A0A2K6E447_MACNE Loading...

PDZ and LIM domain protein 7

AlphaFold DB , UniProt , Accession A0A2K6E447, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene PDLIM7, Length 457 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	59.7	Low	87.1	Confident	180 Å²	180	80.8 Å²	80.8	89%	0.887	44%	0.437	S	S	*	.				0	108.3	0	-85.6	177.6	171.9	0	0	105.7	S3	M1-S3 PolarHBondContact O-N 3.44Å; M1-S3 VanDerWaalsContact O-N 3.16Å
2	D	80.2	Confident	86.7	Confident	117 Å²	117	78.9 Å²	78.9	63%	0.626	44%	0.441	S	S	*	.			trans	-85.1	96.9	-170.5	-49.9	-61.9	0	0	0	108.1	R83	D2-R83 PolarHBondContact O-N 3.11Å
3	S	88.3	Confident	86.8	Confident	88 Å²	88	81.6 Å²	81.6	62%	0.615	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	126.5	178	57	0	0	0	0	110.4	M1 L81	M1-S3 PolarHBondContact O-N 3.44Å; M1-S3 VanDerWaalsContact O-N 3.16Å; S3-L81 CarbonylContact C-O 3.48Å; S3-L81 WeakPolarHBondContact CA-O 3.01Å
4	F	92.4	Very high	87.2	Confident	59 Å²	59	76.7 Å²	76.7	26%	0.259	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.1	-179	66.6	-76.1	0	0	0	110.5	V6 D48 L81 R83	F4-V6 HydrophobicContact CD2-CG2 3.64Å; F4-V6 HydrophobicContact CE2-CG2 3.44Å; F4-V6 VanDerWaalsContact CE2-CG2 3.44Å; F4-D48 WeakPolarHBondContact CZ-OD2 3.48Å; F4-L81 HydrophobicContact CD1-CB 4.19Å; F4-L81 HydrophobicContact CE1-CB 3.74Å; F4-L81 HydrophobicContact CE2-CB 4.23Å; F4-L81 HydrophobicContact CE2-CD1 4Å; F4-L81 HydrophobicContact CZ-CB 3.76Å; F4-L81 HydrophobicContact CZ-CD1 3.84Å; F4-L81 HydrophobicContact CZ-CG 4.45Å; F4-L81 PolarHBondContact N-O 2.87Å; F4-L81 PolarHBondContact O-N 2.96Å; F4-R83 HydrophobicContact CE1-CB 4.04Å
5	K	93.1	Very high	87.4	Confident	151 Å²	151	72.4 Å²	72.4	66%	0.657	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	129.1	178.6	-170.9	-179.3	-176.6	-179.5	0	109.6	S78 L79	K5-S78 WeakPolarHBondContact CE-OG 3.36Å; K5-L79 WeakPolarHBondContact CA-O 3.38Å
6	V	93.9	Very high	87.8	Confident	9 Å²	9	69.8 Å²	69.8	6%	0.055	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.8	172.4	-178.5	0	0	0	0	108.6	F4 L8 A42 V44 S78 L79 L81	F4-V6 HydrophobicContact CD2-CG2 3.64Å; F4-V6 HydrophobicContact CE2-CG2 3.44Å; F4-V6 VanDerWaalsContact CE2-CG2 3.44Å; V6-L8 HydrophobicContact CG1-CD2 3.71Å; V6-L8 HydrophobicContact CG1-CG 4.39Å; V6-A42 HydrophobicContact CG1-CB 3.59Å; V6-V44 HydrophobicContact CB-CG2 4.44Å; V6-V44 HydrophobicContact CG1-CG2 4.02Å; V6-V44 HydrophobicContact CG2-CG2 4.19Å; V6-S78 WeakPolarHBondContact O-CA 3.15Å; V6-L79 PolarHBondContact N-O 3.03Å; V6-L79 PolarHBondContact O-N 3.31Å; V6-L81 HydrophobicContact CG2-CD1 3.93Å
7	V	94	Very high	88.1	Confident	56 Å²	56	73.6 Å²	73.6	34%	0.339	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128.2	172	-173.7	0	0	0	0	107.7	E9 R76	V7-E9 VanDerWaalsContact CG1-OE1 3.27Å; V7-E9 WeakPolarHBondContact CG1-OE1 3.2Å; V7-R76 HydrophobicContact CG1-CG 3.6Å
8	L	92.3	Very high	88.4	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.021	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130	177.7	-51.5	-176.9	0	0	0	108.7	V6 W14 F16 A39 A42 R76 L77	V6-L8 HydrophobicContact CG1-CD2 3.71Å; V6-L8 HydrophobicContact CG1-CG 4.39Å; L8-W14 HydrophobicContact CB-CE3 3.5Å; L8-W14 HydrophobicContact CB-CZ3 3.59Å; L8-W14 HydrophobicContact CD1-CB 4.02Å; L8-W14 HydrophobicContact CD1-CD2 4.4Å; L8-W14 HydrophobicContact CD1-CE3 3.9Å; L8-W14 HydrophobicContact CD1-CG 4.49Å; L8-W14 HydrophobicContact CG-CE3 4.35Å; L8-W14 WeakPolarHBondContact O-CZ3 3.33Å; L8-F16 HydrophobicContact CD1-CE1 4.3Å; L8-A39 HydrophobicContact CD1-CB 4.11Å; L8-A42 HydrophobicContact CD2-CB 3.33Å; L8-R76 WeakPolarHBondContact O-CA 3.46Å; L8-R76 WeakPolarHBondContact O-CG 3.5Å; L8-L77 HydrophobicContact CB-CB 4.49Å; L8-L77 HydrophobicContact CD1-CD2 4.35Å; L8-L77 PolarHBondContact N-O 2.92Å; L8-L77 PolarHBondContact O-N 3.47Å
9	E	91.3	Very high	88.6	Confident	116 Å²	116	73.1 Å²	73.1	54%	0.542	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	154.2	-174.2	-58.9	-65.1	166.8	0	0	112.5	V7 K38 E75 R76	V7-E9 VanDerWaalsContact CG1-OE1 3.27Å; V7-E9 WeakPolarHBondContact CG1-OE1 3.2Å; E9-K38 WeakPolarHBondContact O-CE 3.16Å; E9-K38 PolarHBondContact O-NZ 3.18Å; E9-E75 CarbonylContact C-O 3.46Å; E9-R76 WeakPolarHBondContact OE1-CD 3.48Å; E9-R76 WeakPolarHBondContact OE2-CD 3.34Å; E9-R76 VanDerWaalsContact OE2-CG 3.28Å; E9-R76 WeakPolarHBondContact OE2-CG 3.44Å
10	G	87	Confident	88.8	Confident	26 Å²	26	69.7 Å²	69.7	27%	0.268	38%	0.378	S	S	.	.	S	Bend	trans	70.4	167.8	-172.3	0	0	0	0	0	113.8	W14 K38 E75	G10-W14 WeakPolarHBondContact O-CH2 3.46Å; G10-W14 WeakPolarHBondContact O-CZ3 3.49Å; G10-K38 PolarHBondContact O-NZ 2.91Å; G10-E75 CarbonylContact C-O 3.59Å; G10-E75 VanDerWaalsContact CA-O 3.26Å; G10-E75 WeakPolarHBondContact CA-O 3.33Å; G10-E75 PolarHBondContact N-O 3.35Å
11	P	86.1	Confident	88.9	Confident	83 Å²	83	66.5 Å²	66.5	54%	0.539	36%	0.361	S	S	.	.	S	Bend	trans	-61.5	159.9	-171.6	24.3	-35.4	0	0	0	115.8	K38 G74	P11-K38 PolarHBondContact O-NZ 3.04Å; P11-G74 WeakPolarHBondContact CA-O 3.16Å
12	A	82.3	Confident	90.4	Very high	58 Å²	58	64.5 Å²	64.5	48%	0.479	35%	0.347	S	S	.	.	S	Bend	trans	-53.8	151	168	0	0	0	0	0	111.9
13	P	88.3	Confident	90.9	Very high	114 Å²	114	62.6 Å²	62.6	74%	0.74	34%	0.337	S	S	*	.	P	Polyproline II helix	cis	-81.7	140.8	13	31.6	-36.1	0	0	0	115	G15	P13-G15 VanDerWaalsContact C-N 3.34Å; P13-G15 PolarHBondContact O-N 3.32Å
14	W	91.8	Very high	90.9	Very high	13 Å²	13	64.6 Å²	64.6	5%	0.049	34%	0.335	C	S	.	.			trans	-78.1	-12.3	-179	-57.1	116.7	0	0	0	114.9	L8 G10 F16 K38 A39 I70 C73 L77	L8-W14 HydrophobicContact CB-CE3 3.5Å; L8-W14 HydrophobicContact CB-CZ3 3.59Å; L8-W14 HydrophobicContact CD1-CB 4.02Å; L8-W14 HydrophobicContact CD1-CD2 4.4Å; L8-W14 HydrophobicContact CD1-CE3 3.9Å; L8-W14 HydrophobicContact CD1-CG 4.49Å; L8-W14 HydrophobicContact CG-CE3 4.35Å; L8-W14 WeakPolarHBondContact O-CZ3 3.33Å; G10-W14 WeakPolarHBondContact O-CH2 3.46Å; G10-W14 WeakPolarHBondContact O-CZ3 3.49Å; W14-F16 HydrophobicContact CB-CD1 3.71Å; W14-F16 HydrophobicContact CB-CE1 3.52Å; W14-F16 HydrophobicContact CG-CE1 4.27Å; W14-K38 HydrophobicContact CE3-CD 4.14Å; W14-K38 HydrophobicContact CZ3-CD 4.38Å; W14-A39 WeakPolarHBondContact O-CB 3.31Å; W14-A39 PolarHBondContact O-N 3.47Å; W14-I70 PolarHBondContact NE1-O 2.62Å; W14-C73 HydrophobicContact CZ2-CB 4.18Å; W14-C73 WeakPolarHBondContact CZ2-O 3.29Å; W14-L77 HydrophobicContact CB-CD2 4.29Å; W14-L77 HydrophobicContact CD2-CB 3.94Å; W14-L77 HydrophobicContact CD2-CD2 3.75Å; W14-L77 HydrophobicContact CE3-CB 4.08Å; W14-L77 HydrophobicContact CE3-CD2 4.43Å; W14-L77 HydrophobicContact CG-CD2 3.64Å; W14-L77 HydrophobicContact CH2-CB 3.77Å; W14-L77 HydrophobicContact CZ2-CB 3.6Å; W14-L77 HydrophobicContact CZ3-CB 4Å
15	G	90.6	Very high	90.7	Very high	12 Å²	12	69.1 Å²	69.1	12%	0.124	36%	0.362	C	S	.	.	S	Bend	trans	79.7	24.8	174.4	0	0	0	0	0	115.8	P13 T34	P13-G15 VanDerWaalsContact C-N 3.34Å; P13-G15 PolarHBondContact O-N 3.32Å; G15-T34 PolarHBondContact O-N 3.07Å; G15-T34 PolarHBondContact O-OG1 3.29Å
16	F	93.8	Very high	90.4	Very high	31 Å²	31	65.3 Å²	65.3	14%	0.136	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	159	173.9	71.2	-88.8	0	0	0	112.2	L8 W14 I30 R32 L33 A39 I70 L77 L79	L8-F16 HydrophobicContact CD1-CE1 4.3Å; W14-F16 HydrophobicContact CB-CD1 3.71Å; W14-F16 HydrophobicContact CB-CE1 3.52Å; W14-F16 HydrophobicContact CG-CE1 4.27Å; F16-I30 HydrophobicContact CB-CG2 4.25Å; F16-I30 HydrophobicContact CD2-CD1 3.51Å; F16-I30 HydrophobicContact CE2-CD1 3.82Å; F16-I30 HydrophobicContact CG-CD1 4.19Å; F16-R32 CarbonylContact C-O 3.57Å; F16-R32 WeakPolarHBondContact CA-O 3.48Å; F16-L33 HydrophobicContact CB-CD2 3.68Å; F16-A39 HydrophobicContact CB-CB 4.05Å; F16-A39 HydrophobicContact CD1-CB 3.86Å; F16-A39 HydrophobicContact CG-CB 4.38Å; F16-I70 HydrophobicContact CE2-CD1 4.08Å; F16-I70 HydrophobicContact CZ-CD1 3.91Å; F16-I70 HydrophobicContact CZ-CG1 4.42Å; F16-I70 HydrophobicContact CZ-CG2 4.1Å; F16-L77 HydrophobicContact CE1-CD2 3.88Å; F16-L77 HydrophobicContact CZ-CD2 4.08Å; F16-L79 HydrophobicContact CE1-CD1 3.99Å; F16-L79 HydrophobicContact CZ-CD1 3.86Å
17	R	92.2	Very high	90.2	Very high	135 Å²	135	67.8 Å²	67.8	51%	0.509	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	143.6	164.3	-72.3	-163.2	178.7	-158.3	2.3	110.3	S31 R32	R17-S31 PolarHBondContact O-N 2.92Å; R17-S31 PolarHBondContact O-OG 3.43Å; R17-R32 HydrophobicContact CB-CB 4.26Å; R17-R32 PolarHBondContact N-O 3.06Å
18	L	93.8	Very high	90.2	Very high	24 Å²	24	65.4 Å²	65.4	13%	0.126	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	151.8	177.9	-166.8	66.7	0	0	0	110	L28 S29 V50 A66 I70	L18-L28 HydrophobicContact CD1-CB 4.43Å; L18-L28 HydrophobicContact CD1-CD2 4.26Å; L18-L28 HydrophobicContact CD2-CD2 3.88Å; L18-L28 HydrophobicContact CG-CD2 3.96Å; L18-S29 CarbonylContact C-O 3.39Å; L18-V50 HydrophobicContact CD1-CG2 3.78Å; L18-A66 HydrophobicContact CD2-CB 3.76Å; L18-I70 HydrophobicContact CD2-CD1 3.88Å
19	Q	92.5	Very high	90.3	Very high	113 Å²	113	66.2 Å²	66.2	53%	0.528	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	160	172.9	177	172.4	-9.1	0	0	109.6	L28 S29	Q19-L28 CarbonylContact O-C 3.55Å; Q19-L28 WeakPolarHBondContact O-CA 3.49Å; Q19-S29 PolarHBondContact N-O 3.45Å; Q19-S29 PolarHBondContact O-N 3.43Å
20	G	92.8	Very high	90.5	Very high	5 Å²	5	60.7 Å²	60.7	5%	0.052	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.9	-169.9	-172.9	0	0	0	0	0	111.9	L28 H63	G20-L28 VanDerWaalsContact C-CD2 3.49Å; G20-L28 VanDerWaalsContact O-CD2 3.26Å; G20-L28 WeakPolarHBondContact O-CD2 3.45Å; G20-H63 WeakPolarHBondContact O-CB 3.32Å; G20-H63 PolarHBondContact O-ND1 3.03Å
21	G	91.6	Very high	90.8	Very high	2 Å²	2	61 Å²	61	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137.2	153.2	-168	0	0	0	0	0	110	D23 F24 N25 V26	G21-D23 VanDerWaalsContact CA-OD1 3.28Å; G21-D23 WeakPolarHBondContact CA-OD1 3.5Å; G21-D23 PolarHBondContact O-N 3.37Å; G21-F24 CarbonylContact O-C 3.58Å; G21-F24 WeakPolarHBondContact O-CA 3.46Å; G21-F24 PolarHBondContact O-N 3.37Å; G21-N25 PolarHBondContact O-N 2.83Å; G21-N25 VanDerWaalsContact O-N 3.17Å; G21-V26 CarbonylContact C-O 3.44Å; G21-V26 PolarHBondContact N-O 2.87Å; G21-V26 PolarHBondContact O-N 2.86Å
22	K	90.8	Very high	90.8	Very high	138 Å²	138	63.8 Å²	63.8	60%	0.6	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-59.4	-33.6	179.3	-178.9	177.8	173.8	-173.4	0	113	F24 N25 S60 L61	K22-F24 VanDerWaalsContact C-N 3.25Å; K22-F24 PolarHBondContact O-N 3.02Å; K22-N25 PolarHBondContact O-N 3.38Å; K22-S60 WeakPolarHBondContact CD-O 3.46Å; K22-L61 VanDerWaalsContact CB-O 3.32Å; K22-L61 WeakPolarHBondContact CB-O 3.41Å; K22-L61 PolarHBondContact N-O 3.46Å
23	D	90.3	Very high	91.3	Very high	78 Å²	78	62.9 Å²	62.9	42%	0.417	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-60.1	-28	170.4	48.5	-22.4	0	0	0	114	G21 T62 H63	G21-D23 VanDerWaalsContact CA-OD1 3.28Å; G21-D23 WeakPolarHBondContact CA-OD1 3.5Å; G21-D23 PolarHBondContact O-N 3.37Å; D23-T62 HydrophobicContact CB-CG2 3.95Å; D23-T62 VanDerWaalsContact OD1-CA 3.32Å; D23-T62 WeakPolarHBondContact OD1-CA 3.39Å; D23-H63 PolarHBondContact OD1-N 3.38Å; D23-H63 WeakPolarHBondContact OD2-CB 3.39Å; D23-H63 PolarHBondContact OD2-N 3.35Å
24	F	87.8	Confident	91.4	Very high	129 Å²	129	61.1 Å²	61.1	57%	0.566	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-99.7	-1.3	175.5	-65.5	-79.7	0	0	0	113.7	G21 K22 V26 H63	G21-F24 CarbonylContact O-C 3.58Å; G21-F24 WeakPolarHBondContact O-CA 3.46Å; G21-F24 PolarHBondContact O-N 3.37Å; K22-F24 VanDerWaalsContact C-N 3.25Å; K22-F24 PolarHBondContact O-N 3.02Å; F24-V26 PolarHBondContact O-N 3.34Å; F24-H63 HydrophobicContact CD2-CB 3.96Å; F24-H63 HydrophobicContact CE2-CB 3.64Å
25	N	87.8	Confident	91.1	Very high	155 Å²	155	66.3 Å²	66.3	83%	0.829	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	34.6	-172.2	-161.9	31.6	0	0	0	113.8	G21 K22	G21-N25 PolarHBondContact O-N 2.83Å; G21-N25 VanDerWaalsContact O-N 3.17Å; K22-N25 PolarHBondContact O-N 3.38Å
26	V	88.7	Confident	90.9	Very high	70 Å²	70	68.5 Å²	68.5	42%	0.424	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	135.1	-179.2	168.3	0	0	0	0	108.2	G21 F24	G21-V26 CarbonylContact C-O 3.44Å; G21-V26 PolarHBondContact N-O 2.87Å; G21-V26 PolarHBondContact O-N 2.86Å; F24-V26 PolarHBondContact O-N 3.34Å
27	P	89.1	Confident	90.7	Very high	61 Å²	61	67.8 Å²	67.8	40%	0.396	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	141.5	179.5	24.8	-34.8	0	0	0	111.9	S29 W49	P27-S29 PolarHBondContact O-N 3.13Å; P27-S29 PolarHBondContact O-OG 3.4Å; P27-W49 HydrophobicContact CB-CD2 4.26Å; P27-W49 HydrophobicContact CB-CE3 3.99Å; P27-W49 HydrophobicContact CB-CZ3 4.16Å; P27-W49 HydrophobicContact CG-CD2 4.2Å; P27-W49 HydrophobicContact CG-CE3 4.14Å; P27-W49 HydrophobicContact CG-CH2 3.94Å; P27-W49 HydrophobicContact CG-CZ2 3.99Å; P27-W49 HydrophobicContact CG-CZ3 4.01Å
28	L	94.3	Very high	90.6	Very high	7 Å²	7	64.3 Å²	64.3	4%	0.037	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	130.4	175.4	-74.7	166.3	0	0	0	110	L18 Q19 G20 W49 V50 A58 L61 A66	L18-L28 HydrophobicContact CD1-CB 4.43Å; L18-L28 HydrophobicContact CD1-CD2 4.26Å; L18-L28 HydrophobicContact CD2-CD2 3.88Å; L18-L28 HydrophobicContact CG-CD2 3.96Å; Q19-L28 CarbonylContact O-C 3.55Å; Q19-L28 WeakPolarHBondContact O-CA 3.49Å; G20-L28 VanDerWaalsContact C-CD2 3.49Å; G20-L28 VanDerWaalsContact O-CD2 3.26Å; G20-L28 WeakPolarHBondContact O-CD2 3.45Å; L28-W49 CarbonylContact O-C 3.53Å; L28-V50 HydrophobicContact CB-CB 4.03Å; L28-V50 PolarHBondContact O-N 3.3Å; L28-A58 HydrophobicContact CD1-CB 3.96Å; L28-A58 WeakPolarHBondContact CD1-O 3.36Å; L28-L61 HydrophobicContact CD1-CB 4.25Å; L28-A66 HydrophobicContact CD1-CB 3.63Å; L28-A66 HydrophobicContact CD2-CB 4Å
29	S	94.4	Very high	90.6	Very high	20 Å²	20	63.1 Å²	63.1	14%	0.14	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	156.3	-171.3	47.7	0	0	0	0	112.5	L18 Q19 P27 S31 D48	L18-S29 CarbonylContact C-O 3.39Å; Q19-S29 PolarHBondContact N-O 3.45Å; Q19-S29 PolarHBondContact O-N 3.43Å; P27-S29 PolarHBondContact O-N 3.13Å; P27-S29 PolarHBondContact O-OG 3.4Å; S29-S31 PolarHBondContact O-N 3.43Å; S29-D48 CarbonylContact C-O 3.57Å; S29-D48 VanDerWaalsContact CA-O 3.29Å; S29-D48 WeakPolarHBondContact CA-O 3.42Å
30	I	94.8	Very high	90.5	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	108.5	-179.2	-54	-62.8	0	0	0	109.6	F16 L33 V44 G47 D48 V50	F16-I30 HydrophobicContact CB-CG2 4.25Å; F16-I30 HydrophobicContact CD2-CD1 3.51Å; F16-I30 HydrophobicContact CE2-CD1 3.82Å; F16-I30 HydrophobicContact CG-CD1 4.19Å; I30-L33 HydrophobicContact CG2-CD1 4.43Å; I30-L33 HydrophobicContact CG2-CD2 4.15Å; I30-L33 HydrophobicContact CG2-CG 3.95Å; I30-V44 HydrophobicContact CB-CG1 4.42Å; I30-V44 HydrophobicContact CD1-CG1 4.26Å; I30-V44 HydrophobicContact CG1-CG1 3.79Å; I30-V44 HydrophobicContact CG2-CG1 4.12Å; I30-G47 PolarHBondContact O-N 2.82Å; I30-D48 HydrophobicContact CG1-CB 4.3Å; I30-D48 PolarHBondContact N-O 3.11Å; I30-V50 HydrophobicContact CD1-CG2 3.94Å; I30-V50 HydrophobicContact CG1-CG2 4.4Å
31	S	92.9	Very high	90.4	Very high	31 Å²	31	66.7 Å²	66.7	22%	0.217	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-31.1	-173.4	58.1	0	0	0	0	114.6	R17 S29 V46	R17-S31 PolarHBondContact O-N 2.92Å; R17-S31 PolarHBondContact O-OG 3.43Å; S29-S31 PolarHBondContact O-N 3.43Å; S31-V46 WeakPolarHBondContact O-CG1 3.28Å
32	R	87.3	Confident	90.4	Very high	142 Å²	142	68.5 Å²	68.5	54%	0.536	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	150.8	174.2	-58.8	-174.2	-173.7	170.3	3.8	109.6	F16 R17 D408	F16-R32 CarbonylContact C-O 3.57Å; F16-R32 WeakPolarHBondContact CA-O 3.48Å; R17-R32 HydrophobicContact CB-CB 4.26Å; R17-R32 PolarHBondContact N-O 3.06Å; R32-D408 IonicContact NH2-OD2 2.84Å
33	L	92.9	Very high	90.3	Very high	39 Å²	39	63.8 Å²	63.8	20%	0.204	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	145.2	171.6	-78.1	163.2	0	0	0	109.9	F16 I30 P35 A39 V44 V46	F16-L33 HydrophobicContact CB-CD2 3.68Å; I30-L33 HydrophobicContact CG2-CD1 4.43Å; I30-L33 HydrophobicContact CG2-CD2 4.15Å; I30-L33 HydrophobicContact CG2-CG 3.95Å; L33-P35 WeakPolarHBondContact O-CD 3.44Å; L33-A39 HydrophobicContact CD2-CB 3.6Å; L33-V44 HydrophobicContact CD1-CG1 4.42Å; L33-V44 WeakPolarHBondContact CD1-O 3.09Å; L33-V44 HydrophobicContact CD2-CB 4.25Å; L33-V44 HydrophobicContact CD2-CG1 4.14Å; L33-V46 HydrophobicContact CB-CG2 4.22Å; L33-V46 HydrophobicContact CD1-CG2 4Å; L33-V46 HydrophobicContact CG-CG2 4.11Å
34	T	89.2	Confident	90.4	Very high	78 Å²	78	60.5 Å²	60.5	48%	0.479	36%	0.355	S	S	.	.			trans	-81.6	119.8	170.3	-55.4	0	0	0	0	108.6	G15 G36 G37	G15-T34 PolarHBondContact O-N 3.07Å; G15-T34 PolarHBondContact O-OG1 3.29Å; T34-G36 PolarHBondContact O-N 2.67Å; T34-G37 PolarHBondContact O-N 2.83Å
35	P	86.8	Confident	90.6	Very high	122 Å²	122	56 Å²	56	79%	0.792	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	130.2	175.5	-25.3	35.4	0	0	0	111.1	L33 G37	L33-P35 WeakPolarHBondContact O-CD 3.44Å; P35-G37 PolarHBondContact O-N 3.09Å
36	G	86.1	Confident	90.9	Very high	58 Å²	58	52.8 Å²	52.8	60%	0.598	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	-1.2	-175.3	0	0	0	0	0	115.8	T34 Q41	T34-G36 PolarHBondContact O-N 2.67Å; G36-Q41 PolarHBondContact O-NE2 3.08Å
37	G	88.1	Confident	90.9	Very high	15 Å²	15	50.8 Å²	50.8	16%	0.155	32%	0.321	C	S	.	.	S	Bend	trans	-73.7	163.7	175.2	0	0	0	0	0	113.2	T34 P35 A39 A40 Q41	T34-G37 PolarHBondContact O-N 2.83Å; P35-G37 PolarHBondContact O-N 3.09Å; G37-A39 PolarHBondContact O-N 2.96Å; G37-A40 WeakPolarHBondContact O-CA 3.24Å; G37-A40 WeakPolarHBondContact O-CB 3.42Å; G37-A40 PolarHBondContact O-N 3.12Å; G37-Q41 PolarHBondContact O-N 2.83Å
38	K	92	Very high	91.1	Very high	62 Å²	62	48 Å²	48	27%	0.27	30%	0.303	S	S	.	.	H	α-helix	trans	-50	-51.1	-172.9	-62.5	-175.1	175.7	-169.5	0	113.7	E9 G10 P11 W14 A40 Q41 A42	E9-K38 WeakPolarHBondContact O-CE 3.16Å; E9-K38 PolarHBondContact O-NZ 3.18Å; G10-K38 PolarHBondContact O-NZ 2.91Å; P11-K38 PolarHBondContact O-NZ 3.04Å; W14-K38 HydrophobicContact CE3-CD 4.14Å; W14-K38 HydrophobicContact CZ3-CD 4.38Å; K38-A40 VanDerWaalsContact C-N 3.31Å; K38-A40 PolarHBondContact O-N 3.28Å; K38-Q41 PolarHBondContact O-N 2.87Å; K38-A42 WeakPolarHBondContact O-CB 3.21Å; K38-A42 PolarHBondContact O-N 2.83Å
39	A	92.4	Very high	91.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.8	-38.2	177.9	0	0	0	0	0	113.3	L8 W14 F16 L33 G37 A42 G43 V44	L8-A39 HydrophobicContact CD1-CB 4.11Å; W14-A39 WeakPolarHBondContact O-CB 3.31Å; W14-A39 PolarHBondContact O-N 3.47Å; F16-A39 HydrophobicContact CB-CB 4.05Å; F16-A39 HydrophobicContact CD1-CB 3.86Å; F16-A39 HydrophobicContact CG-CB 4.38Å; L33-A39 HydrophobicContact CD2-CB 3.6Å; G37-A39 PolarHBondContact O-N 2.96Å; A39-A42 CarbonylContact O-C 3.58Å; A39-A42 PolarHBondContact O-N 2.61Å; A39-G43 PolarHBondContact O-N 3.43Å; A39-V44 HydrophobicContact CB-CB 4.13Å; A39-V44 HydrophobicContact CB-CG2 4Å; A39-V44 VanDerWaalsContact O-CB 3.24Å; A39-V44 WeakPolarHBondContact O-CB 3.43Å; A39-V44 VanDerWaalsContact O-CG2 3.29Å; A39-V44 WeakPolarHBondContact O-CG2 3.35Å; A39-V44 PolarHBondContact O-N 3.34Å
40	A	90.8	Very high	91.1	Very high	36 Å²	36	52.2 Å²	52.2	30%	0.298	32%	0.316	S	S	.	.	H	α-helix	trans	-70.4	-39.2	177.2	0	0	0	0	0	112.1	G37 K38 A42 G43	G37-A40 WeakPolarHBondContact O-CA 3.24Å; G37-A40 WeakPolarHBondContact O-CB 3.42Å; G37-A40 PolarHBondContact O-N 3.12Å; K38-A40 VanDerWaalsContact C-N 3.31Å; K38-A40 PolarHBondContact O-N 3.28Å; A40-A42 VanDerWaalsContact C-N 3.29Å; A40-A42 PolarHBondContact O-N 3.34Å; A40-G43 PolarHBondContact O-N 3.43Å
41	Q	91.1	Very high	91.1	Very high	157 Å²	157	55.6 Å²	55.6	73%	0.734	33%	0.334	S	S	*	.	H	α-helix	trans	-63.3	-36.5	172.9	-63.9	-176.4	21.7	0	0	111.7	G36 G37 K38 G43	G36-Q41 PolarHBondContact O-NE2 3.08Å; G37-Q41 PolarHBondContact O-N 2.83Å; K38-Q41 PolarHBondContact O-N 2.87Å; Q41-G43 PolarHBondContact O-N 2.86Å
42	A	90.6	Very high	91.2	Very high	39 Å²	39	55.6 Å²	55.6	32%	0.322	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	14.5	178.7	0	0	0	0	0	114.4	V6 L8 K38 A39 A40 V44	V6-A42 HydrophobicContact CG1-CB 3.59Å; L8-A42 HydrophobicContact CD2-CB 3.33Å; K38-A42 WeakPolarHBondContact O-CB 3.21Å; K38-A42 PolarHBondContact O-N 2.83Å; A39-A42 CarbonylContact O-C 3.58Å; A39-A42 PolarHBondContact O-N 2.61Å; A40-A42 VanDerWaalsContact C-N 3.29Å; A40-A42 PolarHBondContact O-N 3.34Å; A42-V44 PolarHBondContact O-N 3Å
43	G	89.2	Confident	91.5	Very high	39 Å²	39	48.9 Å²	48.9	40%	0.402	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	13.1	170	0	0	0	0	0	116.4	A39 A40 Q41 R83	A39-G43 PolarHBondContact O-N 3.43Å; A40-G43 PolarHBondContact O-N 3.43Å; Q41-G43 PolarHBondContact O-N 2.86Å; G43-R83 PolarHBondContact O-NH2 2.85Å
44	V	92.9	Very high	91.4	Very high	9 Å²	9	51.1 Å²	51.1	6%	0.055	32%	0.321	C	S	.	.			trans	-66.5	140.9	168.9	-175.1	0	0	0	0	109.3	V6 I30 L33 A39 A42 L81	V6-V44 HydrophobicContact CB-CG2 4.44Å; V6-V44 HydrophobicContact CG1-CG2 4.02Å; V6-V44 HydrophobicContact CG2-CG2 4.19Å; I30-V44 HydrophobicContact CB-CG1 4.42Å; I30-V44 HydrophobicContact CD1-CG1 4.26Å; I30-V44 HydrophobicContact CG1-CG1 3.79Å; I30-V44 HydrophobicContact CG2-CG1 4.12Å; L33-V44 HydrophobicContact CD1-CG1 4.42Å; L33-V44 WeakPolarHBondContact CD1-O 3.09Å; L33-V44 HydrophobicContact CD2-CB 4.25Å; L33-V44 HydrophobicContact CD2-CG1 4.14Å; A39-V44 HydrophobicContact CB-CB 4.13Å; A39-V44 HydrophobicContact CB-CG2 4Å; A39-V44 VanDerWaalsContact O-CB 3.24Å; A39-V44 WeakPolarHBondContact O-CB 3.43Å; A39-V44 VanDerWaalsContact O-CG2 3.29Å; A39-V44 WeakPolarHBondContact O-CG2 3.35Å; A39-V44 PolarHBondContact O-N 3.34Å; A42-V44 PolarHBondContact O-N 3Å; V44-L81 HydrophobicContact CB-CD1 4.27Å; V44-L81 HydrophobicContact CG1-CD1 3.85Å; V44-L81 HydrophobicContact CG2-CD1 3.79Å
45	A	91.6	Very high	91.2	Very high	34 Å²	34	50.3 Å²	50.3	28%	0.281	33%	0.327	S	S	.	.			trans	-116.8	157.5	175.3	0	0	0	0	0	112.5	D48	A45-D48 WeakPolarHBondContact CB-OD2 3.39Å; A45-D48 PolarHBondContact N-OD2 2.85Å; A45-D48 WeakPolarHBondContact O-CB 3.44Å; A45-D48 PolarHBondContact O-N 3.06Å
46	V	93.1	Very high	91.4	Very high	89 Å²	89	49.7 Å²	49.7	54%	0.539	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	131.5	170.1	177	0	0	0	0	108.7	S31 L33	S31-V46 WeakPolarHBondContact O-CG1 3.28Å; L33-V46 HydrophobicContact CB-CG2 4.22Å; L33-V46 HydrophobicContact CD1-CG2 4Å; L33-V46 HydrophobicContact CG-CG2 4.11Å
47	G	89.8	Confident	91.6	Very high	28 Å²	28	52.2 Å²	52.2	29%	0.289	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-7.8	-174.1	0	0	0	0	0	114.7	I30 W49 A84	I30-G47 PolarHBondContact O-N 2.82Å; G47-W49 VanDerWaalsContact O-CD1 3.32Å; G47-A84 WeakPolarHBondContact O-CB 2.96Å
48	D	93.9	Very high	91.7	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.016	31%	0.307	C	S	.	.			trans	-62.9	137.2	173	-72.7	-18	0	0	0	110.5	F4 S29 I30 A45 R83	F4-D48 WeakPolarHBondContact CZ-OD2 3.48Å; S29-D48 CarbonylContact C-O 3.57Å; S29-D48 VanDerWaalsContact CA-O 3.29Å; S29-D48 WeakPolarHBondContact CA-O 3.42Å; I30-D48 HydrophobicContact CG1-CB 4.3Å; I30-D48 PolarHBondContact N-O 3.11Å; A45-D48 WeakPolarHBondContact CB-OD2 3.39Å; A45-D48 PolarHBondContact N-OD2 2.85Å; A45-D48 WeakPolarHBondContact O-CB 3.44Å; A45-D48 PolarHBondContact O-N 3.06Å; D48-R83 WeakPolarHBondContact OD1-CA 3.42Å; D48-R83 IonicContact OD1-NE 3.22Å; D48-R83 IonicContact OD2-NH2 3.99Å
49	W	93.9	Very high	91.5	Very high	108 Å²	108	51.6 Å²	51.6	41%	0.409	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.5	-179.3	-70.8	22.1	0	0	0	110	P27 L28 G47 L51 L81 S82	P27-W49 HydrophobicContact CB-CD2 4.26Å; P27-W49 HydrophobicContact CB-CE3 3.99Å; P27-W49 HydrophobicContact CB-CZ3 4.16Å; P27-W49 HydrophobicContact CG-CD2 4.2Å; P27-W49 HydrophobicContact CG-CE3 4.14Å; P27-W49 HydrophobicContact CG-CH2 3.94Å; P27-W49 HydrophobicContact CG-CZ2 3.99Å; P27-W49 HydrophobicContact CG-CZ3 4.01Å; L28-W49 CarbonylContact O-C 3.53Å; G47-W49 VanDerWaalsContact O-CD1 3.32Å; W49-L51 PolarHBondContact O-N 3.22Å; W49-L81 CarbonylContact O-C 3.5Å; W49-L81 WeakPolarHBondContact O-CA 3.44Å; W49-S82 PolarHBondContact N-O 3.07Å; W49-S82 PolarHBondContact O-N 3.24Å
50	V	94.8	Very high	91.2	Very high	7 Å²	7	54.7 Å²	54.7	4%	0.042	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	109	176.5	-172.8	0	0	0	0	108.9	L18 L28 I30 I53 A58 L79 L81	L18-V50 HydrophobicContact CD1-CG2 3.78Å; L28-V50 HydrophobicContact CB-CB 4.03Å; L28-V50 PolarHBondContact O-N 3.3Å; I30-V50 HydrophobicContact CD1-CG2 3.94Å; I30-V50 HydrophobicContact CG1-CG2 4.4Å; V50-I53 HydrophobicContact CG1-CD1 4.25Å; V50-I53 HydrophobicContact CG1-CG1 3.74Å; V50-A58 HydrophobicContact CG1-CB 4.07Å; V50-A58 WeakPolarHBondContact O-CB 3.35Å; V50-L79 HydrophobicContact CG1-CD2 4.42Å; V50-L81 HydrophobicContact CB-CD2 4.33Å; V50-L81 HydrophobicContact CG2-CD2 3.88Å
51	L	93.7	Very high	91.2	Very high	72 Å²	72	53.5 Å²	53.5	38%	0.377	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-32.7	177.6	-59.6	-176.8	0	0	0	112.3	W49 A58 G80	W49-L51 PolarHBondContact O-N 3.22Å; L51-A58 PolarHBondContact O-N 3.31Å; L51-G80 PolarHBondContact N-O 2.94Å
52	S	94.2	Very high	91.3	Very high	30 Å²	30	47.6 Å²	47.6	21%	0.21	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	151.9	175.7	59.5	0	0	0	0	113.6	E56 L79 G80	S52-E56 CarbonylContact C-O 3.52Å; S52-E56 WeakPolarHBondContact CA-O 3.49Å; S52-E56 WeakPolarHBondContact CB-O 3.17Å; S52-L79 WeakPolarHBondContact O-CA 3.44Å; S52-G80 PolarHBondContact N-O 3.27Å; S52-G80 VanDerWaalsContact N-O 3.13Å; S52-G80 PolarHBondContact O-N 3.25Å; S52-G80 WeakPolarHBondContact OG-CA 3.39Å; S52-G80 PolarHBondContact OG-N 2.84Å
53	I	94.9	Very high	91.3	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	120.6	176.5	-60.5	170.5	0	0	0	107.2	V50 G55 E56 A58 L61 A66 K69 I70 L77 L79	V50-I53 HydrophobicContact CG1-CD1 4.25Å; V50-I53 HydrophobicContact CG1-CG1 3.74Å; I53-G55 PolarHBondContact O-N 3.02Å; I53-E56 PolarHBondContact N-O 2.94Å; I53-E56 PolarHBondContact O-N 2.99Å; I53-A58 HydrophobicContact CD1-CB 4.44Å; I53-A58 HydrophobicContact CG1-CB 4.32Å; I53-L61 HydrophobicContact CD1-CD1 4.24Å; I53-A66 HydrophobicContact CD1-CB 3.74Å; I53-K69 HydrophobicContact CG2-CB 3.9Å; I53-I70 HydrophobicContact CD1-CD1 3.91Å; I53-I70 HydrophobicContact CD1-CG1 4.17Å; I53-I70 HydrophobicContact CG2-CG1 3.93Å; I53-L77 HydrophobicContact CG2-CD1 4.18Å; I53-L79 HydrophobicContact CG1-CD2 4.06Å
54	D	90.2	Very high	91.3	Very high	87 Å²	87	50.2 Å²	50.2	47%	0.465	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	46	26.7	-171.6	-141.1	31.5	0	0	0	116.2	S78	D54-S78 WeakPolarHBondContact CA-O 3.48Å; D54-S78 PolarHBondContact N-O 2.85Å; D54-S78 WeakPolarHBondContact OD1-CB 3.28Å; D54-S78 PolarHBondContact OD1-N 2.87Å
55	G	85.4	Confident	91.3	Very high	60 Å²	60	54 Å²	54	62%	0.619	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.7	-19.1	-179.3	0	0	0	0	0	114.3	I53	I53-G55 PolarHBondContact O-N 3.02Å
56	E	89.8	Confident	91.4	Very high	110 Å²	110	52.4 Å²	52.4	51%	0.514	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	140.7	174.5	-66.4	-169.6	-92.3	0	0	111.9	S52 I53 A58 K69	S52-E56 CarbonylContact C-O 3.52Å; S52-E56 WeakPolarHBondContact CA-O 3.49Å; S52-E56 WeakPolarHBondContact CB-O 3.17Å; I53-E56 PolarHBondContact N-O 2.94Å; I53-E56 PolarHBondContact O-N 2.99Å; E56-A58 PolarHBondContact O-N 3.33Å; E56-K69 WeakPolarHBondContact OE1-CE 3.39Å; E56-K69 IonicContact OE1-NZ 3.82Å; E56-K69 PolarHBondContact OE1-NZ 2.77Å; E56-K69 IonicContact OE2-NZ 2.83Å; E56-K69 PolarHBondContact OE2-NZ 2.77Å
57	N	91.3	Very high	91.3	Very high	110 Å²	110	50.7 Å²	50.7	59%	0.588	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	128.2	179.3	-169.7	-72.9	0	0	0	111.1	G59	N57-G59 PolarHBondContact OD1-N 2.86Å
58	A	90.4	Very high	91.4	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.008	31%	0.305	C	S	.	.	S	Bend	trans	-86.9	-20.1	-176.1	0	0	0	0	0	113.4	L28 V50 L51 I53 E56 S60 L61	L28-A58 HydrophobicContact CD1-CB 3.96Å; L28-A58 WeakPolarHBondContact CD1-O 3.36Å; V50-A58 HydrophobicContact CG1-CB 4.07Å; V50-A58 WeakPolarHBondContact O-CB 3.35Å; L51-A58 PolarHBondContact O-N 3.31Å; I53-A58 HydrophobicContact CD1-CB 4.44Å; I53-A58 HydrophobicContact CG1-CB 4.32Å; E56-A58 PolarHBondContact O-N 3.33Å; A58-S60 PolarHBondContact O-N 3.37Å; A58-S60 VanDerWaalsContact O-N 3.14Å; A58-L61 HydrophobicContact CB-CD1 4.46Å; A58-L61 WeakPolarHBondContact O-CB 3.48Å; A58-L61 PolarHBondContact O-N 3.5Å
59	G	86.5	Confident	91.3	Very high	63 Å²	63	55.9 Å²	55.9	65%	0.649	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.9	-175.1	0	0	0	0	0	115	N57	N57-G59 PolarHBondContact OD1-N 2.86Å
60	S	87.1	Confident	91.2	Very high	65 Å²	65	51.6 Å²	51.6	46%	0.455	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-8.3	174.8	57.5	0	0	0	0	114.3	K22 A58	K22-S60 WeakPolarHBondContact CD-O 3.46Å; A58-S60 PolarHBondContact O-N 3.37Å; A58-S60 VanDerWaalsContact O-N 3.14Å
61	L	91.4	Very high	90.8	Very high	11 Å²	11	59.5 Å²	59.5	6%	0.058	33%	0.33	C	S	.	.			trans	-85.8	142.1	-173.6	-56.9	179.8	0	0	0	112.3	K22 L28 I53 A58 E65 A66 K69	K22-L61 VanDerWaalsContact CB-O 3.32Å; K22-L61 WeakPolarHBondContact CB-O 3.41Å; K22-L61 PolarHBondContact N-O 3.46Å; L28-L61 HydrophobicContact CD1-CB 4.25Å; I53-L61 HydrophobicContact CD1-CD1 4.24Å; A58-L61 HydrophobicContact CB-CD1 4.46Å; A58-L61 WeakPolarHBondContact O-CB 3.48Å; A58-L61 PolarHBondContact O-N 3.5Å; L61-E65 HydrophobicContact CB-CB 4.32Å; L61-E65 HydrophobicContact CD2-CB 4.3Å; L61-A66 HydrophobicContact CB-CB 4.36Å; L61-A66 HydrophobicContact CD1-CB 4.32Å; L61-K69 HydrophobicContact CD1-CD 4.13Å
62	T	92.8	Very high	90.5	Very high	34 Å²	34	60 Å²	60	21%	0.209	34%	0.344	C	S	.	.			trans	-70	162.3	160.8	61.7	0	0	0	0	111.3	D23 I64 E65 A66	D23-T62 HydrophobicContact CB-CG2 3.95Å; D23-T62 VanDerWaalsContact OD1-CA 3.32Å; D23-T62 WeakPolarHBondContact OD1-CA 3.39Å; T62-I64 VanDerWaalsContact C-N 3.25Å; T62-I64 PolarHBondContact O-N 3.49Å; T62-I64 WeakPolarHBondContact OG1-CG2 3.21Å; T62-E65 VanDerWaalsContact CB-OE2 3.32Å; T62-E65 WeakPolarHBondContact CB-OE2 3.47Å; T62-E65 WeakPolarHBondContact CG2-OE2 3.21Å; T62-E65 PolarHBondContact N-OE2 3.07Å; T62-E65 PolarHBondContact O-N 3.41Å; T62-E65 VanDerWaalsContact OG1-CD 3.25Å; T62-E65 VanDerWaalsContact OG1-CG 3.24Å; T62-E65 WeakPolarHBondContact OG1-CG 3.48Å; T62-E65 PolarHBondContact OG1-N 3.03Å; T62-E65 PolarHBondContact OG1-OE2 2.96Å; T62-A66 WeakPolarHBondContact O-CB 3.41Å; T62-A66 PolarHBondContact O-N 3.02Å
63	H	90.3	Very high	90.2	Very high	38 Å²	38	59.3 Å²	59.3	18%	0.176	34%	0.339	C	S	.	.	H	α-helix	trans	-55.8	-41.2	176.5	-171.5	82.3	0	0	0	112.3	G20 D23 F24 Q67	G20-H63 WeakPolarHBondContact O-CB 3.32Å; G20-H63 PolarHBondContact O-ND1 3.03Å; D23-H63 PolarHBondContact OD1-N 3.38Å; D23-H63 WeakPolarHBondContact OD2-CB 3.39Å; D23-H63 PolarHBondContact OD2-N 3.35Å; F24-H63 HydrophobicContact CD2-CB 3.96Å; F24-H63 HydrophobicContact CE2-CB 3.64Å; H63-Q67 PolarHBondContact CD2-NE2 3.31Å; H63-Q67 PolarHBondContact NE2-NE2 3.28Å; H63-Q67 WeakPolarHBondContact O-CG 3.27Å; H63-Q67 PolarHBondContact O-N 3.34Å
64	I	89.7	Confident	89.6	Confident	94 Å²	94	61.5 Å²	61.5	48%	0.482	36%	0.362	S	S	.	.	H	α-helix	trans	-71.8	-39.1	-179.4	-173.2	58.6	0	0	0	112.2	T62 Q67 N68	T62-I64 VanDerWaalsContact C-N 3.25Å; T62-I64 PolarHBondContact O-N 3.49Å; T62-I64 WeakPolarHBondContact OG1-CG2 3.21Å; I64-Q67 PolarHBondContact O-N 2.78Å; I64-N68 VanDerWaalsContact O-CB 3.32Å; I64-N68 WeakPolarHBondContact O-CB 3.14Å; I64-N68 PolarHBondContact O-N 2.88Å; I64-N68 PolarHBondContact O-ND2 2.87Å
65	E	91.8	Very high	89.6	Confident	89 Å²	89	64.6 Å²	64.6	42%	0.416	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-44	173.4	-71.2	164.4	128	0	0	111.4	L61 T62 N68 K69	L61-E65 HydrophobicContact CB-CB 4.32Å; L61-E65 HydrophobicContact CD2-CB 4.3Å; T62-E65 VanDerWaalsContact CB-OE2 3.32Å; T62-E65 WeakPolarHBondContact CB-OE2 3.47Å; T62-E65 WeakPolarHBondContact CG2-OE2 3.21Å; T62-E65 PolarHBondContact N-OE2 3.07Å; T62-E65 PolarHBondContact O-N 3.41Å; T62-E65 VanDerWaalsContact OG1-CD 3.25Å; T62-E65 VanDerWaalsContact OG1-CG 3.24Å; T62-E65 WeakPolarHBondContact OG1-CG 3.48Å; T62-E65 PolarHBondContact OG1-N 3.03Å; T62-E65 PolarHBondContact OG1-OE2 2.96Å; E65-N68 PolarHBondContact O-N 2.87Å; E65-K69 WeakPolarHBondContact O-CG 3.44Å; E65-K69 PolarHBondContact O-N 2.77Å
66	A	93.8	Very high	89.9	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-62.6	-43.7	177.1	0	0	0	0	0	112	L18 L28 I53 L61 T62 I70	L18-A66 HydrophobicContact CD2-CB 3.76Å; L28-A66 HydrophobicContact CD1-CB 3.63Å; L28-A66 HydrophobicContact CD2-CB 4Å; I53-A66 HydrophobicContact CD1-CB 3.74Å; L61-A66 HydrophobicContact CB-CB 4.36Å; L61-A66 HydrophobicContact CD1-CB 4.32Å; T62-A66 WeakPolarHBondContact O-CB 3.41Å; T62-A66 PolarHBondContact O-N 3.02Å; A66-I70 WeakPolarHBondContact O-CD1 3.16Å; A66-I70 WeakPolarHBondContact O-CG1 3.33Å; A66-I70 PolarHBondContact O-N 2.99Å; A66-I70 VanDerWaalsContact O-N 3.12Å
67	Q	91.4	Very high	90.1	Very high	54 Å²	54	62.7 Å²	62.7	25%	0.252	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-45.2	171.1	-80	-157	37.9	0	0	112.3	H63 I64 K69 I70 R71	H63-Q67 PolarHBondContact CD2-NE2 3.31Å; H63-Q67 PolarHBondContact NE2-NE2 3.28Å; H63-Q67 WeakPolarHBondContact O-CG 3.27Å; H63-Q67 PolarHBondContact O-N 3.34Å; I64-Q67 PolarHBondContact O-N 2.78Å; Q67-K69 VanDerWaalsContact C-N 3.35Å; Q67-K69 PolarHBondContact O-N 3.49Å; Q67-I70 PolarHBondContact O-N 2.99Å; Q67-R71 WeakPolarHBondContact O-CB 3.36Å; Q67-R71 VanDerWaalsContact O-CG 3.25Å; Q67-R71 WeakPolarHBondContact O-CG 3.33Å; Q67-R71 PolarHBondContact O-N 3.39Å
68	N	91.6	Very high	90.2	Very high	87 Å²	87	57.6 Å²	57.6	47%	0.465	32%	0.316	S	S	.	.	H	α-helix	trans	-64.3	-39.1	-177.3	-73.4	-13.8	0	0	0	111.7	I64 E65 R71 A72	I64-N68 VanDerWaalsContact O-CB 3.32Å; I64-N68 WeakPolarHBondContact O-CB 3.14Å; I64-N68 PolarHBondContact O-N 2.88Å; I64-N68 PolarHBondContact O-ND2 2.87Å; E65-N68 PolarHBondContact O-N 2.87Å; N68-R71 PolarHBondContact O-N 3.03Å; N68-A72 WeakPolarHBondContact O-CB 3.45Å; N68-A72 PolarHBondContact O-N 3.19Å
69	K	92	Very high	90.4	Very high	53 Å²	53	57.6 Å²	57.6	23%	0.23	32%	0.315	C	S	.	.	H	α-helix	trans	-64.5	-45.9	173.5	-67.5	-174.6	-173.8	-165.2	0	112	I53 E56 L61 E65 Q67 R71 A72 C73	I53-K69 HydrophobicContact CG2-CB 3.9Å; E56-K69 WeakPolarHBondContact OE1-CE 3.39Å; E56-K69 IonicContact OE1-NZ 3.82Å; E56-K69 PolarHBondContact OE1-NZ 2.77Å; E56-K69 IonicContact OE2-NZ 2.83Å; E56-K69 PolarHBondContact OE2-NZ 2.77Å; L61-K69 HydrophobicContact CD1-CD 4.13Å; E65-K69 WeakPolarHBondContact O-CG 3.44Å; E65-K69 PolarHBondContact O-N 2.77Å; Q67-K69 VanDerWaalsContact C-N 3.35Å; Q67-K69 PolarHBondContact O-N 3.49Å; K69-R71 PolarHBondContact O-N 3.39Å; K69-A72 PolarHBondContact O-N 3.05Å; K69-C73 PolarHBondContact O-N 3.45Å; K69-C73 PolarHBondContact O-SG 3.28Å; K69-C73 VanDerWaalsContact O-SG 3.39Å
70	I	92.4	Very high	90.8	Very high	17 Å²	17	55 Å²	55	9%	0.087	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-27.8	175.7	-71.9	162.9	0	0	0	112.8	W14 F16 L18 I53 A66 Q67 L77	W14-I70 PolarHBondContact NE1-O 2.62Å; F16-I70 HydrophobicContact CE2-CD1 4.08Å; F16-I70 HydrophobicContact CZ-CD1 3.91Å; F16-I70 HydrophobicContact CZ-CG1 4.42Å; F16-I70 HydrophobicContact CZ-CG2 4.1Å; L18-I70 HydrophobicContact CD2-CD1 3.88Å; I53-I70 HydrophobicContact CD1-CD1 3.91Å; I53-I70 HydrophobicContact CD1-CG1 4.17Å; I53-I70 HydrophobicContact CG2-CG1 3.93Å; A66-I70 WeakPolarHBondContact O-CD1 3.16Å; A66-I70 WeakPolarHBondContact O-CG1 3.33Å; A66-I70 PolarHBondContact O-N 2.99Å; A66-I70 VanDerWaalsContact O-N 3.12Å; Q67-I70 PolarHBondContact O-N 2.99Å; I70-L77 HydrophobicContact CG1-CD1 4.27Å; I70-L77 HydrophobicContact CG1-CD2 4.39Å; I70-L77 HydrophobicContact CG2-CD2 4.06Å
71	R	86.7	Confident	91.2	Very high	174 Å²	174	52 Å²	52	66%	0.657	27%	0.268	S	S	*	.	H	α-helix	trans	-84.5	-27.2	174.1	-68.1	168.5	-170.2	-88.2	5.9	113.6	Q67 N68 K69	Q67-R71 WeakPolarHBondContact O-CB 3.36Å; Q67-R71 VanDerWaalsContact O-CG 3.25Å; Q67-R71 WeakPolarHBondContact O-CG 3.33Å; Q67-R71 PolarHBondContact O-N 3.39Å; N68-R71 PolarHBondContact O-N 3.03Å; K69-R71 PolarHBondContact O-N 3.39Å
72	A	87.4	Confident	91.3	Very high	83 Å²	83	51.7 Å²	51.7	69%	0.686	27%	0.267	S	S	*	.	H	α-helix	trans	-77.5	-27.5	176.1	0	0	0	0	0	112.4	N68 K69 G74	N68-A72 WeakPolarHBondContact O-CB 3.45Å; N68-A72 PolarHBondContact O-N 3.19Å; K69-A72 PolarHBondContact O-N 3.05Å; A72-G74 PolarHBondContact O-N 3.01Å
73	C	86.4	Confident	91.2	Very high	15 Å²	15	55.5 Å²	55.5	10%	0.101	28%	0.277	C	S	.	.			trans	-57.5	105.1	164.1	-69.2	0	0	0	0	109.9	W14 K69 R76 L77	W14-C73 HydrophobicContact CZ2-CB 4.18Å; W14-C73 WeakPolarHBondContact CZ2-O 3.29Å; K69-C73 PolarHBondContact O-N 3.45Å; K69-C73 PolarHBondContact O-SG 3.28Å; K69-C73 VanDerWaalsContact O-SG 3.39Å; C73-R76 WeakPolarHBondContact CB-O 3.46Å; C73-L77 HydrophobicContact CB-CB 4Å; C73-L77 HydrophobicContact CB-CD1 4.05Å; C73-L77 VanDerWaalsContact SG-CD1 3.51Å
74	G	84.3	Confident	90.1	Very high	46 Å²	46	55.8 Å²	55.8	47%	0.474	29%	0.286	S	S	.	.			trans	-75.8	-91.4	-179.6	0	0	0	0	0	112	P11 A72	P11-G74 WeakPolarHBondContact CA-O 3.16Å; A72-G74 PolarHBondContact O-N 3.01Å
75	E	88.5	Confident	88.5	Confident	152 Å²	152	59.2 Å²	59.2	71%	0.71	30%	0.3	S	S	*	.	S	Bend	trans	-87.4	-8.5	-176.4	-59.9	-165.7	134.1	0	0	114.5	E9 G10	E9-E75 CarbonylContact C-O 3.46Å; G10-E75 CarbonylContact C-O 3.59Å; G10-E75 VanDerWaalsContact CA-O 3.26Å; G10-E75 WeakPolarHBondContact CA-O 3.33Å; G10-E75 PolarHBondContact N-O 3.35Å
76	R	91.8	Very high	86.1	Confident	131 Å²	131	60.4 Å²	60.4	49%	0.494	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	140.4	177	-165.9	178.4	79.3	169.5	0.6	111.9	V7 L8 E9 C73	V7-R76 HydrophobicContact CG1-CG 3.6Å; L8-R76 WeakPolarHBondContact O-CA 3.46Å; L8-R76 WeakPolarHBondContact O-CG 3.5Å; E9-R76 WeakPolarHBondContact OE1-CD 3.48Å; E9-R76 WeakPolarHBondContact OE2-CD 3.34Å; E9-R76 VanDerWaalsContact OE2-CG 3.28Å; E9-R76 WeakPolarHBondContact OE2-CG 3.44Å; C73-R76 WeakPolarHBondContact CB-O 3.46Å
77	L	94.3	Very high	83.3	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.1	173	169.8	62.5	0	0	0	110.1	L8 W14 F16 I53 I70 C73 L79	L8-L77 HydrophobicContact CB-CB 4.49Å; L8-L77 HydrophobicContact CD1-CD2 4.35Å; L8-L77 PolarHBondContact N-O 2.92Å; L8-L77 PolarHBondContact O-N 3.47Å; W14-L77 HydrophobicContact CB-CD2 4.29Å; W14-L77 HydrophobicContact CD2-CB 3.94Å; W14-L77 HydrophobicContact CD2-CD2 3.75Å; W14-L77 HydrophobicContact CE3-CB 4.08Å; W14-L77 HydrophobicContact CE3-CD2 4.43Å; W14-L77 HydrophobicContact CG-CD2 3.64Å; W14-L77 HydrophobicContact CH2-CB 3.77Å; W14-L77 HydrophobicContact CZ2-CB 3.6Å; W14-L77 HydrophobicContact CZ3-CB 4Å; F16-L77 HydrophobicContact CE1-CD2 3.88Å; F16-L77 HydrophobicContact CZ-CD2 4.08Å; I53-L77 HydrophobicContact CG2-CD1 4.18Å; I70-L77 HydrophobicContact CG1-CD1 4.27Å; I70-L77 HydrophobicContact CG1-CD2 4.39Å; I70-L77 HydrophobicContact CG2-CD2 4.06Å; C73-L77 HydrophobicContact CB-CB 4Å; C73-L77 HydrophobicContact CB-CD1 4.05Å; C73-L77 VanDerWaalsContact SG-CD1 3.51Å; L77-L79 HydrophobicContact CD1-CD2 3.93Å; L77-L79 HydrophobicContact CD1-CG 4.34Å; L77-L79 HydrophobicContact CD2-CD1 4.37Å; L77-L79 HydrophobicContact CD2-CD2 4.34Å; L77-L79 HydrophobicContact CD2-CG 4.32Å; L77-L79 HydrophobicContact CG-CD2 4.19Å; L77-L79 HydrophobicContact CG-CG 4.1Å
78	S	94.5	Very high	80.6	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.021	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132.1	168.6	162.1	0	0	0	0	110.9	K5 V6 D54	K5-S78 WeakPolarHBondContact CE-OG 3.36Å; V6-S78 WeakPolarHBondContact O-CA 3.15Å; D54-S78 WeakPolarHBondContact CA-O 3.48Å; D54-S78 PolarHBondContact N-O 2.85Å; D54-S78 WeakPolarHBondContact OD1-CB 3.28Å; D54-S78 PolarHBondContact OD1-N 2.87Å
79	L	94.8	Very high	77.8	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.2	173.3	-63.3	175.3	0	0	0	110.3	K5 V6 F16 V50 S52 I53 L77 L81	K5-L79 WeakPolarHBondContact CA-O 3.38Å; V6-L79 PolarHBondContact N-O 3.03Å; V6-L79 PolarHBondContact O-N 3.31Å; F16-L79 HydrophobicContact CE1-CD1 3.99Å; F16-L79 HydrophobicContact CZ-CD1 3.86Å; V50-L79 HydrophobicContact CG1-CD2 4.42Å; S52-L79 WeakPolarHBondContact O-CA 3.44Å; I53-L79 HydrophobicContact CG1-CD2 4.06Å; L77-L79 HydrophobicContact CD1-CD2 3.93Å; L77-L79 HydrophobicContact CD1-CG 4.34Å; L77-L79 HydrophobicContact CD2-CD1 4.37Å; L77-L79 HydrophobicContact CD2-CD2 4.34Å; L77-L79 HydrophobicContact CD2-CG 4.32Å; L77-L79 HydrophobicContact CG-CD2 4.19Å; L77-L79 HydrophobicContact CG-CG 4.1Å; L79-L81 HydrophobicContact CB-CD2 4.09Å; L79-L81 HydrophobicContact CB-CG 4.16Å
80	G	94.5	Very high	74.8	Confident	10 Å²	10	80.4 Å²	80.4	10%	0.103	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	118.6	161.1	0	0	0	0	0	108.8	L51 S52	L51-G80 PolarHBondContact N-O 2.94Å; S52-G80 PolarHBondContact N-O 3.27Å; S52-G80 VanDerWaalsContact N-O 3.13Å; S52-G80 PolarHBondContact O-N 3.25Å; S52-G80 WeakPolarHBondContact OG-CA 3.39Å; S52-G80 PolarHBondContact OG-N 2.84Å
81	L	94.7	Very high	71.8	Confident	1 Å²	1	85.6 Å²	85.6	1%	0.005	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	157.5	-177.6	-60.3	-178.5	0	0	0	110.9	S3 F4 V6 V44 W49 V50 L79	S3-L81 CarbonylContact C-O 3.48Å; S3-L81 WeakPolarHBondContact CA-O 3.01Å; F4-L81 HydrophobicContact CD1-CB 4.19Å; F4-L81 HydrophobicContact CE1-CB 3.74Å; F4-L81 HydrophobicContact CE2-CB 4.23Å; F4-L81 HydrophobicContact CE2-CD1 4Å; F4-L81 HydrophobicContact CZ-CB 3.76Å; F4-L81 HydrophobicContact CZ-CD1 3.84Å; F4-L81 HydrophobicContact CZ-CG 4.45Å; F4-L81 PolarHBondContact N-O 2.87Å; F4-L81 PolarHBondContact O-N 2.96Å; V6-L81 HydrophobicContact CG2-CD1 3.93Å; V44-L81 HydrophobicContact CB-CD1 4.27Å; V44-L81 HydrophobicContact CG1-CD1 3.85Å; V44-L81 HydrophobicContact CG2-CD1 3.79Å; W49-L81 CarbonylContact O-C 3.5Å; W49-L81 WeakPolarHBondContact O-CA 3.44Å; V50-L81 HydrophobicContact CB-CD2 4.33Å; V50-L81 HydrophobicContact CG2-CD2 3.88Å; L79-L81 HydrophobicContact CB-CD2 4.09Å; L79-L81 HydrophobicContact CB-CG 4.16Å
82	S	93.3	Very high	69.5	Low	5 Å²	5	86.5 Å²	86.5	4%	0.035	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.8	162.6	170.3	0	0	0	0	109.5	W49 A84	W49-S82 PolarHBondContact N-O 3.07Å; W49-S82 PolarHBondContact O-N 3.24Å; S82-A84 PolarHBondContact O-N 2.97Å
83	R	90.7	Very high	66.6	Low	114 Å²	114	92.3 Å²	92.3	43%	0.43	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-70.2	128.3	179.6	-176	146.6	-74.1	166.1	-0.3	111.1	D2 F4 G43 D48	D2-R83 PolarHBondContact O-N 3.11Å; F4-R83 HydrophobicContact CE1-CB 4.04Å; G43-R83 PolarHBondContact O-NH2 2.85Å; D48-R83 WeakPolarHBondContact OD1-CA 3.42Å; D48-R83 IonicContact OD1-NE 3.22Å; D48-R83 IonicContact OD2-NH2 3.99Å
84	A	67.8	Low	63.7	Low	44 Å²	44	95.8 Å²	95.8	36%	0.364	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-68	132.8	167.2	0	0	0	0	0	109.4	G47 S82	G47-A84 WeakPolarHBondContact O-CB 2.96Å; S82-A84 PolarHBondContact O-N 2.97Å
85	Q	56.3	Low	60.9	Low	166 Å²	166	99.3 Å²	99.3	78%	0.776	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-66.7	132.9	177.4	-79.7	-169.7	-32.4	0	0	110.4	V87	Q85-V87 PolarHBondContact O-N 3.45Å; Q85-V87 VanDerWaalsContact O-N 3.15Å
86	P	42.2	Very low	58	Low	113 Å²	113	98.7 Å²	98.7	73%	0.734	54%	0.537	S	S	*	.			trans	-68.4	113.9	173.2	28	-32.9	0	0	0	109.4	Q88	P86-Q88 PolarHBondContact O-N 3.44Å
87	V	33.6	Very low	55.6	Low	144 Å²	144	97.9 Å²	97.9	87%	0.873	55%	0.548	S	S	*	.			trans	-63.2	108.7	172.7	179.8	0	0	0	0	108.2	Q85 S89	Q85-V87 PolarHBondContact O-N 3.45Å; Q85-V87 VanDerWaalsContact O-N 3.15Å; V87-S89 PolarHBondContact O-N 2.9Å; V87-S89 VanDerWaalsContact O-N 3.15Å
88	Q	35.8	Very low	52.4	Low	167 Å²	167	102.2 Å²	102.2	78%	0.78	59%	0.585	S	S	*	*			trans	-62.3	117.2	-176.6	-71.7	-174.3	-6.9	0	0	111.6	P86 K90	P86-Q88 PolarHBondContact O-N 3.44Å; Q88-K90 PolarHBondContact O-N 3.32Å; Q88-K90 VanDerWaalsContact O-N 3.1Å
89	S	32.7	Very low	48.9	Very low	121 Å²	121	107 Å²	107	85%	0.846	62%	0.624	S	S	*	*			trans	-67.1	102.1	169.9	55	0	0	0	0	111	V87	V87-S89 PolarHBondContact O-N 2.9Å; V87-S89 VanDerWaalsContact O-N 3.15Å
90	K	28	Very low	46.1	Very low	182 Å²	182	114.2 Å²	114.2	79%	0.791	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-83.9	149.9	169.5	-85.7	-175.6	174.8	178.2	0	111.5	Q88	Q88-K90 PolarHBondContact O-N 3.32Å; Q88-K90 VanDerWaalsContact O-N 3.1Å
91	P	30.6	Very low	44.2	Very low	126 Å²	126	117.9 Å²	117.9	82%	0.818	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-72.3	163.2	-176.9	30.3	-36.1	0	0	0	113.3
92	Q	37.8	Very low	41.4	Very low	193 Å²	193	122.7 Å²	122.7	90%	0.902	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-75.5	136.4	-168.3	-55.4	172.5	-70.5	0	0	114.6
93	K	26.3	Very low	38.4	Very low	206 Å²	206	130 Å²	130	90%	0.896	74%	0.743	S	S	*	*				-163	141.4	127.5	-123.8	175.2	-178.9	177.3	0	114.2
94	A	25.1	Very low	35.5	Very low	88 Å²	88	130.6 Å²	130.6	73%	0.727	75%	0.746	S	S	*	*			trans	70.8	131.1	159.8	0	0	0	0	0	121.6
95	S	25.7	Very low	33.7	Very low	120 Å²	120	135 Å²	135	84%	0.839	77%	0.769	S	S	*	*			trans	56.1	115.1	149.9	46.3	0	0	0	0	122.5
96	V	27.7	Very low	32.6	Very low	138 Å²	138	135.9 Å²	135.9	84%	0.836	77%	0.77	S	S	*	*			trans	-112.3	-175.7	154.6	-122.1	0	0	0	0	107.3
97	P	41.1	Very low	32.3	Very low	114 Å²	114	134.8 Å²	134.8	74%	0.74	77%	0.77	S	S	*	*			cis	-114.4	176.9	-29.8	20.2	3.9	0	0	0	110.4
98	A	26.7	Very low	33.2	Very low	92 Å²	92	134 Å²	134	76%	0.76	77%	0.768	S	S	*	*			cis	83.9	133.2	31.1	0	0	0	0	0	116.6
99	A	21.1	Very low	33.1	Very low	102 Å²	102	131.8 Å²	131.8	84%	0.843	77%	0.772	S	S	*	*			trans	-151.2	143.2	171.5	0	0	0	0	0	110.4
100	D	36.6	Very low	33.1	Very low	153 Å²	153	132.4 Å²	132.4	82%	0.818	77%	0.77	S	S	*	*			trans	-141.6	-173.8	-165.2	-95	-57.8	0	0	0	109.9
101	P	54.5	Low	33.4	Very low	87 Å²	87	128.7 Å²	128.7	57%	0.565	77%	0.767	S	S	*	*			cis	-106.2	-135	-12.7	39.1	-22.7	0	0	0	109.4
102	P	36.3	Very low	33.4	Very low	102 Å²	102	130 Å²	130	66%	0.662	77%	0.766	S	S	*	*			cis	-132.9	-164.7	31.4	22.9	5.5	0	0	0	113.7
103	R	30	Very low	33.1	Very low	158 Å²	158	128.5 Å²	128.5	60%	0.596	76%	0.764	S	S	*	*			cis	-172.7	-176.5	-35.6	-90.7	166.5	-179.2	128.5	3.5	107.3	V226	R103-V226 PolarHBondContact NE-O 2.82Å; R103-V226 PolarHBondContact NH2-O 2.9Å
104	Y	30.3	Very low	33.1	Very low	127 Å²	127	127.6 Å²	127.6	50%	0.498	76%	0.76	S	S	.	*				173	119	-58.6	177	-96.3	0	0	0	109.5	P228	Y104-P228 HydrophobicContact CD2-CG 4.28Å; Y104-P228 HydrophobicContact CE2-CB 4.27Å; Y104-P228 HydrophobicContact CE2-CG 3.94Å
105	T	28.4	Very low	33.3	Very low	137 Å²	137	129.9 Å²	129.9	84%	0.84	77%	0.765	S	S	*	*			trans	-152	153.2	176.2	8.2	0	0	0	0	114.6
106	F	34.6	Very low	33.1	Very low	183 Å²	183	128.4 Å²	128.4	80%	0.803	76%	0.761	S	S	*	*			trans	-157.3	160.4	-174.3	-120.2	-80.7	0	0	0	110.2
107	A	34.7	Very low	33.6	Very low	90 Å²	90	133.3 Å²	133.3	74%	0.744	76%	0.764	S	S	*	*			trans	-156.1	142.7	163	0	0	0	0	0	112.7
108	P	52.4	Low	33.7	Very low	128 Å²	128	132.9 Å²	132.9	83%	0.831	76%	0.761	S	S	*	*			trans	-115.6	-178.8	178.5	42.3	-33.8	0	0	0	114.1
109	S	34.3	Very low	33.7	Very low	121 Å²	121	138.3 Å²	138.3	85%	0.846	77%	0.768	S	S	*	*			trans	-144.6	162.6	168.6	61	0	0	0	0	112.8
110	V	33.4	Very low	33.9	Very low	134 Å²	134	136.9 Å²	136.9	81%	0.812	76%	0.763	S	S	*	*			trans	-148.7	141.5	-166.1	177.5	0	0	0	0	110.2
111	S	33.2	Very low	33.5	Very low	103 Å²	103	134.4 Å²	134.4	72%	0.72	76%	0.764	S	S	*	*			trans	169	137.4	141.4	-83.8	0	0	0	0	116.3
112	L	31.8	Very low	32.8	Very low	154 Å²	154	135.9 Å²	135.9	81%	0.806	77%	0.774	S	S	*	*			trans	64.8	149.8	150.9	-61.2	168.6	0	0	0	118.1
113	N	31.1	Very low	32.6	Very low	162 Å²	162	136.5 Å²	136.5	87%	0.866	78%	0.778	S	S	*	*			cis	-124.4	-178.6	24	-91.5	-45.1	0	0	0	115.2
114	K	26.7	Very low	32.7	Very low	187 Å²	187	135.2 Å²	135.2	81%	0.813	79%	0.79	S	S	*	*			trans	-146.6	161.5	-170.9	-170.6	179.8	179.8	-178.4	0	112.3
115	T	28.7	Very low	32.6	Very low	135 Å²	135	133.8 Å²	133.8	83%	0.828	80%	0.804	S	S	*	*			trans	76.8	145.6	172.3	-2.6	0	0	0	0	114.3
116	A	22.3	Very low	32.6	Very low	90 Å²	90	134.9 Å²	134.9	74%	0.744	81%	0.805	S	S	*	*			cis	-145.9	176	15	0	0	0	0	0	116.2
117	R	37	Very low	32.3	Very low	240 Å²	240	131.6 Å²	131.6	91%	0.906	81%	0.805	S	S	*	*			trans	-124.4	177.7	165.9	-77.9	-170.7	176.2	-142.3	2.1	107.5
118	P	44	Very low	31.9	Very low	106 Å²	106	132.2 Å²	132.2	69%	0.688	81%	0.81	S	S	*	*			cis	-127.8	-145.8	6.6	38.3	-14.7	0	0	0	111.4
119	F	27.2	Very low	30.6	Very low	205 Å²	205	133.5 Å²	133.5	90%	0.899	81%	0.809	S	S	*	*			cis	-160	176.6	0.4	-130.9	-25.7	0	0	0	111.5
120	G	25.3	Very low	30.4	Very low	72 Å²	72	134.8 Å²	134.8	74%	0.742	80%	0.802	S	S	*	*			trans	84.5	142.7	170.7	0	0	0	0	0	114.9
121	A	27.1	Very low	30.1	Very low	101 Å²	101	136.4 Å²	136.4	84%	0.835	80%	0.8	S	S	*	*			cis	-147.7	176.8	-3.1	0	0	0	0	0	109.2
122	P	41	Very low	29.8	Very low	119 Å²	119	139.7 Å²	139.7	77%	0.773	81%	0.81	S	S	*	*			trans	-105	167.5	-153.2	40.8	-38.2	0	0	0	117.3
123	P	31	Very low	29.6	Very low	114 Å²	114	135.1 Å²	135.1	74%	0.74	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-90.3	167.2	153	36.9	-31	0	0	0	112.2
124	P	33	Very low	29.6	Very low	131 Å²	131	136.9 Å²	136.9	85%	0.851	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-85.8	171.3	-160.9	34.4	-37.6	0	0	0	115.9
125	A	28.3	Very low	29.8	Very low	97 Å²	97	133.3 Å²	133.3	80%	0.802	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-85.7	161.7	175.4	0	0	0	0	0	112.9
126	D	27.4	Very low	29.7	Very low	161 Å²	161	135.4 Å²	135.4	86%	0.861	80%	0.803	S	S	*	*			trans	-138.4	163.8	147.7	-140	-32.4	0	0	0	110.3
127	S	28.1	Very low	30.2	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	81%	0.81	S	S	*	*			trans	-103.8	138.9	-144.2	-57	0	0	0	0	116.7
128	A	26.3	Very low	29.7	Very low	102 Å²	102	136.9 Å²	136.9	84%	0.843	81%	0.807	S	S	*	*			trans	-147.6	129.2	158.6	0	0	0	0	0	112.6
129	L	26.3	Very low	29	Very low	155 Å²	155	139.9 Å²	139.9	81%	0.812	82%	0.816	S	S	*	*			trans	-92.9	168.3	170.3	-64.5	158.5	0	0	0	108.5
130	Q	29.3	Very low	29.6	Very low	149 Å²	149	136.5 Å²	136.5	70%	0.696	81%	0.812	S	S	*	*			cis	-158	149.6	4.8	-140	154.9	-24.4	0	0	112.2
131	Q	27.3	Very low	30.1	Very low	168 Å²	168	138.6 Å²	138.6	79%	0.785	81%	0.813	S	S	*	*			trans	3.4	128.9	156.9	-57.1	173	14.5	0	0	122.1
132	N	27.4	Very low	30.3	Very low	172 Å²	172	139.6 Å²	139.6	92%	0.92	80%	0.804	S	S	*	*			trans	-167.5	171.2	141.5	-115.3	-96.8	0	0	0	109.7
133	G	27.2	Very low	30.2	Very low	57 Å²	57	137.6 Å²	137.6	59%	0.588	80%	0.798	S	S	*	*			cis	179.7	56	1.3	0	0	0	0	0	116.4
134	Q	29.8	Very low	30.7	Very low	200 Å²	200	136.7 Å²	136.7	94%	0.935	79%	0.794	S	S	*	*			trans	65.6	167.7	171.6	-87.7	-165.2	-29.5	0	0	118.4
135	P	31.6	Very low	30.9	Very low	111 Å²	111	139.1 Å²	139.1	72%	0.721	79%	0.791	S	S	*	*			trans	-113.4	166.2	-150.6	41.9	-35.5	0	0	0	116.8
136	L	26.7	Very low	31.3	Very low	179 Å²	179	142.5 Å²	142.5	94%	0.937	79%	0.79	S	S	*	*			trans	-126.5	158.7	164.7	-72.6	175.1	0	0	0	111.9
137	R	32	Very low	32	Very low	231 Å²	231	145.8 Å²	145.8	87%	0.872	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-73.6	153.3	-167.7	-69	174.4	171.7	160.9	-4.2	113.5	L139	R137-L139 PolarHBondContact O-N 3.04Å
138	P	27.6	Very low	32.6	Very low	130 Å²	130	147.8 Å²	147.8	84%	0.844	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-64.1	129.4	167.5	-15.9	30	0	0	0	111.1
139	L	28.9	Very low	33.2	Very low	170 Å²	170	151 Å²	151	89%	0.89	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-92.2	139.2	162.5	-82.9	166.3	0	0	0	109.5	R137	R137-L139 PolarHBondContact O-N 3.04Å
140	V	40.4	Very low	33.9	Very low	133 Å²	133	151.4 Å²	151.4	81%	0.806	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-69.4	130.7	-177.6	-179.4	0	0	0	0	110	D142	V140-D142 PolarHBondContact O-N 3.4Å
141	P	35.1	Very low	34.4	Very low	117 Å²	117	151.4 Å²	151.4	76%	0.76	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-64.5	130.7	171.6	-21.8	34	0	0	0	111.6
142	D	31.3	Very low	35.1	Very low	121 Å²	121	148.4 Å²	148.4	65%	0.647	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.9	134.2	-176	-166.5	-64.1	0	0	0	112.7	V140 S144 K145	V140-D142 PolarHBondContact O-N 3.4Å; D142-S144 PolarHBondContact O-N 3.26Å; D142-S144 WeakPolarHBondContact OD1-CB 3.16Å; D142-S144 PolarHBondContact OD1-N 2.89Å; D142-S144 PolarHBondContact OD1-OG 3.38Å; D142-K145 PolarHBondContact O-N 3.2Å
143	A	39.6	Very low	35.9	Very low	78 Å²	78	148.8 Å²	148.8	65%	0.645	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-61.6	-16.8	-176.4	0	0	0	0	0	114	K145 Q146	A143-K145 PolarHBondContact O-N 2.9Å; A143-Q146 PolarHBondContact O-N 3.23Å
144	S	41.3	Very low	36.5	Very low	95 Å²	95	150.8 Å²	150.8	66%	0.664	78%	0.781	S	S	*	*	G	3₁₀ helix	trans	-54.9	-23.9	177.8	-58.9	0	0	0	0	114.2	D142	D142-S144 PolarHBondContact O-N 3.26Å; D142-S144 WeakPolarHBondContact OD1-CB 3.16Å; D142-S144 PolarHBondContact OD1-N 2.89Å; D142-S144 PolarHBondContact OD1-OG 3.38Å
145	K	38.1	Very low	37.1	Very low	181 Å²	181	151.4 Å²	151.4	79%	0.787	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-89.6	-18.9	-175.9	-147.1	174.8	-174.7	178.9	0	114.9	D142 A143	D142-K145 PolarHBondContact O-N 3.2Å; A143-K145 PolarHBondContact O-N 2.9Å
146	Q	36.6	Very low	37.7	Very low	169 Å²	169	156 Å²	156	79%	0.79	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-83.9	-29.2	177.9	-91.7	-179.9	-33.2	0	0	113.1	A143 L148	A143-Q146 PolarHBondContact O-N 3.23Å; Q146-L148 PolarHBondContact O-N 3.36Å
147	R	41.5	Very low	38.1	Very low	230 Å²	230	153.6 Å²	153.6	87%	0.868	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-77.2	18.6	177.9	-152.6	-174.5	-80.5	-158.9	-4.2	114.2
148	L	39.7	Very low	38.4	Very low	155 Å²	155	150.6 Å²	150.6	81%	0.812	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-119.5	4.4	179.4	-144.1	80.4	0	0	0	114.3	Q146	Q146-L148 PolarHBondContact O-N 3.36Å
149	M	39.6	Very low	38.7	Very low	169 Å²	169	150.9 Å²	150.9	83%	0.833	76%	0.763	S	S	*	*	S	Bend	trans	-119	-0.5	176.7	-74	175.6	59.2	0	0	113.9
150	E	41.9	Very low	39.5	Very low	165 Å²	165	146.6 Å²	146.6	77%	0.771	76%	0.76	S	S	*	*	S	Bend	trans	-126.6	80.4	-177.5	-167.4	173.6	110.8	0	0	110.8
151	N	39.7	Very low	40	Very low	149 Å²	149	144.8 Å²	144.8	80%	0.797	75%	0.749	S	S	*	*			trans	-172.7	59.8	156.6	-114.9	-101.6	0	0	0	109.7	E153	N151-E153 PolarHBondContact O-N 3.49Å
152	T	41	Very low	40.7	Very low	104 Å²	104	143.5 Å²	143.5	64%	0.638	76%	0.757	S	S	*	*			trans	-79.6	-3.8	-178.2	-60.4	0	0	0	0	112.7	W155	T152-W155 PolarHBondContact O-NE1 3.4Å
153	E	45	Very low	41.6	Very low	180 Å²	180	143.6 Å²	143.6	84%	0.841	75%	0.754	S	S	*	*			trans	-125.6	52	-155.2	-63.2	178.6	101.3	0	0	115.2	N151	N151-E153 PolarHBondContact O-N 3.49Å
154	D	39.2	Very low	42.1	Very low	100 Å²	100	142.9 Å²	142.9	54%	0.535	74%	0.744	S	S	.	*			trans	-151.1	56.3	151.5	-147.4	-5	0	0	0	113.2	R156 R158	D154-R156 PolarHBondContact O-N 3.43Å; D154-R156 VanDerWaalsContact O-N 3.08Å; D154-R158 IonicContact OD1-NH1 3.75Å; D154-R158 IonicContact OD2-NH1 3.92Å; D154-R158 PolarHBondContact OD2-NH1 2.86Å; D154-R158 IonicContact OD2-NH2 3.5Å
155	W	41.8	Very low	42.5	Very low	212 Å²	212	148.1 Å²	148.1	80%	0.803	75%	0.749	S	S	*	*			trans	-75.8	22.4	176.7	-72.7	101.9	0	0	0	114.4	T152	T152-W155 PolarHBondContact O-NE1 3.4Å
156	R	44	Very low	43.1	Very low	208 Å²	208	142.2 Å²	142.2	79%	0.785	73%	0.731	S	S	*	*			trans	-105.9	123.9	-178.8	-69.5	-174.1	-178.9	-95.3	1.7	111.7	D154 R158	D154-R156 PolarHBondContact O-N 3.43Å; D154-R156 VanDerWaalsContact O-N 3.08Å; R156-R158 PolarHBondContact O-N 2.9Å
157	P	36.8	Very low	43.9	Very low	128 Å²	128	140.4 Å²	140.4	83%	0.831	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-59	132.3	168.8	-22.3	33.4	0	0	0	111.2
158	R	37.3	Very low	45	Very low	169 Å²	169	136.8 Å²	136.8	64%	0.638	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-75	140.4	161	-68	-69.8	-162.2	-81.2	-0.7	108.2	D154 R156 G160	D154-R158 IonicContact OD1-NH1 3.75Å; D154-R158 IonicContact OD2-NH1 3.92Å; D154-R158 PolarHBondContact OD2-NH1 2.86Å; D154-R158 IonicContact OD2-NH2 3.5Å; R156-R158 PolarHBondContact O-N 2.9Å; R158-G160 PolarHBondContact O-N 3.16Å
159	P	33.8	Very low	45.9	Very low	135 Å²	135	133.7 Å²	133.7	88%	0.877	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	132.4	171.2	-18.6	31.4	0	0	0	110.5
160	G	46.3	Very low	46.5	Very low	81 Å²	81	130.4 Å²	130.4	84%	0.835	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.8	-10.5	168.1	0	0	0	0	0	117.5	R158	R158-G160 PolarHBondContact O-N 3.16Å
161	T	50.4	Low	47.6	Very low	94 Å²	94	123.6 Å²	123.6	58%	0.577	65%	0.648	S	S	*	*			trans	-130.1	118.4	177.2	56.2	0	0	0	0	112.5	Q163	T161-Q163 VanDerWaalsContact C-N 3.26Å; T161-Q163 PolarHBondContact O-N 2.68Å; T161-Q163 VanDerWaalsContact O-N 3.08Å
162	G	49.3	Very low	48.5	Very low	90 Å²	90	123.1 Å²	123.1	93%	0.928	64%	0.64	S	S	*	*			trans	-77.8	18.9	-169.8	0	0	0	0	0	117.3
163	Q	50.9	Low	48.9	Very low	124 Å²	124	125 Å²	125	58%	0.579	65%	0.646	S	S	*	*	S	Bend	trans	-137.9	144.7	178.8	-75.1	-168.9	2.1	0	0	112.6	T161	T161-Q163 VanDerWaalsContact C-N 3.26Å; T161-Q163 PolarHBondContact O-N 2.68Å; T161-Q163 VanDerWaalsContact O-N 3.08Å
164	S	50.1	Low	49.6	Very low	63 Å²	63	120.8 Å²	120.8	44%	0.441	63%	0.633	S	S	.	*			trans	-77.6	151.3	178	65.3	0	0	0	0	112.4	S166 F167	S164-S166 PolarHBondContact O-N 2.96Å; S164-F167 WeakPolarHBondContact O-CB 3.39Å; S164-F167 PolarHBondContact O-N 2.81Å
165	R	49.4	Very low	50.2	Low	204 Å²	204	118.9 Å²	118.9	77%	0.77	64%	0.637	S	S	*	*	H	α-helix	trans	-57.7	-33.4	178.2	-161.3	179.6	-172.1	-149.2	2.6	112.2	F167 R168 I169	R165-F167 VanDerWaalsContact C-N 3.3Å; R165-F167 PolarHBondContact O-N 3.26Å; R165-R168 PolarHBondContact O-N 3.36Å; R165-I169 HydrophobicContact CG-CD1 4.24Å; R165-I169 WeakPolarHBondContact O-CG1 3.28Å; R165-I169 PolarHBondContact O-N 2.8Å
166	S	51.9	Low	50.9	Low	58 Å²	58	113.1 Å²	113.1	41%	0.406	63%	0.625	S	S	.	*	H	α-helix	trans	-57.9	-39.3	174.9	-38.1	0	0	0	0	112.8	S164 I169 L170	S164-S166 PolarHBondContact O-N 2.96Å; S166-I169 PolarHBondContact O-N 3.46Å; S166-L170 WeakPolarHBondContact O-CB 3.42Å; S166-L170 WeakPolarHBondContact O-CG 3.47Å; S166-L170 PolarHBondContact O-N 2.84Å
167	F	53.6	Low	51.5	Low	131 Å²	131	109 Å²	109	58%	0.575	62%	0.615	S	S	*	*	H	α-helix	trans	-68.3	-38.3	179	-120.8	-92.7	0	0	0	112	S164 R165 L170 A171	S164-F167 WeakPolarHBondContact O-CB 3.39Å; S164-F167 PolarHBondContact O-N 2.81Å; R165-F167 VanDerWaalsContact C-N 3.3Å; R165-F167 PolarHBondContact O-N 3.26Å; F167-L170 PolarHBondContact O-N 3.16Å; F167-A171 WeakPolarHBondContact O-CB 3.1Å; F167-A171 PolarHBondContact O-N 2.93Å
168	R	62.7	Low	52.2	Low	153 Å²	153	111.4 Å²	111.4	58%	0.577	61%	0.612	S	S	*	*	H	α-helix	trans	-68.1	-40	174.8	-65.9	-173.8	176.8	-170.3	-3.1	112.6	R165 L170 A171 H172	R165-R168 PolarHBondContact O-N 3.36Å; R168-L170 VanDerWaalsContact C-N 3.35Å; R168-A171 PolarHBondContact O-N 3.28Å; R168-H172 PolarHBondContact O-N 2.9Å
169	I	59.1	Low	52.4	Low	90 Å²	90	111.7 Å²	111.7	46%	0.462	62%	0.623	S	S	.	*	H	α-helix	trans	-62.7	-44.3	174.8	-67.5	164.8	0	0	0	110.2	R165 S166 H172 L173	R165-I169 HydrophobicContact CG-CD1 4.24Å; R165-I169 WeakPolarHBondContact O-CG1 3.28Å; R165-I169 PolarHBondContact O-N 2.8Å; S166-I169 PolarHBondContact O-N 3.46Å; I169-H172 PolarHBondContact O-N 3.2Å; I169-L173 HydrophobicContact CG2-CD1 3.83Å; I169-L173 VanDerWaalsContact O-CD1 3.28Å; I169-L173 WeakPolarHBondContact O-CD1 3.45Å; I169-L173 PolarHBondContact O-N 3.01Å
170	L	52.7	Low	52.7	Low	101 Å²	101	113.4 Å²	113.4	53%	0.529	62%	0.619	S	S	.	*	H	α-helix	trans	-60.8	-45.9	173.9	-74.8	171.9	0	0	0	112	S166 F167 R168 H172 L173 T174	S166-L170 WeakPolarHBondContact O-CB 3.42Å; S166-L170 WeakPolarHBondContact O-CG 3.47Å; S166-L170 PolarHBondContact O-N 2.84Å; F167-L170 PolarHBondContact O-N 3.16Å; R168-L170 VanDerWaalsContact C-N 3.35Å; L170-H172 PolarHBondContact O-N 3.13Å; L170-L173 CarbonylContact O-C 3.59Å; L170-L173 WeakPolarHBondContact O-CA 3.5Å; L170-L173 PolarHBondContact O-N 2.93Å; L170-T174 PolarHBondContact O-N 2.77Å; L170-T174 PolarHBondContact O-OG1 3.4Å
171	A	63.9	Low	52.2	Low	22 Å²	22	116.2 Å²	116.2	18%	0.182	62%	0.615	C	S	.	*	H	α-helix	trans	-61.8	-38.2	179.9	0	0	0	0	0	113.6	F167 R168 T174 G175 T176	F167-A171 WeakPolarHBondContact O-CB 3.1Å; F167-A171 PolarHBondContact O-N 2.93Å; R168-A171 PolarHBondContact O-N 3.28Å; A171-T174 PolarHBondContact O-N 3Å; A171-G175 PolarHBondContact O-N 3.08Å; A171-T176 PolarHBondContact O-N 3.06Å
172	H	60.1	Low	51.5	Low	138 Å²	138	117.3 Å²	117.3	64%	0.639	62%	0.624	S	S	*	*	H	α-helix	trans	-62	-46.3	168.5	-94.1	-5.9	0	0	0	111.5	R168 I169 L170 T174 G175 E177	R168-H172 PolarHBondContact O-N 2.9Å; I169-H172 PolarHBondContact O-N 3.2Å; L170-H172 PolarHBondContact O-N 3.13Å; H172-T174 VanDerWaalsContact C-N 3.29Å; H172-T174 PolarHBondContact O-N 3.01Å; H172-G175 PolarHBondContact O-N 3.08Å; H172-E177 IonicContact CE1-OE2 3.83Å; H172-E177 PolarHBondContact CE1-OE2 3.35Å; H172-E177 IonicContact CG-OE2 2.7Å; H172-E177 IonicContact ND1-OE2 2.73Å; H172-E177 PolarHBondContact ND1-OE2 3.08Å
173	L	49.4	Very low	51.2	Low	144 Å²	144	119.4 Å²	119.4	75%	0.754	61%	0.614	S	S	*	*	H	α-helix	trans	-66.6	-25.8	179.3	-95.9	109.6	0	0	0	113.9	I169 L170	I169-L173 HydrophobicContact CG2-CD1 3.83Å; I169-L173 VanDerWaalsContact O-CD1 3.28Å; I169-L173 WeakPolarHBondContact O-CD1 3.45Å; I169-L173 PolarHBondContact O-N 3.01Å; L170-L173 CarbonylContact O-C 3.59Å; L170-L173 WeakPolarHBondContact O-CA 3.5Å; L170-L173 PolarHBondContact O-N 2.93Å
174	T	59.1	Low	50.8	Low	92 Å²	92	120.7 Å²	120.7	56%	0.564	62%	0.62	S	S	*	*	H	α-helix	trans	-97.7	-2.3	176.7	52.8	0	0	0	0	114	L170 A171 H172 T176	L170-T174 PolarHBondContact O-N 2.77Å; L170-T174 PolarHBondContact O-OG1 3.4Å; A171-T174 PolarHBondContact O-N 3Å; H172-T174 VanDerWaalsContact C-N 3.29Å; H172-T174 PolarHBondContact O-N 3.01Å; T174-T176 PolarHBondContact O-N 3.2Å; T174-T176 PolarHBondContact OG1-OG1 3.43Å
175	G	51.9	Low	49.9	Very low	60 Å²	60	126.3 Å²	126.3	62%	0.619	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.8	18.7	-177.4	0	0	0	0	0	114.5	A171 H172 E177	A171-G175 PolarHBondContact O-N 3.08Å; H172-G175 PolarHBondContact O-N 3.08Å; G175-E177 VanDerWaalsContact C-N 3.33Å; G175-E177 PolarHBondContact O-N 2.62Å
176	T	55.6	Low	49.3	Very low	90 Å²	90	125.2 Å²	125.2	55%	0.552	64%	0.642	S	S	*	*			trans	-99.2	34.4	-175.4	59	0	0	0	0	112	A171 T174	A171-T176 PolarHBondContact O-N 3.06Å; T174-T176 PolarHBondContact O-N 3.2Å; T174-T176 PolarHBondContact OG1-OG1 3.43Å
177	E	57.9	Low	48.7	Very low	123 Å²	123	130.5 Å²	130.5	58%	0.575	67%	0.665	S	S	*	*			trans	-81.5	-12.2	-171.9	63.6	-173.7	-171.9	0	0	114.6	H172 G175	H172-E177 IonicContact CE1-OE2 3.83Å; H172-E177 PolarHBondContact CE1-OE2 3.35Å; H172-E177 IonicContact CG-OE2 2.7Å; H172-E177 IonicContact ND1-OE2 2.73Å; H172-E177 PolarHBondContact ND1-OE2 3.08Å; G175-E177 VanDerWaalsContact C-N 3.33Å; G175-E177 PolarHBondContact O-N 2.62Å
178	F	50.7	Low	47.8	Very low	177 Å²	177	131 Å²	131	78%	0.776	67%	0.667	S	S	*	*			trans	-128	58.1	-173.7	-140.7	-86.3	0	0	0	113.3
179	M	41.3	Very low	46.3	Very low	176 Å²	176	133 Å²	133	87%	0.867	68%	0.68	S	S	*	*			trans	-124.9	111.4	156.4	-68.7	-167	73.5	0	0	108.7
180	Q	40.6	Very low	44.8	Very low	170 Å²	170	134.6 Å²	134.6	79%	0.794	70%	0.699	S	S	*	*			trans	-119.4	121.7	170.8	-71.1	-177.1	-44.4	0	0	107.8
181	D	36.1	Very low	43.7	Very low	140 Å²	140	135.6 Å²	135.6	75%	0.749	71%	0.714	S	S	*	*			trans	-70.7	142.3	169.6	-69.7	-65.7	0	0	0	110	D183	D181-D183 VanDerWaalsContact C-N 3.28Å; D181-D183 PolarHBondContact O-N 3.22Å
182	P	35.4	Very low	42	Very low	117 Å²	117	143.3 Å²	143.3	76%	0.76	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	6.8	-166.8	32.6	-37.3	0	0	0	115.6
183	D	42.2	Very low	40.6	Very low	134 Å²	134	143.2 Å²	143.2	72%	0.717	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	5.8	-162.1	-68	-55.8	0	0	0	116.5	D181 E185	D181-D183 VanDerWaalsContact C-N 3.28Å; D181-D183 PolarHBondContact O-N 3.22Å; D183-E185 PolarHBondContact O-N 2.81Å
184	E	42.3	Very low	39.8	Very low	151 Å²	151	142.1 Å²	142.1	71%	0.706	76%	0.757	S	S	*	*	S	Bend	trans	-84.5	6.8	-173.5	-139.9	-162.3	96.6	0	0	116.5	K188	E184-K188 PolarHBondContact O-NZ 3.21Å; E184-K188 VanDerWaalsContact O-NZ 3.08Å; E184-K188 IonicContact OE1-NZ 3.99Å; E184-K188 PolarHBondContact OE1-NZ 2.87Å
185	E	32.3	Very low	38.3	Very low	182 Å²	182	148.9 Å²	148.9	85%	0.85	77%	0.772	S	S	*	*	S	Bend	trans	-91.2	-33.3	176.4	-150.6	-176.5	127.5	0	0	113.4	D183 L187	D183-E185 PolarHBondContact O-N 2.81Å; E185-L187 VanDerWaalsContact C-N 3.35Å; E185-L187 PolarHBondContact O-N 3.22Å
186	H	37	Very low	36.9	Very low	180 Å²	180	152.2 Å²	152.2	83%	0.833	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	2.6	-161.4	-140.2	-74.6	0	0	0	116.3
187	L	39.8	Very low	35.4	Very low	169 Å²	169	156.8 Å²	156.8	89%	0.885	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	9.8	-175.4	-131.1	74.7	0	0	0	115.4	E185	E185-L187 VanDerWaalsContact C-N 3.35Å; E185-L187 PolarHBondContact O-N 3.22Å
188	K	33.6	Very low	33.8	Very low	143 Å²	143	155.3 Å²	155.3	62%	0.622	81%	0.805	S	S	*	*			trans	-115.3	39.6	-176.9	-64.8	172	-168.8	137.8	0	113.6	E184	E184-K188 PolarHBondContact O-NZ 3.21Å; E184-K188 VanDerWaalsContact O-NZ 3.08Å; E184-K188 IonicContact OE1-NZ 3.99Å; E184-K188 PolarHBondContact OE1-NZ 2.87Å
189	K	31.9	Very low	33	Very low	195 Å²	195	153.1 Å²	153.1	85%	0.848	81%	0.808	S	S	*	*			trans	-137.6	51.7	-178.4	-157.4	77.8	176.1	-166.4	0	114.2
190	S	27.8	Very low	32.3	Very low	123 Å²	123	149 Å²	149	86%	0.86	80%	0.803	S	S	*	*			trans	-158.9	156.2	165.5	-86.8	0	0	0	0	113.2
191	S	28.7	Very low	32.3	Very low	122 Å²	122	147.1 Å²	147.1	85%	0.853	81%	0.805	S	S	*	*			trans	69.6	100.2	177.5	-151.7	0	0	0	0	117.1
192	Q	29.3	Very low	31.8	Very low	184 Å²	184	144.2 Å²	144.2	86%	0.86	80%	0.8	S	S	*	*			trans	-131.8	110.7	160.8	-82.5	-171.8	-13	0	0	109.1
193	V	29.4	Very low	31.4	Very low	135 Å²	135	144 Å²	144	82%	0.818	80%	0.802	S	S	*	*			trans	52.8	165.7	157.6	-77.8	0	0	0	0	120.5
194	P	33.3	Very low	30.7	Very low	122 Å²	122	142.7 Å²	142.7	79%	0.792	80%	0.803	S	S	*	*			cis	-128.8	-169.1	-26.7	29.6	-7.9	0	0	0	114.2
195	R	26.6	Very low	29.9	Very low	233 Å²	233	141.6 Å²	141.6	88%	0.879	81%	0.807	S	S	*	*			trans	-61.7	165.4	175.6	-63.1	165.1	152.5	-175.1	-9.4	115.2
196	T	24.2	Very low	29.9	Very low	131 Å²	131	138.9 Å²	138.9	80%	0.804	81%	0.805	S	S	*	*				-174.6	-180	114.5	-67	0	0	0	0	110.9
197	E	22.8	Very low	29.4	Very low	186 Å²	186	138 Å²	138	87%	0.869	80%	0.801	S	S	*	*			trans	-81.3	-173	-153.7	-67.8	151.5	94.4	0	0	119.1
198	A	25.1	Very low	28.8	Very low	92 Å²	92	136 Å²	136	76%	0.76	79%	0.787	S	S	*	*			trans	-105.6	-179.9	-174.4	0	0	0	0	0	113.6
199	P	33.7	Very low	28.8	Very low	131 Å²	131	134.9 Å²	134.9	85%	0.851	79%	0.794	S	S	*	*				-146.9	-174.6	83.5	38.5	-19.1	0	0	0	115.9
200	A	25.3	Very low	28.6	Very low	90 Å²	90	136 Å²	136	74%	0.744	79%	0.793	S	S	*	*			trans	-105.6	-171.4	-178.4	0	0	0	0	0	112.8
201	P	40.6	Very low	28.7	Very low	129 Å²	129	136.1 Å²	136.1	84%	0.838	79%	0.792	S	S	*	*				-132.8	-156.7	63.4	37	-16.1	0	0	0	111.9
202	A	26	Very low	28.5	Very low	80 Å²	80	133.3 Å²	133.3	66%	0.661	78%	0.782	S	S	*	*			cis	-158.5	176.5	8.9	0	0	0	0	0	113.4
203	S	27.3	Very low	28.6	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	78%	0.782	S	S	*	*			trans	24	136.6	149.2	53.4	0	0	0	0	122.4
204	S	27.5	Very low	28.5	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	79%	0.785	S	S	*	*			cis	-162.7	127.5	6	50.9	0	0	0	0	115.1
205	T	24.7	Very low	28.3	Very low	127 Å²	127	131.8 Å²	131.8	78%	0.779	79%	0.786	S	S	*	*			trans	26.9	154.9	136.3	53.7	0	0	0	0	123.4
206	P	34.1	Very low	28.6	Very low	125 Å²	125	126.9 Å²	126.9	81%	0.812	78%	0.784	S	S	*	*			cis	-132.2	177.7	16.3	26.9	-2.2	0	0	0	118.4
207	Q	26.5	Very low	28.8	Very low	162 Å²	162	126 Å²	126	76%	0.757	78%	0.783	S	S	*	*			trans	-96.1	-179.6	-176.7	-84.4	166.9	-108.6	0	0	112.5
208	E	26	Very low	29.5	Very low	126 Å²	126	122.5 Å²	122.5	59%	0.589	78%	0.777	S	S	*	*			cis	-163.6	-159.5	-1.1	-125.6	-163.8	97	0	0	109.4
209	P	33.1	Very low	30	Very low	120 Å²	120	124.6 Å²	124.6	78%	0.779	78%	0.781	S	S	*	*			cis	-129.2	173.9	1.7	25.7	0.2	0	0	0	118.5
210	W	28.9	Very low	30.3	Very low	218 Å²	218	123.9 Å²	123.9	83%	0.826	78%	0.779	S	S	*	*			trans	-94.7	171.2	-179.1	-72	74.3	0	0	0	115.3
211	P	29	Very low	30.9	Very low	127 Å²	127	129.2 Å²	129.2	83%	0.825	78%	0.779	S	S	*	*				-138	168	98.9	39	-27.6	0	0	0	115.1
212	G	25.7	Very low	30.8	Very low	63 Å²	63	125.8 Å²	125.8	65%	0.649	76%	0.757	S	S	*	*			trans	-121.3	-147.4	172.1	0	0	0	0	0	112
213	P	31.2	Very low	31.5	Very low	132 Å²	132	125.9 Å²	125.9	86%	0.857	75%	0.751	S	S	*	*			cis	-121.6	159.6	-30.9	38.9	-26.6	0	0	0	112.7
214	T	26.4	Very low	32.1	Very low	145 Å²	145	128.9 Å²	128.9	89%	0.89	75%	0.745	S	S	*	*			trans	-114.5	142.7	-174.1	-38.4	0	0	0	0	113.6
215	T	29.7	Very low	32.8	Very low	131 Å²	131	125.6 Å²	125.6	80%	0.804	72%	0.724	S	S	*	*			trans	-94.3	160.4	-178.7	42.1	0	0	0	0	114
216	P	33.1	Very low	33.6	Very low	130 Å²	130	121.2 Å²	121.2	84%	0.844	70%	0.697	S	S	*	*			trans	-82.9	158.7	-168.2	32.7	-37	0	0	0	115.4
217	S	28.2	Very low	34.3	Very low	112 Å²	112	117.9 Å²	117.9	78%	0.783	67%	0.673	S	S	*	*			trans	-106.7	139.9	-173.1	-170	0	0	0	0	113.7
218	P	36.8	Very low	35.3	Very low	114 Å²	114	113 Å²	113	74%	0.74	66%	0.656	S	S	*	*			trans	-100.7	116.1	-173.5	35.8	-32.8	0	0	0	115.4	S220	P218-S220 PolarHBondContact O-N 2.81Å
219	T	35.8	Very low	36.4	Very low	136 Å²	136	109.1 Å²	109.1	83%	0.834	64%	0.644	S	S	*	*			trans	-95.5	79.8	-177.9	-51.2	0	0	0	0	112.7
220	S	39.5	Very low	37	Very low	116 Å²	116	106.7 Å²	106.7	81%	0.811	62%	0.622	S	S	*	*			trans	-152.3	13	177.9	-59.8	0	0	0	0	117.1	P218	P218-S220 PolarHBondContact O-N 2.81Å
221	R	39.8	Very low	37.8	Very low	201 Å²	201	98.3 Å²	98.3	76%	0.758	60%	0.599	S	S	*	*			trans	-93.2	138.1	-179.3	-72.3	-170.5	177	-132.5	-1.4	113.3	V226	R221-V226 HydrophobicContact CB-CG1 4.03Å
222	P	38.5	Very low	39	Very low	58 Å²	58	97.4 Å²	97.4	38%	0.377	58%	0.584	S	S	.	*			trans	-71.7	156.9	-180	30.4	-36.6	0	0	0	112.9	W224 A225	P222-W224 VanDerWaalsContact C-N 3.33Å; P222-W224 HydrophobicContact CG-CZ2 3.96Å; P222-W224 PolarHBondContact O-N 3.07Å; P222-W224 VanDerWaalsContact O-N 3.14Å; P222-A225 PolarHBondContact O-N 2.89Å; P222-A225 VanDerWaalsContact O-N 3.12Å
223	P	39.3	Very low	40.2	Very low	81 Å²	81	99.8 Å²	99.8	53%	0.526	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-58.6	-33.7	-165.3	-28.2	36.3	0	0	0	116.2	A225 V226 D227 F230	P223-A225 PolarHBondContact O-N 2.86Å; P223-V226 VanDerWaalsContact O-CG2 3.26Å; P223-V226 WeakPolarHBondContact O-CG2 3.34Å; P223-V226 PolarHBondContact O-N 3.18Å; P223-D227 PolarHBondContact O-N 2.9Å; P223-F230 HydrophobicContact CB-CE2 4.48Å
224	W	41.4	Very low	40.7	Very low	176 Å²	176	100.1 Å²	100.1	67%	0.667	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-65.7	-21.9	-178.8	59.7	-100.2	0	0	0	113.9	P222 V226 F230	P222-W224 VanDerWaalsContact C-N 3.33Å; P222-W224 HydrophobicContact CG-CZ2 3.96Å; P222-W224 PolarHBondContact O-N 3.07Å; P222-W224 VanDerWaalsContact O-N 3.14Å; W224-V226 VanDerWaalsContact C-N 3.35Å; W224-F230 HydrophobicContact CB-CD1 4.13Å; W224-F230 HydrophobicContact CB-CE1 4.13Å
225	A	41.2	Very low	41.7	Very low	37 Å²	37	94.4 Å²	94.4	31%	0.306	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-88.7	-0.2	-178.9	0	0	0	0	0	113.5	P222 P223	P222-A225 PolarHBondContact O-N 2.89Å; P222-A225 VanDerWaalsContact O-N 3.12Å; P223-A225 PolarHBondContact O-N 2.86Å
226	V	41.3	Very low	42.1	Very low	35 Å²	35	94 Å²	94	21%	0.212	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142.5	-1.8	-163.6	-63.7	0	0	0	0	115.2	R103 R221 P223 W224	R103-V226 PolarHBondContact NE-O 2.82Å; R103-V226 PolarHBondContact NH2-O 2.9Å; R221-V226 HydrophobicContact CB-CG1 4.03Å; P223-V226 VanDerWaalsContact O-CG2 3.26Å; P223-V226 WeakPolarHBondContact O-CG2 3.34Å; P223-V226 PolarHBondContact O-N 3.18Å; W224-V226 VanDerWaalsContact C-N 3.35Å
227	D	48.2	Very low	42.7	Very low	56 Å²	56	94.6 Å²	94.6	30%	0.299	52%	0.521	S	S	.	.			trans	-136.6	109.7	171.6	176.7	11.7	0	0	0	110.1	P223 A229 F230 A231	P223-D227 PolarHBondContact O-N 2.9Å; D227-A229 PolarHBondContact O-N 3.12Å; D227-A229 WeakPolarHBondContact OD1-CA 3.11Å; D227-A229 WeakPolarHBondContact OD1-CB 3.5Å; D227-A229 PolarHBondContact OD1-N 2.85Å; D227-F230 HydrophobicContact CB-CB 3.83Å; D227-F230 WeakPolarHBondContact O-CB 3.18Å; D227-F230 PolarHBondContact O-N 1.94Å; D227-F230 PolarHBondContact OD1-N 3.06Å; D227-F230 PolarHBondContact OD2-N 3.27Å; D227-A231 PolarHBondContact O-N 3.22Å
228	P	48.1	Very low	43.9	Very low	60 Å²	60	91.7 Å²	91.7	39%	0.39	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-25.4	177	27.4	-34	0	0	0	112.5	Y104 F230 A231 E232	Y104-P228 HydrophobicContact CD2-CG 4.28Å; Y104-P228 HydrophobicContact CE2-CB 4.27Å; Y104-P228 HydrophobicContact CE2-CG 3.94Å; P228-F230 VanDerWaalsContact C-N 3.3Å; P228-A231 PolarHBondContact O-N 3.03Å; P228-E232 WeakPolarHBondContact O-CB 3.5Å; P228-E232 PolarHBondContact O-N 2.73Å
229	A	49.7	Very low	44.9	Very low	43 Å²	43	89.3 Å²	89.3	36%	0.355	48%	0.478	S	S	.	.	H	α-helix	trans	-80.1	-10.4	174.5	0	0	0	0	0	113.3	D227 R233	D227-A229 PolarHBondContact O-N 3.12Å; D227-A229 WeakPolarHBondContact OD1-CA 3.11Å; D227-A229 WeakPolarHBondContact OD1-CB 3.5Å; D227-A229 PolarHBondContact OD1-N 2.85Å; A229-R233 WeakPolarHBondContact O-CG 3.46Å; A229-R233 PolarHBondContact O-NE 3.09Å
230	F	44.5	Very low	46.2	Very low	70 Å²	70	84.4 Å²	84.4	31%	0.307	45%	0.449	S	S	.	.	H	α-helix	trans	-84.9	-45.6	163.3	-172.3	-82.1	0	0	0	110	P223 W224 D227 P228 E232 R233 Y234	P223-F230 HydrophobicContact CB-CE2 4.48Å; W224-F230 HydrophobicContact CB-CD1 4.13Å; W224-F230 HydrophobicContact CB-CE1 4.13Å; D227-F230 HydrophobicContact CB-CB 3.83Å; D227-F230 WeakPolarHBondContact O-CB 3.18Å; D227-F230 PolarHBondContact O-N 1.94Å; D227-F230 PolarHBondContact OD1-N 3.06Å; D227-F230 PolarHBondContact OD2-N 3.27Å; P228-F230 VanDerWaalsContact C-N 3.3Å; F230-E232 PolarHBondContact O-N 2.87Å; F230-R233 PolarHBondContact O-N 3.39Å; F230-R233 VanDerWaalsContact O-N 3.07Å; F230-Y234 AromaticContact CD1-CD2 3.94Å; F230-Y234 HydrophobicContact CD1-CD2 3.94Å; F230-Y234 HydrophobicContact CD2-CD2 4.15Å; F230-Y234 HydrophobicContact CD2-CE2 4.18Å; F230-Y234 AromaticContact CE1-CD2 3.66Å; F230-Y234 HydrophobicContact CE1-CD2 3.66Å; F230-Y234 HydrophobicContact CE1-CE2 4.28Å; F230-Y234 HydrophobicContact CE1-CG 4.15Å; F230-Y234 AromaticContact CE2-CD2 3.89Å; F230-Y234 HydrophobicContact CE2-CD2 3.89Å; F230-Y234 AromaticContact CE2-CE2 3.72Å; F230-Y234 HydrophobicContact CE2-CE2 3.72Å; F230-Y234 HydrophobicContact CG-CD2 4.17Å; F230-Y234 AromaticContact CZ-CD2 3.63Å; F230-Y234 HydrophobicContact CZ-CD2 3.63Å; F230-Y234 AromaticContact CZ-CE2 3.78Å; F230-Y234 HydrophobicContact CZ-CE2 3.78Å; F230-Y234 HydrophobicContact CZ-CG 4.33Å; F230-Y234 WeakPolarHBondContact O-CD2 3.34Å; F230-Y234 PolarHBondContact O-N 3.1Å; F230-Y234 VanDerWaalsContact O-N 3.14Å
231	A	46.9	Very low	47.7	Very low	42 Å²	42	78.9 Å²	78.9	35%	0.347	41%	0.411	S	S	.	.	H	α-helix	trans	-58	-47.2	177.4	0	0	0	0	0	112.2	D227 P228 R233 Y234 A235	D227-A231 PolarHBondContact O-N 3.22Å; P228-A231 PolarHBondContact O-N 3.03Å; A231-R233 PolarHBondContact O-N 3.4Å; A231-Y234 CarbonylContact O-C 3.6Å; A231-Y234 PolarHBondContact O-N 3.43Å; A231-Y234 VanDerWaalsContact O-N 3.1Å; A231-A235 PolarHBondContact O-N 3.13Å
232	E	53.7	Low	49.3	Very low	107 Å²	107	71.9 Å²	71.9	50%	0.5	39%	0.391	S	S	.	.	H	α-helix	trans	-58.8	-27.7	174.8	-89.6	-69.6	109	0	0	113.9	P228 F230 K238	P228-E232 WeakPolarHBondContact O-CB 3.5Å; P228-E232 PolarHBondContact O-N 2.73Å; F230-E232 PolarHBondContact O-N 2.87Å; E232-K238 IonicContact OE1-NZ 3.43Å; E232-K238 PolarHBondContact OE1-NZ 2.83Å; E232-K238 IonicContact OE2-NZ 3.92Å; E232-K238 PolarHBondContact OE2-NZ 3.24Å
233	R	50.4	Low	51	Low	113 Å²	113	71.9 Å²	71.9	43%	0.426	39%	0.387	S	S	.	.	H	α-helix	trans	-88	-13.2	178.6	-69.5	-174.5	-128.4	-157.7	3.4	114	A229 F230 A231 S240 N376	A229-R233 WeakPolarHBondContact O-CG 3.46Å; A229-R233 PolarHBondContact O-NE 3.09Å; F230-R233 PolarHBondContact O-N 3.39Å; F230-R233 VanDerWaalsContact O-N 3.07Å; A231-R233 PolarHBondContact O-N 3.4Å; R233-S240 WeakPolarHBondContact O-CB 3.39Å; R233-S240 PolarHBondContact O-OG 3.01Å; R233-N376 PolarHBondContact NH1-ND2 2.86Å
234	Y	41.6	Very low	52.7	Low	139 Å²	139	70.8 Å²	70.8	55%	0.545	38%	0.379	S	S	.	.	H	α-helix	trans	-132.9	14.5	-174.4	-72.9	-77.2	0	0	0	113.6	F230 A231	F230-Y234 AromaticContact CD1-CD2 3.94Å; F230-Y234 HydrophobicContact CD1-CD2 3.94Å; F230-Y234 HydrophobicContact CD2-CD2 4.15Å; F230-Y234 HydrophobicContact CD2-CE2 4.18Å; F230-Y234 AromaticContact CE1-CD2 3.66Å; F230-Y234 HydrophobicContact CE1-CD2 3.66Å; F230-Y234 HydrophobicContact CE1-CE2 4.28Å; F230-Y234 HydrophobicContact CE1-CG 4.15Å; F230-Y234 AromaticContact CE2-CD2 3.89Å; F230-Y234 HydrophobicContact CE2-CD2 3.89Å; F230-Y234 AromaticContact CE2-CE2 3.72Å; F230-Y234 HydrophobicContact CE2-CE2 3.72Å; F230-Y234 HydrophobicContact CG-CD2 4.17Å; F230-Y234 AromaticContact CZ-CD2 3.63Å; F230-Y234 HydrophobicContact CZ-CD2 3.63Å; F230-Y234 AromaticContact CZ-CE2 3.78Å; F230-Y234 HydrophobicContact CZ-CE2 3.78Å; F230-Y234 HydrophobicContact CZ-CG 4.33Å; F230-Y234 WeakPolarHBondContact O-CD2 3.34Å; F230-Y234 PolarHBondContact O-N 3.1Å; F230-Y234 VanDerWaalsContact O-N 3.14Å; A231-Y234 CarbonylContact O-C 3.6Å; A231-Y234 PolarHBondContact O-N 3.43Å; A231-Y234 VanDerWaalsContact O-N 3.1Å
235	A	47	Very low	54.1	Low	25 Å²	25	71.8 Å²	71.8	21%	0.207	38%	0.382	C	S	.	.			trans	-58.2	126.9	169.3	0	0	0	0	0	108.9	A231 D237 K238	A231-A235 PolarHBondContact O-N 3.13Å; A235-D237 PolarHBondContact O-N 2.82Å; A235-K238 HydrophobicContact CB-CB 4.25Å; A235-K238 HydrophobicContact CB-CD 4.36Å; A235-K238 HydrophobicContact CB-CG 4.36Å; A235-K238 PolarHBondContact O-N 2.97Å
236	P	39.7	Very low	55.2	Low	124 Å²	124	71.7 Å²	71.7	81%	0.805	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-22.2	-170.5	25.7	-34.3	0	0	0	113
237	D	45	Very low	55.8	Low	141 Å²	141	74.8 Å²	74.8	75%	0.754	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-18.4	-179	-29.1	-82.8	0	0	0	112.6	A235	A235-D237 PolarHBondContact O-N 2.82Å
238	K	53.2	Low	56.1	Low	51 Å²	51	76.1 Å²	76.1	22%	0.222	40%	0.403	C	S	.	.	S	Bend	trans	-107.3	103.6	179.6	-68.7	-178.5	172.4	179.3	0	110	E232 A235 S240	E232-K238 IonicContact OE1-NZ 3.43Å; E232-K238 PolarHBondContact OE1-NZ 2.83Å; E232-K238 IonicContact OE2-NZ 3.92Å; E232-K238 PolarHBondContact OE2-NZ 3.24Å; A235-K238 HydrophobicContact CB-CB 4.25Å; A235-K238 HydrophobicContact CB-CD 4.36Å; A235-K238 HydrophobicContact CB-CG 4.36Å; A235-K238 PolarHBondContact O-N 2.97Å; K238-S240 PolarHBondContact O-N 3.01Å; K238-S240 VanDerWaalsContact O-N 3.12Å
239	T	58.4	Low	56	Low	65 Å²	65	76.3 Å²	76.3	40%	0.399	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-68.7	116.2	172.1	-53.7	0	0	0	0	109.4	L356 F379	T239-L356 HydrophobicContact CG2-CD2 4.14Å; T239-F379 HydrophobicContact CG2-CE1 3.58Å; T239-F379 HydrophobicContact CG2-CE2 4.19Å; T239-F379 HydrophobicContact CG2-CZ 3.34Å; T239-F379 WeakPolarHBondContact O-CD1 3.48Å; T239-F379 WeakPolarHBondContact O-CE1 3.38Å; T239-F379 PolarHBondContact O-N 3.36Å
240	S	62.8	Low	55.7	Low	32 Å²	32	78.9 Å²	78.9	22%	0.224	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-96.7	157.5	178.2	68.1	0	0	0	0	112.1	R233 K238	R233-S240 WeakPolarHBondContact O-CB 3.39Å; R233-S240 PolarHBondContact O-OG 3.01Å; K238-S240 PolarHBondContact O-N 3.01Å; K238-S240 VanDerWaalsContact O-N 3.12Å
241	T	70.3	Confident	56.1	Low	1 Å²	1	80.5 Å²	80.5	1%	0.006	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-100.6	131.4	171.3	44.3	0	0	0	0	110.2	M353 A355 F365 I374 N376 R377 F379	T241-M353 HydrophobicContact CG2-CE 3.89Å; T241-A355 HydrophobicContact CG2-CB 4.22Å; T241-F365 HydrophobicContact CG2-CD1 3.89Å; T241-F365 HydrophobicContact CG2-CE1 3.55Å; T241-I374 HydrophobicContact CG2-CG2 3.9Å; T241-N376 WeakPolarHBondContact O-CA 3.47Å; T241-N376 PolarHBondContact OG1-N 2.68Å; T241-N376 VanDerWaalsContact OG1-N 3.07Å; T241-R377 PolarHBondContact N-O 3.12Å; T241-R377 PolarHBondContact OG1-N 3.28Å; T241-R377 PolarHBondContact OG1-O 3.41Å; T241-F379 HydrophobicContact CG2-CD1 3.65Å; T241-F379 HydrophobicContact CG2-CE1 3.62Å
242	V	74.2	Confident	56.3	Low	54 Å²	54	80.7 Å²	80.7	33%	0.327	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.1	171.8	179.4	0	0	0	0	109.1	T244 H354	V242-T244 HydrophobicContact CG1-CG2 4.36Å; V242-H354 HydrophobicContact CB-CB 4.37Å; V242-H354 PolarHBondContact N-O 2.66Å; V242-H354 VanDerWaalsContact N-O 3.12Å; V242-H354 PolarHBondContact O-N 3.17Å
243	L	73.3	Confident	56.4	Low	58 Å²	58	77.4 Å²	77.4	30%	0.304	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.6	164.4	-86.8	84.5	0	0	0	109.3	I352 M353 R375 N376	L243-I352 WeakPolarHBondContact CA-O 3.42Å; L243-M353 HydrophobicContact CD1-CE 3.65Å; L243-M353 HydrophobicContact CD1-SD 3.5Å; L243-M353 WeakPolarHBondContact CD1-SD 3.44Å; L243-M353 HydrophobicContact CD2-SD 4.33Å; L243-M353 HydrophobicContact CG-CE 4.27Å; L243-M353 HydrophobicContact CG-SD 3.61Å; L243-R375 HydrophobicContact CD1-CB 3.72Å; L243-R375 HydrophobicContact CD1-CG 3.94Å; L243-R375 HydrophobicContact CD2-CG 4.41Å; L243-N376 HydrophobicContact CD1-CB 4.14Å
244	T	76.8	Confident	56.3	Low	57 Å²	57	75.4 Å²	75.4	35%	0.35	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	166.5	153	74.8	0	0	0	0	108.9	V242 I352 H354	V242-T244 HydrophobicContact CG1-CG2 4.36Å; T244-I352 PolarHBondContact N-O 3.03Å; T244-I352 PolarHBondContact O-N 3.32Å; T244-I352 VanDerWaalsContact O-O 3.12Å; T244-H354 WeakPolarHBondContact CB-NE2 3.44Å; T244-H354 WeakPolarHBondContact CG2-NE2 3.48Å; T244-H354 PolarHBondContact OG1-NE2 2.84Å
245	R	70.7	Confident	56.4	Low	197 Å²	197	75.5 Å²	75.5	74%	0.743	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	150.2	158.8	-177.4	172.9	160.8	179.4	-6.4	107.5	S247 G350	R245-S247 PolarHBondContact O-N 3.06Å; R245-G350 WeakPolarHBondContact CA-O 3.42Å
246	H	64.3	Low	56.5	Low	35 Å²	35	81.9 Å²	81.9	16%	0.162	46%	0.463	C	S	.	.			trans	-61.5	110.9	165	-171.5	-101.1	0	0	0	108.2	Y337 G350 I352	H246-Y337 PolarHBondContact NE2-O 3.09Å; H246-Y337 VanDerWaalsContact NE2-O 3.07Å; H246-G350 PolarHBondContact N-O 2.87Å; H246-I352 HydrophobicContact CB-CD1 3.86Å
247	S	53.7	Low	56.7	Low	101 Å²	101	79.4 Å²	79.4	71%	0.706	44%	0.443	S	S	*	.			trans	-87.6	114.5	179.8	51.1	0	0	0	0	108.9	R245	R245-S247 PolarHBondContact O-N 3.06Å
248	Q	53.7	Low	56.9	Low	83 Å²	83	79.1 Å²	79.1	39%	0.388	43%	0.431	S	S	.	.			trans	-56.2	141.2	170	-65.9	-175.4	-25.6	0	0	109.8	F321 D334	Q248-F321 HydrophobicContact CB-CZ 4.37Å; Q248-D334 WeakPolarHBondContact CG-OD1 3.38Å; Q248-D334 PolarHBondContact NE2-OD1 2.71Å; Q248-D334 PolarHBondContact NE2-OD2 2.73Å
249	P	46.6	Very low	56.5	Low	64 Å²	64	82.4 Å²	82.4	42%	0.416	46%	0.456	S	S	.	.	S	Bend	trans	-52.9	153.3	166.7	-27.3	37.5	0	0	0	111.5	T251 Y333	P249-T251 PolarHBondContact O-N 3.03Å; P249-Y333 HydrophobicContact CG-CE1 3.93Å
250	A	43.9	Very low	56.1	Low	97 Å²	97	81.7 Å²	81.7	80%	0.802	45%	0.453	S	S	*	.	S	Bend	trans	-57	110.5	-163.7	0	0	0	0	0	113.2
251	T	51.4	Low	56	Low	104 Å²	104	80.4 Å²	80.4	64%	0.638	44%	0.444	S	S	*	.			trans	56	127.1	172.7	55.2	0	0	0	0	116.9	P249	P249-T251 PolarHBondContact O-N 3.03Å
252	P	51.6	Low	55.6	Low	47 Å²	47	83.2 Å²	83.2	31%	0.305	46%	0.461	S	S	.	.	S	Bend	trans	-58.2	156.5	150	28.6	-33.9	0	0	0	109.6	G319	P252-G319 VanDerWaalsContact CB-CA 3.41Å
253	T	56.2	Low	55.3	Low	38 Å²	38	84.3 Å²	84.3	23%	0.233	46%	0.463	C	S	.	.	S	Bend	trans	-29.8	123.8	179.7	48.3	0	0	0	0	112.9	F320	T253-F320 HydrophobicContact CG2-CD1 4.47Å; T253-F320 HydrophobicContact CG2-CE1 3.77Å; T253-F320 HydrophobicContact CG2-CE2 4.26Å; T253-F320 HydrophobicContact CG2-CZ 3.64Å
254	P	48.6	Very low	54.6	Low	71 Å²	71	85.5 Å²	85.5	46%	0.461	48%	0.481	S	S	.	.			trans	-45.5	145.7	-163.7	-34	35.5	0	0	0	114.6	Q256 N257	P254-Q256 PolarHBondContact O-N 2.99Å; P254-N257 WeakPolarHBondContact O-CB 3.15Å; P254-N257 PolarHBondContact O-N 2.98Å
255	L	43.7	Very low	53.6	Low	140 Å²	140	84.1 Å²	84.1	73%	0.733	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-57.1	-27.1	-165.8	-144.1	149.9	0	0	0	113.4	N257 R258	L255-N257 PolarHBondContact O-N 3.42Å; L255-R258 PolarHBondContact O-N 3.24Å
256	Q	48.3	Very low	52.5	Low	159 Å²	159	79.1 Å²	79.1	74%	0.743	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-59.3	-21.9	171.3	-66.7	144.3	-39.8	0	0	114.7	P254 S260	P254-Q256 PolarHBondContact O-N 2.99Å; Q256-S260 PolarHBondContact O-OG 2.94Å
257	N	44.8	Very low	51.5	Low	73 Å²	73	80.5 Å²	80.5	39%	0.39	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-85	-11.9	177.5	-98	-3.7	0	0	0	114.2	P254 L255 T259 S260 I261	P254-N257 WeakPolarHBondContact O-CB 3.15Å; P254-N257 PolarHBondContact O-N 2.98Å; L255-N257 PolarHBondContact O-N 3.42Å; N257-T259 PolarHBondContact O-N 3.18Å; N257-T259 VanDerWaalsContact O-N 3.13Å; N257-S260 PolarHBondContact O-N 3.34Å; N257-I261 WeakPolarHBondContact O-CG1 3.48Å; N257-I261 PolarHBondContact O-N 3.44Å
258	R	48.9	Very low	50.8	Low	135 Å²	135	79.6 Å²	79.6	51%	0.509	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.8	-178.6	-65.2	-177.6	77.5	159.8	1.6	113	L255	L255-R258 PolarHBondContact O-N 3.24Å
259	T	45.5	Very low	50.1	Low	119 Å²	119	81.9 Å²	81.9	73%	0.73	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-10	172.6	44.5	0	0	0	0	114.1	N257	N257-T259 PolarHBondContact O-N 3.18Å; N257-T259 VanDerWaalsContact O-N 3.13Å
260	S	50.3	Low	49.9	Very low	50 Å²	50	85.3 Å²	85.3	35%	0.35	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-16.1	-169.1	-48	0	0	0	0	113.5	Q256 N257 Q263	Q256-S260 PolarHBondContact O-OG 2.94Å; N257-S260 PolarHBondContact O-N 3.34Å; S260-Q263 PolarHBondContact O-NE2 2.89Å; S260-Q263 VanDerWaalsContact O-NE2 3.11Å
261	I	59.2	Low	49.8	Very low	5 Å²	5	84.4 Å²	84.4	3%	0.026	55%	0.548	C	S	.	.	S	Bend	trans	-65.6	-49.1	170.4	-63.2	159.1	0	0	0	109.3	N257 Q263 L294 V295 F320	N257-I261 WeakPolarHBondContact O-CG1 3.48Å; N257-I261 PolarHBondContact O-N 3.44Å; I261-Q263 PolarHBondContact O-N 2.92Å; I261-L294 HydrophobicContact CG2-CB 3.77Å; I261-L294 HydrophobicContact CG2-CD2 3.83Å; I261-L294 HydrophobicContact CG2-CG 4.27Å; I261-L294 CarbonylContact O-C 3.56Å; I261-L294 VanDerWaalsContact O-CA 3.28Å; I261-L294 WeakPolarHBondContact O-CA 3.46Å; I261-V295 PolarHBondContact O-N 3.2Å; I261-F320 HydrophobicContact CD1-CE1 4.3Å
262	V	62	Low	49	Very low	61 Å²	61	83.3 Å²	83.3	37%	0.37	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.9	108.2	-179.7	-171.2	0	0	0	0	110.3	Y293 L294	V262-Y293 WeakPolarHBondContact CA-O 3.26Å; V262-L294 HydrophobicContact CB-CD2 4.32Å; V262-L294 HydrophobicContact CG2-CD2 3.67Å
263	Q	68.2	Low	48.4	Very low	77 Å²	77	84.6 Å²	84.6	36%	0.36	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.8	145.3	176.6	-61.7	-172.5	12.8	0	0	110.7	S260 I261 R292 Y293 V295	S260-Q263 PolarHBondContact O-NE2 2.89Å; S260-Q263 VanDerWaalsContact O-NE2 3.11Å; I261-Q263 PolarHBondContact O-N 2.92Å; Q263-R292 CarbonylContact O-C 3.59Å; Q263-R292 WeakPolarHBondContact O-CA 3.4Å; Q263-Y293 HydrophobicContact CB-CD1 4.07Å; Q263-Y293 HydrophobicContact CB-CE1 3.63Å; Q263-Y293 HydrophobicContact CB-CE2 4.15Å; Q263-Y293 HydrophobicContact CB-CG 4.49Å; Q263-Y293 PolarHBondContact N-O 3.23Å; Q263-Y293 WeakPolarHBondContact O-CD1 3.39Å; Q263-Y293 PolarHBondContact O-N 3.38Å; Q263-Y293 PolarHBondContact OE1-OH 2.83Å; Q263-V295 HydrophobicContact CG-CG2 4.16Å
264	A	59.1	Low	47.9	Very low	82 Å²	82	88.2 Å²	88.2	68%	0.678	61%	0.606	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88.7	125.5	170.5	0	0	0	0	0	109.1	A266	A264-A266 VanDerWaalsContact C-N 3.3Å; A264-A266 PolarHBondContact O-N 2.95Å
265	A	55.9	Low	47.7	Very low	29 Å²	29	91.9 Å²	91.9	24%	0.24	62%	0.622	C	S	.	*			trans	-71.8	91.7	167.1	0	0	0	0	0	107.9	G267 P280 G291 Y293	A265-G267 PolarHBondContact O-N 3.42Å; A265-P280 HydrophobicContact CB-CG 4.29Å; A265-G291 WeakPolarHBondContact CB-O 3.34Å; A265-G291 PolarHBondContact N-O 3.26Å; A265-Y293 HydrophobicContact CB-CD1 3.97Å; A265-Y293 HydrophobicContact CB-CE1 3.94Å
266	A	46.6	Very low	47.9	Very low	92 Å²	92	91.5 Å²	91.5	76%	0.76	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-57.3	125.2	-178.1	0	0	0	0	0	110.4	A264	A264-A266 VanDerWaalsContact C-N 3.3Å; A264-A266 PolarHBondContact O-N 2.95Å
267	G	44.1	Very low	48.2	Very low	64 Å²	64	88.4 Å²	88.4	66%	0.66	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-59.4	137.4	165.8	0	0	0	0	0	109.1	A265 V269	A265-G267 PolarHBondContact O-N 3.42Å; G267-V269 PolarHBondContact O-N 3.01Å
268	G	38.7	Very low	49.4	Very low	82 Å²	82	93.1 Å²	93.1	85%	0.845	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-59	122.5	-166.7	0	0	0	0	0	113.8
269	V	38.7	Very low	50.7	Low	131 Å²	131	90.7 Å²	90.7	79%	0.794	65%	0.649	S	S	*	*			trans	-106.8	130.5	164.2	179.7	0	0	0	0	107.5	G267 G271	G267-V269 PolarHBondContact O-N 3.01Å; V269-G271 PolarHBondContact O-N 3.21Å
270	P	42.8	Very low	52.5	Low	136 Å²	136	86.4 Å²	86.4	88%	0.883	62%	0.623	S	S	*	*	S	Bend	trans	-82.1	105.6	-174.9	30.8	-33.7	0	0	0	112.5
271	G	40.9	Very low	54.4	Low	78 Å²	78	87.6 Å²	87.6	80%	0.804	63%	0.627	S	S	*	*			trans	147.2	132.1	162.7	0	0	0	0	0	114.8	V269	V269-G271 PolarHBondContact O-N 3.21Å
272	G	34.9	Very low	55.7	Low	81 Å²	81	87.4 Å²	87.4	84%	0.835	63%	0.627	S	S	*	*			trans	118.2	61.7	165.2	0	0	0	0	0	118.2
273	G	39.1	Very low	57	Low	73 Å²	73	88.6 Å²	88.6	75%	0.753	63%	0.628	S	S	*	*			trans	40.8	118.2	147	0	0	0	0	0	122.7
274	S	45	Very low	57.8	Low	114 Å²	114	90.2 Å²	90.2	80%	0.797	64%	0.635	S	S	*	*			trans	64.3	119.9	154.2	-61.6	0	0	0	0	118.1
275	N	45.4	Very low	59.2	Low	149 Å²	149	87.8 Å²	87.8	80%	0.797	61%	0.613	S	S	*	*	S	Bend	cis	-149.3	155.8	5.6	-93.7	-44.7	0	0	0	111.3
276	N	48.2	Very low	60.8	Low	131 Å²	131	93.4 Å²	93.4	70%	0.701	63%	0.634	S	S	*	*			trans	57.6	71	175.2	-78	-48.5	0	0	0	116.5	K278	N276-K278 PolarHBondContact O-N 3.26Å
277	G	54.1	Low	62.8	Low	94 Å²	94	95.8 Å²	95.8	97%	0.969	63%	0.628	S	S	*	*			trans	-69.6	52.4	163.9	0	0	0	0	0	114.4
278	K	69.6	Low	64.8	Low	172 Å²	172	95.9 Å²	95.9	75%	0.748	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-90.8	125.9	170.3	-67.7	-177.6	-179.4	178.8	0	108.7	N276	N276-K278 PolarHBondContact O-N 3.26Å
279	T	77.1	Confident	67.1	Low	85 Å²	85	92 Å²	92	52%	0.521	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-59.5	129.7	177.6	-37.5	0	0	0	0	109.5	V281 V288	T279-V281 PolarHBondContact O-N 3.07Å; T279-V288 HydrophobicContact CG2-CG1 3.35Å
280	P	83.6	Confident	69.2	Low	29 Å²	29	95.6 Å²	95.6	19%	0.188	57%	0.574	C	S	.	*	P	Polyproline II helix	trans	-62.1	131.4	-172.7	23.4	-33.9	0	0	0	111	A265 I289 Y293 A300	A265-P280 HydrophobicContact CB-CG 4.29Å; P280-I289 HydrophobicContact CB-CD1 4.41Å; P280-I289 HydrophobicContact CG-CB 4.49Å; P280-I289 PolarHBondContact O-N 3.36Å; P280-Y293 HydrophobicContact CB-CD2 4.29Å; P280-Y293 HydrophobicContact CB-CE2 4.09Å; P280-Y293 HydrophobicContact CG-CD1 4.33Å; P280-Y293 HydrophobicContact CG-CD2 4.44Å; P280-Y293 HydrophobicContact CG-CE1 4.17Å; P280-Y293 HydrophobicContact CG-CE2 4.24Å; P280-Y293 HydrophobicContact CG-CG 4.47Å; P280-A300 HydrophobicContact CB-CB 4.08Å
281	V	88.9	Confident	71	Confident	74 Å²	74	91 Å²	91	45%	0.448	55%	0.551	S	S	.	*	B	Isolated β-bridge	trans	-104.5	132.3	177	179.1	0	0	0	0	108.3	T279 H283 H286 V288	T279-V281 PolarHBondContact O-N 3.07Å; V281-H283 PolarHBondContact O-N 2.91Å; V281-H286 WeakPolarHBondContact CG1-O 3.39Å; V281-V288 HydrophobicContact CG2-CG2 4.25Å
282	C	88.1	Confident	73	Confident	1 Å²	1	93 Å²	93	1%	0.007	54%	0.535	C	S	.	.	B	Isolated β-bridge	trans	-67.1	125.8	178.1	179.6	0	0	0	0	110.7	Q284 C285 H286 K287 I289 A300 H302	C282-Q284 VanDerWaalsContact C-N 3.27Å; C282-Q284 PolarHBondContact O-N 3.18Å; C282-Q284 PolarHBondContact SG-N 3.37Å; C282-Q284 VanDerWaalsContact SG-N 3.45Å; C282-C285 VanDerWaalsContact SG-SG 3.65Å; C282-H286 WeakPolarHBondContact O-CA 3.35Å; C282-H286 PolarHBondContact O-N 2.87Å; C282-K287 PolarHBondContact N-O 3.12Å; C282-I289 HydrophobicContact CB-CD1 3.96Å; C282-I289 HydrophobicContact CB-CG1 3.82Å; C282-A300 CarbonylContact C-O 3.56Å; C282-A300 WeakPolarHBondContact CA-O 3.26Å; C282-H302 VanDerWaalsContact CB-ND1 3.34Å; C282-H302 WeakPolarHBondContact CB-ND1 3.26Å; C282-H302 PolarHBondContact SG-ND1 2.85Å; C282-H302 VanDerWaalsContact SG-ND1 3.43Å
283	H	87.3	Confident	75.3	Confident	87 Å²	87	91 Å²	91	40%	0.403	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-33.7	177.2	-175.8	102.8	0	0	0	112.3	V281 H286 H299 A300 Y301	V281-H283 PolarHBondContact O-N 2.91Å; H283-H286 PolarHBondContact O-CE1 3.25Å; H283-H286 PolarHBondContact O-ND1 3.03Å; H283-H299 HydrophobicContact CB-CB 4.03Å; H283-H299 AromaticContact CE1-CD2 3.32Å; H283-H299 PolarHBondContact CE1-CD2 3.47Å; H283-H299 AromaticContact CE1-NE2 3.35Å; H283-H299 PolarHBondContact CE1-NE2 3.1Å; H283-H299 AromaticContact CG-CD2 3.81Å; H283-H299 AromaticContact ND1-CD2 3.11Å; H283-H299 PolarHBondContact ND1-CD2 3.21Å; H283-H299 AromaticContact ND1-CE1 3.95Å; H283-H299 AromaticContact ND1-CG 3.5Å; H283-H299 AromaticContact ND1-NE2 3.4Å; H283-H299 PolarHBondContact ND1-NE2 3.16Å; H283-A300 PolarHBondContact N-O 3.41Å; H283-Y301 HydrophobicContact CB-CD1 4.39Å; H283-Y301 HydrophobicContact CB-CE1 3.83Å
284	Q	85.6	Confident	77.4	Confident	110 Å²	110	87.5 Å²	87.5	51%	0.514	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-38.6	-175.3	-171.5	56.9	43.8	0	0	114.2	C282 Y301 E305	C282-Q284 VanDerWaalsContact C-N 3.27Å; C282-Q284 PolarHBondContact O-N 3.18Å; C282-Q284 PolarHBondContact SG-N 3.37Å; C282-Q284 VanDerWaalsContact SG-N 3.45Å; Q284-Y301 HydrophobicContact CB-CD1 4.22Å; Q284-E305 HydrophobicContact CB-CB 4.08Å; Q284-E305 HydrophobicContact CG-CB 4.2Å; Q284-E305 WeakPolarHBondContact CG-OE2 3.44Å
285	C	89.4	Confident	79.2	Confident	32 Å²	32	84.3 Å²	84.3	22%	0.216	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	5.9	-175	70	0	0	0	0	114.6	C282 K287 H302	C282-C285 VanDerWaalsContact SG-SG 3.65Å; C285-K287 PolarHBondContact O-N 3.14Å; C285-H302 VanDerWaalsContact SG-CE1 3.56Å; C285-H302 PolarHBondContact SG-ND1 3.07Å; C285-H302 VanDerWaalsContact SG-ND1 3.43Å
286	H	88.3	Confident	80.7	Confident	146 Å²	146	77.5 Å²	77.5	68%	0.676	41%	0.406	S	S	*	.			trans	54.1	15.2	176.7	-53.1	-45.1	0	0	0	116.4	V281 C282 H283	V281-H286 WeakPolarHBondContact CG1-O 3.39Å; C282-H286 WeakPolarHBondContact O-CA 3.35Å; C282-H286 PolarHBondContact O-N 2.87Å; H283-H286 PolarHBondContact O-CE1 3.25Å; H283-H286 PolarHBondContact O-ND1 3.03Å
287	K	88.4	Confident	82.1	Confident	143 Å²	143	74.9 Å²	74.9	62%	0.622	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-91.5	148.5	176.4	-69	165	-171.3	171.7	0	111.4	C282 C285 I289	C282-K287 PolarHBondContact N-O 3.12Å; C285-K287 PolarHBondContact O-N 3.14Å; K287-I289 PolarHBondContact O-N 3.14Å
288	V	87.7	Confident	83.3	Confident	65 Å²	65	74 Å²	74	39%	0.394	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-67	119.8	173.1	179.9	0	0	0	0	109.7	T279 V281	T279-V288 HydrophobicContact CG2-CG1 3.35Å; V281-V288 HydrophobicContact CG2-CG2 4.25Å
289	I	85.6	Confident	84.1	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-77	139.8	-179.8	-49.7	165.1	0	0	0	109.5	P280 C282 K287 A300	P280-I289 HydrophobicContact CB-CD1 4.41Å; P280-I289 HydrophobicContact CG-CB 4.49Å; P280-I289 PolarHBondContact O-N 3.36Å; C282-I289 HydrophobicContact CB-CD1 3.96Å; C282-I289 HydrophobicContact CB-CG1 3.82Å; K287-I289 PolarHBondContact O-N 3.14Å; I289-A300 HydrophobicContact CD1-CB 3.94Å
290	R	84.1	Confident	84.5	Confident	207 Å²	207	66.5 Å²	66.5	78%	0.781	35%	0.347	S	S	*	.			trans	-130.7	122.6	173.4	-72.8	-176.8	164.1	82.4	-1.8	109.6
291	G	80.5	Confident	84.7	Confident	39 Å²	39	66 Å²	66	40%	0.402	34%	0.341	S	S	.	.	S	Bend	trans	101	-141.9	-175.6	0	0	0	0	0	113	A265	A265-G291 WeakPolarHBondContact CB-O 3.34Å; A265-G291 PolarHBondContact N-O 3.26Å
292	R	81.5	Confident	84.7	Confident	120 Å²	120	64.1 Å²	64.1	45%	0.453	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	136.3	178.5	56.4	175.3	-66.8	-152.2	-3.3	111.3	Q263 P303 E316	Q263-R292 CarbonylContact O-C 3.59Å; Q263-R292 WeakPolarHBondContact O-CA 3.4Å; R292-P303 HydrophobicContact CG-CG 3.99Å; R292-E316 IonicContact CZ-OE2 2.73Å; R292-E316 IonicContact NH1-OE2 2.84Å; R292-E316 PolarHBondContact NH1-OE2 3.04Å; R292-E316 IonicContact NH2-OE2 2.71Å; R292-E316 PolarHBondContact NH2-OE2 3.34Å
293	Y	83.2	Confident	84.5	Confident	38 Å²	38	64.3 Å²	64.3	15%	0.149	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	159.9	175.3	67.8	-76.8	0	0	0	111.1	V262 Q263 A265 P280 V295 A300 Y301	V262-Y293 WeakPolarHBondContact CA-O 3.26Å; Q263-Y293 HydrophobicContact CB-CD1 4.07Å; Q263-Y293 HydrophobicContact CB-CE1 3.63Å; Q263-Y293 HydrophobicContact CB-CE2 4.15Å; Q263-Y293 HydrophobicContact CB-CG 4.49Å; Q263-Y293 PolarHBondContact N-O 3.23Å; Q263-Y293 WeakPolarHBondContact O-CD1 3.39Å; Q263-Y293 PolarHBondContact O-N 3.38Å; Q263-Y293 PolarHBondContact OE1-OH 2.83Å; A265-Y293 HydrophobicContact CB-CD1 3.97Å; A265-Y293 HydrophobicContact CB-CE1 3.94Å; P280-Y293 HydrophobicContact CB-CD2 4.29Å; P280-Y293 HydrophobicContact CB-CE2 4.09Å; P280-Y293 HydrophobicContact CG-CD1 4.33Å; P280-Y293 HydrophobicContact CG-CD2 4.44Å; P280-Y293 HydrophobicContact CG-CE1 4.17Å; P280-Y293 HydrophobicContact CG-CE2 4.24Å; P280-Y293 HydrophobicContact CG-CG 4.47Å; Y293-V295 HydrophobicContact CD2-CG2 3.69Å; Y293-V295 HydrophobicContact CE2-CG2 3.37Å; Y293-A300 HydrophobicContact CD2-CB 3.95Å; Y293-A300 HydrophobicContact CE2-CB 4.33Å; Y293-Y301 WeakPolarHBondContact CA-O 3.42Å
294	L	84.2	Confident	84.5	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.6	176.7	-58.5	-178.4	0	0	0	109.6	I261 V262 A300 Y301 P303 F306 E316	I261-L294 HydrophobicContact CG2-CB 3.77Å; I261-L294 HydrophobicContact CG2-CD2 3.83Å; I261-L294 HydrophobicContact CG2-CG 4.27Å; I261-L294 CarbonylContact O-C 3.56Å; I261-L294 VanDerWaalsContact O-CA 3.28Å; I261-L294 WeakPolarHBondContact O-CA 3.46Å; V262-L294 HydrophobicContact CB-CD2 4.32Å; V262-L294 HydrophobicContact CG2-CD2 3.67Å; L294-A300 CarbonylContact O-C 3.6Å; L294-A300 WeakPolarHBondContact O-CA 3.45Å; L294-Y301 PolarHBondContact N-O 3.48Å; L294-Y301 PolarHBondContact O-N 2.97Å; L294-P303 HydrophobicContact CD1-CB 4.36Å; L294-P303 HydrophobicContact CG-CB 4.45Å; L294-F306 HydrophobicContact CD1-CB 3.51Å; L294-F306 HydrophobicContact CD1-CD1 3.82Å; L294-F306 HydrophobicContact CD1-CG 3.92Å; L294-E316 HydrophobicContact CD1-CB 4.28Å; L294-E316 HydrophobicContact CD2-CB 4.42Å
295	V	82.6	Confident	84.5	Confident	47 Å²	47	64.6 Å²	64.6	29%	0.285	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.7	173.9	-178.4	0	0	0	0	109.7	I261 Q263 Y293 H299	I261-V295 PolarHBondContact O-N 3.2Å; Q263-V295 HydrophobicContact CG-CG2 4.16Å; Y293-V295 HydrophobicContact CD2-CG2 3.69Å; Y293-V295 HydrophobicContact CE2-CG2 3.37Å; V295-H299 WeakPolarHBondContact CA-O 3.28Å
296	A	77.8	Confident	84.5	Confident	6 Å²	6	63.1 Å²	63.1	5%	0.05	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	143.9	-180	0	0	0	0	0	109.5	G298 H299 Y301 F306 F320	A296-G298 PolarHBondContact O-N 3.43Å; A296-H299 PolarHBondContact N-O 3.43Å; A296-H299 WeakPolarHBondContact O-CA 3.08Å; A296-H299 PolarHBondContact O-N 2.81Å; A296-Y301 HydrophobicContact CB-CD2 4.5Å; A296-Y301 HydrophobicContact CB-CE2 4.32Å; A296-F306 HydrophobicContact CB-CD2 4.43Å; A296-F306 HydrophobicContact CB-CE1 4.45Å; A296-F306 HydrophobicContact CB-CE2 3.47Å; A296-F306 VanDerWaalsContact CB-CE2 3.47Å; A296-F306 HydrophobicContact CB-CZ 3.5Å; A296-F306 VanDerWaalsContact CB-CZ 3.5Å; A296-F320 HydrophobicContact CB-CE1 4.32Å; A296-F320 HydrophobicContact CB-CZ 3.83Å
297	L	77.7	Confident	84.5	Confident	77 Å²	77	58.3 Å²	58.3	40%	0.403	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	28.1	173.1	-50.3	176.2	0	0	0	114.8	H299 F320 E322 I327	L297-H299 VanDerWaalsContact C-N 3.3Å; L297-F320 HydrophobicContact CD1-CE2 4.33Å; L297-F320 HydrophobicContact CD2-CE2 4.01Å; L297-F320 HydrophobicContact CD2-CZ 4.44Å; L297-F320 HydrophobicContact CG-CE2 4.11Å; L297-F320 HydrophobicContact CG-CZ 4.48Å; L297-E322 HydrophobicContact CD1-CB 4.09Å; L297-E322 HydrophobicContact CD1-CG 3.61Å; L297-E322 HydrophobicContact CD2-CB 4.28Å; L297-E322 HydrophobicContact CD2-CG 4.48Å; L297-E322 WeakPolarHBondContact CD2-OE2 3.34Å; L297-I327 HydrophobicContact CD1-CG2 3.93Å
298	G	78.8	Confident	84.6	Confident	74 Å²	74	51.6 Å²	51.6	76%	0.763	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	11.1	-175.5	0	0	0	0	0	114.8	A296	A296-G298 PolarHBondContact O-N 3.43Å
299	H	85.2	Confident	84.8	Confident	84 Å²	84	52.4 Å²	52.4	39%	0.389	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156	-175.5	-66.5	-21.3	0	0	0	112.1	H283 V295 A296 L297 Y301	H283-H299 HydrophobicContact CB-CB 4.03Å; H283-H299 AromaticContact CE1-CD2 3.32Å; H283-H299 PolarHBondContact CE1-CD2 3.47Å; H283-H299 AromaticContact CE1-NE2 3.35Å; H283-H299 PolarHBondContact CE1-NE2 3.1Å; H283-H299 AromaticContact CG-CD2 3.81Å; H283-H299 AromaticContact ND1-CD2 3.11Å; H283-H299 PolarHBondContact ND1-CD2 3.21Å; H283-H299 AromaticContact ND1-CE1 3.95Å; H283-H299 AromaticContact ND1-CG 3.5Å; H283-H299 AromaticContact ND1-NE2 3.4Å; H283-H299 PolarHBondContact ND1-NE2 3.16Å; V295-H299 WeakPolarHBondContact CA-O 3.28Å; A296-H299 PolarHBondContact N-O 3.43Å; A296-H299 WeakPolarHBondContact O-CA 3.08Å; A296-H299 PolarHBondContact O-N 2.81Å; L297-H299 VanDerWaalsContact C-N 3.3Å; H299-Y301 HydrophobicContact CB-CE2 3.61Å
300	A	86.9	Confident	84.9	Confident	16 Å²	16	56.7 Å²	56.7	13%	0.132	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	141.4	177.2	0	0	0	0	0	111.1	P280 C282 H283 I289 Y293 L294	P280-A300 HydrophobicContact CB-CB 4.08Å; C282-A300 CarbonylContact C-O 3.56Å; C282-A300 WeakPolarHBondContact CA-O 3.26Å; H283-A300 PolarHBondContact N-O 3.41Å; I289-A300 HydrophobicContact CD1-CB 3.94Å; Y293-A300 HydrophobicContact CD2-CB 3.95Å; Y293-A300 HydrophobicContact CE2-CB 4.33Å; L294-A300 CarbonylContact O-C 3.6Å; L294-A300 WeakPolarHBondContact O-CA 3.45Å
301	Y	87.8	Confident	85.2	Confident	20 Å²	20	50.1 Å²	50.1	8%	0.078	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.6	-179	-59.1	-94.7	0	0	0	111	H283 Q284 Y293 L294 A296 H299 F306	H283-Y301 HydrophobicContact CB-CD1 4.39Å; H283-Y301 HydrophobicContact CB-CE1 3.83Å; Q284-Y301 HydrophobicContact CB-CD1 4.22Å; Y293-Y301 WeakPolarHBondContact CA-O 3.42Å; L294-Y301 PolarHBondContact N-O 3.48Å; L294-Y301 PolarHBondContact O-N 2.97Å; A296-Y301 HydrophobicContact CB-CD2 4.5Å; A296-Y301 HydrophobicContact CB-CE2 4.32Å; H299-Y301 HydrophobicContact CB-CE2 3.61Å; Y301-F306 HydrophobicContact CD1-CD2 4.21Å; Y301-F306 AromaticContact CD2-CD2 3.84Å; Y301-F306 HydrophobicContact CD2-CD2 3.84Å; Y301-F306 HydrophobicContact CD2-CE2 4.22Å; Y301-F306 HydrophobicContact CE2-CD2 4.24Å; Y301-F306 HydrophobicContact CE2-CE2 4.27Å; Y301-F306 AromaticContact CG-CD2 3.84Å; Y301-F306 HydrophobicContact CG-CD2 3.84Å
302	H	87.7	Confident	85.6	Confident	34 Å²	34	50.7 Å²	50.7	16%	0.157	29%	0.292	C	S	.	.			trans	-68.3	149.5	160.6	-63.6	99.2	0	0	0	108.9	C282 C285 E304 E305 F306	C282-H302 VanDerWaalsContact CB-ND1 3.34Å; C282-H302 WeakPolarHBondContact CB-ND1 3.26Å; C282-H302 PolarHBondContact SG-ND1 2.85Å; C282-H302 VanDerWaalsContact SG-ND1 3.43Å; C285-H302 VanDerWaalsContact SG-CE1 3.56Å; C285-H302 PolarHBondContact SG-ND1 3.07Å; C285-H302 VanDerWaalsContact SG-ND1 3.43Å; H302-E304 VanDerWaalsContact C-N 3.29Å; H302-E304 PolarHBondContact O-N 3.42Å; H302-E305 HydrophobicContact CB-CB 4.18Å; H302-E305 HydrophobicContact CB-CG 3.78Å; H302-E305 PolarHBondContact O-N 3.41Å; H302-E305 VanDerWaalsContact O-N 3.12Å; H302-F306 PolarHBondContact O-N 3.06Å
303	P	83.8	Confident	85.9	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.032	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-54.5	-44.5	175.8	-22.5	31.8	0	0	0	112.9	R292 L294 E305 F306 V314	R292-P303 HydrophobicContact CG-CG 3.99Å; L294-P303 HydrophobicContact CD1-CB 4.36Å; L294-P303 HydrophobicContact CG-CB 4.45Å; P303-E305 VanDerWaalsContact C-N 3.25Å; P303-E305 PolarHBondContact O-N 3.24Å; P303-F306 PolarHBondContact O-N 3.43Å; P303-V314 VanDerWaalsContact O-CG1 3.24Å; P303-V314 WeakPolarHBondContact O-CG1 3.49Å
304	E	86.9	Confident	86.2	Confident	131 Å²	131	52 Å²	52	61%	0.612	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-63.3	-26.3	179	-49.3	80.4	-104	0	0	114	H302 V307	H302-E304 VanDerWaalsContact C-N 3.29Å; H302-E304 PolarHBondContact O-N 3.42Å; E304-V307 VanDerWaalsContact O-CG1 3.31Å; E304-V307 WeakPolarHBondContact O-CG1 3.29Å
305	E	86.6	Confident	86.2	Confident	72 Å²	72	52.5 Å²	52.5	34%	0.336	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-92.4	-15.6	-173.9	-62.2	-82.9	-166.6	0	0	112.6	Q284 H302 P303 V307	Q284-E305 HydrophobicContact CB-CB 4.08Å; Q284-E305 HydrophobicContact CG-CB 4.2Å; Q284-E305 WeakPolarHBondContact CG-OE2 3.44Å; H302-E305 HydrophobicContact CB-CB 4.18Å; H302-E305 HydrophobicContact CB-CG 3.78Å; H302-E305 PolarHBondContact O-N 3.41Å; H302-E305 VanDerWaalsContact O-N 3.12Å; P303-E305 VanDerWaalsContact C-N 3.25Å; P303-E305 PolarHBondContact O-N 3.24Å; E305-V307 VanDerWaalsContact C-N 3.3Å; E305-V307 PolarHBondContact O-N 3.07Å
306	F	88.6	Confident	85.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.311	C	S	.	.			trans	-86.8	69.2	-179.2	-165.8	-111.2	0	0	0	111.1	L294 A296 Y301 H302 P303 L315 F320 I327	L294-F306 HydrophobicContact CD1-CB 3.51Å; L294-F306 HydrophobicContact CD1-CD1 3.82Å; L294-F306 HydrophobicContact CD1-CG 3.92Å; A296-F306 HydrophobicContact CB-CD2 4.43Å; A296-F306 HydrophobicContact CB-CE1 4.45Å; A296-F306 HydrophobicContact CB-CE2 3.47Å; A296-F306 VanDerWaalsContact CB-CE2 3.47Å; A296-F306 HydrophobicContact CB-CZ 3.5Å; A296-F306 VanDerWaalsContact CB-CZ 3.5Å; Y301-F306 HydrophobicContact CD1-CD2 4.21Å; Y301-F306 AromaticContact CD2-CD2 3.84Å; Y301-F306 HydrophobicContact CD2-CD2 3.84Å; Y301-F306 HydrophobicContact CD2-CE2 4.22Å; Y301-F306 HydrophobicContact CE2-CD2 4.24Å; Y301-F306 HydrophobicContact CE2-CE2 4.27Å; Y301-F306 AromaticContact CG-CD2 3.84Å; Y301-F306 HydrophobicContact CG-CD2 3.84Å; H302-F306 PolarHBondContact O-N 3.06Å; P303-F306 PolarHBondContact O-N 3.43Å; F306-L315 HydrophobicContact CD1-CB 3.77Å; F306-L315 HydrophobicContact CE1-CB 3.82Å; F306-L315 PolarHBondContact O-N 2.7Å; F306-F320 AromaticContact CE1-CD1 3.91Å; F306-F320 HydrophobicContact CE1-CD1 3.91Å; F306-F320 HydrophobicContact CE1-CE1 4.09Å; F306-F320 HydrophobicContact CE1-CG 4.33Å; F306-F320 AromaticContact CZ-CD1 3.85Å; F306-F320 HydrophobicContact CZ-CD1 3.85Å; F306-F320 HydrophobicContact CZ-CD2 4.18Å; F306-F320 AromaticContact CZ-CE1 3.76Å; F306-F320 HydrophobicContact CZ-CE1 3.76Å; F306-F320 HydrophobicContact CZ-CE2 4.09Å; F306-F320 HydrophobicContact CZ-CG 4.07Å; F306-F320 AromaticContact CZ-CZ 3.89Å; F306-F320 HydrophobicContact CZ-CZ 3.89Å; F306-I327 HydrophobicContact CD1-CD1 4.42Å; F306-I327 HydrophobicContact CD2-CD1 3.51Å; F306-I327 HydrophobicContact CE1-CD1 4.32Å; F306-I327 HydrophobicContact CE2-CD1 3.39Å; F306-I327 HydrophobicContact CG-CD1 4.03Å; F306-I327 HydrophobicContact CZ-CD1 3.82Å
307	V	89.9	Confident	85.2	Confident	46 Å²	46	61.7 Å²	61.7	28%	0.279	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-107.6	147.3	-171	-66	0	0	0	0	113.5	E304 E305 S309 G312 K313 V314 I327	E304-V307 VanDerWaalsContact O-CG1 3.31Å; E304-V307 WeakPolarHBondContact O-CG1 3.29Å; E305-V307 VanDerWaalsContact C-N 3.3Å; E305-V307 PolarHBondContact O-N 3.07Å; V307-S309 PolarHBondContact O-N 2.81Å; V307-G312 VanDerWaalsContact CG1-O 3.29Å; V307-G312 WeakPolarHBondContact CG1-O 3.47Å; V307-K313 WeakPolarHBondContact CA-O 3.45Å; V307-V314 HydrophobicContact CG1-CG2 3.78Å; V307-I327 WeakPolarHBondContact O-CD1 3.29Å; V307-I327 WeakPolarHBondContact O-CG1 3.36Å
308	C	89.9	Confident	84.7	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.007	34%	0.336	C	S	.	.			trans	-60.3	117.5	168.7	174.9	0	0	0	0	110.7	Q310 C311 G312 K313 L315 C329	C308-Q310 PolarHBondContact O-N 3.15Å; C308-C311 PolarHBondContact O-N 2.85Å; C308-C311 VanDerWaalsContact O-N 3.08Å; C308-G312 PolarHBondContact O-N 3.25Å; C308-K313 PolarHBondContact N-O 2.73Å; C308-L315 HydrophobicContact CB-CD1 4.12Å; C308-L315 HydrophobicContact CB-CD2 4.17Å; C308-L315 HydrophobicContact CB-CG 4.41Å; C308-C329 HydrophobicContact CB-CB 4.01Å; C308-C329 PolarHBondContact SG-N 3.38Å; C308-C329 VanDerWaalsContact SG-SG 3.61Å
309	S	90.7	Very high	84.7	Confident	83 Å²	83	56.2 Å²	56.2	58%	0.58	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-19.2	-178.8	155.4	0	0	0	0	114.2	V307 I327 F328	V307-S309 PolarHBondContact O-N 2.81Å; S309-I327 PolarHBondContact N-O 3.27Å; S309-F328 WeakPolarHBondContact OG-CE1 3.35Å
310	Q	88.6	Confident	84.7	Confident	90 Å²	90	52.7 Å²	52.7	42%	0.421	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-17.8	179.8	-176	169.4	-24.6	0	0	114.7	C308 F328 C332	C308-Q310 PolarHBondContact O-N 3.15Å; Q310-F328 HydrophobicContact CB-CD1 3.97Å; Q310-F328 HydrophobicContact CB-CE1 4.15Å; Q310-C332 HydrophobicContact CB-CB 4.01Å; Q310-C332 HydrophobicContact CG-CB 4.16Å
311	C	90.8	Very high	84.5	Confident	70 Å²	70	52.8 Å²	52.8	47%	0.473	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142	4.1	-176.9	71.4	0	0	0	0	116.1	C308 K313 C332	C308-C311 PolarHBondContact O-N 2.85Å; C308-C311 VanDerWaalsContact O-N 3.08Å; C311-K313 PolarHBondContact O-N 3.17Å; C311-C332 VanDerWaalsContact SG-SG 3.69Å
312	G	88.5	Confident	84.4	Confident	51 Å²	51	56.4 Å²	56.4	53%	0.526	31%	0.307	S	S	.	.			trans	67.9	-3.1	177.8	0	0	0	0	0	115.5	V307 C308 V314	V307-G312 VanDerWaalsContact CG1-O 3.29Å; V307-G312 WeakPolarHBondContact CG1-O 3.47Å; C308-G312 PolarHBondContact O-N 3.25Å; G312-V314 PolarHBondContact O-N 3.44Å
313	K	88.4	Confident	84.1	Confident	140 Å²	140	57 Å²	57	61%	0.609	31%	0.31	S	S	*	.			trans	-68.8	125.7	178.8	-166.2	-166.1	169.8	-176.1	0	110.5	V307 C308 C311 L315	V307-K313 WeakPolarHBondContact CA-O 3.45Å; C308-K313 PolarHBondContact N-O 2.73Å; C311-K313 PolarHBondContact O-N 3.17Å; K313-L315 WeakPolarHBondContact O-CD2 3.35Å
314	V	87.8	Confident	84	Confident	44 Å²	44	66.1 Å²	66.1	27%	0.267	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-54.8	137.3	167.9	171.5	0	0	0	0	111.2	P303 V307 G312 E316	P303-V314 VanDerWaalsContact O-CG1 3.24Å; P303-V314 WeakPolarHBondContact O-CG1 3.49Å; V307-V314 HydrophobicContact CG1-CG2 3.78Å; G312-V314 PolarHBondContact O-N 3.44Å; V314-E316 HydrophobicContact CG1-CB 3.91Å; V314-E316 HydrophobicContact CG1-CG 3.94Å
315	L	85.8	Confident	83.6	Confident	12 Å²	12	63 Å²	63	6%	0.063	35%	0.352	C	S	.	.			trans	-111.8	35.2	-175.2	-51.3	-178.6	0	0	0	112.4	F306 C308 K313 E317 F320 I327 C329	F306-L315 HydrophobicContact CD1-CB 3.77Å; F306-L315 HydrophobicContact CE1-CB 3.82Å; F306-L315 PolarHBondContact O-N 2.7Å; C308-L315 HydrophobicContact CB-CD1 4.12Å; C308-L315 HydrophobicContact CB-CD2 4.17Å; C308-L315 HydrophobicContact CB-CG 4.41Å; K313-L315 WeakPolarHBondContact O-CD2 3.35Å; L315-E317 VanDerWaalsContact C-N 3.33Å; L315-F320 HydrophobicContact CD1-CB 3.81Å; L315-I327 HydrophobicContact CD1-CD1 4.41Å; L315-C329 HydrophobicContact CD2-CB 3.62Å
316	E	72.4	Confident	83.6	Confident	75 Å²	75	60.9 Å²	60.9	35%	0.35	35%	0.347	S	S	.	.	S	Bend	trans	-63.2	-36.2	175	68.4	-174.6	149.9	0	0	112.7	R292 L294 V314	R292-E316 IonicContact CZ-OE2 2.73Å; R292-E316 IonicContact NH1-OE2 2.84Å; R292-E316 PolarHBondContact NH1-OE2 3.04Å; R292-E316 IonicContact NH2-OE2 2.71Å; R292-E316 PolarHBondContact NH2-OE2 3.34Å; L294-E316 HydrophobicContact CD1-CB 4.28Å; L294-E316 HydrophobicContact CD2-CB 4.42Å; V314-E316 HydrophobicContact CG1-CB 3.91Å; V314-E316 HydrophobicContact CG1-CG 3.94Å
317	E	67.4	Low	83.4	Confident	170 Å²	170	61.9 Å²	61.9	79%	0.794	35%	0.352	S	S	*	.	S	Bend	trans	-120.6	108.2	178.5	-77.7	-166	173	0	0	111.7	L315	L315-E317 VanDerWaalsContact C-N 3.33Å
318	G	67.1	Low	83.3	Confident	19 Å²	19	60.1 Å²	60.1	20%	0.196	34%	0.34	C	S	.	.	S	Bend	trans	141.9	-158.1	170	0	0	0	0	0	113.2
319	G	77.9	Confident	83.1	Confident	17 Å²	17	60.6 Å²	60.6	18%	0.175	34%	0.344	C	S	.	.			trans	-97.3	155.5	167.6	0	0	0	0	0	111.3	P252 P330	P252-G319 VanDerWaalsContact CB-CA 3.41Å; G319-P330 WeakPolarHBondContact O-CD 3.35Å
320	F	84.7	Confident	82.8	Confident	10 Å²	10	58 Å²	58	4%	0.044	33%	0.325	C	S	.	.			trans	-133.6	158.7	166.5	64.8	-86.8	0	0	0	109.6	T253 I261 A296 L297 F306 L315 I327 F328	T253-F320 HydrophobicContact CG2-CD1 4.47Å; T253-F320 HydrophobicContact CG2-CE1 3.77Å; T253-F320 HydrophobicContact CG2-CE2 4.26Å; T253-F320 HydrophobicContact CG2-CZ 3.64Å; I261-F320 HydrophobicContact CD1-CE1 4.3Å; A296-F320 HydrophobicContact CB-CE1 4.32Å; A296-F320 HydrophobicContact CB-CZ 3.83Å; L297-F320 HydrophobicContact CD1-CE2 4.33Å; L297-F320 HydrophobicContact CD2-CE2 4.01Å; L297-F320 HydrophobicContact CD2-CZ 4.44Å; L297-F320 HydrophobicContact CG-CE2 4.11Å; L297-F320 HydrophobicContact CG-CZ 4.48Å; F306-F320 AromaticContact CE1-CD1 3.91Å; F306-F320 HydrophobicContact CE1-CD1 3.91Å; F306-F320 HydrophobicContact CE1-CE1 4.09Å; F306-F320 HydrophobicContact CE1-CG 4.33Å; F306-F320 AromaticContact CZ-CD1 3.85Å; F306-F320 HydrophobicContact CZ-CD1 3.85Å; F306-F320 HydrophobicContact CZ-CD2 4.18Å; F306-F320 AromaticContact CZ-CE1 3.76Å; F306-F320 HydrophobicContact CZ-CE1 3.76Å; F306-F320 HydrophobicContact CZ-CE2 4.09Å; F306-F320 HydrophobicContact CZ-CG 4.07Å; F306-F320 AromaticContact CZ-CZ 3.89Å; F306-F320 HydrophobicContact CZ-CZ 3.89Å; L315-F320 HydrophobicContact CD1-CB 3.81Å; F320-I327 HydrophobicContact CD2-CB 4.46Å; F320-I327 HydrophobicContact CD2-CG2 4.09Å; F320-I327 HydrophobicContact CE2-CG2 4.4Å; F320-F328 WeakPolarHBondContact CA-O 3.24Å
321	F	83.9	Confident	82.6	Confident	18 Å²	18	57.8 Å²	57.8	8%	0.079	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.9	170.4	-65.8	-80.7	0	0	0	108.4	Q248 I327 F328 P330 Y333	Q248-F321 HydrophobicContact CB-CZ 4.37Å; F321-I327 WeakPolarHBondContact O-CA 3.49Å; F321-F328 PolarHBondContact N-O 2.87Å; F321-F328 PolarHBondContact O-N 2.75Å; F321-P330 HydrophobicContact CD2-CB 4.44Å; F321-P330 HydrophobicContact CD2-CG 4.33Å; F321-P330 HydrophobicContact CE2-CB 3.87Å; F321-P330 HydrophobicContact CE2-CG 3.95Å; F321-Y333 HydrophobicContact CB-CD1 4.41Å; F321-Y333 HydrophobicContact CB-CD2 3.59Å; F321-Y333 HydrophobicContact CB-CE2 3.86Å; F321-Y333 HydrophobicContact CB-CG 3.89Å; F321-Y333 HydrophobicContact CD1-CD1 4.39Å; F321-Y333 HydrophobicContact CD1-CE1 4.33Å; F321-Y333 AromaticContact CD2-CD1 3.83Å; F321-Y333 HydrophobicContact CD2-CD1 3.83Å; F321-Y333 HydrophobicContact CD2-CD2 4.32Å; F321-Y333 AromaticContact CD2-CG 3.7Å; F321-Y333 HydrophobicContact CD2-CG 3.7Å; F321-Y333 HydrophobicContact CE2-CD1 4.14Å; F321-Y333 HydrophobicContact CE2-CG 4.41Å; F321-Y333 AromaticContact CG-CD1 3.96Å; F321-Y333 HydrophobicContact CG-CD1 3.96Å; F321-Y333 HydrophobicContact CG-CD2 4.05Å; F321-Y333 HydrophobicContact CG-CE1 4.27Å; F321-Y333 HydrophobicContact CG-CE2 4.34Å; F321-Y333 AromaticContact CG-CG 3.85Å; F321-Y333 HydrophobicContact CG-CG 3.85Å
322	E	85.6	Confident	82.3	Confident	97 Å²	97	55.3 Å²	55.3	45%	0.453	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	139	169	-164	-146.8	143.1	0	0	109.7	L297 G325 I327	L297-E322 HydrophobicContact CD1-CB 4.09Å; L297-E322 HydrophobicContact CD1-CG 3.61Å; L297-E322 HydrophobicContact CD2-CB 4.28Å; L297-E322 HydrophobicContact CD2-CG 4.48Å; L297-E322 WeakPolarHBondContact CD2-OE2 3.34Å; E322-G325 WeakPolarHBondContact OE1-CA 3.41Å; E322-G325 PolarHBondContact OE1-N 3.41Å; E322-G325 VanDerWaalsContact OE1-N 3.13Å; E322-I327 HydrophobicContact CG-CG2 4.41Å
323	E	80.3	Confident	82.2	Confident	47 Å²	47	54.5 Å²	54.5	22%	0.22	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	117.8	167	-177.2	178.9	-164.6	0	0	109.9	G325 A326 F328 R336 Y337	E323-G325 VanDerWaalsContact C-N 3.31Å; E323-G325 PolarHBondContact O-N 3.5Å; E323-A326 PolarHBondContact N-O 3.45Å; E323-A326 PolarHBondContact O-N 3.3Å; E323-F328 HydrophobicContact CB-CD2 4.43Å; E323-F328 HydrophobicContact CB-CE2 4.22Å; E323-R336 IonicContact OE2-NH1 3.09Å; E323-R336 PolarHBondContact OE2-NH1 2.91Å; E323-Y337 PolarHBondContact OE1-OH 2.96Å; E323-Y337 WeakPolarHBondContact OE2-CE2 3.37Å; E323-Y337 PolarHBondContact OE2-OH 3.12Å
324	K	81.7	Confident	81.9	Confident	196 Å²	196	49.4 Å²	49.4	85%	0.852	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	41.6	176.7	-56.9	170.7	-174	172.8	0	112.9	A326	K324-A326 VanDerWaalsContact C-N 3.26Å; K324-A326 PolarHBondContact O-N 2.84Å
325	G	78.9	Confident	81.8	Confident	64 Å²	64	50.2 Å²	50.2	66%	0.66	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	0.5	-177.5	0	0	0	0	0	115.4	E322 E323	E322-G325 WeakPolarHBondContact OE1-CA 3.41Å; E322-G325 PolarHBondContact OE1-N 3.41Å; E322-G325 VanDerWaalsContact OE1-N 3.13Å; E323-G325 VanDerWaalsContact C-N 3.31Å; E323-G325 PolarHBondContact O-N 3.5Å
326	A	85.7	Confident	81.6	Confident	28 Å²	28	53.2 Å²	53.2	23%	0.231	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.9	174.3	0	0	0	0	0	111.1	E323 K324 F328	E323-A326 PolarHBondContact N-O 3.45Å; E323-A326 PolarHBondContact O-N 3.3Å; K324-A326 VanDerWaalsContact C-N 3.26Å; K324-A326 PolarHBondContact O-N 2.84Å; A326-F328 HydrophobicContact CB-CE1 4.42Å; A326-F328 HydrophobicContact CB-CE2 3.65Å; A326-F328 HydrophobicContact CB-CZ 3.44Å; A326-F328 VanDerWaalsContact CB-CZ 3.44Å; A326-F328 VanDerWaalsContact O-CE2 3.32Å; A326-F328 WeakPolarHBondContact O-CE2 3.18Å
327	I	85.4	Confident	82.1	Confident	22 Å²	22	54.3 Å²	54.3	11%	0.113	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	138.2	179.9	60.8	177.7	0	0	0	112.1	L297 F306 V307 S309 L315 F320 F321 E322	L297-I327 HydrophobicContact CD1-CG2 3.93Å; F306-I327 HydrophobicContact CD1-CD1 4.42Å; F306-I327 HydrophobicContact CD2-CD1 3.51Å; F306-I327 HydrophobicContact CE1-CD1 4.32Å; F306-I327 HydrophobicContact CE2-CD1 3.39Å; F306-I327 HydrophobicContact CG-CD1 4.03Å; F306-I327 HydrophobicContact CZ-CD1 3.82Å; V307-I327 WeakPolarHBondContact O-CD1 3.29Å; V307-I327 WeakPolarHBondContact O-CG1 3.36Å; S309-I327 PolarHBondContact N-O 3.27Å; L315-I327 HydrophobicContact CD1-CD1 4.41Å; F320-I327 HydrophobicContact CD2-CB 4.46Å; F320-I327 HydrophobicContact CD2-CG2 4.09Å; F320-I327 HydrophobicContact CE2-CG2 4.4Å; F321-I327 WeakPolarHBondContact O-CA 3.49Å; E322-I327 HydrophobicContact CG-CG2 4.41Å
328	F	87.1	Confident	83	Confident	8 Å²	8	46.3 Å²	46.3	4%	0.035	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.6	-177.9	-58.3	-66.6	0	0	0	111.7	S309 Q310 F320 F321 E323 A326 Y333 R336	S309-F328 WeakPolarHBondContact OG-CE1 3.35Å; Q310-F328 HydrophobicContact CB-CD1 3.97Å; Q310-F328 HydrophobicContact CB-CE1 4.15Å; F320-F328 WeakPolarHBondContact CA-O 3.24Å; F321-F328 PolarHBondContact N-O 2.87Å; F321-F328 PolarHBondContact O-N 2.75Å; E323-F328 HydrophobicContact CB-CD2 4.43Å; E323-F328 HydrophobicContact CB-CE2 4.22Å; A326-F328 HydrophobicContact CB-CE1 4.42Å; A326-F328 HydrophobicContact CB-CE2 3.65Å; A326-F328 HydrophobicContact CB-CZ 3.44Å; A326-F328 VanDerWaalsContact CB-CZ 3.44Å; A326-F328 VanDerWaalsContact O-CE2 3.32Å; A326-F328 WeakPolarHBondContact O-CE2 3.18Å; F328-Y333 HydrophobicContact CB-CD2 4.32Å; F328-Y333 HydrophobicContact CD2-CD2 4.5Å; F328-R336 VanDerWaalsContact CD1-NH2 3.31Å
329	C	87.1	Confident	84	Confident	12 Å²	12	47.1 Å²	47.1	8%	0.081	26%	0.257	C	S	.	.			trans	-71.9	150.1	169.1	71.1	0	0	0	0	110.4	C308 L315 P331 C332 Y333	C308-C329 HydrophobicContact CB-CB 4.01Å; C308-C329 PolarHBondContact SG-N 3.38Å; C308-C329 VanDerWaalsContact SG-SG 3.61Å; L315-C329 HydrophobicContact CD2-CB 3.62Å; C329-P331 VanDerWaalsContact C-N 3.35Å; C329-C332 PolarHBondContact O-N 3.01Å; C329-C332 PolarHBondContact SG-SG 2.97Å; C329-Y333 PolarHBondContact O-N 2.89Å
330	P	83.6	Confident	84.6	Confident	28 Å²	28	49.4 Å²	49.4	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-51.2	-43.9	-178.3	-27.3	33.5	0	0	0	114.1	G319 F321 C332 Y333 D334	G319-P330 WeakPolarHBondContact O-CD 3.35Å; F321-P330 HydrophobicContact CD2-CB 4.44Å; F321-P330 HydrophobicContact CD2-CG 4.33Å; F321-P330 HydrophobicContact CE2-CB 3.87Å; F321-P330 HydrophobicContact CE2-CG 3.95Å; P330-C332 VanDerWaalsContact C-N 3.34Å; P330-C332 PolarHBondContact O-N 2.87Å; P330-Y333 PolarHBondContact O-N 2.85Å; P330-D334 WeakPolarHBondContact O-CB 3.46Å; P330-D334 PolarHBondContact O-N 2.92Å
331	P	83.9	Confident	85	Confident	86 Å²	86	49 Å²	49	56%	0.558	27%	0.269	S	S	*	.	H	α-helix	trans	-60.8	-35.9	176.5	-25.3	35.9	0	0	0	114.8	C329 V335	C329-P331 VanDerWaalsContact C-N 3.35Å; P331-V335 WeakPolarHBondContact O-CB 3.48Å; P331-V335 WeakPolarHBondContact O-CG2 3.38Å; P331-V335 PolarHBondContact O-N 3.48Å; P331-V335 VanDerWaalsContact O-N 3.16Å
332	C	86.1	Confident	85.3	Confident	17 Å²	17	48.8 Å²	48.8	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-75.4	-39.3	177.7	-73.2	0	0	0	0	111.8	Q310 C311 C329 P330 V335 R336	Q310-C332 HydrophobicContact CB-CB 4.01Å; Q310-C332 HydrophobicContact CG-CB 4.16Å; C311-C332 VanDerWaalsContact SG-SG 3.69Å; C329-C332 PolarHBondContact O-N 3.01Å; C329-C332 PolarHBondContact SG-SG 2.97Å; P330-C332 VanDerWaalsContact C-N 3.34Å; P330-C332 PolarHBondContact O-N 2.87Å; C332-V335 PolarHBondContact O-N 3.33Å; C332-R336 PolarHBondContact O-N 3.46Å
333	Y	85.1	Confident	85.6	Confident	34 Å²	34	49.8 Å²	49.8	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-63.7	-47.2	176.3	-168	-91.4	0	0	0	111.2	P249 F321 F328 C329 P330 V335 R336 Y337	P249-Y333 HydrophobicContact CG-CE1 3.93Å; F321-Y333 HydrophobicContact CB-CD1 4.41Å; F321-Y333 HydrophobicContact CB-CD2 3.59Å; F321-Y333 HydrophobicContact CB-CE2 3.86Å; F321-Y333 HydrophobicContact CB-CG 3.89Å; F321-Y333 HydrophobicContact CD1-CD1 4.39Å; F321-Y333 HydrophobicContact CD1-CE1 4.33Å; F321-Y333 AromaticContact CD2-CD1 3.83Å; F321-Y333 HydrophobicContact CD2-CD1 3.83Å; F321-Y333 HydrophobicContact CD2-CD2 4.32Å; F321-Y333 AromaticContact CD2-CG 3.7Å; F321-Y333 HydrophobicContact CD2-CG 3.7Å; F321-Y333 HydrophobicContact CE2-CD1 4.14Å; F321-Y333 HydrophobicContact CE2-CG 4.41Å; F321-Y333 AromaticContact CG-CD1 3.96Å; F321-Y333 HydrophobicContact CG-CD1 3.96Å; F321-Y333 HydrophobicContact CG-CD2 4.05Å; F321-Y333 HydrophobicContact CG-CE1 4.27Å; F321-Y333 HydrophobicContact CG-CE2 4.34Å; F321-Y333 AromaticContact CG-CG 3.85Å; F321-Y333 HydrophobicContact CG-CG 3.85Å; F328-Y333 HydrophobicContact CB-CD2 4.32Å; F328-Y333 HydrophobicContact CD2-CD2 4.5Å; C329-Y333 PolarHBondContact O-N 2.89Å; P330-Y333 PolarHBondContact O-N 2.85Å; Y333-V335 PolarHBondContact O-N 2.87Å; Y333-R336 WeakPolarHBondContact O-CB 3.09Å; Y333-R336 PolarHBondContact O-N 2.91Å; Y333-Y337 HydrophobicContact CD1-CD2 4Å; Y333-Y337 HydrophobicContact CD2-CD2 4.09Å; Y333-Y337 AromaticContact CD2-CE2 3.96Å; Y333-Y337 HydrophobicContact CD2-CE2 3.96Å; Y333-Y337 AromaticContact CE1-CD2 3.69Å; Y333-Y337 HydrophobicContact CE1-CD2 3.69Å; Y333-Y337 HydrophobicContact CE1-CE2 4.27Å; Y333-Y337 AromaticContact CE2-CD2 3.81Å; Y333-Y337 HydrophobicContact CE2-CD2 3.81Å; Y333-Y337 AromaticContact CE2-CE2 3.53Å; Y333-Y337 HydrophobicContact CE2-CE2 3.53Å; Y333-Y337 HydrophobicContact CG-CD2 4.18Å; Y333-Y337 AromaticContact CZ-CD2 3.6Å; Y333-Y337 AromaticContact CZ-CE2 3.7Å; Y333-Y337 WeakPolarHBondContact O-CD2 2.97Å; Y333-Y337 PolarHBondContact O-N 3.43Å
334	D	82.9	Confident	86.2	Confident	33 Å²	33	49.9 Å²	49.9	18%	0.176	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-45.9	175.6	-68.6	-5.8	0	0	0	111.6	Q248 P330 R336 Y337 A338	Q248-D334 WeakPolarHBondContact CG-OD1 3.38Å; Q248-D334 PolarHBondContact NE2-OD1 2.71Å; Q248-D334 PolarHBondContact NE2-OD2 2.73Å; P330-D334 WeakPolarHBondContact O-CB 3.46Å; P330-D334 PolarHBondContact O-N 2.92Å; D334-R336 VanDerWaalsContact C-N 3.3Å; D334-R336 PolarHBondContact O-N 2.89Å; D334-Y337 PolarHBondContact O-N 2.81Å; D334-A338 WeakPolarHBondContact O-CA 3.29Å; D334-A338 WeakPolarHBondContact O-CB 3.43Å; D334-A338 PolarHBondContact O-N 3.13Å
335	V	84.4	Confident	86.6	Confident	62 Å²	62	47.8 Å²	47.8	38%	0.376	27%	0.27	S	S	.	.	H	α-helix	trans	-64.5	-33.9	178.3	166.9	0	0	0	0	112.3	P331 C332 Y333 K347 T349	P331-V335 WeakPolarHBondContact O-CB 3.48Å; P331-V335 WeakPolarHBondContact O-CG2 3.38Å; P331-V335 PolarHBondContact O-N 3.48Å; P331-V335 VanDerWaalsContact O-N 3.16Å; C332-V335 PolarHBondContact O-N 3.33Å; Y333-V335 PolarHBondContact O-N 2.87Å; V335-K347 WeakPolarHBondContact O-CD 3.24Å; V335-T349 HydrophobicContact CG2-CG2 3.73Å
336	R	82.3	Confident	87.2	Confident	75 Å²	75	52.2 Å²	52.2	28%	0.283	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-51.4	175.2	-173.1	179.8	-61.1	174.8	3.2	111.1	E323 F328 C332 Y333 D334 K347	E323-R336 IonicContact OE2-NH1 3.09Å; E323-R336 PolarHBondContact OE2-NH1 2.91Å; F328-R336 VanDerWaalsContact CD1-NH2 3.31Å; C332-R336 PolarHBondContact O-N 3.46Å; Y333-R336 WeakPolarHBondContact O-CB 3.09Å; Y333-R336 PolarHBondContact O-N 2.91Å; D334-R336 VanDerWaalsContact C-N 3.3Å; D334-R336 PolarHBondContact O-N 2.89Å; R336-K347 PolarHBondContact O-NZ 2.84Å
337	Y	82.2	Confident	87.4	Confident	97 Å²	97	54.9 Å²	54.9	38%	0.38	28%	0.277	S	S	.	.	H	α-helix	trans	-91.3	2	-174.9	-64.7	-62.6	0	0	0	115.1	H246 E323 Y333 D334	H246-Y337 PolarHBondContact NE2-O 3.09Å; H246-Y337 VanDerWaalsContact NE2-O 3.07Å; E323-Y337 PolarHBondContact OE1-OH 2.96Å; E323-Y337 WeakPolarHBondContact OE2-CE2 3.37Å; E323-Y337 PolarHBondContact OE2-OH 3.12Å; Y333-Y337 HydrophobicContact CD1-CD2 4Å; Y333-Y337 HydrophobicContact CD2-CD2 4.09Å; Y333-Y337 AromaticContact CD2-CE2 3.96Å; Y333-Y337 HydrophobicContact CD2-CE2 3.96Å; Y333-Y337 AromaticContact CE1-CD2 3.69Å; Y333-Y337 HydrophobicContact CE1-CD2 3.69Å; Y333-Y337 HydrophobicContact CE1-CE2 4.27Å; Y333-Y337 AromaticContact CE2-CD2 3.81Å; Y333-Y337 HydrophobicContact CE2-CD2 3.81Å; Y333-Y337 AromaticContact CE2-CE2 3.53Å; Y333-Y337 HydrophobicContact CE2-CE2 3.53Å; Y333-Y337 HydrophobicContact CG-CD2 4.18Å; Y333-Y337 AromaticContact CZ-CD2 3.6Å; Y333-Y337 AromaticContact CZ-CE2 3.7Å; Y333-Y337 WeakPolarHBondContact O-CD2 2.97Å; Y333-Y337 PolarHBondContact O-N 3.43Å; D334-Y337 PolarHBondContact O-N 2.81Å
338	A	86.2	Confident	87.6	Confident	3 Å²	3	53.9 Å²	53.9	3%	0.025	27%	0.272	C	S	.	.	S	Bend	trans	-62.7	141.1	169.4	0	0	0	0	0	111.5	D334 K347 I348	D334-A338 WeakPolarHBondContact O-CA 3.29Å; D334-A338 WeakPolarHBondContact O-CB 3.43Å; D334-A338 PolarHBondContact O-N 3.13Å; A338-K347 HydrophobicContact CB-CB 4.06Å; A338-K347 HydrophobicContact CB-CD 4Å; A338-K347 WeakPolarHBondContact O-CD 3.11Å; A338-K347 PolarHBondContact O-NZ 3.36Å; A338-I348 VanDerWaalsContact CB-O 3.27Å; A338-I348 WeakPolarHBondContact CB-O 3.39Å
339	P	87.9	Confident	87.4	Confident	36 Å²	36	57.6 Å²	57.6	23%	0.234	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-71.3	158.1	170.3	30.7	-33.8	0	0	0	111	K347 I348 I352 T359	P339-K347 CarbonylContact O-C 3.56Å; P339-K347 WeakPolarHBondContact O-CA 3.16Å; P339-I348 HydrophobicContact CG-CB 4.37Å; P339-I348 HydrophobicContact CG-CD1 4.26Å; P339-I348 PolarHBondContact O-N 3.4Å; P339-I352 HydrophobicContact CG-CD1 3.75Å; P339-I352 HydrophobicContact CG-CG1 4.18Å; P339-T359 HydrophobicContact CB-CG2 4.1Å; P339-T359 HydrophobicContact CG-CG2 4.26Å
340	S	91.1	Very high	87.2	Confident	64 Å²	64	58.6 Å²	58.6	45%	0.448	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-98.6	129.4	-179.3	-60.5	0	0	0	0	111.3	A342 T359	S340-A342 PolarHBondContact O-N 3.42Å; S340-T359 PolarHBondContact O-OG1 3.34Å
341	C	93.1	Very high	87.2	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.007	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-66.7	131.2	-177.9	172	0	0	0	0	112.8	K343 K345 K346 I348 T359 H361	C341-K343 VanDerWaalsContact C-N 3.28Å; C341-K343 PolarHBondContact O-N 2.81Å; C341-K343 PolarHBondContact SG-N 2.9Å; C341-K343 VanDerWaalsContact SG-N 3.38Å; C341-K345 WeakPolarHBondContact O-CA 3.23Å; C341-K345 PolarHBondContact O-N 2.96Å; C341-K346 PolarHBondContact N-O 3.23Å; C341-I348 HydrophobicContact CB-CD1 3.94Å; C341-I348 HydrophobicContact CB-CG1 3.84Å; C341-T359 WeakPolarHBondContact CA-O 3.39Å; C341-H361 VanDerWaalsContact CB-CE1 3.48Å; C341-H361 WeakPolarHBondContact CB-CE1 3.47Å; C341-H361 WeakPolarHBondContact CB-ND1 3.41Å
342	A	91.1	Very high	87.4	Confident	15 Å²	15	57.7 Å²	57.7	12%	0.124	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-37.3	178.2	0	0	0	0	0	114.2	S340 K345 M358 T359 W360	S340-A342 PolarHBondContact O-N 3.42Å; A342-K345 WeakPolarHBondContact O-CE 3.5Å; A342-K345 PolarHBondContact O-NZ 2.88Å; A342-M358 HydrophobicContact CB-CB 4.12Å; A342-M358 HydrophobicContact CB-CE 3.57Å; A342-M358 HydrophobicContact CB-SD 3.74Å; A342-T359 PolarHBondContact N-O 3.01Å; A342-W360 HydrophobicContact CB-CD2 3.86Å; A342-W360 HydrophobicContact CB-CE3 3.85Å; A342-W360 HydrophobicContact CB-CH2 3.67Å; A342-W360 HydrophobicContact CB-CZ2 3.69Å; A342-W360 HydrophobicContact CB-CZ3 3.76Å
343	K	90.4	Very high	87.4	Confident	118 Å²	118	56.9 Å²	56.9	51%	0.513	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-62.1	-179	-167.6	176	-169.3	175.2	0	113.1	C341 W360 C364	C341-K343 VanDerWaalsContact C-N 3.28Å; C341-K343 PolarHBondContact O-N 2.81Å; C341-K343 PolarHBondContact SG-N 2.9Å; C341-K343 VanDerWaalsContact SG-N 3.38Å; K343-W360 HydrophobicContact CB-CE3 3.87Å; K343-W360 HydrophobicContact CB-CZ3 3.86Å; K343-C364 HydrophobicContact CB-CB 3.93Å; K343-C364 HydrophobicContact CD-CB 3.66Å; K343-C364 WeakPolarHBondContact CD-O 3.41Å; K343-C364 HydrophobicContact CG-CB 4.38Å; K343-C364 PolarHBondContact NZ-O 3.32Å
344	C	93.1	Very high	87.6	Confident	48 Å²	48	59.2 Å²	59.2	32%	0.324	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-1.6	-169.8	72.2	0	0	0	0	114.3	K346 H361	C344-K346 PolarHBondContact O-N 2.92Å; C344-H361 PolarHBondContact SG-CE1 3.14Å; C344-H361 PolarHBondContact SG-ND1 3.44Å; C344-H361 VanDerWaalsContact SG-ND1 3.36Å
345	K	91.4	Very high	87.7	Confident	153 Å²	153	57.8 Å²	57.8	67%	0.665	29%	0.293	S	S	*	.			trans	60.2	-8	-177.3	-47.3	-52.9	-175.3	-170.3	0	116.5	C341 A342	C341-K345 WeakPolarHBondContact O-CA 3.23Å; C341-K345 PolarHBondContact O-N 2.96Å; A342-K345 WeakPolarHBondContact O-CE 3.5Å; A342-K345 PolarHBondContact O-NZ 2.88Å
346	K	90.5	Very high	87.8	Confident	156 Å²	156	58.3 Å²	58.3	68%	0.678	29%	0.293	S	S	*	.	S	Bend	trans	-70.5	152.9	175.5	-60.8	-180	-177.3	-177.5	0	111.7	C341 C344 H361	C341-K346 PolarHBondContact N-O 3.23Å; C344-K346 PolarHBondContact O-N 2.92Å; K346-H361 PolarHBondContact O-CE1 3.24Å
347	K	90.4	Very high	87.8	Confident	85 Å²	85	65.3 Å²	65.3	37%	0.37	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-59.3	143.7	173.2	-69.4	-73.8	-171.9	163.6	0	111.9	V335 R336 A338 P339 H361	V335-K347 WeakPolarHBondContact O-CD 3.24Å; R336-K347 PolarHBondContact O-NZ 2.84Å; A338-K347 HydrophobicContact CB-CB 4.06Å; A338-K347 HydrophobicContact CB-CD 4Å; A338-K347 WeakPolarHBondContact O-CD 3.11Å; A338-K347 PolarHBondContact O-NZ 3.36Å; P339-K347 CarbonylContact O-C 3.56Å; P339-K347 WeakPolarHBondContact O-CA 3.16Å; K347-H361 PolarHBondContact O-CE1 2.92Å; K347-H361 PolarHBondContact O-NE2 3.26Å
348	I	89.4	Confident	88.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.33	C	S	.	.			trans	-101.7	102.7	178.8	-54.2	161.8	0	0	0	109.9	A338 P339 C341 E351 I352	A338-I348 VanDerWaalsContact CB-O 3.27Å; A338-I348 WeakPolarHBondContact CB-O 3.39Å; P339-I348 HydrophobicContact CG-CB 4.37Å; P339-I348 HydrophobicContact CG-CD1 4.26Å; P339-I348 PolarHBondContact O-N 3.4Å; C341-I348 HydrophobicContact CB-CD1 3.94Å; C341-I348 HydrophobicContact CB-CG1 3.84Å; I348-E351 WeakPolarHBondContact CG2-O 3.35Å; I348-I352 HydrophobicContact CB-CG1 4.32Å; I348-I352 HydrophobicContact CD1-CG2 4.41Å; I348-I352 HydrophobicContact CG2-CB 4.36Å; I348-I352 HydrophobicContact CG2-CG1 3.68Å
349	T	83.9	Confident	88.4	Confident	87 Å²	87	66.3 Å²	66.3	53%	0.534	34%	0.336	S	S	.	.			trans	-92.9	131.4	170.2	48.1	0	0	0	0	110	V335	V335-T349 HydrophobicContact CG2-CG2 3.73Å
350	G	81.2	Confident	88.6	Confident	32 Å²	32	66.5 Å²	66.5	33%	0.33	33%	0.332	S	S	.	.	S	Bend	trans	89.5	-123.3	178.3	0	0	0	0	0	114.6	R245 H246	R245-G350 WeakPolarHBondContact CA-O 3.42Å; H246-G350 PolarHBondContact N-O 2.87Å
351	E	84.6	Confident	88.6	Confident	91 Å²	91	64.5 Å²	64.5	43%	0.425	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.4	-179.4	-69.7	-173.7	-175.4	0	0	111.5	I348 V362 R375	I348-E351 WeakPolarHBondContact CG2-O 3.35Å; E351-V362 HydrophobicContact CB-CG2 3.69Å; E351-V362 WeakPolarHBondContact OE2-CG2 3.26Å; E351-R375 IonicContact OE1-NH1 2.67Å; E351-R375 IonicContact OE2-NH1 2.66Å; E351-R375 PolarHBondContact OE2-NH1 2.98Å
352	I	87.2	Confident	88.5	Confident	5 Å²	5	65.3 Å²	65.3	3%	0.026	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.1	175.2	-58.6	160.9	0	0	0	108.8	L243 T244 H246 P339 I348 T359	L243-I352 WeakPolarHBondContact CA-O 3.42Å; T244-I352 PolarHBondContact N-O 3.03Å; T244-I352 PolarHBondContact O-N 3.32Å; T244-I352 VanDerWaalsContact O-O 3.12Å; H246-I352 HydrophobicContact CB-CD1 3.86Å; P339-I352 HydrophobicContact CG-CD1 3.75Å; P339-I352 HydrophobicContact CG-CG1 4.18Å; I348-I352 HydrophobicContact CB-CG1 4.32Å; I348-I352 HydrophobicContact CD1-CG2 4.41Å; I348-I352 HydrophobicContact CG2-CB 4.36Å; I348-I352 HydrophobicContact CG2-CG1 3.68Å; I352-T359 HydrophobicContact CG2-CG2 3.83Å
353	M	87.5	Confident	88.6	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.6	163.3	-63.6	-57.4	-46.5	0	0	109.6	T241 L243 T359 W360 V362 F365 I374 R375	T241-M353 HydrophobicContact CG2-CE 3.89Å; L243-M353 HydrophobicContact CD1-CE 3.65Å; L243-M353 HydrophobicContact CD1-SD 3.5Å; L243-M353 WeakPolarHBondContact CD1-SD 3.44Å; L243-M353 HydrophobicContact CD2-SD 4.33Å; L243-M353 HydrophobicContact CG-CE 4.27Å; L243-M353 HydrophobicContact CG-SD 3.61Å; M353-T359 CarbonylContact O-C 3.56Å; M353-T359 WeakPolarHBondContact O-CA 3.49Å; M353-W360 HydrophobicContact CB-CB 4.12Å; M353-W360 WeakPolarHBondContact CB-O 3.42Å; M353-W360 PolarHBondContact N-O 3.23Å; M353-W360 PolarHBondContact O-N 2.93Å; M353-V362 HydrophobicContact CG-CB 4.29Å; M353-V362 HydrophobicContact CG-CG2 3.9Å; M353-V362 HydrophobicContact SD-CG2 3.93Å; M353-F365 HydrophobicContact CG-CB 4.44Å; M353-I374 WeakPolarHBondContact CE-O 3.09Å; M353-R375 HydrophobicContact SD-CG 3.91Å
354	H	88.2	Confident	88.6	Confident	82 Å²	82	65.6 Å²	65.6	38%	0.38	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.2	165.9	-60.1	-93.2	0	0	0	108.9	V242 T244	V242-H354 HydrophobicContact CB-CB 4.37Å; V242-H354 PolarHBondContact N-O 2.66Å; V242-H354 VanDerWaalsContact N-O 3.12Å; V242-H354 PolarHBondContact O-N 3.17Å; T244-H354 WeakPolarHBondContact CB-NE2 3.44Å; T244-H354 WeakPolarHBondContact CG2-NE2 3.48Å; T244-H354 PolarHBondContact OG1-NE2 2.84Å
355	A	86	Confident	88.6	Confident	4 Å²	4	63.5 Å²	63.5	3%	0.033	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	140	178.8	0	0	0	0	0	109.6	T241 K357 M358 W360 F365 F379	T241-A355 HydrophobicContact CG2-CB 4.22Å; A355-K357 VanDerWaalsContact C-N 3.28Å; A355-K357 PolarHBondContact O-N 3.04Å; A355-M358 PolarHBondContact N-O 2.93Å; A355-M358 CarbonylContact O-C 3.57Å; A355-M358 PolarHBondContact O-N 3.33Å; A355-W360 PolarHBondContact O-NE1 2.8Å; A355-F365 HydrophobicContact CB-CD1 4.39Å; A355-F365 HydrophobicContact CB-CD2 4.29Å; A355-F365 HydrophobicContact CB-CE1 3.97Å; A355-F365 HydrophobicContact CB-CE2 3.86Å; A355-F365 HydrophobicContact CB-CZ 3.69Å; A355-F379 HydrophobicContact CB-CE1 4.35Å; A355-F379 HydrophobicContact CB-CZ 4.18Å
356	L	85.2	Confident	88.7	Confident	72 Å²	72	57.6 Å²	57.6	38%	0.377	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	36.6	177.5	-54.1	169.8	0	0	0	113.9	T239 M358 F379 M381	T239-L356 HydrophobicContact CG2-CD2 4.14Å; L356-M358 PolarHBondContact O-N 3.06Å; L356-M358 VanDerWaalsContact O-N 3.16Å; L356-F379 HydrophobicContact CD2-CE2 4.32Å; L356-F379 HydrophobicContact CD2-CZ 4.19Å; L356-F379 HydrophobicContact CG-CE2 4.4Å; L356-F379 HydrophobicContact CG-CZ 4.16Å; L356-M381 HydrophobicContact CD1-CE 3.63Å; L356-M381 HydrophobicContact CD1-CG 4.45Å; L356-M381 HydrophobicContact CD1-SD 3.89Å; L356-M381 HydrophobicContact CD2-CG 4.49Å
357	K	83.2	Confident	88.8	Confident	222 Å²	222	50.2 Å²	50.2	97%	0.965	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	14.3	-172.4	-52.2	178.1	-177.5	176.4	0	114.7	A355	A355-K357 VanDerWaalsContact C-N 3.28Å; A355-K357 PolarHBondContact O-N 3.04Å
358	M	89.3	Confident	88.9	Confident	97 Å²	97	47.4 Å²	47.4	48%	0.478	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	164.7	178.4	-57.7	-171	90.5	0	0	111.7	A342 A355 L356 W360	A342-M358 HydrophobicContact CB-CB 4.12Å; A342-M358 HydrophobicContact CB-CE 3.57Å; A342-M358 HydrophobicContact CB-SD 3.74Å; A355-M358 PolarHBondContact N-O 2.93Å; A355-M358 CarbonylContact O-C 3.57Å; A355-M358 PolarHBondContact O-N 3.33Å; L356-M358 PolarHBondContact O-N 3.06Å; L356-M358 VanDerWaalsContact O-N 3.16Å; M358-W360 HydrophobicContact CB-CZ2 4.25Å; M358-W360 HydrophobicContact SD-CZ2 4.24Å
359	T	91.1	Very high	89	Confident	25 Å²	25	49.2 Å²	49.2	15%	0.153	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	144.9	174.9	58.2	0	0	0	0	111.9	P339 S340 C341 A342 I352 M353	P339-T359 HydrophobicContact CB-CG2 4.1Å; P339-T359 HydrophobicContact CG-CG2 4.26Å; S340-T359 PolarHBondContact O-OG1 3.34Å; C341-T359 WeakPolarHBondContact CA-O 3.39Å; A342-T359 PolarHBondContact N-O 3.01Å; I352-T359 HydrophobicContact CG2-CG2 3.83Å; M353-T359 CarbonylContact O-C 3.56Å; M353-T359 WeakPolarHBondContact O-CA 3.49Å
360	W	92.5	Very high	89.4	Confident	39 Å²	39	47.2 Å²	47.2	15%	0.148	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	150.4	-177.4	-42.4	72.3	0	0	0	111	A342 K343 M353 A355 M358 F365	A342-W360 HydrophobicContact CB-CD2 3.86Å; A342-W360 HydrophobicContact CB-CE3 3.85Å; A342-W360 HydrophobicContact CB-CH2 3.67Å; A342-W360 HydrophobicContact CB-CZ2 3.69Å; A342-W360 HydrophobicContact CB-CZ3 3.76Å; K343-W360 HydrophobicContact CB-CE3 3.87Å; K343-W360 HydrophobicContact CB-CZ3 3.86Å; M353-W360 HydrophobicContact CB-CB 4.12Å; M353-W360 WeakPolarHBondContact CB-O 3.42Å; M353-W360 PolarHBondContact N-O 3.23Å; M353-W360 PolarHBondContact O-N 2.93Å; A355-W360 PolarHBondContact O-NE1 2.8Å; M358-W360 HydrophobicContact CB-CZ2 4.25Å; M358-W360 HydrophobicContact SD-CZ2 4.24Å; W360-F365 HydrophobicContact CB-CB 4Å; W360-F365 AromaticContact CD2-CD2 3.7Å; W360-F365 HydrophobicContact CD2-CD2 3.7Å; W360-F365 HydrophobicContact CD2-CE2 4.41Å; W360-F365 AromaticContact CE2-CD2 3.91Å; W360-F365 AromaticContact CE3-CD2 4Å; W360-F365 HydrophobicContact CE3-CD2 4Å; W360-F365 HydrophobicContact CG-CB 4.26Å; W360-F365 AromaticContact CG-CD2 3.94Å; W360-F365 HydrophobicContact CG-CD2 3.94Å; W360-F365 HydrophobicContact CG-CG 4.4Å; W360-F365 HydrophobicContact CZ2-CD2 4.44Å; W360-F365 HydrophobicContact CZ2-CE2 4.39Å; W360-F365 HydrophobicContact CZ3-CD2 4.49Å
361	H	92.2	Very high	90	Very high	22 Å²	22	52.6 Å²	52.6	10%	0.102	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	150.4	160	-55.2	93.6	0	0	0	109.6	C341 C344 K346 K347 H363 C364 F365	C341-H361 VanDerWaalsContact CB-CE1 3.48Å; C341-H361 WeakPolarHBondContact CB-CE1 3.47Å; C341-H361 WeakPolarHBondContact CB-ND1 3.41Å; C344-H361 PolarHBondContact SG-CE1 3.14Å; C344-H361 PolarHBondContact SG-ND1 3.44Å; C344-H361 VanDerWaalsContact SG-ND1 3.36Å; K346-H361 PolarHBondContact O-CE1 3.24Å; K347-H361 PolarHBondContact O-CE1 2.92Å; K347-H361 PolarHBondContact O-NE2 3.26Å; H361-H363 VanDerWaalsContact CB-CE1 3.48Å; H361-H363 WeakPolarHBondContact CB-CE1 3.46Å; H361-H363 AromaticContact CD2-CE1 3.95Å; H361-H363 AromaticContact CG-CE1 3.64Å; H361-H363 AromaticContact CG-NE2 4Å; H361-C364 HydrophobicContact CB-CB 4.18Å; H361-C364 WeakPolarHBondContact O-CA 3.44Å; H361-C364 WeakPolarHBondContact O-CB 3.33Å; H361-C364 PolarHBondContact O-N 3.33Å; H361-F365 PolarHBondContact O-N 3.11Å
362	V	90.8	Very high	90.3	Very high	19 Å²	19	52 Å²	52	12%	0.115	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-52.2	-71.5	177.1	176.9	0	0	0	0	112.9	E351 M353 C364 F365 P373 R375	E351-V362 HydrophobicContact CB-CG2 3.69Å; E351-V362 WeakPolarHBondContact OE2-CG2 3.26Å; M353-V362 HydrophobicContact CG-CB 4.29Å; M353-V362 HydrophobicContact CG-CG2 3.9Å; M353-V362 HydrophobicContact SD-CG2 3.93Å; V362-C364 VanDerWaalsContact C-N 3.31Å; V362-C364 PolarHBondContact O-N 3.43Å; V362-C364 VanDerWaalsContact O-N 3.1Å; V362-F365 PolarHBondContact O-N 3.37Å; V362-F365 VanDerWaalsContact O-N 3.09Å; V362-P373 HydrophobicContact CG1-CB 3.67Å; V362-P373 HydrophobicContact CG1-CG 4.23Å; V362-R375 VanDerWaalsContact CG1-CD 3.49Å; V362-R375 HydrophobicContact CG1-CG 3.86Å
363	H	91.8	Very high	90.5	Very high	129 Å²	129	54 Å²	54	60%	0.597	28%	0.279	S	S	*	.	G	3₁₀ helix		42.1	-86.3	113.7	133.2	-85.9	0	0	0	121.3	H361 T366	H361-H363 VanDerWaalsContact CB-CE1 3.48Å; H361-H363 WeakPolarHBondContact CB-CE1 3.46Å; H361-H363 AromaticContact CD2-CE1 3.95Å; H361-H363 AromaticContact CG-CE1 3.64Å; H361-H363 AromaticContact CG-NE2 4Å; H363-T366 VanDerWaalsContact O-CG2 3.28Å; H363-T366 WeakPolarHBondContact O-CG2 3.49Å
364	C	91.3	Very high	90.6	Very high	10 Å²	10	54.3 Å²	54.3	7%	0.068	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-89.4	-30.3	-170.3	-80.7	0	0	0	0	111.4	K343 H361 V362 T366	K343-C364 HydrophobicContact CB-CB 3.93Å; K343-C364 HydrophobicContact CD-CB 3.66Å; K343-C364 WeakPolarHBondContact CD-O 3.41Å; K343-C364 HydrophobicContact CG-CB 4.38Å; K343-C364 PolarHBondContact NZ-O 3.32Å; H361-C364 HydrophobicContact CB-CB 4.18Å; H361-C364 WeakPolarHBondContact O-CA 3.44Å; H361-C364 WeakPolarHBondContact O-CB 3.33Å; H361-C364 PolarHBondContact O-N 3.33Å; V362-C364 VanDerWaalsContact C-N 3.31Å; V362-C364 PolarHBondContact O-N 3.43Å; V362-C364 VanDerWaalsContact O-N 3.1Å; C364-T366 PolarHBondContact O-N 2.85Å
365	F	92.5	Very high	90.5	Very high	3 Å²	3	55.9 Å²	55.9	1%	0.013	28%	0.284	C	S	.	.	S	Bend	trans	-91.6	72.2	-179.6	-156.4	-100.8	0	0	0	111.1	T241 M353 A355 W360 H361 V362 I374 F379 P386	T241-F365 HydrophobicContact CG2-CD1 3.89Å; T241-F365 HydrophobicContact CG2-CE1 3.55Å; M353-F365 HydrophobicContact CG-CB 4.44Å; A355-F365 HydrophobicContact CB-CD1 4.39Å; A355-F365 HydrophobicContact CB-CD2 4.29Å; A355-F365 HydrophobicContact CB-CE1 3.97Å; A355-F365 HydrophobicContact CB-CE2 3.86Å; A355-F365 HydrophobicContact CB-CZ 3.69Å; W360-F365 HydrophobicContact CB-CB 4Å; W360-F365 AromaticContact CD2-CD2 3.7Å; W360-F365 HydrophobicContact CD2-CD2 3.7Å; W360-F365 HydrophobicContact CD2-CE2 4.41Å; W360-F365 AromaticContact CE2-CD2 3.91Å; W360-F365 AromaticContact CE3-CD2 4Å; W360-F365 HydrophobicContact CE3-CD2 4Å; W360-F365 HydrophobicContact CG-CB 4.26Å; W360-F365 AromaticContact CG-CD2 3.94Å; W360-F365 HydrophobicContact CG-CD2 3.94Å; W360-F365 HydrophobicContact CG-CG 4.4Å; W360-F365 HydrophobicContact CZ2-CD2 4.44Å; W360-F365 HydrophobicContact CZ2-CE2 4.39Å; W360-F365 HydrophobicContact CZ3-CD2 4.49Å; H361-F365 PolarHBondContact O-N 3.11Å; V362-F365 PolarHBondContact O-N 3.37Å; V362-F365 VanDerWaalsContact O-N 3.09Å; F365-I374 HydrophobicContact CD1-CB 4.02Å; F365-I374 HydrophobicContact CE1-CB 4.2Å; F365-I374 HydrophobicContact CE1-CD1 4.35Å; F365-I374 HydrophobicContact CE1-CG2 4.36Å; F365-I374 PolarHBondContact O-N 2.76Å; F365-F379 HydrophobicContact CE1-CD1 4.18Å; F365-F379 HydrophobicContact CE1-CD2 4.26Å; F365-F379 HydrophobicContact CE1-CE1 4.12Å; F365-F379 HydrophobicContact CE1-CE2 4.24Å; F365-F379 HydrophobicContact CE1-CG 4.23Å; F365-F379 HydrophobicContact CE1-CZ 4.14Å; F365-F379 HydrophobicContact CZ-CD1 4.47Å; F365-F379 AromaticContact CZ-CD2 3.96Å; F365-F379 HydrophobicContact CZ-CD2 3.96Å; F365-F379 HydrophobicContact CZ-CE1 4.12Å; F365-F379 AromaticContact CZ-CE2 3.6Å; F365-F379 HydrophobicContact CZ-CE2 3.6Å; F365-F379 HydrophobicContact CZ-CG 4.37Å; F365-F379 AromaticContact CZ-CZ 3.68Å; F365-F379 HydrophobicContact CZ-CZ 3.68Å; F365-P386 HydrophobicContact CE1-CB 4.36Å; F365-P386 HydrophobicContact CE2-CB 4.2Å; F365-P386 HydrophobicContact CE2-CG 4.14Å; F365-P386 HydrophobicContact CZ-CB 3.83Å; F365-P386 HydrophobicContact CZ-CG 4.24Å
366	T	93.9	Very high	90	Very high	29 Å²	29	59.7 Å²	59.7	18%	0.178	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-112.6	143.3	-174.1	48.2	0	0	0	0	111.8	H363 C364 A368 K371 T372 P373	H363-T366 VanDerWaalsContact O-CG2 3.28Å; H363-T366 WeakPolarHBondContact O-CG2 3.49Å; C364-T366 PolarHBondContact O-N 2.85Å; T366-A368 PolarHBondContact O-N 3.2Å; T366-K371 WeakPolarHBondContact CB-O 3.38Å; T366-K371 WeakPolarHBondContact CG2-O 3.45Å; T366-T372 WeakPolarHBondContact CA-O 3.35Å; T366-P373 HydrophobicContact CG2-CB 4.17Å
367	C	93.2	Very high	89.9	Confident	1 Å²	1	65 Å²	65	1%	0.007	32%	0.318	C	S	.	.			trans	-57.1	130.7	176.1	178	0	0	0	0	111	A369 K371 T372 I374 P386 C388 D391	C367-A369 PolarHBondContact O-N 3.41Å; C367-A369 PolarHBondContact SG-N 3.16Å; C367-A369 VanDerWaalsContact SG-N 3.42Å; C367-K371 WeakPolarHBondContact O-CA 3.32Å; C367-K371 PolarHBondContact O-N 2.97Å; C367-T372 PolarHBondContact N-O 3.28Å; C367-I374 HydrophobicContact CB-CD1 4.26Å; C367-I374 HydrophobicContact CB-CG1 4.3Å; C367-P386 CarbonylContact C-O 3.53Å; C367-P386 WeakPolarHBondContact CA-O 3.49Å; C367-C388 HydrophobicContact CB-CB 4.21Å; C367-C388 PolarHBondContact SG-N 3.23Å; C367-C388 VanDerWaalsContact SG-SG 3.67Å; C367-D391 PolarHBondContact SG-OD2 3.15Å
368	A	92.4	Very high	89.8	Confident	27 Å²	27	55.1 Å²	55.1	22%	0.223	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.7	178.6	0	0	0	0	0	113.4	T366 K371 V385 P386 Y387	T366-A368 PolarHBondContact O-N 3.2Å; A368-K371 WeakPolarHBondContact O-CE 3.49Å; A368-K371 PolarHBondContact O-NZ 2.83Å; A368-V385 HydrophobicContact CB-CB 4.2Å; A368-V385 HydrophobicContact CB-CG2 4.16Å; A368-P386 PolarHBondContact N-O 3.41Å; A368-Y387 HydrophobicContact CB-CD1 4.15Å; A368-Y387 HydrophobicContact CB-CE1 3.63Å; A368-Y387 HydrophobicContact CB-CE2 4.24Å
369	A	91.1	Very high	89.9	Confident	38 Å²	38	50.7 Å²	50.7	31%	0.314	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-85	173.5	0	0	0	0	0	112.3	C367 K371 Y387 D391 M395	C367-A369 PolarHBondContact O-N 3.41Å; C367-A369 PolarHBondContact SG-N 3.16Å; C367-A369 VanDerWaalsContact SG-N 3.42Å; A369-K371 PolarHBondContact O-N 2.83Å; A369-Y387 HydrophobicContact CB-CD1 4.09Å; A369-Y387 HydrophobicContact CB-CE1 4.05Å; A369-D391 HydrophobicContact CB-CB 3.9Å; A369-D391 WeakPolarHBondContact CB-OD2 3.28Å; A369-M395 HydrophobicContact CB-CE 4.28Å; A369-M395 HydrophobicContact CB-SD 4.45Å
370	C	93	Very high	89.8	Confident	45 Å²	45	52.5 Å²	52.5	30%	0.304	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	3.6	-174.1	70.7	0	0	0	0	116.5	T372 R390 D391	C370-T372 PolarHBondContact O-N 2.86Å; C370-T372 PolarHBondContact O-OG1 3.15Å; C370-T372 VanDerWaalsContact SG-CB 3.51Å; C370-T372 PolarHBondContact SG-OG1 3.1Å; C370-T372 VanDerWaalsContact SG-OG1 3.41Å; C370-R390 PolarHBondContact SG-NH2 3.23Å; C370-R390 VanDerWaalsContact SG-NH2 3.42Å; C370-D391 WeakPolarHBondContact CB-OD2 3.32Å; C370-D391 PolarHBondContact N-OD2 3.46Å; C370-D391 PolarHBondContact SG-OD2 2.94Å
371	K	92	Very high	89.6	Confident	145 Å²	145	54.2 Å²	54.2	63%	0.63	27%	0.271	S	S	*	.			trans	54.9	5.9	-178.1	-47	-53.2	-176.3	-172	0	115.9	T366 C367 A368 A369	T366-K371 WeakPolarHBondContact CB-O 3.38Å; T366-K371 WeakPolarHBondContact CG2-O 3.45Å; C367-K371 WeakPolarHBondContact O-CA 3.32Å; C367-K371 PolarHBondContact O-N 2.97Å; A368-K371 WeakPolarHBondContact O-CE 3.49Å; A368-K371 PolarHBondContact O-NZ 2.83Å; A369-K371 PolarHBondContact O-N 2.83Å
372	T	91.6	Very high	89.4	Confident	78 Å²	78	56.4 Å²	56.4	48%	0.479	28%	0.281	S	S	.	.			trans	-75.9	139.3	-178.4	-59.3	0	0	0	0	110	T366 C367 C370 I374	T366-T372 WeakPolarHBondContact CA-O 3.35Å; C367-T372 PolarHBondContact N-O 3.28Å; C370-T372 PolarHBondContact O-N 2.86Å; C370-T372 PolarHBondContact O-OG1 3.15Å; C370-T372 VanDerWaalsContact SG-CB 3.51Å; C370-T372 PolarHBondContact SG-OG1 3.1Å; C370-T372 VanDerWaalsContact SG-OG1 3.41Å; T372-I374 PolarHBondContact O-N 2.93Å
373	P	91	Very high	89.2	Confident	46 Å²	46	64.5 Å²	64.5	30%	0.299	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-64.6	130.3	176.9	25.7	-34.8	0	0	0	111.5	V362 T366 R375	V362-P373 HydrophobicContact CG1-CB 3.67Å; V362-P373 HydrophobicContact CG1-CG 4.23Å; T366-P373 HydrophobicContact CG2-CB 4.17Å; P373-R375 PolarHBondContact O-N 3.44Å
374	I	90.1	Very high	88.8	Confident	7 Å²	7	61 Å²	61	4%	0.036	32%	0.317	C	S	.	.			trans	-83.1	112	179.1	-58.3	-179.1	0	0	0	107.7	T241 M353 F365 C367 T372 F379 P386 C388	T241-I374 HydrophobicContact CG2-CG2 3.9Å; M353-I374 WeakPolarHBondContact CE-O 3.09Å; F365-I374 HydrophobicContact CD1-CB 4.02Å; F365-I374 HydrophobicContact CE1-CB 4.2Å; F365-I374 HydrophobicContact CE1-CD1 4.35Å; F365-I374 HydrophobicContact CE1-CG2 4.36Å; F365-I374 PolarHBondContact O-N 2.76Å; C367-I374 HydrophobicContact CB-CD1 4.26Å; C367-I374 HydrophobicContact CB-CG1 4.3Å; T372-I374 PolarHBondContact O-N 2.93Å; I374-F379 HydrophobicContact CD1-CB 3.92Å; I374-F379 HydrophobicContact CG2-CB 4.02Å; I374-P386 HydrophobicContact CD1-CB 4.22Å; I374-C388 HydrophobicContact CD1-CB 4.18Å; I374-C388 HydrophobicContact CG1-CB 4.17Å
375	R	86.1	Confident	88.7	Confident	116 Å²	116	63.5 Å²	63.5	44%	0.438	33%	0.331	S	S	.	.			trans	-128.5	120.3	-176.5	-72.9	-156.3	-90.4	-167.5	2.8	112.2	L243 E351 M353 V362 P373 R377	L243-R375 HydrophobicContact CD1-CB 3.72Å; L243-R375 HydrophobicContact CD1-CG 3.94Å; L243-R375 HydrophobicContact CD2-CG 4.41Å; E351-R375 IonicContact OE1-NH1 2.67Å; E351-R375 IonicContact OE2-NH1 2.66Å; E351-R375 PolarHBondContact OE2-NH1 2.98Å; M353-R375 HydrophobicContact SD-CG 3.91Å; V362-R375 VanDerWaalsContact CG1-CD 3.49Å; V362-R375 HydrophobicContact CG1-CG 3.86Å; P373-R375 PolarHBondContact O-N 3.44Å; R375-R377 VanDerWaalsContact C-N 3.26Å; R375-R377 PolarHBondContact O-N 2.92Å
376	N	76.6	Confident	88.7	Confident	83 Å²	83	64.4 Å²	64.4	44%	0.444	34%	0.338	S	S	.	.	S	Bend	trans	47.8	46.2	175.4	-170.9	49.2	0	0	0	113.3	R233 T241 L243	R233-N376 PolarHBondContact NH1-ND2 2.86Å; T241-N376 WeakPolarHBondContact O-CA 3.47Å; T241-N376 PolarHBondContact OG1-N 2.68Å; T241-N376 VanDerWaalsContact OG1-N 3.07Å; L243-N376 HydrophobicContact CD1-CB 4.14Å
377	R	81.1	Confident	88.6	Confident	184 Å²	184	64.7 Å²	64.7	69%	0.694	34%	0.336	S	S	*	.	S	Bend	trans	-141.8	162.2	178.4	-70.2	-177.9	-171.7	-158.4	-0.9	110.2	T241 R375	T241-R377 PolarHBondContact N-O 3.12Å; T241-R377 PolarHBondContact OG1-N 3.28Å; T241-R377 PolarHBondContact OG1-O 3.41Å; R375-R377 VanDerWaalsContact C-N 3.26Å; R375-R377 PolarHBondContact O-N 2.92Å
378	A	83.1	Confident	88.5	Confident	15 Å²	15	65.9 Å²	65.9	12%	0.124	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-62.6	148.1	167.1	0	0	0	0	0	111
379	F	90.2	Very high	88.3	Confident	3 Å²	3	67.7 Å²	67.7	1%	0.013	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	157.8	171.6	71.1	-84.4	0	0	0	110.3	T239 T241 A355 L356 F365 I374 M381 P386 Y387	T239-F379 HydrophobicContact CG2-CE1 3.58Å; T239-F379 HydrophobicContact CG2-CE2 4.19Å; T239-F379 HydrophobicContact CG2-CZ 3.34Å; T239-F379 WeakPolarHBondContact O-CD1 3.48Å; T239-F379 WeakPolarHBondContact O-CE1 3.38Å; T239-F379 PolarHBondContact O-N 3.36Å; T241-F379 HydrophobicContact CG2-CD1 3.65Å; T241-F379 HydrophobicContact CG2-CE1 3.62Å; A355-F379 HydrophobicContact CB-CE1 4.35Å; A355-F379 HydrophobicContact CB-CZ 4.18Å; L356-F379 HydrophobicContact CD2-CE2 4.32Å; L356-F379 HydrophobicContact CD2-CZ 4.19Å; L356-F379 HydrophobicContact CG-CE2 4.4Å; L356-F379 HydrophobicContact CG-CZ 4.16Å; F365-F379 HydrophobicContact CE1-CD1 4.18Å; F365-F379 HydrophobicContact CE1-CD2 4.26Å; F365-F379 HydrophobicContact CE1-CE1 4.12Å; F365-F379 HydrophobicContact CE1-CE2 4.24Å; F365-F379 HydrophobicContact CE1-CG 4.23Å; F365-F379 HydrophobicContact CE1-CZ 4.14Å; F365-F379 HydrophobicContact CZ-CD1 4.47Å; F365-F379 AromaticContact CZ-CD2 3.96Å; F365-F379 HydrophobicContact CZ-CD2 3.96Å; F365-F379 HydrophobicContact CZ-CE1 4.12Å; F365-F379 AromaticContact CZ-CE2 3.6Å; F365-F379 HydrophobicContact CZ-CE2 3.6Å; F365-F379 HydrophobicContact CZ-CG 4.37Å; F365-F379 AromaticContact CZ-CZ 3.68Å; F365-F379 HydrophobicContact CZ-CZ 3.68Å; I374-F379 HydrophobicContact CD1-CB 3.92Å; I374-F379 HydrophobicContact CG2-CB 4.02Å; F379-M381 HydrophobicContact CD2-CG 4.14Å; F379-M381 HydrophobicContact CE2-CG 3.75Å; F379-M381 HydrophobicContact CE2-SD 4.25Å; F379-P386 HydrophobicContact CD2-CB 4.17Å; F379-Y387 WeakPolarHBondContact CA-O 3.45Å; F379-Y387 WeakPolarHBondContact CB-O 3.36Å
380	Y	88.7	Confident	88.2	Confident	64 Å²	64	73.3 Å²	73.3	25%	0.251	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	150.7	179	-59.9	-86.1	0	0	0	108.5	P386 Y387 E389 Y392	Y380-P386 WeakPolarHBondContact O-CA 3.25Å; Y380-Y387 PolarHBondContact N-O 2.8Å; Y380-Y387 PolarHBondContact O-N 2.78Å; Y380-E389 HydrophobicContact CE2-CB 4.03Å; Y380-E389 HydrophobicContact CE2-CG 4.17Å; Y380-Y392 VanDerWaalsContact CB-CD2 3.48Å; Y380-Y392 HydrophobicContact CD1-CD1 4.09Å; Y380-Y392 AromaticContact CD1-CE1 3.94Å; Y380-Y392 HydrophobicContact CD1-CE1 3.94Å; Y380-Y392 AromaticContact CD2-CD1 3.64Å; Y380-Y392 HydrophobicContact CD2-CD1 3.64Å; Y380-Y392 HydrophobicContact CD2-CE1 4.32Å; Y380-Y392 AromaticContact CD2-CG 3.79Å; Y380-Y392 HydrophobicContact CD2-CG 3.79Å; Y380-Y392 HydrophobicContact CE2-CD1 4.25Å; Y380-Y392 AromaticContact CG-CD1 3.56Å; Y380-Y392 HydrophobicContact CG-CD1 3.56Å; Y380-Y392 HydrophobicContact CG-CD2 4.16Å; Y380-Y392 AromaticContact CG-CE1 3.82Å; Y380-Y392 HydrophobicContact CG-CE1 3.82Å; Y380-Y392 HydrophobicContact CG-CE2 4.39Å; Y380-Y392 AromaticContact CG-CG 3.75Å; Y380-Y392 HydrophobicContact CG-CG 3.75Å
381	M	88.3	Confident	88	Confident	74 Å²	74	71.8 Å²	71.8	37%	0.365	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	114.6	-178.7	-79.3	-80.7	-70.4	0	0	107.9	L356 F379 G384 P386	L356-M381 HydrophobicContact CD1-CE 3.63Å; L356-M381 HydrophobicContact CD1-CG 4.45Å; L356-M381 HydrophobicContact CD1-SD 3.89Å; L356-M381 HydrophobicContact CD2-CG 4.49Å; F379-M381 HydrophobicContact CD2-CG 4.14Å; F379-M381 HydrophobicContact CE2-CG 3.75Å; F379-M381 HydrophobicContact CE2-SD 4.25Å; M381-G384 WeakPolarHBondContact CE-O 3.42Å; M381-P386 HydrophobicContact SD-CB 3.98Å
382	E	88	Confident	87.9	Confident	68 Å²	68	67.7 Å²	67.7	32%	0.318	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.7	176.6	-163	60.3	-96.2	0	0	107.9	G384 V385 Y387 Y392 F396	E382-G384 PolarHBondContact O-N 2.87Å; E382-V385 PolarHBondContact N-O 2.94Å; E382-V385 VanDerWaalsContact N-O 3.13Å; E382-V385 WeakPolarHBondContact O-CG2 3.29Å; E382-V385 PolarHBondContact O-N 3.2Å; E382-Y387 HydrophobicContact CB-CD2 4.01Å; E382-Y387 HydrophobicContact CB-CE2 3.89Å; E382-Y392 HydrophobicContact CB-CE2 4.44Å; E382-F396 HydrophobicContact CB-CE2 4.45Å; E382-F396 HydrophobicContact CB-CZ 4.34Å; E382-F396 HydrophobicContact CG-CE1 4.03Å; E382-F396 HydrophobicContact CG-CE2 4.45Å; E382-F396 HydrophobicContact CG-CZ 3.99Å
383	E	86.3	Confident	87.5	Confident	190 Å²	190	67.6 Å²	67.6	89%	0.888	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	23.9	-174.6	-58	-171	141	0	0	115.4
384	G	84.4	Confident	87.1	Confident	55 Å²	55	73 Å²	73	57%	0.567	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	3.1	-176.9	0	0	0	0	0	115.8	M381 E382	M381-G384 WeakPolarHBondContact CE-O 3.42Å; E382-G384 PolarHBondContact O-N 2.87Å
385	V	89.5	Confident	86.7	Confident	62 Å²	62	76.9 Å²	76.9	38%	0.376	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	140.4	174.4	-67.4	0	0	0	0	112.3	A368 E382 Y387	A368-V385 HydrophobicContact CB-CB 4.2Å; A368-V385 HydrophobicContact CB-CG2 4.16Å; E382-V385 PolarHBondContact N-O 2.94Å; E382-V385 VanDerWaalsContact N-O 3.13Å; E382-V385 WeakPolarHBondContact O-CG2 3.29Å; E382-V385 PolarHBondContact O-N 3.2Å; V385-Y387 HydrophobicContact CG2-CE2 3.7Å
386	P	91.3	Very high	86.5	Confident	23 Å²	23	75.5 Å²	75.5	15%	0.149	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	133.4	-175.9	31.8	-34.4	0	0	0	112.5	F365 C367 A368 I374 F379 Y380 M381	F365-P386 HydrophobicContact CE1-CB 4.36Å; F365-P386 HydrophobicContact CE2-CB 4.2Å; F365-P386 HydrophobicContact CE2-CG 4.14Å; F365-P386 HydrophobicContact CZ-CB 3.83Å; F365-P386 HydrophobicContact CZ-CG 4.24Å; C367-P386 CarbonylContact C-O 3.53Å; C367-P386 WeakPolarHBondContact CA-O 3.49Å; A368-P386 PolarHBondContact N-O 3.41Å; I374-P386 HydrophobicContact CD1-CB 4.22Å; F379-P386 HydrophobicContact CD2-CB 4.17Å; Y380-P386 WeakPolarHBondContact O-CA 3.25Å; M381-P386 HydrophobicContact SD-CB 3.98Å
387	Y	91.9	Very high	86.8	Confident	35 Å²	35	72.6 Å²	72.6	14%	0.137	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	140.1	170.2	-68.9	-85.5	0	0	0	110.6	A368 A369 F379 Y380 E382 V385 M395 F396	A368-Y387 HydrophobicContact CB-CD1 4.15Å; A368-Y387 HydrophobicContact CB-CE1 3.63Å; A368-Y387 HydrophobicContact CB-CE2 4.24Å; A369-Y387 HydrophobicContact CB-CD1 4.09Å; A369-Y387 HydrophobicContact CB-CE1 4.05Å; F379-Y387 WeakPolarHBondContact CA-O 3.45Å; F379-Y387 WeakPolarHBondContact CB-O 3.36Å; Y380-Y387 PolarHBondContact N-O 2.8Å; Y380-Y387 PolarHBondContact O-N 2.78Å; E382-Y387 HydrophobicContact CB-CD2 4.01Å; E382-Y387 HydrophobicContact CB-CE2 3.89Å; V385-Y387 HydrophobicContact CG2-CE2 3.7Å; Y387-M395 HydrophobicContact CD1-CE 3.91Å; Y387-M395 HydrophobicContact CE1-CE 3.32Å; Y387-F396 HydrophobicContact CD1-CE2 4.36Å; Y387-F396 HydrophobicContact CD2-CE2 4.04Å; Y387-F396 HydrophobicContact CE1-CE2 4.26Å; Y387-F396 AromaticContact CE2-CE2 3.91Å; Y387-F396 HydrophobicContact CE2-CE2 3.91Å; Y387-F396 HydrophobicContact CE2-CZ 4.1Å; Y387-F396 HydrophobicContact CG-CE2 4.26Å
388	C	91.8	Very high	86.9	Confident	25 Å²	25	67.3 Å²	67.3	17%	0.169	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	145	167.7	67.8	0	0	0	0	110	C367 I374 R390 D391 Y392	C367-C388 HydrophobicContact CB-CB 4.21Å; C367-C388 PolarHBondContact SG-N 3.23Å; C367-C388 VanDerWaalsContact SG-SG 3.67Å; I374-C388 HydrophobicContact CD1-CB 4.18Å; I374-C388 HydrophobicContact CG1-CB 4.17Å; C388-R390 PolarHBondContact O-N 3.31Å; C388-D391 PolarHBondContact O-N 3.17Å; C388-D391 PolarHBondContact SG-OD2 3.32Å; C388-Y392 PolarHBondContact O-N 3.41Å
389	E	87.7	Confident	87.1	Confident	65 Å²	65	70.9 Å²	70.9	30%	0.304	35%	0.35	S	S	.	.	H	α-helix	trans	-33.4	-60.5	179.1	-179.8	169.7	-113.6	0	0	114.9	Y380 D391 Y392 E393	Y380-E389 HydrophobicContact CE2-CB 4.03Å; Y380-E389 HydrophobicContact CE2-CG 4.17Å; E389-D391 VanDerWaalsContact C-N 3.31Å; E389-D391 PolarHBondContact O-N 3.2Å; E389-Y392 PolarHBondContact O-N 3.04Å; E389-Y392 VanDerWaalsContact O-N 3.17Å; E389-E393 PolarHBondContact O-N 2.96Å
390	R	88.8	Confident	87.1	Confident	157 Å²	157	70.8 Å²	70.8	59%	0.592	35%	0.35	S	S	*	.	H	α-helix	trans	-54	-41.8	178	-178	-162.6	66.1	-158.3	-6.4	114.1	C370 C388 K394	C370-R390 PolarHBondContact SG-NH2 3.23Å; C370-R390 VanDerWaalsContact SG-NH2 3.42Å; C388-R390 PolarHBondContact O-N 3.31Å; R390-K394 WeakPolarHBondContact O-CB 3.32Å; R390-K394 PolarHBondContact O-N 3.36Å; R390-K394 VanDerWaalsContact O-N 3.15Å
391	D	89.8	Confident	87.1	Confident	12 Å²	12	71.6 Å²	71.6	6%	0.064	36%	0.356	C	S	.	.	H	α-helix	trans	-80.5	-32.4	-177	-64.8	4.9	0	0	0	110.8	C367 A369 C370 C388 E389 K394 M395	C367-D391 PolarHBondContact SG-OD2 3.15Å; A369-D391 HydrophobicContact CB-CB 3.9Å; A369-D391 WeakPolarHBondContact CB-OD2 3.28Å; C370-D391 WeakPolarHBondContact CB-OD2 3.32Å; C370-D391 PolarHBondContact N-OD2 3.46Å; C370-D391 PolarHBondContact SG-OD2 2.94Å; C388-D391 PolarHBondContact O-N 3.17Å; C388-D391 PolarHBondContact SG-OD2 3.32Å; E389-D391 VanDerWaalsContact C-N 3.31Å; E389-D391 PolarHBondContact O-N 3.2Å; D391-K394 PolarHBondContact O-N 2.81Å; D391-M395 WeakPolarHBondContact O-CG 3.24Å; D391-M395 PolarHBondContact O-N 3.26Å; D391-M395 VanDerWaalsContact O-N 3.16Å
392	Y	89.2	Confident	87	Confident	60 Å²	60	70 Å²	70	24%	0.235	36%	0.359	C	S	.	.	H	α-helix	trans	-64.6	-51.8	172.6	-175.5	-98	0	0	0	110.9	Y380 E382 C388 E389 K394 M395 F396 G397	Y380-Y392 VanDerWaalsContact CB-CD2 3.48Å; Y380-Y392 HydrophobicContact CD1-CD1 4.09Å; Y380-Y392 AromaticContact CD1-CE1 3.94Å; Y380-Y392 HydrophobicContact CD1-CE1 3.94Å; Y380-Y392 AromaticContact CD2-CD1 3.64Å; Y380-Y392 HydrophobicContact CD2-CD1 3.64Å; Y380-Y392 HydrophobicContact CD2-CE1 4.32Å; Y380-Y392 AromaticContact CD2-CG 3.79Å; Y380-Y392 HydrophobicContact CD2-CG 3.79Å; Y380-Y392 HydrophobicContact CE2-CD1 4.25Å; Y380-Y392 AromaticContact CG-CD1 3.56Å; Y380-Y392 HydrophobicContact CG-CD1 3.56Å; Y380-Y392 HydrophobicContact CG-CD2 4.16Å; Y380-Y392 AromaticContact CG-CE1 3.82Å; Y380-Y392 HydrophobicContact CG-CE1 3.82Å; Y380-Y392 HydrophobicContact CG-CE2 4.39Å; Y380-Y392 AromaticContact CG-CG 3.75Å; Y380-Y392 HydrophobicContact CG-CG 3.75Å; E382-Y392 HydrophobicContact CB-CE2 4.44Å; C388-Y392 PolarHBondContact O-N 3.41Å; E389-Y392 PolarHBondContact O-N 3.04Å; E389-Y392 VanDerWaalsContact O-N 3.17Å; Y392-K394 VanDerWaalsContact C-N 3.26Å; Y392-K394 PolarHBondContact O-N 3.46Å; Y392-M395 PolarHBondContact O-N 2.8Å; Y392-F396 HydrophobicContact CD2-CB 4.36Å; Y392-F396 AromaticContact CD2-CD2 3.38Å; Y392-F396 HydrophobicContact CD2-CD2 3.38Å; Y392-F396 AromaticContact CD2-CE2 4Å; Y392-F396 HydrophobicContact CD2-CE2 4Å; Y392-F396 HydrophobicContact CD2-CG 4.19Å; Y392-F396 HydrophobicContact CE2-CB 4.1Å; Y392-F396 AromaticContact CE2-CD2 3.68Å; Y392-F396 HydrophobicContact CE2-CD2 3.68Å; Y392-F396 HydrophobicContact CE2-CE2 4.38Å; Y392-F396 HydrophobicContact CE2-CG 4.07Å; Y392-F396 HydrophobicContact CG-CD2 4.08Å; Y392-F396 PolarHBondContact O-N 3.33Å; Y392-G397 PolarHBondContact O-N 3.15Å
393	E	84.1	Confident	87.1	Confident	75 Å²	75	68.7 Å²	68.7	35%	0.35	36%	0.356	S	S	.	.	H	α-helix	trans	-52.2	-43.7	171.4	-77.5	-179	-133.1	0	0	112.2	E389 M395 G397 K406	E389-E393 PolarHBondContact O-N 2.96Å; E393-M395 VanDerWaalsContact C-N 3.35Å; E393-M395 PolarHBondContact O-N 3.03Å; E393-G397 VanDerWaalsContact O-CA 3.26Å; E393-G397 WeakPolarHBondContact O-CA 3.37Å; E393-G397 PolarHBondContact O-N 2.93Å; E393-G397 VanDerWaalsContact O-N 3.07Å; E393-K406 IonicContact OE2-NZ 2.68Å; E393-K406 PolarHBondContact OE2-NZ 2.98Å
394	K	83.3	Confident	87	Confident	160 Å²	160	66.1 Å²	66.1	70%	0.696	35%	0.349	S	S	*	.	H	α-helix	trans	-64.5	-38.2	-177.1	-174.9	179.1	178.1	-174.7	0	112.4	R390 D391 Y392 K399	R390-K394 WeakPolarHBondContact O-CB 3.32Å; R390-K394 PolarHBondContact O-N 3.36Å; R390-K394 VanDerWaalsContact O-N 3.15Å; D391-K394 PolarHBondContact O-N 2.81Å; Y392-K394 VanDerWaalsContact C-N 3.26Å; Y392-K394 PolarHBondContact O-N 3.46Å; K394-K399 PolarHBondContact O-NZ 2.88Å
395	M	81.7	Confident	87	Confident	89 Å²	89	70.8 Å²	70.8	44%	0.438	35%	0.354	S	S	.	.	H	α-helix	trans	-94.5	-51.3	-175.2	-58.8	-163	-44.1	0	0	112.3	A369 Y387 D391 Y392 E393 K399	A369-M395 HydrophobicContact CB-CE 4.28Å; A369-M395 HydrophobicContact CB-SD 4.45Å; Y387-M395 HydrophobicContact CD1-CE 3.91Å; Y387-M395 HydrophobicContact CE1-CE 3.32Å; D391-M395 WeakPolarHBondContact O-CG 3.24Å; D391-M395 PolarHBondContact O-N 3.26Å; D391-M395 VanDerWaalsContact O-N 3.16Å; Y392-M395 PolarHBondContact O-N 2.8Å; E393-M395 VanDerWaalsContact C-N 3.35Å; E393-M395 PolarHBondContact O-N 3.03Å; M395-K399 PolarHBondContact O-NZ 3.29Å
396	F	81.3	Confident	86.8	Confident	86 Å²	86	71.8 Å²	71.8	38%	0.377	35%	0.353	S	S	.	.	H	α-helix	trans	-102.6	-10.7	-171.9	-49.2	-76.9	0	0	0	114.1	E382 Y387 Y392	E382-F396 HydrophobicContact CB-CE2 4.45Å; E382-F396 HydrophobicContact CB-CZ 4.34Å; E382-F396 HydrophobicContact CG-CE1 4.03Å; E382-F396 HydrophobicContact CG-CE2 4.45Å; E382-F396 HydrophobicContact CG-CZ 3.99Å; Y387-F396 HydrophobicContact CD1-CE2 4.36Å; Y387-F396 HydrophobicContact CD2-CE2 4.04Å; Y387-F396 HydrophobicContact CE1-CE2 4.26Å; Y387-F396 AromaticContact CE2-CE2 3.91Å; Y387-F396 HydrophobicContact CE2-CE2 3.91Å; Y387-F396 HydrophobicContact CE2-CZ 4.1Å; Y387-F396 HydrophobicContact CG-CE2 4.26Å; Y392-F396 HydrophobicContact CD2-CB 4.36Å; Y392-F396 AromaticContact CD2-CD2 3.38Å; Y392-F396 HydrophobicContact CD2-CD2 3.38Å; Y392-F396 AromaticContact CD2-CE2 4Å; Y392-F396 HydrophobicContact CD2-CE2 4Å; Y392-F396 HydrophobicContact CD2-CG 4.19Å; Y392-F396 HydrophobicContact CE2-CB 4.1Å; Y392-F396 AromaticContact CE2-CD2 3.68Å; Y392-F396 HydrophobicContact CE2-CD2 3.68Å; Y392-F396 HydrophobicContact CE2-CE2 4.38Å; Y392-F396 HydrophobicContact CE2-CG 4.07Å; Y392-F396 HydrophobicContact CG-CD2 4.08Å; Y392-F396 PolarHBondContact O-N 3.33Å
397	G	81.5	Confident	86.7	Confident	22 Å²	22	71.9 Å²	71.9	23%	0.227	35%	0.352	C	S	.	.	S	Bend	trans	-65.6	134.3	177.9	0	0	0	0	0	112.8	Y392 E393 K399	Y392-G397 PolarHBondContact O-N 3.15Å; E393-G397 VanDerWaalsContact O-CA 3.26Å; E393-G397 WeakPolarHBondContact O-CA 3.37Å; E393-G397 PolarHBondContact O-N 2.93Å; E393-G397 VanDerWaalsContact O-N 3.07Å; G397-K399 WeakPolarHBondContact O-CE 3.32Å; G397-K399 PolarHBondContact O-N 3.22Å
398	T	84.4	Confident	86.2	Confident	73 Å²	73	72.5 Å²	72.5	45%	0.448	36%	0.358	S	S	.	.			trans	-56.2	128.6	178.9	-49	0	0	0	0	111.5	K406 I407 S420	T398-K406 WeakPolarHBondContact O-CA 3.03Å; T398-I407 HydrophobicContact CG2-CD1 4.06Å; T398-I407 PolarHBondContact O-N 3.31Å; T398-S420 VanDerWaalsContact CG2-OG 3.26Å; T398-S420 WeakPolarHBondContact CG2-OG 3.37Å
399	K	87.4	Confident	85.4	Confident	91 Å²	91	77 Å²	77	40%	0.396	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-119.4	144.1	-180	-68.6	146.5	-168.4	158.5	0	110.3	K394 M395 G397 H401 F405	K394-K399 PolarHBondContact O-NZ 2.88Å; M395-K399 PolarHBondContact O-NZ 3.29Å; G397-K399 WeakPolarHBondContact O-CE 3.32Å; G397-K399 PolarHBondContact O-N 3.22Å; K399-H401 PolarHBondContact O-N 2.95Å; K399-F405 WeakPolarHBondContact CA-O 3.09Å
400	C	90.4	Very high	85	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	42%	0.421	C	S	.	.			trans	-76.7	117.6	175.6	169.5	0	0	0	0	110.2	G402 C403 D404 F405 I407 S420 H422 C425	C400-G402 PolarHBondContact O-N 3.36Å; C400-G402 VanDerWaalsContact O-N 3.13Å; C400-G402 PolarHBondContact SG-N 3.36Å; C400-G402 VanDerWaalsContact SG-N 3.42Å; C400-C403 PolarHBondContact O-N 3.3Å; C400-C403 VanDerWaalsContact O-N 3.12Å; C400-D404 WeakPolarHBondContact O-CA 3.29Å; C400-D404 PolarHBondContact O-N 3.45Å; C400-F405 PolarHBondContact N-O 3.46Å; C400-I407 HydrophobicContact CB-CD1 4.19Å; C400-I407 HydrophobicContact CB-CG1 4.08Å; C400-S420 WeakPolarHBondContact CA-O 3.44Å; C400-H422 WeakPolarHBondContact CB-ND1 3.39Å; C400-H422 PolarHBondContact SG-N 2.94Å; C400-C425 WeakPolarHBondContact SG-CB 3.35Å
401	H	88.1	Confident	84.8	Confident	81 Å²	81	72.3 Å²	72.3	38%	0.375	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.2	179.4	-168.6	114.1	0	0	0	113.2	K399 F419 S420 W421	K399-H401 PolarHBondContact O-N 2.95Å; H401-F419 HydrophobicContact CB-CB 3.82Å; H401-F419 HydrophobicContact CB-CG 4.17Å; H401-F419 AromaticContact CE1-CD2 3.85Å; H401-F419 AromaticContact CE1-CE1 3.88Å; H401-F419 AromaticContact CE1-CE2 3.68Å; H401-F419 AromaticContact CE1-CZ 3.69Å; H401-F419 AromaticContact CG-CG 3.95Å; H401-F419 AromaticContact ND1-CD1 3.29Å; H401-F419 VanDerWaalsContact ND1-CD1 3.29Å; H401-F419 WeakPolarHBondContact ND1-CD1 3.47Å; H401-F419 AromaticContact ND1-CD2 3.54Å; H401-F419 AromaticContact ND1-CE1 3.53Å; H401-F419 AromaticContact ND1-CE2 3.78Å; H401-F419 AromaticContact ND1-CG 3.29Å; H401-F419 VanDerWaalsContact ND1-CG 3.29Å; H401-F419 WeakPolarHBondContact ND1-CG 3.42Å; H401-F419 AromaticContact ND1-CZ 3.77Å; H401-S420 PolarHBondContact N-O 3.12Å; H401-W421 HydrophobicContact CB-CD2 4.18Å; H401-W421 HydrophobicContact CB-CE3 4.3Å; H401-W421 HydrophobicContact CB-CH2 4.02Å; H401-W421 HydrophobicContact CB-CZ2 3.9Å; H401-W421 HydrophobicContact CB-CZ3 4.23Å; H401-W421 AromaticContact CD2-CH2 3.49Å; H401-W421 VanDerWaalsContact CD2-CH2 3.49Å; H401-W421 WeakPolarHBondContact CD2-CH2 3.24Å; H401-W421 AromaticContact CD2-CZ2 3.88Å; H401-W421 AromaticContact CG-CH2 3.99Å; H401-W421 AromaticContact CG-CZ2 3.99Å
402	G	87.1	Confident	84.7	Confident	41 Å²	41	79.3 Å²	79.3	42%	0.423	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-13.3	177.9	0	0	0	0	0	115.4	C400	C400-G402 PolarHBondContact O-N 3.36Å; C400-G402 VanDerWaalsContact O-N 3.13Å; C400-G402 PolarHBondContact SG-N 3.36Å; C400-G402 VanDerWaalsContact SG-N 3.42Å
403	C	89.2	Confident	84.8	Confident	40 Å²	40	81.6 Å²	81.6	27%	0.27	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.1	2.6	-175.8	69.8	0	0	0	0	115.8	C400 F405	C400-C403 PolarHBondContact O-N 3.3Å; C400-C403 VanDerWaalsContact O-N 3.12Å; C403-F405 HydrophobicContact CB-CD2 4.08Å; C403-F405 WeakPolarHBondContact O-CD2 3.04Å; C403-F405 PolarHBondContact O-N 3.29Å
404	D	84.9	Confident	85.2	Confident	137 Å²	137	79.9 Å²	79.9	73%	0.733	43%	0.434	S	S	*	.			trans	56.9	-1.9	-177.1	-65.1	-49.5	0	0	0	117	C400	C400-D404 WeakPolarHBondContact O-CA 3.29Å; C400-D404 PolarHBondContact O-N 3.45Å
405	F	83.8	Confident	85.6	Confident	153 Å²	153	79.3 Å²	79.3	67%	0.671	43%	0.434	S	S	*	.			trans	-74.5	149.3	173.3	-68.5	-75.5	0	0	0	111.8	K399 C400 C403	K399-F405 WeakPolarHBondContact CA-O 3.09Å; C400-F405 PolarHBondContact N-O 3.46Å; C403-F405 HydrophobicContact CB-CD2 4.08Å; C403-F405 WeakPolarHBondContact O-CD2 3.04Å; C403-F405 PolarHBondContact O-N 3.29Å
406	K	85.4	Confident	85.9	Confident	83 Å²	83	75.7 Å²	75.7	36%	0.361	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-61.2	151.5	172.3	64.9	168.2	179	152.9	0	111.8	E393 T398 D408 H422	E393-K406 IonicContact OE2-NZ 2.68Å; E393-K406 PolarHBondContact OE2-NZ 2.98Å; T398-K406 WeakPolarHBondContact O-CA 3.03Å; K406-D408 WeakPolarHBondContact CD-OD1 3.44Å; K406-D408 WeakPolarHBondContact CE-OD1 3.35Å; K406-D408 IonicContact NZ-OD1 3.94Å; K406-D408 PolarHBondContact NZ-OD1 2.63Å; K406-H422 PolarHBondContact O-CE1 3.41Å
407	I	88.2	Confident	86.2	Confident	24 Å²	24	74 Å²	74	12%	0.123	41%	0.413	C	S	.	.			trans	-95.5	108.4	171.8	-54	-174.5	0	0	0	106.5	T398 C400 D411 F413	T398-I407 HydrophobicContact CG2-CD1 4.06Å; T398-I407 PolarHBondContact O-N 3.31Å; C400-I407 HydrophobicContact CB-CD1 4.19Å; C400-I407 HydrophobicContact CB-CG1 4.08Å; I407-D411 HydrophobicContact CG2-CB 3.83Å; I407-F413 HydrophobicContact CD1-CB 3.87Å; I407-F413 HydrophobicContact CD1-CD2 4.32Å; I407-F413 HydrophobicContact CD1-CG 4.23Å; I407-F413 HydrophobicContact CG2-CB 3.72Å; I407-F413 HydrophobicContact CG2-CD1 3.8Å; I407-F413 HydrophobicContact CG2-CG 3.86Å
408	D	83.3	Confident	86.3	Confident	48 Å²	48	77 Å²	77	26%	0.257	44%	0.444	S	S	.	.			trans	-76.5	154.1	-176.9	-82.7	-44.1	0	0	0	110.9	R32 K406 G410 D411	R32-D408 IonicContact NH2-OD2 2.84Å; K406-D408 WeakPolarHBondContact CD-OD1 3.44Å; K406-D408 WeakPolarHBondContact CE-OD1 3.35Å; K406-D408 IonicContact NZ-OD1 3.94Å; K406-D408 PolarHBondContact NZ-OD1 2.63Å; D408-G410 PolarHBondContact O-N 2.91Å; D408-D411 PolarHBondContact N-OD2 2.81Å; D408-D411 WeakPolarHBondContact O-CB 3.4Å; D408-D411 PolarHBondContact O-N 2.81Å
409	A	74.6	Confident	86.6	Confident	119 Å²	119	77.5 Å²	77.5	98%	0.983	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	99.5	-178.7	0	0	0	0	0	111.4
410	G	78	Confident	86.8	Confident	80 Å²	80	74 Å²	74	83%	0.825	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.3	-10.9	-172.4	0	0	0	0	0	114.2	D408	D408-G410 PolarHBondContact O-N 2.91Å
411	D	85.4	Confident	86.9	Confident	44 Å²	44	74.6 Å²	74.6	24%	0.235	43%	0.429	C	S	.	.			trans	-61.3	139.7	164.4	-84.5	-23.5	0	0	0	109.6	I407 D408 F413 H422	I407-D411 HydrophobicContact CG2-CB 3.83Å; D408-D411 PolarHBondContact N-OD2 2.81Å; D408-D411 WeakPolarHBondContact O-CB 3.4Å; D408-D411 PolarHBondContact O-N 2.81Å; D411-F413 PolarHBondContact O-N 3.32Å; D411-H422 IonicContact OD2-CD2 2.62Å; D411-H422 IonicContact OD2-CE1 3.26Å; D411-H422 IonicContact OD2-NE2 3.44Å; D411-H422 PolarHBondContact OD2-NE2 2.86Å
412	R	87.6	Confident	87.1	Confident	159 Å²	159	71.2 Å²	71.2	60%	0.6	41%	0.414	S	S	*	.			trans	-74.1	123.4	167.3	-73.8	179.3	58.4	80.9	3.9	109.3	D423 E436	R412-D423 HydrophobicContact CB-CB 4.06Å; R412-D423 VanDerWaalsContact CB-CG 3.47Å; R412-D423 WeakPolarHBondContact CB-OD2 3.48Å; R412-D423 VanDerWaalsContact CD-OD2 3.24Å; R412-D423 WeakPolarHBondContact CD-OD2 3.26Å; R412-D423 IonicContact CZ-OD2 2.72Å; R412-D423 IonicContact NE-OD2 2.71Å; R412-D423 PolarHBondContact NE-OD2 3.44Å; R412-D423 PolarHBondContact O-N 3.03Å; R412-E436 IonicContact CZ-OE1 3.81Å; R412-E436 IonicContact NH2-OE1 3.79Å; R412-E436 PolarHBondContact NH2-OE1 2.86Å
413	F	92.1	Very high	87.2	Confident	109 Å²	109	70.6 Å²	70.6	48%	0.478	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	163.6	177.6	79.8	-85	0	0	0	111.8	I407 D411 E415 W421	I407-F413 HydrophobicContact CD1-CB 3.87Å; I407-F413 HydrophobicContact CD1-CD2 4.32Å; I407-F413 HydrophobicContact CD1-CG 4.23Å; I407-F413 HydrophobicContact CG2-CB 3.72Å; I407-F413 HydrophobicContact CG2-CD1 3.8Å; I407-F413 HydrophobicContact CG2-CG 3.86Å; D411-F413 PolarHBondContact O-N 3.32Å; F413-E415 HydrophobicContact CD2-CG 4.36Å; F413-E415 HydrophobicContact CE2-CG 4.03Å; F413-W421 CarbonylContact C-O 3.53Å; F413-W421 WeakPolarHBondContact CA-O 3.49Å; F413-W421 VanDerWaalsContact CB-O 3.24Å; F413-W421 WeakPolarHBondContact CB-O 3.41Å
414	L	91.9	Very high	87.3	Confident	39 Å²	39	73.1 Å²	73.1	20%	0.204	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	160.4	174.2	61.8	86.1	0	0	0	110	A416 S420 W421 F426 E436	L414-A416 HydrophobicContact CD1-CB 3.8Å; L414-S420 WeakPolarHBondContact O-CA 3.33Å; L414-W421 HydrophobicContact CD1-CB 4.11Å; L414-W421 HydrophobicContact CD1-CG 4.35Å; L414-W421 HydrophobicContact CG-CB 4.44Å; L414-W421 PolarHBondContact N-O 2.83Å; L414-W421 PolarHBondContact O-N 3.25Å; L414-F426 HydrophobicContact CD1-CB 4.01Å; L414-F426 HydrophobicContact CD1-CD1 3.95Å; L414-F426 HydrophobicContact CD1-CD2 3.86Å; L414-F426 HydrophobicContact CD1-CE1 4.4Å; L414-F426 HydrophobicContact CD1-CE2 4.32Å; L414-F426 HydrophobicContact CD1-CG 3.67Å; L414-F426 HydrophobicContact CD2-CB 3.84Å; L414-F426 HydrophobicContact CD2-CD1 3.92Å; L414-F426 HydrophobicContact CD2-CG 4.03Å; L414-F426 HydrophobicContact CG-CB 4.24Å; L414-F426 HydrophobicContact CG-CG 4.37Å; L414-E436 HydrophobicContact CD2-CB 4.33Å; L414-E436 HydrophobicContact CD2-CG 4.36Å
415	E	91.8	Very high	87.6	Confident	148 Å²	148	68 Å²	68	69%	0.692	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.4	175.8	-59.4	-167.7	137.9	0	0	109.5	F413 F419 S420	F413-E415 HydrophobicContact CD2-CG 4.36Å; F413-E415 HydrophobicContact CE2-CG 4.03Å; E415-F419 WeakPolarHBondContact CA-O 3.36Å; E415-S420 PolarHBondContact OE1-OG 2.72Å
416	A	88.1	Confident	88	Confident	12 Å²	12	60.9 Å²	60.9	10%	0.099	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	139.8	-176.1	0	0	0	0	0	110.1	L414 G418 F419 W421 F426 F440	L414-A416 HydrophobicContact CD1-CB 3.8Å; A416-G418 PolarHBondContact O-N 2.97Å; A416-F419 PolarHBondContact N-O 3.47Å; A416-F419 PolarHBondContact O-N 3.3Å; A416-W421 PolarHBondContact O-NE1 2.78Å; A416-F426 HydrophobicContact CB-CD2 4.23Å; A416-F426 HydrophobicContact CB-CE2 3.48Å; A416-F426 VanDerWaalsContact CB-CE2 3.48Å; A416-F426 HydrophobicContact CB-CZ 3.68Å; A416-F440 HydrophobicContact CB-CZ 4.28Å
417	L	86.6	Confident	88.4	Confident	52 Å²	52	58.4 Å²	58.4	27%	0.272	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	26.3	179.5	-48.7	-179.1	0	0	0	114.2	F419 F440 D445 P447	L417-F419 VanDerWaalsContact C-N 3.3Å; L417-F419 HydrophobicContact CB-CD2 4.49Å; L417-F419 VanDerWaalsContact O-CD2 3.28Å; L417-F419 WeakPolarHBondContact O-CD2 3.22Å; L417-F440 HydrophobicContact CD2-CE2 4.06Å; L417-F440 HydrophobicContact CG-CE2 4.43Å; L417-D445 WeakPolarHBondContact CD1-O 3.06Å; L417-P447 HydrophobicContact CD1-CB 4.41Å
418	G	84.8	Confident	88.6	Confident	85 Å²	85	57.2 Å²	57.2	88%	0.876	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	5.1	-176.4	0	0	0	0	0	114.6	A416	A416-G418 PolarHBondContact O-N 2.97Å
419	F	89.4	Confident	88.9	Confident	82 Å²	82	56.8 Å²	56.8	36%	0.36	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	154.1	178.8	-56.1	-74.7	0	0	0	111.8	H401 E415 A416 L417 W421 D445	H401-F419 HydrophobicContact CB-CB 3.82Å; H401-F419 HydrophobicContact CB-CG 4.17Å; H401-F419 AromaticContact CE1-CD2 3.85Å; H401-F419 AromaticContact CE1-CE1 3.88Å; H401-F419 AromaticContact CE1-CE2 3.68Å; H401-F419 AromaticContact CE1-CZ 3.69Å; H401-F419 AromaticContact CG-CG 3.95Å; H401-F419 AromaticContact ND1-CD1 3.29Å; H401-F419 VanDerWaalsContact ND1-CD1 3.29Å; H401-F419 WeakPolarHBondContact ND1-CD1 3.47Å; H401-F419 AromaticContact ND1-CD2 3.54Å; H401-F419 AromaticContact ND1-CE1 3.53Å; H401-F419 AromaticContact ND1-CE2 3.78Å; H401-F419 AromaticContact ND1-CG 3.29Å; H401-F419 VanDerWaalsContact ND1-CG 3.29Å; H401-F419 WeakPolarHBondContact ND1-CG 3.42Å; H401-F419 AromaticContact ND1-CZ 3.77Å; E415-F419 WeakPolarHBondContact CA-O 3.36Å; A416-F419 PolarHBondContact N-O 3.47Å; A416-F419 PolarHBondContact O-N 3.3Å; L417-F419 VanDerWaalsContact C-N 3.3Å; L417-F419 HydrophobicContact CB-CD2 4.49Å; L417-F419 VanDerWaalsContact O-CD2 3.28Å; L417-F419 WeakPolarHBondContact O-CD2 3.22Å; F419-W421 PolarHBondContact O-NE1 3.38Å; F419-D445 HydrophobicContact CE2-CB 4.37Å
420	S	91.6	Very high	89.6	Confident	18 Å²	18	55.9 Å²	55.9	13%	0.126	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	145.1	170.1	-40.4	0	0	0	0	110.5	T398 C400 H401 L414 E415	T398-S420 VanDerWaalsContact CG2-OG 3.26Å; T398-S420 WeakPolarHBondContact CG2-OG 3.37Å; C400-S420 WeakPolarHBondContact CA-O 3.44Å; H401-S420 PolarHBondContact N-O 3.12Å; L414-S420 WeakPolarHBondContact O-CA 3.33Å; E415-S420 PolarHBondContact OE1-OG 2.72Å
421	W	92.3	Very high	90.3	Very high	12 Å²	12	54.3 Å²	54.3	5%	0.045	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	137.4	-178.6	-52.6	75.6	0	0	0	109.6	H401 F413 L414 A416 F419 F426 P447	H401-W421 HydrophobicContact CB-CD2 4.18Å; H401-W421 HydrophobicContact CB-CE3 4.3Å; H401-W421 HydrophobicContact CB-CH2 4.02Å; H401-W421 HydrophobicContact CB-CZ2 3.9Å; H401-W421 HydrophobicContact CB-CZ3 4.23Å; H401-W421 AromaticContact CD2-CH2 3.49Å; H401-W421 VanDerWaalsContact CD2-CH2 3.49Å; H401-W421 WeakPolarHBondContact CD2-CH2 3.24Å; H401-W421 AromaticContact CD2-CZ2 3.88Å; H401-W421 AromaticContact CG-CH2 3.99Å; H401-W421 AromaticContact CG-CZ2 3.99Å; F413-W421 CarbonylContact C-O 3.53Å; F413-W421 WeakPolarHBondContact CA-O 3.49Å; F413-W421 VanDerWaalsContact CB-O 3.24Å; F413-W421 WeakPolarHBondContact CB-O 3.41Å; L414-W421 HydrophobicContact CD1-CB 4.11Å; L414-W421 HydrophobicContact CD1-CG 4.35Å; L414-W421 HydrophobicContact CG-CB 4.44Å; L414-W421 PolarHBondContact N-O 2.83Å; L414-W421 PolarHBondContact O-N 3.25Å; A416-W421 PolarHBondContact O-NE1 2.78Å; F419-W421 PolarHBondContact O-NE1 3.38Å; W421-F426 HydrophobicContact CB-CB 4.15Å; W421-F426 HydrophobicContact CB-CD2 4.32Å; W421-F426 AromaticContact CD2-CD2 3.79Å; W421-F426 HydrophobicContact CD2-CD2 3.79Å; W421-F426 HydrophobicContact CD2-CE2 4.48Å; W421-F426 HydrophobicContact CE3-CD2 4.19Å; W421-F426 AromaticContact CG-CD2 3.83Å; W421-F426 HydrophobicContact CG-CD2 3.83Å; W421-P447 HydrophobicContact CH2-CG 4.27Å; W421-P447 HydrophobicContact CZ3-CG 4.5Å
422	H	92.7	Very high	90.5	Very high	11 Å²	11	58 Å²	58	5%	0.051	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	144.4	160.8	-67.9	114.9	0	0	0	109.5	C400 K406 D411 T424 C425 F426	C400-H422 WeakPolarHBondContact CB-ND1 3.39Å; C400-H422 PolarHBondContact SG-N 2.94Å; K406-H422 PolarHBondContact O-CE1 3.41Å; D411-H422 IonicContact OD2-CD2 2.62Å; D411-H422 IonicContact OD2-CE1 3.26Å; D411-H422 IonicContact OD2-NE2 3.44Å; D411-H422 PolarHBondContact OD2-NE2 2.86Å; H422-T424 PolarHBondContact O-N 3.04Å; H422-C425 HydrophobicContact CB-CB 3.96Å; H422-C425 CarbonylContact O-C 3.56Å; H422-C425 WeakPolarHBondContact O-CA 3.45Å; H422-C425 PolarHBondContact O-N 3.36Å; H422-F426 PolarHBondContact O-N 3.22Å; H422-F426 VanDerWaalsContact O-N 3.14Å
423	D	90.6	Very high	90.7	Very high	27 Å²	27	54.9 Å²	54.9	14%	0.144	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-51.8	-45.2	178.9	63.1	-10.6	0	0	0	112.5	R412 C425 F426 N434	R412-D423 HydrophobicContact CB-CB 4.06Å; R412-D423 VanDerWaalsContact CB-CG 3.47Å; R412-D423 WeakPolarHBondContact CB-OD2 3.48Å; R412-D423 VanDerWaalsContact CD-OD2 3.24Å; R412-D423 WeakPolarHBondContact CD-OD2 3.26Å; R412-D423 IonicContact CZ-OD2 2.72Å; R412-D423 IonicContact NE-OD2 2.71Å; R412-D423 PolarHBondContact NE-OD2 3.44Å; R412-D423 PolarHBondContact O-N 3.03Å; D423-C425 VanDerWaalsContact C-N 3.29Å; D423-C425 PolarHBondContact O-N 3.24Å; D423-F426 PolarHBondContact O-N 2.96Å; D423-N434 PolarHBondContact O-OD1 2.73Å
424	T	90.1	Very high	90.6	Very high	94 Å²	94	52 Å²	52	58%	0.577	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-73	-11.5	176.9	41.1	0	0	0	0	114.8	H422	H422-T424 PolarHBondContact O-N 3.04Å
425	C	90.9	Very high	90.6	Very high	29 Å²	29	50.2 Å²	50.2	20%	0.196	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-104.4	-6.8	176.6	-65.4	0	0	0	0	113.4	C400 H422 D423 V427	C400-C425 WeakPolarHBondContact SG-CB 3.35Å; H422-C425 HydrophobicContact CB-CB 3.96Å; H422-C425 CarbonylContact O-C 3.56Å; H422-C425 WeakPolarHBondContact O-CA 3.45Å; H422-C425 PolarHBondContact O-N 3.36Å; D423-C425 VanDerWaalsContact C-N 3.29Å; D423-C425 PolarHBondContact O-N 3.24Å; C425-V427 PolarHBondContact O-N 3.02Å
426	F	93.8	Very high	90.5	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.018	27%	0.272	C	S	.	.			trans	-81.9	68.4	173.9	-168.2	-116.7	0	0	0	111	L414 A416 W421 H422 D423 N434 L435 F440 P447	L414-F426 HydrophobicContact CD1-CB 4.01Å; L414-F426 HydrophobicContact CD1-CD1 3.95Å; L414-F426 HydrophobicContact CD1-CD2 3.86Å; L414-F426 HydrophobicContact CD1-CE1 4.4Å; L414-F426 HydrophobicContact CD1-CE2 4.32Å; L414-F426 HydrophobicContact CD1-CG 3.67Å; L414-F426 HydrophobicContact CD2-CB 3.84Å; L414-F426 HydrophobicContact CD2-CD1 3.92Å; L414-F426 HydrophobicContact CD2-CG 4.03Å; L414-F426 HydrophobicContact CG-CB 4.24Å; L414-F426 HydrophobicContact CG-CG 4.37Å; A416-F426 HydrophobicContact CB-CD2 4.23Å; A416-F426 HydrophobicContact CB-CE2 3.48Å; A416-F426 VanDerWaalsContact CB-CE2 3.48Å; A416-F426 HydrophobicContact CB-CZ 3.68Å; W421-F426 HydrophobicContact CB-CB 4.15Å; W421-F426 HydrophobicContact CB-CD2 4.32Å; W421-F426 AromaticContact CD2-CD2 3.79Å; W421-F426 HydrophobicContact CD2-CD2 3.79Å; W421-F426 HydrophobicContact CD2-CE2 4.48Å; W421-F426 HydrophobicContact CE3-CD2 4.19Å; W421-F426 AromaticContact CG-CD2 3.83Å; W421-F426 HydrophobicContact CG-CD2 3.83Å; H422-F426 PolarHBondContact O-N 3.22Å; H422-F426 VanDerWaalsContact O-N 3.14Å; D423-F426 PolarHBondContact O-N 2.96Å; F426-N434 PolarHBondContact O-OD1 3.3Å; F426-L435 HydrophobicContact CD1-CB 3.64Å; F426-L435 HydrophobicContact CE1-CB 3.62Å; F426-L435 WeakPolarHBondContact O-CB 3.5Å; F426-L435 PolarHBondContact O-N 2.79Å; F426-F440 AromaticContact CE1-CD1 3.75Å; F426-F440 HydrophobicContact CE1-CD1 3.75Å; F426-F440 AromaticContact CE1-CE1 3.92Å; F426-F440 HydrophobicContact CE1-CE1 3.92Å; F426-F440 HydrophobicContact CE1-CG 4.08Å; F426-F440 HydrophobicContact CE1-CZ 4.37Å; F426-F440 AromaticContact CZ-CD1 3.86Å; F426-F440 HydrophobicContact CZ-CD1 3.86Å; F426-F440 AromaticContact CZ-CD2 3.85Å; F426-F440 HydrophobicContact CZ-CD2 3.85Å; F426-F440 AromaticContact CZ-CE1 3.83Å; F426-F440 HydrophobicContact CZ-CE1 3.83Å; F426-F440 AromaticContact CZ-CE2 3.82Å; F426-F440 HydrophobicContact CZ-CE2 3.82Å; F426-F440 AromaticContact CZ-CG 3.88Å; F426-F440 HydrophobicContact CZ-CG 3.88Å; F426-F440 AromaticContact CZ-CZ 3.81Å; F426-F440 HydrophobicContact CZ-CZ 3.81Å; F426-P447 HydrophobicContact CD2-CB 4.36Å; F426-P447 HydrophobicContact CD2-CG 4.07Å; F426-P447 HydrophobicContact CE2-CB 3.61Å; F426-P447 HydrophobicContact CE2-CG 3.76Å; F426-P447 HydrophobicContact CZ-CB 3.82Å; F426-P447 HydrophobicContact CZ-CG 4.42Å
427	V	92.8	Very high	90.3	Very high	30 Å²	30	50 Å²	50	18%	0.182	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-110.1	149.7	-172	-64.8	0	0	0	0	112	C425 A429 Q432 I433 N434	C425-V427 PolarHBondContact O-N 3.02Å; V427-A429 PolarHBondContact O-N 2.88Å; V427-Q432 WeakPolarHBondContact CG1-O 3.46Å; V427-Q432 VanDerWaalsContact CG2-OE1 3.25Å; V427-I433 WeakPolarHBondContact CA-O 3.47Å; V427-N434 HydrophobicContact CG1-CB 4.47Å
428	C	92.8	Very high	90.3	Very high	0 Å²	0	53 Å²	53	0%	0	32%	0.322	C	S	.	.			trans	-60.2	121.6	175.4	176.3	0	0	0	0	111	I430 C431 Q432 I433 L435 P447 C449	C428-I430 PolarHBondContact O-N 3.06Å; C428-C431 PolarHBondContact O-N 2.94Å; C428-Q432 WeakPolarHBondContact O-CA 3.49Å; C428-Q432 PolarHBondContact O-N 2.85Å; C428-I433 PolarHBondContact N-O 3.05Å; C428-L435 HydrophobicContact CB-CD1 4.08Å; C428-L435 HydrophobicContact CB-CD2 4.3Å; C428-L435 HydrophobicContact CB-CG 4.3Å; C428-P447 WeakPolarHBondContact CA-O 3.35Å; C428-C449 HydrophobicContact CB-CB 4.27Å; C428-C449 PolarHBondContact SG-N 3.46Å
429	A	89.5	Confident	90.4	Very high	38 Å²	38	53.9 Å²	53.9	31%	0.314	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-12.7	-173.4	0	0	0	0	0	115.5	V427 R446 P447 L448	V427-A429 PolarHBondContact O-N 2.88Å; A429-R446 HydrophobicContact CB-CB 3.93Å; A429-R446 HydrophobicContact CB-CG 4.48Å; A429-P447 PolarHBondContact N-O 3.13Å; A429-L448 HydrophobicContact CB-CD2 4.21Å
430	I	89.9	Confident	90.5	Very high	101 Å²	101	53.7 Å²	53.7	52%	0.518	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-57.7	173.1	-57.4	-168.7	0	0	0	111.4	C428 L448 H452	C428-I430 PolarHBondContact O-N 3.06Å; I430-L448 HydrophobicContact CD1-CD2 4.36Å; I430-L448 HydrophobicContact CG1-CD2 3.97Å; I430-H452 HydrophobicContact CB-CB 4.37Å; I430-H452 HydrophobicContact CD1-CB 4.04Å; I430-H452 HydrophobicContact CG1-CB 4.42Å
431	C	92.2	Very high	90.4	Very high	46 Å²	46	57 Å²	57	31%	0.311	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	4.9	-171.3	64	0	0	0	0	116.1	C428 I433 H452	C428-C431 PolarHBondContact O-N 2.94Å; C431-I433 HydrophobicContact CB-CG1 4.45Å; C431-I433 PolarHBondContact O-N 2.95Å; C431-H452 VanDerWaalsContact SG-CE1 3.56Å; C431-H452 PolarHBondContact SG-ND1 3.37Å; C431-H452 VanDerWaalsContact SG-ND1 3.41Å
432	Q	90.1	Very high	90.3	Very high	123 Å²	123	59.8 Å²	59.8	58%	0.575	34%	0.342	S	S	*	.			trans	58.2	12.6	175.9	-52.1	-59.5	-41.8	0	0	116.1	V427 C428	V427-Q432 WeakPolarHBondContact CG1-O 3.46Å; V427-Q432 VanDerWaalsContact CG2-OE1 3.25Å; C428-Q432 WeakPolarHBondContact O-CA 3.49Å; C428-Q432 PolarHBondContact O-N 2.85Å
433	I	90.3	Very high	90.1	Very high	93 Å²	93	64.9 Å²	64.9	48%	0.477	36%	0.364	S	S	.	.			trans	-71.5	129	174	-62.4	176.2	0	0	0	109.6	V427 C428 C431 L435	V427-I433 WeakPolarHBondContact CA-O 3.47Å; C428-I433 PolarHBondContact N-O 3.05Å; C431-I433 HydrophobicContact CB-CG1 4.45Å; C431-I433 PolarHBondContact O-N 2.95Å; I433-L435 PolarHBondContact O-N 3.14Å
434	N	91.3	Very high	89.8	Confident	47 Å²	47	72.9 Å²	72.9	25%	0.251	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-56.4	130.2	173.2	-177.9	6.8	0	0	0	111.1	D423 F426 V427 E436 K438	D423-N434 PolarHBondContact O-OD1 2.73Å; F426-N434 PolarHBondContact O-OD1 3.3Å; V427-N434 HydrophobicContact CG1-CB 4.47Å; N434-E436 PolarHBondContact ND2-OE2 2.89Å; N434-E436 VanDerWaalsContact ND2-OE2 3.15Å; N434-E436 WeakPolarHBondContact OD1-CB 3.36Å; N434-E436 PolarHBondContact OD1-N 2.83Å; N434-K438 WeakPolarHBondContact O-CD 3.17Å; N434-K438 WeakPolarHBondContact O-CE 3.34Å; N434-K438 PolarHBondContact O-NZ 2.84Å
435	L	90.9	Very high	89.5	Confident	3 Å²	3	73 Å²	73	2%	0.016	40%	0.395	C	S	.	.			trans	-102.3	-2.1	-178.1	-63.5	172.9	0	0	0	113.7	F426 C428 I433 G437 K438 F440 P447 C449	F426-L435 HydrophobicContact CD1-CB 3.64Å; F426-L435 HydrophobicContact CE1-CB 3.62Å; F426-L435 WeakPolarHBondContact O-CB 3.5Å; F426-L435 PolarHBondContact O-N 2.79Å; C428-L435 HydrophobicContact CB-CD1 4.08Å; C428-L435 HydrophobicContact CB-CD2 4.3Å; C428-L435 HydrophobicContact CB-CG 4.3Å; I433-L435 PolarHBondContact O-N 3.14Å; L435-G437 PolarHBondContact O-N 2.86Å; L435-K438 WeakPolarHBondContact O-CB 3.45Å; L435-K438 PolarHBondContact O-N 2.95Å; L435-F440 HydrophobicContact CB-CB 4.35Å; L435-F440 HydrophobicContact CD1-CB 3.97Å; L435-F440 HydrophobicContact CD2-CB 4.41Å; L435-F440 HydrophobicContact CG-CB 4.49Å; L435-P447 HydrophobicContact CD1-CB 3.78Å; L435-P447 HydrophobicContact CD1-CG 4.39Å; L435-C449 HydrophobicContact CD2-CB 3.72Å
436	E	89.8	Confident	89.4	Confident	64 Å²	64	79.5 Å²	79.5	30%	0.299	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	127.9	169.5	-175.4	-174.7	-164.8	0	0	111	R412 L414 N434 K438	R412-E436 IonicContact CZ-OE1 3.81Å; R412-E436 IonicContact NH2-OE1 3.79Å; R412-E436 PolarHBondContact NH2-OE1 2.86Å; L414-E436 HydrophobicContact CD2-CB 4.33Å; L414-E436 HydrophobicContact CD2-CG 4.36Å; N434-E436 PolarHBondContact ND2-OE2 2.89Å; N434-E436 VanDerWaalsContact ND2-OE2 3.15Å; N434-E436 WeakPolarHBondContact OD1-CB 3.36Å; N434-E436 PolarHBondContact OD1-N 2.83Å; E436-K438 PolarHBondContact O-N 2.86Å
437	G	84.7	Confident	89.2	Confident	91 Å²	91	79.4 Å²	79.4	94%	0.938	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	5.7	-178.7	0	0	0	0	0	116	L435	L435-G437 PolarHBondContact O-N 2.86Å
438	K	86.5	Confident	89.2	Confident	114 Å²	114	78.6 Å²	78.6	50%	0.496	41%	0.409	S	S	.	.	S	Bend	trans	-113.4	159.8	-176.8	-62.7	170.1	-164.5	164.6	0	111.6	N434 L435 E436 F440	N434-K438 WeakPolarHBondContact O-CD 3.17Å; N434-K438 WeakPolarHBondContact O-CE 3.34Å; N434-K438 PolarHBondContact O-NZ 2.84Å; L435-K438 WeakPolarHBondContact O-CB 3.45Å; L435-K438 PolarHBondContact O-N 2.95Å; E436-K438 PolarHBondContact O-N 2.86Å; K438-F440 PolarHBondContact O-N 3Å
439	T	87.2	Confident	89.1	Confident	104 Å²	104	79.4 Å²	79.4	64%	0.638	42%	0.415	S	S	*	.			trans	-70.6	124	169	42.6	0	0	0	0	110.2
440	F	90.5	Very high	89.1	Confident	78 Å²	78	83.9 Å²	83.9	34%	0.342	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	164.7	177.9	69.6	-90.4	0	0	0	110.5	A416 L417 F426 L435 K438 P447 L448	A416-F440 HydrophobicContact CB-CZ 4.28Å; L417-F440 HydrophobicContact CD2-CE2 4.06Å; L417-F440 HydrophobicContact CG-CE2 4.43Å; F426-F440 AromaticContact CE1-CD1 3.75Å; F426-F440 HydrophobicContact CE1-CD1 3.75Å; F426-F440 AromaticContact CE1-CE1 3.92Å; F426-F440 HydrophobicContact CE1-CE1 3.92Å; F426-F440 HydrophobicContact CE1-CG 4.08Å; F426-F440 HydrophobicContact CE1-CZ 4.37Å; F426-F440 AromaticContact CZ-CD1 3.86Å; F426-F440 HydrophobicContact CZ-CD1 3.86Å; F426-F440 AromaticContact CZ-CD2 3.85Å; F426-F440 HydrophobicContact CZ-CD2 3.85Å; F426-F440 AromaticContact CZ-CE1 3.83Å; F426-F440 HydrophobicContact CZ-CE1 3.83Å; F426-F440 AromaticContact CZ-CE2 3.82Å; F426-F440 HydrophobicContact CZ-CE2 3.82Å; F426-F440 AromaticContact CZ-CG 3.88Å; F426-F440 HydrophobicContact CZ-CG 3.88Å; F426-F440 AromaticContact CZ-CZ 3.81Å; F426-F440 HydrophobicContact CZ-CZ 3.81Å; L435-F440 HydrophobicContact CB-CB 4.35Å; L435-F440 HydrophobicContact CD1-CB 3.97Å; L435-F440 HydrophobicContact CD2-CB 4.41Å; L435-F440 HydrophobicContact CG-CB 4.49Å; K438-F440 PolarHBondContact O-N 3Å; F440-P447 HydrophobicContact CD2-CB 4.45Å; F440-L448 CarbonylContact C-O 3.49Å; F440-L448 VanDerWaalsContact CA-O 3.29Å; F440-L448 WeakPolarHBondContact CA-O 3.28Å
441	Y	90.7	Very high	89.1	Confident	87 Å²	87	82.7 Å²	82.7	34%	0.341	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	151.5	176.6	-59	-95.8	0	0	0	108.9	P447 L448 K450 A453 F454	Y441-P447 CarbonylContact O-C 3.59Å; Y441-L448 PolarHBondContact N-O 2.92Å; Y441-L448 PolarHBondContact O-N 2.78Å; Y441-K450 HydrophobicContact CE2-CB 4.01Å; Y441-K450 HydrophobicContact CE2-CG 4.07Å; Y441-A453 HydrophobicContact CD1-CB 4.37Å; Y441-A453 HydrophobicContact CD2-CB 3.37Å; Y441-A453 HydrophobicContact CE2-CB 4.18Å; Y441-A453 HydrophobicContact CG-CB 3.5Å; Y441-A453 VanDerWaalsContact CG-CB 3.5Å; Y441-F454 HydrophobicContact CD1-CE2 4.37Å; Y441-F454 HydrophobicContact CD1-CZ 4.05Å; Y441-F454 HydrophobicContact CD2-CE2 4.39Å; Y441-F454 AromaticContact CE1-CE2 3.81Å; Y441-F454 HydrophobicContact CE1-CE2 3.81Å; Y441-F454 AromaticContact CE1-CZ 3.55Å; Y441-F454 HydrophobicContact CE1-CZ 3.55Å; Y441-F454 AromaticContact CE2-CE2 3.84Å; Y441-F454 HydrophobicContact CE2-CE2 3.84Å; Y441-F454 HydrophobicContact CE2-CZ 4.42Å; Y441-F454 AromaticContact CZ-CE2 3.51Å; Y441-F454 AromaticContact CZ-CZ 3.77Å
442	S	90.3	Very high	88.9	Confident	71 Å²	71	82.9 Å²	82.9	50%	0.497	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	143.1	175.7	46.3	0	0	0	0	112.2	R446	S442-R446 WeakPolarHBondContact CA-O 3.05Å
443	K	87.6	Confident	88.8	Confident	119 Å²	119	77.9 Å²	77.9	52%	0.517	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	109.4	172.1	-164.3	172.1	-174.7	174.3	0	108.4	R446 L448	K443-R446 PolarHBondContact N-O 2.79Å; K443-R446 VanDerWaalsContact N-O 3.09Å; K443-R446 PolarHBondContact O-N 3.46Å; K443-L448 HydrophobicContact CB-CD1 3.66Å; K443-L448 HydrophobicContact CD-CD1 4.07Å
444	K	84.5	Confident	88.5	Confident	194 Å²	194	79.5 Å²	79.5	84%	0.843	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	54.2	-169.6	-55.9	180	179.2	-176.7	0	111.6	R446	K444-R446 PolarHBondContact O-N 3.39Å
445	D	83.6	Confident	87.5	Confident	98 Å²	98	79.3 Å²	79.3	52%	0.524	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	5.1	177.7	-46.4	-46.6	0	0	0	116.7	L417 F419	L417-D445 WeakPolarHBondContact CD1-O 3.06Å; F419-D445 HydrophobicContact CE2-CB 4.37Å
446	R	88.1	Confident	85.9	Confident	164 Å²	164	88.2 Å²	88.2	62%	0.619	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.3	173.1	-67.4	-179.1	179.1	-144.3	-6	110.8	A429 S442 K443 K444	A429-R446 HydrophobicContact CB-CB 3.93Å; A429-R446 HydrophobicContact CB-CG 4.48Å; S442-R446 WeakPolarHBondContact CA-O 3.05Å; K443-R446 PolarHBondContact N-O 2.79Å; K443-R446 VanDerWaalsContact N-O 3.09Å; K443-R446 PolarHBondContact O-N 3.46Å; K444-R446 PolarHBondContact O-N 3.39Å
447	P	91.1	Very high	84	Confident	3 Å²	3	94.3 Å²	94.3	2%	0.019	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	141	176.9	33.4	-35.6	0	0	0	111.5	L417 W421 F426 C428 A429 L435 F440 Y441	L417-P447 HydrophobicContact CD1-CB 4.41Å; W421-P447 HydrophobicContact CH2-CG 4.27Å; W421-P447 HydrophobicContact CZ3-CG 4.5Å; F426-P447 HydrophobicContact CD2-CB 4.36Å; F426-P447 HydrophobicContact CD2-CG 4.07Å; F426-P447 HydrophobicContact CE2-CB 3.61Å; F426-P447 HydrophobicContact CE2-CG 3.76Å; F426-P447 HydrophobicContact CZ-CB 3.82Å; F426-P447 HydrophobicContact CZ-CG 4.42Å; C428-P447 WeakPolarHBondContact CA-O 3.35Å; A429-P447 PolarHBondContact N-O 3.13Å; L435-P447 HydrophobicContact CD1-CB 3.78Å; L435-P447 HydrophobicContact CD1-CG 4.39Å; F440-P447 HydrophobicContact CD2-CB 4.45Å; Y441-P447 CarbonylContact O-C 3.59Å
448	L	91.3	Very high	83.9	Confident	12 Å²	12	94.5 Å²	94.5	6%	0.063	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.7	-177.3	-63.4	173.3	0	0	0	110.4	A429 I430 F440 Y441 K443 H452	A429-L448 HydrophobicContact CB-CD2 4.21Å; I430-L448 HydrophobicContact CD1-CD2 4.36Å; I430-L448 HydrophobicContact CG1-CD2 3.97Å; F440-L448 CarbonylContact C-O 3.49Å; F440-L448 VanDerWaalsContact CA-O 3.29Å; F440-L448 WeakPolarHBondContact CA-O 3.28Å; Y441-L448 PolarHBondContact N-O 2.92Å; Y441-L448 PolarHBondContact O-N 2.78Å; K443-L448 HydrophobicContact CB-CD1 3.66Å; K443-L448 HydrophobicContact CD-CD1 4.07Å; L448-H452 HydrophobicContact CD2-CB 4.3Å
449	C	92	Very high	83.8	Confident	17 Å²	17	93.5 Å²	93.5	12%	0.115	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	162	167.6	64.4	0	0	0	0	111.1	C428 L435 S451 H452 A453	C428-C449 HydrophobicContact CB-CB 4.27Å; C428-C449 PolarHBondContact SG-N 3.46Å; L435-C449 HydrophobicContact CD2-CB 3.72Å; C449-S451 VanDerWaalsContact C-N 3.26Å; C449-S451 PolarHBondContact O-N 3.16Å; C449-S451 VanDerWaalsContact O-N 3.11Å; C449-S451 PolarHBondContact SG-OG 3.38Å; C449-H452 PolarHBondContact O-N 2.92Å; C449-H452 PolarHBondContact SG-ND1 2.95Å; C449-A453 PolarHBondContact O-N 3.01Å
450	K	89.4	Confident	83.6	Confident	133 Å²	133	92.9 Å²	92.9	58%	0.578	46%	0.46	S	S	*	.	H	α-helix	trans	-50.1	-37.4	-179	-172.9	176.3	178.4	-178.6	0	114.8	Y441 F454	Y441-K450 HydrophobicContact CE2-CB 4.01Å; Y441-K450 HydrophobicContact CE2-CG 4.07Å; K450-F454 HydrophobicContact CG-CD2 4.46Å; K450-F454 HydrophobicContact CG-CE2 4.43Å; K450-F454 WeakPolarHBondContact O-CD2 3.27Å
451	S	88.7	Confident	83.2	Confident	76 Å²	76	93.8 Å²	93.8	53%	0.531	47%	0.467	S	S	.	.	H	α-helix	trans	-68.4	-42.8	177.7	59.3	0	0	0	0	112.4	C449 S455	C449-S451 VanDerWaalsContact C-N 3.26Å; C449-S451 PolarHBondContact O-N 3.16Å; C449-S451 VanDerWaalsContact O-N 3.11Å; C449-S451 PolarHBondContact SG-OG 3.38Å; S451-S455 WeakPolarHBondContact O-CB 3.17Å; S451-S455 PolarHBondContact O-N 2.89Å
452	H	89	Confident	82.7	Confident	49 Å²	49	94.2 Å²	94.2	23%	0.227	47%	0.474	C	S	.	.	H	α-helix	trans	-84.3	-12.8	-177.1	-66.5	120.2	0	0	0	114.2	I430 C431 L448 C449 S455	I430-H452 HydrophobicContact CB-CB 4.37Å; I430-H452 HydrophobicContact CD1-CB 4.04Å; I430-H452 HydrophobicContact CG1-CB 4.42Å; C431-H452 VanDerWaalsContact SG-CE1 3.56Å; C431-H452 PolarHBondContact SG-ND1 3.37Å; C431-H452 VanDerWaalsContact SG-ND1 3.41Å; L448-H452 HydrophobicContact CD2-CB 4.3Å; C449-H452 PolarHBondContact O-N 2.92Å; C449-H452 PolarHBondContact SG-ND1 2.95Å; H452-S455 WeakPolarHBondContact CA-OG 2.92Å; H452-S455 PolarHBondContact O-OG 2.72Å
453	A	86.5	Confident	82.2	Confident	18 Å²	18	95.7 Å²	95.7	15%	0.149	47%	0.473	C	S	.	.	H	α-helix	trans	-68.6	-41.6	170.8	0	0	0	0	0	112.3	Y441 C449	Y441-A453 HydrophobicContact CD1-CB 4.37Å; Y441-A453 HydrophobicContact CD2-CB 3.37Å; Y441-A453 HydrophobicContact CE2-CB 4.18Å; Y441-A453 HydrophobicContact CG-CB 3.5Å; Y441-A453 VanDerWaalsContact CG-CB 3.5Å; C449-A453 PolarHBondContact O-N 3.01Å
454	F	84.6	Confident	81.9	Confident	128 Å²	128	94.1 Å²	94.1	56%	0.561	47%	0.47	S	S	*	.	H	α-helix	trans	-110	-3.2	-173.9	-57.6	-68.6	0	0	0	114.3	Y441 K450 H456	Y441-F454 HydrophobicContact CD1-CE2 4.37Å; Y441-F454 HydrophobicContact CD1-CZ 4.05Å; Y441-F454 HydrophobicContact CD2-CE2 4.39Å; Y441-F454 AromaticContact CE1-CE2 3.81Å; Y441-F454 HydrophobicContact CE1-CE2 3.81Å; Y441-F454 AromaticContact CE1-CZ 3.55Å; Y441-F454 HydrophobicContact CE1-CZ 3.55Å; Y441-F454 AromaticContact CE2-CE2 3.84Å; Y441-F454 HydrophobicContact CE2-CE2 3.84Å; Y441-F454 HydrophobicContact CE2-CZ 4.42Å; Y441-F454 AromaticContact CZ-CE2 3.51Å; Y441-F454 AromaticContact CZ-CZ 3.77Å; K450-F454 HydrophobicContact CG-CD2 4.46Å; K450-F454 HydrophobicContact CG-CE2 4.43Å; K450-F454 WeakPolarHBondContact O-CD2 3.27Å; F454-H456 PolarHBondContact O-N 2.71Å
455	S	71.4	Confident	81.6	Confident	43 Å²	43	86.4 Å²	86.4	30%	0.301	44%	0.441	S	S	.	.			trans	-62.5	110.2	164.6	59.4	0	0	0	0	109	S451 H452	S451-S455 WeakPolarHBondContact O-CB 3.17Å; S451-S455 PolarHBondContact O-N 2.89Å; H452-S455 WeakPolarHBondContact CA-OG 2.92Å; H452-S455 PolarHBondContact O-OG 2.72Å
456	H	57.3	Low	81.5	Confident	189 Å²	189	85.4 Å²	85.4	88%	0.875	43%	0.434	S	S	*	.			trans	-61.3	138.6	163.9	-77.8	-111.1	0	0	0	108.9	F454	F454-H456 PolarHBondContact O-N 2.71Å
457	V	48.3	Very low	80.9	Confident	193 Å²	193	78.3 Å²	78.3	100%	1.17	42%	0.417	S	S	*	.			trans	-111.1	0	165.5	-178	0	0	0	0	105.6

Retrieved 457 of 457 residues in 116.4 ms (Link to these results)

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