R289 R295 Q296	V288-L292 HydrophobicContact CG1-CD1 4.11Å; V288-L292 WeakPolarHBondContact O-CG 3.15Å; V288-L292 PolarHBondContact O-N 3.32Å; V288-L292 VanDerWaalsContact O-N 3.07Å; R289-L292 PolarHBondContact O-N 3.02Å; L292-R295 PolarHBondContact O-N 3.16Å; L292-Q296 PolarHBondContact O-N 3Å; L292-Q296 VanDerWaalsContact O-N 3.15Å
293	Q	54.4	Low	50.9	Low	119 Å²	119	120 Å²	120	56%	0.556	59%	0.589	S	S	*	*	H	α-helix	trans	-66.1	-42.5	172.9	-80.9	-178	-27	0	0	112.4	R289 Q290 R295 Q296 M297	R289-Q293 PolarHBondContact O-N 2.77Å; R289-Q293 VanDerWaalsContact O-N 3.1Å; Q290-Q293 PolarHBondContact O-N 3.33Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-R295 PolarHBondContact O-N 3.06Å; Q293-Q296 PolarHBondContact O-N 3.02Å; Q293-M297 HydrophobicContact CB-CE 4.29Å; Q293-M297 WeakPolarHBondContact O-CE 3.31Å; Q293-M297 PolarHBondContact O-N 3.41Å; Q293-M297 VanDerWaalsContact O-N 3.16Å
294	W	59	Low	50.9	Low	140 Å²	140	123.6 Å²	123.6	53%	0.53	59%	0.593	S	S	.	*	H	α-helix	trans	-60.8	-42.2	174.5	176.7	84.4	0	0	0	112	Q290 Y291 Q296 M297 Q298	Q290-W294 WeakPolarHBondContact O-CB 3.4Å; Q290-W294 PolarHBondContact O-N 3.09Å; Y291-W294 HydrophobicContact CD2-CE3 4.47Å; Y291-W294 HydrophobicContact CE2-CE3 4.37Å; Y291-W294 HydrophobicContact CE2-CZ3 4.36Å; Y291-W294 PolarHBondContact O-N 2.8Å; W294-Q296 PolarHBondContact O-N 3.38Å; W294-M297 PolarHBondContact O-N 3.32Å; W294-Q298 HydrophobicContact CD2-CG 4.2Å; W294-Q298 HydrophobicContact CH2-CG 4.15Å; W294-Q298 HydrophobicContact CZ2-CG 3.79Å; W294-Q298 PolarHBondContact O-N 2.75Å; W294-Q298 VanDerWaalsContact O-N 3.08Å
295	R	58.4	Low	51.1	Low	146 Å²	146	124.6 Å²	124.6	55%	0.551	60%	0.597	S	S	*	*	H	α-helix	trans	-63.5	-36.9	177.7	-164.7	-178.2	-174.6	-157.4	2.3	113.1	Y291 L292 Q293 Q298 M299	Y291-R295 WeakPolarHBondContact O-CB 3.49Å; Y291-R295 PolarHBondContact O-N 3.43Å; L292-R295 PolarHBondContact O-N 3.16Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-R295 PolarHBondContact O-N 3.06Å; R295-Q298 PolarHBondContact O-N 3.29Å; R295-M299 PolarHBondContact O-N 3.2Å
296	Q	58.1	Low	50.4	Low	137 Å²	137	130.9 Å²	130.9	64%	0.64	62%	0.619	S	S	*	*	H	α-helix	trans	-67.8	-37.1	174.2	-85	-180	-32.4	0	0	112.7	L292 Q293 W294 Q300	L292-Q296 PolarHBondContact O-N 3Å; L292-Q296 VanDerWaalsContact O-N 3.15Å; Q293-Q296 PolarHBondContact O-N 3.02Å; W294-Q296 PolarHBondContact O-N 3.38Å; Q296-Q300 PolarHBondContact O-N 3.09Å
297	M	60	Low	49.6	Very low	108 Å²	108	133.2 Å²	133.2	53%	0.532	63%	0.63	S	S	.	*	H	α-helix	trans	-67.2	-34.5	175.6	-73.3	-176.2	-96.3	0	0	112.6	Q293 W294 Q300 Q301	Q293-M297 HydrophobicContact CB-CE 4.29Å; Q293-M297 WeakPolarHBondContact O-CE 3.31Å; Q293-M297 PolarHBondContact O-N 3.41Å; Q293-M297 VanDerWaalsContact O-N 3.16Å; W294-M297 PolarHBondContact O-N 3.32Å; M297-Q300 PolarHBondContact O-N 3.29Å; M297-Q301 PolarHBondContact O-N 3.39Å
298	Q	53.3	Low	49.1	Very low	69 Å²	69	136.4 Å²	136.4	32%	0.322	65%	0.646	S	S	.	*	H	α-helix	trans	-69.9	-40.5	176.8	-71.1	-58.5	-59.2	0	0	112.9	W294 R295 Q300 Q301 E302	W294-Q298 HydrophobicContact CD2-CG 4.2Å; W294-Q298 HydrophobicContact CH2-CG 4.15Å; W294-Q298 HydrophobicContact CZ2-CG 3.79Å; W294-Q298 PolarHBondContact O-N 2.75Å; W294-Q298 VanDerWaalsContact O-N 3.08Å; R295-Q298 PolarHBondContact O-N 3.29Å; Q298-Q300 PolarHBondContact O-N 3.05Å; Q298-Q301 PolarHBondContact O-N 3.33Å; Q298-E302 PolarHBondContact O-N 3.42Å; Q298-E302 VanDerWaalsContact O-N 3.17Å
299	M	53.1	Low	48.3	Very low	125 Å²	125	140.4 Å²	140.4	62%	0.616	66%	0.661	S	S	*	*	H	α-helix	trans	-66.7	-23.6	176.6	-66.8	-141	-65.2	0	0	113.3	R295	R295-M299 PolarHBondContact O-N 3.2Å
300	Q	53.7	Low	47.5	Very low	145 Å²	145	140.6 Å²	140.6	68%	0.678	67%	0.674	S	S	*	*	H	α-helix	trans	-78.3	-29.5	170.9	-78.7	-177.3	-14.7	0	0	113	Q296 M297 Q298	Q296-Q300 PolarHBondContact O-N 3.09Å; M297-Q300 PolarHBondContact O-N 3.29Å; Q298-Q300 PolarHBondContact O-N 3.05Å
301	Q	49.3	Very low	46.6	Very low	127 Å²	127	139.2 Å²	139.2	59%	0.593	68%	0.677	S	S	*	*	H	α-helix	trans	-75	-33.2	178	-84.1	-178.1	-22.8	0	0	113.1	M297 Q298 Q303 M304	M297-Q301 PolarHBondContact O-N 3.39Å; Q298-Q301 PolarHBondContact O-N 3.33Å; Q301-Q303 PolarHBondContact O-N 2.95Å; Q301-M304 PolarHBondContact O-N 2.81Å
302	E	46.8	Very low	45.6	Very low	158 Å²	158	143 Å²	143	74%	0.738	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-67.9	-18.6	177.6	-76.2	-177.5	155.8	0	0	113.7	Q298	Q298-E302 PolarHBondContact O-N 3.42Å; Q298-E302 VanDerWaalsContact O-N 3.17Å
303	Q	45.9	Very low	44.6	Very low	175 Å²	175	146.2 Å²	146.2	82%	0.818	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-81.7	-8.6	174.1	-75.6	-171.3	-11.1	0	0	114.4	Q301	Q301-Q303 PolarHBondContact O-N 2.95Å
304	M	41.8	Very low	43.4	Very low	165 Å²	165	152.3 Å²	152.3	81%	0.813	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-111.1	33.9	-175.9	-71.8	-170.8	80.5	0	0	114.6	Q301 K306	Q301-M304 PolarHBondContact O-N 2.81Å; M304-K306 PolarHBondContact O-N 2.82Å
305	Q	46.7	Very low	42.2	Very low	190 Å²	190	154.3 Å²	154.3	89%	0.888	75%	0.745	S	S	*	*			trans	-73.7	83.8	176.8	-148.5	179.2	41.2	0	0	111.8
306	K	36.4	Very low	41.1	Very low	194 Å²	194	156.2 Å²	156.2	84%	0.843	76%	0.76	S	S	*	*			trans	-142.5	124.3	160.2	-91.3	-173	-179.7	175.9	0	113.2	M304	M304-K306 PolarHBondContact O-N 2.82Å
307	C	28	Very low	39.9	Very low	115 Å²	115	155.8 Å²	155.8	78%	0.777	77%	0.772	S	S	*	*			trans	77.6	130.8	161.5	-66.4	0	0	0	0	119.8
308	P	33.2	Very low	38.6	Very low	131 Å²	131	158.7 Å²	158.7	85%	0.851	79%	0.789	S	S	*	*			trans	-82.2	127.7	173.2	32.5	-29.9	0	0	0	111.1
309	M	33.3	Very low	37.4	Very low	167 Å²	167	161 Å²	161	82%	0.823	81%	0.812	S	S	*	*			trans	-104.9	124.6	171.2	-73	-81.8	-144.5	0	0	109.8
310	L	32.3	Very low	36.2	Very low	173 Å²	173	166.1 Å²	166.1	91%	0.906	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-86.7	126.4	171.7	-99.8	133.1	0	0	0	110.3
311	P	29.6	Very low	35	Very low	113 Å²	113	166.6 Å²	166.6	73%	0.734	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-80.1	128.7	173.9	29.3	-30.1	0	0	0	111.6
312	K	31.6	Very low	34.1	Very low	216 Å²	216	165 Å²	165	94%	0.939	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-90.3	118.9	163.8	-101.2	179.5	176.8	173.9	0	108.9
313	I	31.1	Very low	33.4	Very low	158 Å²	158	165 Å²	165	81%	0.81	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-94.9	126.2	171.9	-58.5	174.5	0	0	0	108.5
314	R	29.1	Very low	32.6	Very low	246 Å²	246	166.2 Å²	166.2	93%	0.928	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-91.1	142.1	164.5	-93.5	-170	-171.9	-170.1	4.1	110
315	H	35.5	Very low	32.2	Very low	182 Å²	182	164.1 Å²	164.1	84%	0.843	85%	0.845	S	S	*	*			trans	-104.6	84.1	-166.2	-169	-76.7	0	0	0	109.2
316	E	34.7	Very low	31.4	Very low	187 Å²	187	158.5 Å²	158.5	87%	0.874	84%	0.839	S	S	*	*			trans	-164.2	94.9	174.2	-115.5	165.1	-149.1	0	0	111.7
317	S	32.9	Very low	31.1	Very low	127 Å²	127	154.7 Å²	154.7	89%	0.888	84%	0.837	S	S	*	*			trans	173.5	52	145.7	55.6	0	0	0	0	112.1
318	L	32.9	Very low	31.4	Very low	170 Å²	170	154.1 Å²	154.1	89%	0.89	83%	0.834	S	S	*	*			trans	-102.6	104.5	156.8	-89.6	164.2	0	0	0	107.2
319	C	27.2	Very low	31.4	Very low	118 Å²	118	155.1 Å²	155.1	80%	0.797	83%	0.832	S	S	*	*			trans	165.3	141.8	138.7	-90.9	0	0	0	0	113.9
320	R	28.8	Very low	31.5	Very low	231 Å²	231	158 Å²	158	87%	0.872	83%	0.834	S	S	*	*			trans	79.1	131.5	155.7	-77.3	179.6	-175.4	172.3	1.4	116.9
321	L	28.7	Very low	31.5	Very low	156 Å²	156	155.3 Å²	155.3	82%	0.817	83%	0.83	S	S	*	*			cis	-150.6	154.3	22.4	-101.2	137.3	0	0	0	112.8
322	S	30.3	Very low	31.7	Very low	93 Å²	93	157.9 Å²	157.9	65%	0.65	84%	0.835	S	S	*	*			trans	-76	156.4	171.8	48.4	0	0	0	0	114.6
323	N	31.3	Very low	31.7	Very low	158 Å²	158	153.2 Å²	153.2	85%	0.845	83%	0.827	S	S	*	*			trans	57.2	116.7	152.6	-76	-1.7	0	0	0	120.1
324	E	29.7	Very low	31.8	Very low	201 Å²	201	157.4 Å²	157.4	94%	0.939	83%	0.833	S	S	*	*				-158	143	119.6	-111.9	179.4	-169.4	0	0	112.3
325	S	33.2	Very low	31.9	Very low	120 Å²	120	149.9 Å²	149.9	84%	0.839	82%	0.823	S	S	*	*			trans	-89.3	137.6	-178.4	48.7	0	0	0	0	112
326	G	29.7	Very low	31.7	Very low	73 Å²	73	147.3 Å²	147.3	75%	0.753	82%	0.823	S	S	*	*			trans	147.9	115.9	158.8	0	0	0	0	0	116.2
327	S	30.1	Very low	31.5	Very low	114 Å²	114	146.7 Å²	146.7	80%	0.797	83%	0.825	S	S	*	*			trans	49.8	113.2	142.8	-178.5	0	0	0	0	121.4
328	S	34	Very low	31.4	Very low	103 Å²	103	144.7 Å²	144.7	72%	0.72	82%	0.815	S	S	*	*			trans	68.6	121.1	140.9	99.7	0	0	0	0	120.2
329	N	33.3	Very low	31.3	Very low	152 Å²	152	147.7 Å²	147.7	81%	0.813	82%	0.815	S	S	*	*			trans	62.6	122.8	149.2	-92.4	-15.1	0	0	0	121.3
330	R	34.9	Very low	31.5	Very low	228 Å²	228	151.3 Å²	151.3	86%	0.86	82%	0.818	S	S	*	*			trans	89.5	134.1	149.3	-71	-178.6	175.4	-175.6	-1.4	120
331	S	32	Very low	31.7	Very low	116 Å²	116	147.4 Å²	147.4	81%	0.811	81%	0.814	S	S	*	*			trans	71	111.3	162.2	49.6	0	0	0	0	119.3
332	I	35.4	Very low	31.8	Very low	167 Å²	167	149 Å²	149	86%	0.856	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-73.8	126.2	163.7	-59.1	169.3	0	0	0	108.4
333	P	31.8	Very low	32	Very low	118 Å²	118	149.5 Å²	149.5	77%	0.766	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78.8	133.9	171.8	28.6	-27.3	0	0	0	111.1
334	R	31.8	Very low	31.9	Very low	245 Å²	245	147.3 Å²	147.3	93%	0.925	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.3	134.7	173.3	-79	178.7	175.9	170.5	-0.5	110.7
335	A	31.5	Very low	31.8	Very low	88 Å²	88	144.1 Å²	144.1	73%	0.727	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.3	147.8	164.4	0	0	0	0	0	110.9
336	P	32.6	Very low	31.7	Very low	129 Å²	129	144.2 Å²	144.2	84%	0.838	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.9	140.6	177.4	29.6	-32.2	0	0	0	111.7
337	L	30.5	Very low	31.6	Very low	174 Å²	174	146 Å²	146	91%	0.911	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.4	131.3	174.8	-75	155.8	0	0	0	110.7	R339	L337-R339 PolarHBondContact O-N 3.48Å
338	A	29.9	Very low	31.5	Very low	84 Å²	84	149.9 Å²	149.9	69%	0.694	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-66.1	126.4	165.8	0	0	0	0	0	109.6
339	R	30.3	Very low	31.3	Very low	233 Å²	233	153.5 Å²	153.5	88%	0.879	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-83.3	127.4	170.6	-109.7	-177.8	-160.1	-179.6	5.1	109	L337	L337-R339 PolarHBondContact O-N 3.48Å
340	F	31.8	Very low	31.1	Very low	195 Å²	195	154.4 Å²	154.4	86%	0.855	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-96.5	122.7	163.1	-70.4	-86.7	0	0	0	107.5
341	D	32.6	Very low	31.1	Very low	148 Å²	148	149 Å²	149	79%	0.791	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-81.8	135.1	168.4	-72.7	-35.5	0	0	0	109.2
342	E	31.8	Very low	31.1	Very low	190 Å²	190	151.7 Å²	151.7	89%	0.888	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70	132.9	174.4	-73.9	-172.1	152.8	0	0	111.3
343	P	33	Very low	31.1	Very low	103 Å²	103	155.3 Å²	155.3	67%	0.669	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-84.6	127.1	166.2	31.1	-28.2	0	0	0	110.7	C345	P343-C345 PolarHBondContact O-N 3.1Å
344	S	29.8	Very low	31.1	Very low	112 Å²	112	157.2 Å²	157.2	78%	0.783	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-63.8	120	171	48.2	0	0	0	0	111.9
345	C	28.1	Very low	31	Very low	135 Å²	135	152.5 Å²	152.5	91%	0.912	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-74	119.9	170.7	-88.4	0	0	0	0	111.2	P343	P343-C345 PolarHBondContact O-N 3.1Å
346	V	30.6	Very low	31	Very low	121 Å²	121	156.1 Å²	156.1	73%	0.733	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-100	118.6	162.8	179.9	0	0	0	0	107.6
347	S	27.3	Very low	30.9	Very low	112 Å²	112	157.7 Å²	157.7	78%	0.783	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-74.7	126.6	176.7	52.2	0	0	0	0	111.2
348	F	29.2	Very low	30.9	Very low	194 Å²	194	156.7 Å²	156.7	85%	0.851	83%	0.834	S	S	*	*			trans	-103.9	114.9	162.4	-96.8	-90.7	0	0	0	109.2
349	E	28.2	Very low	31	Very low	180 Å²	180	161.5 Å²	161.5	84%	0.841	84%	0.843	S	S	*	*			trans	-70.9	129.3	163.7	-85.9	179.6	143	0	0	109.7
350	L	30.3	Very low	31.1	Very low	170 Å²	170	156.4 Å²	156.4	89%	0.89	84%	0.841	S	S	*	*			trans	-94.1	95.9	168.8	-101.7	141.4	0	0	0	108.2
351	T	33.8	Very low	31	Very low	114 Å²	114	153.5 Å²	153.5	70%	0.699	84%	0.84	S	S	*	*			trans	-105	131.2	152	40.5	0	0	0	0	108.4
352	H	33.7	Very low	30.9	Very low	174 Å²	174	153.9 Å²	153.9	81%	0.806	84%	0.844	S	S	*	*			trans	66.1	108.2	175.1	-66.3	-76.5	0	0	0	118
353	L	34.5	Very low	30.8	Very low	242 Å²	242	150.6 Å²	150.6	100%	1.267	84%	0.84	S	S	*	*				-167.7	0	105.6	-97.3	159.5	0	0	0	111.5

Retrieved 353 of 353 residues in 165.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).