A0A077YW09_TRITR Loading...

DNA excision repair protein ERCC-8

AlphaFold DB , UniProt , Accession A0A077YW09, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 358 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	48.3	Very low	49.4	Very low	215 Å²	215	123.5 Å²	123.5	100%	1.059	60%	0.595	S	S	*	*				0	-47.9	0	-150.4	170.3	-101.9	0	0	111.6	R3 R4 L5	M1-R3 PolarHBondContact O-N 3.32Å; M1-R4 PolarHBondContact O-N 3.38Å; M1-L5 PolarHBondContact O-N 3.26Å
2	N	54.6	Low	49.6	Very low	139 Å²	139	122.3 Å²	122.3	74%	0.743	59%	0.594	S	S	*	*	H	α-helix	trans	-59.6	-35.7	-178.8	-66.5	-5.3	0	0	0	116.1	L5 A6	N2-L5 PolarHBondContact O-N 2.98Å; N2-A6 WeakPolarHBondContact O-CB 3.44Å; N2-A6 PolarHBondContact O-N 2.92Å
3	R	49	Very low	49.7	Very low	204 Å²	204	118.2 Å²	118.2	77%	0.77	57%	0.573	S	S	*	*	H	α-helix	trans	-67.6	-41.8	-179.4	-155.1	179	-174.2	170.5	3.5	112.7	M1 A6 E7	M1-R3 PolarHBondContact O-N 3.32Å; R3-A6 PolarHBondContact O-N 3.27Å; R3-E7 WeakPolarHBondContact O-CB 3.43Å; R3-E7 VanDerWaalsContact O-CG 3.24Å; R3-E7 WeakPolarHBondContact O-CG 3.19Å; R3-E7 PolarHBondContact O-N 3.46Å
4	R	49.4	Very low	49.6	Very low	203 Å²	203	111.6 Å²	111.6	77%	0.766	55%	0.547	S	S	*	.	H	α-helix	trans	-67.1	-36.6	174.8	-84.7	-173	176.6	177.9	-0.8	112.3	M1 L8	M1-R4 PolarHBondContact O-N 3.38Å; R4-L8 WeakPolarHBondContact O-CB 3.33Å; R4-L8 PolarHBondContact O-N 3.4Å
5	L	45.5	Very low	49.9	Very low	108 Å²	108	113.8 Å²	113.8	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-67.4	-42.8	176.8	-160.4	92.9	0	0	0	111.4	M1 N2 L8 Q9	M1-L5 PolarHBondContact O-N 3.26Å; N2-L5 PolarHBondContact O-N 2.98Å; L5-L8 PolarHBondContact O-N 2.96Å; L5-Q9 PolarHBondContact O-N 2.99Å
6	A	48.4	Very low	50	Low	37 Å²	37	108.1 Å²	108.1	31%	0.306	53%	0.529	S	S	.	.	H	α-helix	trans	-61	-47.1	174	0	0	0	0	0	111.2	N2 R3 L8 Q9 Q10	N2-A6 WeakPolarHBondContact O-CB 3.44Å; N2-A6 PolarHBondContact O-N 2.92Å; R3-A6 PolarHBondContact O-N 3.27Å; A6-L8 VanDerWaalsContact C-N 3.28Å; A6-L8 PolarHBondContact O-N 3.26Å; A6-Q9 PolarHBondContact O-N 2.9Å; A6-Q10 WeakPolarHBondContact O-CB 3.35Å; A6-Q10 VanDerWaalsContact O-CD 3.31Å; A6-Q10 WeakPolarHBondContact O-CG 3.24Å; A6-Q10 PolarHBondContact O-N 3.38Å; A6-Q10 PolarHBondContact O-OE1 2.92Å
7	E	45.5	Very low	50	Low	95 Å²	95	101.8 Å²	101.8	44%	0.444	50%	0.499	S	S	.	.	H	α-helix	trans	-60.4	-34.7	176.1	-74.7	166.7	-176	0	0	112.7	R3 S11	R3-E7 WeakPolarHBondContact O-CB 3.43Å; R3-E7 VanDerWaalsContact O-CG 3.24Å; R3-E7 WeakPolarHBondContact O-CG 3.19Å; R3-E7 PolarHBondContact O-N 3.46Å; E7-S11 WeakPolarHBondContact O-CB 3.37Å; E7-S11 PolarHBondContact O-N 3.18Å
8	L	46.5	Very low	50.2	Low	118 Å²	118	99.7 Å²	99.7	62%	0.618	50%	0.496	S	S	*	.	H	α-helix	trans	-77.1	-41.3	179.6	-136.6	131.9	0	0	0	112.3	R4 L5 A6 Q10 L12	R4-L8 WeakPolarHBondContact O-CB 3.33Å; R4-L8 PolarHBondContact O-N 3.4Å; L5-L8 PolarHBondContact O-N 2.96Å; A6-L8 VanDerWaalsContact C-N 3.28Å; A6-L8 PolarHBondContact O-N 3.26Å; L8-Q10 VanDerWaalsContact C-N 3.3Å; L8-L12 PolarHBondContact O-N 3.32Å
9	Q	51	Low	50.3	Low	113 Å²	113	103.8 Å²	103.8	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-61.1	-41.6	171.1	-82	178.7	-52.8	0	0	110.7	L5 A6 L12 H13	L5-Q9 PolarHBondContact O-N 2.99Å; A6-Q9 PolarHBondContact O-N 2.9Å; Q9-L12 VanDerWaalsContact O-CB 3.28Å; Q9-L12 WeakPolarHBondContact O-CB 3.09Å; Q9-L12 PolarHBondContact O-N 2.99Å; Q9-H13 PolarHBondContact O-CD2 2.98Å; Q9-H13 PolarHBondContact O-N 3.23Å
10	Q	52.4	Low	50.6	Low	57 Å²	57	99 Å²	99	27%	0.266	48%	0.482	S	S	.	.	H	α-helix	trans	-70.3	-41.3	-179.8	-73.9	168.8	-20.7	0	0	113.4	A6 L8 L12 H13 A14 E295 P296	A6-Q10 WeakPolarHBondContact O-CB 3.35Å; A6-Q10 VanDerWaalsContact O-CD 3.31Å; A6-Q10 WeakPolarHBondContact O-CG 3.24Å; A6-Q10 PolarHBondContact O-N 3.38Å; A6-Q10 PolarHBondContact O-OE1 2.92Å; L8-Q10 VanDerWaalsContact C-N 3.3Å; Q10-L12 PolarHBondContact O-N 3.18Å; Q10-H13 WeakPolarHBondContact O-CA 3.28Å; Q10-H13 WeakPolarHBondContact O-CB 3.37Å; Q10-H13 PolarHBondContact O-N 3.31Å; Q10-A14 PolarHBondContact O-N 3.23Å; Q10-E295 WeakPolarHBondContact CB-OE2 3.41Å; Q10-P296 VanDerWaalsContact OE1-CD 3.24Å
11	S	53.1	Low	50.6	Low	69 Å²	69	100 Å²	100	48%	0.483	48%	0.484	S	S	.	.	H	α-helix	trans	-57.8	-33.9	169.3	168	0	0	0	0	112.8	E7 K15	E7-S11 WeakPolarHBondContact O-CB 3.37Å; E7-S11 PolarHBondContact O-N 3.18Å; S11-K15 PolarHBondContact O-N 2.82Å
12	L	51.4	Low	50.8	Low	110 Å²	110	92.9 Å²	92.9	58%	0.576	46%	0.455	S	S	*	.	H	α-helix	trans	-70.8	-37.9	173.8	-108.7	145.7	0	0	0	111.5	L8 Q9 Q10 K15 A16	L8-L12 PolarHBondContact O-N 3.32Å; Q9-L12 VanDerWaalsContact O-CB 3.28Å; Q9-L12 WeakPolarHBondContact O-CB 3.09Å; Q9-L12 PolarHBondContact O-N 2.99Å; Q10-L12 PolarHBondContact O-N 3.18Å; L12-K15 CarbonylContact O-C 3.56Å; L12-K15 PolarHBondContact O-N 2.91Å; L12-A16 WeakPolarHBondContact O-CB 3.47Å; L12-A16 PolarHBondContact O-N 3.26Å
13	H	50.9	Low	50.7	Low	69 Å²	69	95.6 Å²	95.6	32%	0.319	46%	0.456	S	S	.	.	H	α-helix	trans	-64.7	-43.1	175.7	-71.9	-59.2	0	0	0	112.9	Q9 Q10 K15 A16 A17 N342	Q9-H13 PolarHBondContact O-CD2 2.98Å; Q9-H13 PolarHBondContact O-N 3.23Å; Q10-H13 WeakPolarHBondContact O-CA 3.28Å; Q10-H13 WeakPolarHBondContact O-CB 3.37Å; Q10-H13 PolarHBondContact O-N 3.31Å; H13-K15 VanDerWaalsContact C-N 3.31Å; H13-K15 PolarHBondContact O-N 3.32Å; H13-A16 PolarHBondContact O-N 2.93Å; H13-A16 VanDerWaalsContact O-N 3.1Å; H13-A17 WeakPolarHBondContact O-CB 3.39Å; H13-A17 PolarHBondContact O-N 3.45Å; H13-N342 PolarHBondContact CE1-ND2 2.99Å; H13-N342 VanDerWaalsContact CE1-ND2 3.26Å; H13-N342 PolarHBondContact ND1-ND2 3.18Å
14	A	48.9	Very low	51.2	Low	26 Å²	26	86.2 Å²	86.2	22%	0.215	42%	0.423	C	S	.	.	H	α-helix	trans	-61.3	-39.6	173.6	0	0	0	0	0	112.1	Q10 A17 S18	Q10-A14 PolarHBondContact O-N 3.23Å; A14-A17 PolarHBondContact O-N 2.88Å; A14-S18 PolarHBondContact O-N 3.23Å
15	K	54	Low	52.2	Low	144 Å²	144	79.6 Å²	79.6	63%	0.626	41%	0.406	S	S	*	.	H	α-helix	trans	-69.7	-27.9	172.6	-97.3	-176.4	176	178	0	113.9	S11 L12 H13 S18 R19	S11-K15 PolarHBondContact O-N 2.82Å; L12-K15 CarbonylContact O-C 3.56Å; L12-K15 PolarHBondContact O-N 2.91Å; H13-K15 VanDerWaalsContact C-N 3.31Å; H13-K15 PolarHBondContact O-N 3.32Å; K15-S18 PolarHBondContact O-OG 2.69Å; K15-R19 WeakPolarHBondContact O-CG 3.36Å
16	A	50.3	Low	53.9	Low	22 Å²	22	79.3 Å²	79.3	18%	0.182	41%	0.405	C	S	.	.	H	α-helix	trans	-77.2	-37.8	175.7	0	0	0	0	0	110.9	L12 H13 S18 R19	L12-A16 WeakPolarHBondContact O-CB 3.47Å; L12-A16 PolarHBondContact O-N 3.26Å; H13-A16 PolarHBondContact O-N 2.93Å; H13-A16 VanDerWaalsContact O-N 3.1Å; A16-S18 VanDerWaalsContact C-N 3.27Å; A16-S18 PolarHBondContact O-N 2.99Å; A16-R19 WeakPolarHBondContact O-CA 3.48Å; A16-R19 WeakPolarHBondContact O-CB 3.47Å; A16-R19 PolarHBondContact O-N 3.19Å
17	A	50.8	Low	55.6	Low	2 Å²	2	77.7 Å²	77.7	2%	0.017	39%	0.391	C	S	.	.	H	α-helix	trans	-62.6	-33.4	173	0	0	0	0	0	112.2	H13 A14 R19 I20 L293 L302 F304	H13-A17 WeakPolarHBondContact O-CB 3.39Å; H13-A17 PolarHBondContact O-N 3.45Å; A14-A17 PolarHBondContact O-N 2.88Å; A17-R19 PolarHBondContact O-N 2.78Å; A17-I20 HydrophobicContact CB-CD1 4.36Å; A17-I20 VanDerWaalsContact O-CD1 3.29Å; A17-I20 WeakPolarHBondContact O-CD1 3.25Å; A17-I20 WeakPolarHBondContact O-CG1 2.99Å; A17-I20 PolarHBondContact O-N 2.54Å; A17-L293 HydrophobicContact CB-CD2 4.02Å; A17-L302 HydrophobicContact CB-CD1 3.65Å; A17-F304 HydrophobicContact CB-CZ 4.09Å
18	S	53	Low	57.5	Low	63 Å²	63	80.1 Å²	80.1	44%	0.441	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-7.5	171.5	74.9	0	0	0	0	113.9	A14 K15 A16	A14-S18 PolarHBondContact O-N 3.23Å; K15-S18 PolarHBondContact O-OG 2.69Å; A16-S18 VanDerWaalsContact C-N 3.27Å; A16-S18 PolarHBondContact O-N 2.99Å
19	R	51.6	Low	59.5	Low	178 Å²	178	75.8 Å²	75.8	67%	0.672	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	8.1	177.9	-70.4	-179.3	179	-164.9	-1.2	113.3	K15 A16 A17 F21	K15-R19 WeakPolarHBondContact O-CG 3.36Å; A16-R19 WeakPolarHBondContact O-CA 3.48Å; A16-R19 WeakPolarHBondContact O-CB 3.47Å; A16-R19 PolarHBondContact O-N 3.19Å; A17-R19 PolarHBondContact O-N 2.78Å; R19-F21 PolarHBondContact O-N 3.16Å
20	I	57	Low	61.4	Low	7 Å²	7	71.8 Å²	71.8	4%	0.036	37%	0.371	C	S	.	.			trans	-55.3	127.6	173.6	-67.2	173.3	0	0	0	107.9	A17 F304 H325 I344 L356	A17-I20 HydrophobicContact CB-CD1 4.36Å; A17-I20 VanDerWaalsContact O-CD1 3.29Å; A17-I20 WeakPolarHBondContact O-CD1 3.25Å; A17-I20 WeakPolarHBondContact O-CG1 2.99Å; A17-I20 PolarHBondContact O-N 2.54Å; I20-F304 HydrophobicContact CD1-CE1 4.09Å; I20-H325 PolarHBondContact O-CE1 3.42Å; I20-H325 PolarHBondContact O-ND1 3.32Å; I20-I344 HydrophobicContact CD1-CD1 3.43Å; I20-I344 VanDerWaalsContact CD1-CD1 3.43Å; I20-I344 HydrophobicContact CD1-CG1 3.89Å; I20-L356 HydrophobicContact CG2-CB 3.39Å; I20-L356 HydrophobicContact CG2-CD2 4.35Å; I20-L356 HydrophobicContact CG2-CG 4.31Å
21	F	51.4	Low	63.3	Low	122 Å²	122	73 Å²	73	54%	0.535	38%	0.384	S	S	.	.			trans	-75.3	149.4	-173.4	-62.2	-75.5	0	0	0	111.5	R19 Y23 L356 G357 S358	R19-F21 PolarHBondContact O-N 3.16Å; F21-Y23 VanDerWaalsContact C-N 3.3Å; F21-Y23 PolarHBondContact O-N 2.97Å; F21-L356 WeakPolarHBondContact O-CD2 3.24Å; F21-G357 WeakPolarHBondContact CD2-O 3.44Å; F21-S358 WeakPolarHBondContact CE2-OXT 3.45Å
22	S	50.9	Low	65.2	Low	64 Å²	64	69.8 Å²	69.8	45%	0.448	36%	0.361	S	S	.	.	S	Bend	trans	-65	-29	179.8	47.1	0	0	0	0	113.8	Q326	S22-Q326 VanDerWaalsContact O-O 3.09Å
23	Y	52.7	Low	66.9	Low	196 Å²	196	65 Å²	65	77%	0.769	34%	0.337	S	S	*	.	S	Bend	trans	-108.7	93.4	174.4	-73	-82	0	0	0	109.7	F21	F21-Y23 VanDerWaalsContact C-N 3.3Å; F21-Y23 PolarHBondContact O-N 2.97Å
24	G	60.4	Low	68.6	Low	8 Å²	8	66.1 Å²	66.1	8%	0.082	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-72.4	124.9	169.3	0	0	0	0	0	109	L26 H354 L356	G24-L26 PolarHBondContact O-N 3.47Å; G24-H354 PolarHBondContact O-ND1 3.13Å; G24-L356 VanDerWaalsContact CA-CD2 3.4Å; G24-L356 VanDerWaalsContact N-CD2 3.35Å
25	P	71.3	Confident	70.3	Confident	63 Å²	63	71.2 Å²	71.2	41%	0.409	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-59.9	135.9	176.5	23.1	-34.8	0	0	0	111.6	L27 P68 M355	P25-L27 PolarHBondContact O-N 2.78Å; P25-P68 HydrophobicContact CB-CB 4.02Å; P25-P68 HydrophobicContact CB-CG 3.52Å; P25-P68 HydrophobicContact CG-CB 3.5Å; P25-P68 HydrophobicContact CG-CG 3.24Å; P25-M355 VanDerWaalsContact CD-O 3.29Å; P25-M355 WeakPolarHBondContact CD-O 3.43Å; P25-M355 PolarHBondContact O-N 2.75Å
26	L	80.1	Confident	71.9	Confident	102 Å²	102	64.9 Å²	64.9	53%	0.534	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-59	130.8	173.3	177	66.8	0	0	0	109.1	G24 T352 H354	G24-L26 PolarHBondContact O-N 3.47Å; L26-T352 HydrophobicContact CD1-CG2 3.99Å; L26-H354 WeakPolarHBondContact CD1-NE2 3.39Å
27	L	84	Confident	73.8	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.021	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-76.6	134.7	171.4	-64.3	172.1	0	0	0	109	P25 L29 L48 P68 T70 I345 C353 M355	P25-L27 PolarHBondContact O-N 2.78Å; L27-L29 HydrophobicContact CB-CD1 4.01Å; L27-L29 HydrophobicContact CB-CD2 4.27Å; L27-L29 HydrophobicContact CB-CG 3.72Å; L27-L29 HydrophobicContact CD1-CD1 4.26Å; L27-L29 PolarHBondContact O-N 3.03Å; L27-L48 HydrophobicContact CD1-CD2 4.33Å; L27-P68 HydrophobicContact CD2-CB 3.84Å; L27-T70 HydrophobicContact CB-CG2 4.18Å; L27-T70 HydrophobicContact CD1-CG2 4.34Å; L27-T70 HydrophobicContact CD2-CG2 3.58Å; L27-T70 HydrophobicContact CG-CG2 4.25Å; L27-I345 HydrophobicContact CD1-CG2 4.4Å; L27-C353 WeakPolarHBondContact CB-O 3.44Å; L27-C353 HydrophobicContact CD1-CB 4.33Å; L27-C353 PolarHBondContact N-O 3.32Å; L27-M355 HydrophobicContact CD1-CB 4.13Å; L27-M355 HydrophobicContact CD1-CE 4.09Å; L27-M355 HydrophobicContact CD2-CB 3.75Å; L27-M355 HydrophobicContact CD2-CE 3.81Å; L27-M355 HydrophobicContact CD2-SD 4.41Å; L27-M355 HydrophobicContact CG-CB 4Å
28	D	85.5	Confident	75.8	Confident	145 Å²	145	63.9 Å²	63.9	78%	0.775	33%	0.332	S	S	*	.			trans	-72.9	78.1	175	-171.8	20.2	0	0	0	110.2	T70	D28-T70 PolarHBondContact O-OG1 3.2Å
29	L	89.7	Confident	77.9	Confident	27 Å²	27	60.9 Å²	60.9	14%	0.141	31%	0.311	C	S	.	.			trans	-119.2	152.1	178.9	-50.6	-178.4	0	0	0	109.2	L27 L48 Y60 T70 C353	L27-L29 HydrophobicContact CB-CD1 4.01Å; L27-L29 HydrophobicContact CB-CD2 4.27Å; L27-L29 HydrophobicContact CB-CG 3.72Å; L27-L29 HydrophobicContact CD1-CD1 4.26Å; L27-L29 PolarHBondContact O-N 3.03Å; L29-L48 HydrophobicContact CD1-CD2 4.2Å; L29-Y60 HydrophobicContact CB-CE2 4.47Å; L29-Y60 HydrophobicContact CD2-CD1 3.44Å; L29-Y60 VanDerWaalsContact CD2-CD1 3.44Å; L29-Y60 HydrophobicContact CD2-CD2 3.73Å; L29-Y60 HydrophobicContact CD2-CE1 3.52Å; L29-Y60 HydrophobicContact CD2-CE2 3.8Å; L29-Y60 HydrophobicContact CD2-CG 3.54Å; L29-T70 HydrophobicContact CD2-CG2 4.03Å; L29-T70 WeakPolarHBondContact CD2-OG1 3.37Å; L29-C353 HydrophobicContact CD1-CB 3.54Å
30	A	90.7	Very high	80.1	Confident	30 Å²	30	53.1 Å²	53.1	25%	0.248	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-56.8	151.3	164.4	0	0	0	0	0	110.6	L32 N52 Y60	A30-L32 PolarHBondContact O-N 3.03Å; A30-N52 PolarHBondContact O-ND2 2.97Å; A30-Y60 PolarHBondContact N-OH 2.96Å
31	P	92.5	Very high	82	Confident	83 Å²	83	53.9 Å²	53.9	54%	0.539	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-54	134.2	179.6	-26.4	34.6	0	0	0	112.2	N52 A53	P31-N52 CarbonylContact O-C 3.59Å; P31-N52 VanDerWaalsContact O-CA 3.24Å; P31-N52 WeakPolarHBondContact O-CA 3.47Å; P31-N52 WeakPolarHBondContact O-CB 3.24Å; P31-N52 PolarHBondContact O-ND2 2.88Å; P31-A53 PolarHBondContact O-N 3.12Å
32	L	92.7	Very high	84.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-75.1	164.2	171.7	-58	-179.2	0	0	0	110.5	A30 P37 I39 C50 C347 S351 C353	A30-L32 PolarHBondContact O-N 3.03Å; L32-P37 HydrophobicContact CB-CB 4.06Å; L32-P37 HydrophobicContact CD1-CB 4.17Å; L32-I39 HydrophobicContact CD1-CG2 3.97Å; L32-I39 HydrophobicContact CD2-CG2 4.32Å; L32-C50 HydrophobicContact CD2-CB 3.74Å; L32-C347 HydrophobicContact CD1-CB 3.55Å; L32-S351 PolarHBondContact N-O 3.39Å; L32-S351 VanDerWaalsContact O-CB 3.31Å; L32-S351 WeakPolarHBondContact O-CB 3.48Å; L32-S351 PolarHBondContact O-OG 3.2Å; L32-C353 HydrophobicContact CD1-CB 4.24Å
33	D	87.5	Confident	86.1	Confident	10 Å²	10	48.5 Å²	48.5	5%	0.053	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-59.6	139.3	172.4	179.6	47.3	0	0	0	112	D35 N36 P37 T51 F86	D33-D35 PolarHBondContact OD2-N 2.87Å; D33-N36 PolarHBondContact OD2-N 2.73Å; D33-P37 WeakPolarHBondContact O-CB 3.2Å; D33-P37 WeakPolarHBondContact O-CD 3.23Å; D33-T51 PolarHBondContact N-O 3.16Å; D33-F86 HydrophobicContact CB-CD1 4.13Å; D33-F86 HydrophobicContact CB-CD2 4.34Å; D33-F86 HydrophobicContact CB-CE1 4.25Å; D33-F86 HydrophobicContact CB-CE2 4.42Å; D33-F86 HydrophobicContact CB-CG 4.19Å; D33-F86 HydrophobicContact CB-CZ 4.39Å; D33-F86 VanDerWaalsContact CG-CD2 3.5Å; D33-F86 VanDerWaalsContact OD1-CD2 3.32Å; D33-F86 WeakPolarHBondContact OD1-CD2 3.5Å; D33-F86 WeakPolarHBondContact OD1-CE2 3.34Å
34	L	85	Confident	88.1	Confident	91 Å²	91	41.9 Å²	41.9	48%	0.476	24%	0.243	S	C	.	.	S	Bend	trans	-76.2	-31.5	-175.8	-85.5	164	0	0	0	112.5	Y349 S351	L34-Y349 WeakPolarHBondContact O-CD1 3.46Å; L34-S351 WeakPolarHBondContact CD2-OG 3.32Å; L34-S351 VanDerWaalsContact CG-OG 3.24Å; L34-S351 WeakPolarHBondContact CG-OG 3.37Å
35	D	84.6	Confident	89.7	Confident	133 Å²	133	41.8 Å²	41.8	71%	0.711	24%	0.243	S	C	*	.	S	Bend	trans	-94.8	-30.4	-172.8	-70.1	-31.1	0	0	0	112.6	D33 Y349	D33-D35 PolarHBondContact OD2-N 2.87Å; D35-Y349 WeakPolarHBondContact O-CE1 3.22Å
36	N	87.8	Confident	90.7	Very high	11 Å²	11	42.9 Å²	42.9	6%	0.059	24%	0.241	C	C	.	.	S	Bend	trans	-148.3	77.6	175.8	-171.8	34.4	0	0	0	111.5	D33 L38 P87 N88 L286 R333	D33-N36 PolarHBondContact OD2-N 2.73Å; N36-L38 PolarHBondContact O-N 3.19Å; N36-L38 VanDerWaalsContact O-N 3.07Å; N36-P87 PolarHBondContact ND2-O 3.01Å; N36-N88 PolarHBondContact ND2-O 3.26Å; N36-L286 HydrophobicContact CB-CD1 4.32Å; N36-L286 VanDerWaalsContact OD1-CD1 3.25Å; N36-L286 WeakPolarHBondContact OD1-CD1 3.18Å; N36-R333 PolarHBondContact OD1-NE 2.94Å
37	P	91.4	Very high	91.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.226	C	C	.	.			trans	-65.1	112.5	176.8	25.6	-32.8	0	0	0	110.1	L32 D33 R333 C347 S348 Y349	L32-P37 HydrophobicContact CB-CB 4.06Å; L32-P37 HydrophobicContact CD1-CB 4.17Å; D33-P37 WeakPolarHBondContact O-CB 3.2Å; D33-P37 WeakPolarHBondContact O-CD 3.23Å; P37-R333 HydrophobicContact CG-CB 3.76Å; P37-R333 HydrophobicContact CG-CG 3.99Å; P37-R333 WeakPolarHBondContact O-CG 3.34Å; P37-C347 HydrophobicContact CB-CB 4.45Å; P37-C347 PolarHBondContact O-SG 2.84Å; P37-S348 WeakPolarHBondContact CG-O 3.31Å; P37-Y349 HydrophobicContact CG-CD1 4.05Å; P37-Y349 HydrophobicContact CG-CE1 4.35Å; P37-Y349 HydrophobicContact CG-CG 4.49Å
38	L	93.2	Very high	92.1	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.016	23%	0.225	C	C	.	.			trans	-113	131.9	177.9	-61.2	177.7	0	0	0	112.1	N36 T51 P87 M90 M334	N36-L38 PolarHBondContact O-N 3.19Å; N36-L38 VanDerWaalsContact O-N 3.07Å; L38-T51 HydrophobicContact CB-CG2 4.09Å; L38-T51 WeakPolarHBondContact CB-OG1 3.3Å; L38-T51 PolarHBondContact N-OG1 3.31Å; L38-T51 PolarHBondContact O-N 3.36Å; L38-T51 PolarHBondContact O-OG1 2.78Å; L38-P87 HydrophobicContact CD1-CG 4.16Å; L38-P87 WeakPolarHBondContact CD1-O 3.4Å; L38-M90 HydrophobicContact CB-CE 4.2Å; L38-M90 HydrophobicContact CD1-CB 4.33Å; L38-M334 HydrophobicContact CD2-CE 4.49Å; L38-M334 HydrophobicContact CD2-SD 4.07Å
39	I	96.3	Very high	92.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	153.6	170.1	62.2	169.3	0	0	0	110.1	L32 L48 L49 C50 M334 I336 I345 C347	L32-I39 HydrophobicContact CD1-CG2 3.97Å; L32-I39 HydrophobicContact CD2-CG2 4.32Å; I39-L48 HydrophobicContact CB-CD1 4.21Å; I39-L48 HydrophobicContact CD1-CD1 4.48Å; I39-L49 CarbonylContact C-O 3.54Å; I39-L49 WeakPolarHBondContact CA-O 3.4Å; I39-C50 HydrophobicContact CG2-CB 4.43Å; I39-M334 HydrophobicContact CG1-CB 4.28Å; I39-M334 HydrophobicContact CG1-SD 3.9Å; I39-M334 PolarHBondContact N-SD 2.71Å; I39-M334 WeakPolarHBondContact O-CE 2.99Å; I39-I336 HydrophobicContact CD1-CD1 4.09Å; I39-I336 HydrophobicContact CG1-CD1 3.91Å; I39-I345 HydrophobicContact CD1-CG2 3.76Å; I39-C347 HydrophobicContact CD1-CB 3.93Å; I39-C347 HydrophobicContact CG1-CB 4.14Å; I39-C347 HydrophobicContact CG2-CB 4.09Å
40	D	97.2	Very high	93	Very high	16 Å²	16	32.4 Å²	32.4	9%	0.086	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.8	167.9	-156.1	41.8	0	0	0	112.4	L48 L49 M90 E91 W92 R289	D40-L48 WeakPolarHBondContact O-CA 3.24Å; D40-L49 PolarHBondContact N-O 3.26Å; D40-L49 PolarHBondContact O-N 2.97Å; D40-M90 HydrophobicContact CB-CE 4.47Å; D40-E91 WeakPolarHBondContact OD2-CA 3.39Å; D40-W92 PolarHBondContact O-NE1 2.99Å; D40-W92 PolarHBondContact OD2-N 2.82Å; D40-R289 IonicContact OD1-NH1 3.66Å; D40-R289 PolarHBondContact OD1-NH1 3.29Å
41	L	96.5	Very high	93.1	Very high	23 Å²	23	31 Å²	31	12%	0.12	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.7	-176.5	-174.9	71.4	0	0	0	110	L48 L62 I336 R338 I345	L41-L48 HydrophobicContact CD1-CD1 4.46Å; L41-L62 HydrophobicContact CD1-CD1 3.65Å; L41-I336 HydrophobicContact CB-CG2 3.82Å; L41-I336 HydrophobicContact CD2-CG2 4.13Å; L41-R338 HydrophobicContact CD2-CB 3.83Å; L41-R338 HydrophobicContact CD2-CG 4.06Å; L41-I345 HydrophobicContact CD1-CD1 4.12Å
42	D	96.5	Very high	93.2	Very high	7 Å²	7	27.1 Å²	27.1	4%	0.037	15%	0.145	C	C	.	.			trans	-68.1	166.6	-179	86.7	-53.8	0	0	0	113	T44 G45 K46 Y47 W92 N97	D42-T44 PolarHBondContact O-N 2.8Å; D42-T44 VanDerWaalsContact O-N 3.11Å; D42-T44 PolarHBondContact OD1-OG1 3.14Å; D42-T44 VanDerWaalsContact OD2-CB 3.27Å; D42-T44 WeakPolarHBondContact OD2-CB 2.7Å; D42-T44 WeakPolarHBondContact OD2-CG2 3.15Å; D42-T44 PolarHBondContact OD2-N 3.26Å; D42-T44 VanDerWaalsContact OD2-N 3.08Å; D42-T44 PolarHBondContact OD2-OG1 3.47Å; D42-G45 PolarHBondContact O-N 3.32Å; D42-G45 WeakPolarHBondContact OD1-CA 3.43Å; D42-G45 PolarHBondContact OD1-N 3.35Å; D42-K46 PolarHBondContact OD1-N 3.27Å; D42-Y47 PolarHBondContact N-O 3.32Å; D42-Y47 PolarHBondContact OD1-N 3.07Å; D42-Y47 WeakPolarHBondContact OD2-CD2 3.31Å; D42-W92 HydrophobicContact CB-CD2 3.85Å; D42-W92 HydrophobicContact CB-CE3 4.4Å; D42-W92 HydrophobicContact CB-CG 4.08Å; D42-W92 HydrophobicContact CB-CZ2 4.15Å; D42-N97 HydrophobicContact CB-CB 4.21Å; D42-N97 WeakPolarHBondContact OD2-CB 3.2Å
43	C	93.5	Very high	93.1	Very high	66 Å²	66	28.5 Å²	28.5	45%	0.446	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.8	-178.9	65.4	0	0	0	0	114.1	P94	C43-P94 VanDerWaalsContact CB-O 3.24Å; C43-P94 WeakPolarHBondContact CB-O 3.47Å
44	T	93.5	Very high	93.3	Very high	56 Å²	56	31.3 Å²	31.3	34%	0.344	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-14.3	176	78.3	0	0	0	0	113.4	D42 K46	D42-T44 PolarHBondContact O-N 2.8Å; D42-T44 VanDerWaalsContact O-N 3.11Å; D42-T44 PolarHBondContact OD1-OG1 3.14Å; D42-T44 VanDerWaalsContact OD2-CB 3.27Å; D42-T44 WeakPolarHBondContact OD2-CB 2.7Å; D42-T44 WeakPolarHBondContact OD2-CG2 3.15Å; D42-T44 PolarHBondContact OD2-N 3.26Å; D42-T44 VanDerWaalsContact OD2-N 3.08Å; D42-T44 PolarHBondContact OD2-OG1 3.47Å; T44-K46 VanDerWaalsContact C-N 3.31Å; T44-K46 WeakPolarHBondContact OG1-CB 3.28Å; T44-K46 WeakPolarHBondContact OG1-CG 3.47Å; T44-K46 PolarHBondContact OG1-N 2.83Å
45	G	93.5	Very high	93.5	Very high	7 Å²	7	27 Å²	27	7%	0.072	15%	0.149	C	C	.	.	S	Bend	trans	69.6	25.8	-174.3	0	0	0	0	0	113.6	D42 R338	D42-G45 PolarHBondContact O-N 3.32Å; D42-G45 WeakPolarHBondContact OD1-CA 3.43Å; D42-G45 PolarHBondContact OD1-N 3.35Å; G45-R338 PolarHBondContact O-NE 3.03Å; G45-R338 PolarHBondContact O-NH2 2.75Å
46	K	93.8	Very high	94	Very high	86 Å²	86	21 Å²	21	37%	0.374	12%	0.117	S	C	.	.			trans	-112.7	-23.9	-179	-65.3	179.2	-179.9	174.8	0	113	D42 T44 Q61 L62	D42-K46 PolarHBondContact OD1-N 3.27Å; T44-K46 VanDerWaalsContact C-N 3.31Å; T44-K46 WeakPolarHBondContact OG1-CB 3.28Å; T44-K46 WeakPolarHBondContact OG1-CG 3.47Å; T44-K46 PolarHBondContact OG1-N 2.83Å; K46-Q61 CarbonylContact O-C 3.56Å; K46-Q61 WeakPolarHBondContact O-CA 3.37Å; K46-L62 PolarHBondContact O-N 3.39Å
47	Y	96.3	Very high	94.3	Very high	58 Å²	58	20.5 Å²	20.5	23%	0.227	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124.8	-173.8	-54.2	-65.7	0	0	0	110.4	D42 M59 Y60 Q61 I73	D42-Y47 PolarHBondContact N-O 3.32Å; D42-Y47 PolarHBondContact OD1-N 3.07Å; D42-Y47 WeakPolarHBondContact OD2-CD2 3.31Å; Y47-M59 HydrophobicContact CD1-SD 4.47Å; Y47-M59 HydrophobicContact CG-SD 4.37Å; Y47-Y60 CarbonylContact C-O 3.33Å; Y47-Y60 WeakPolarHBondContact CA-O 3.32Å; Y47-Q61 HydrophobicContact CD1-CB 4.19Å; Y47-Q61 HydrophobicContact CD1-CG 4.29Å; Y47-Q61 HydrophobicContact CE1-CB 4.17Å; Y47-Q61 HydrophobicContact CE1-CG 3.98Å; Y47-I73 HydrophobicContact CD1-CD1 3.37Å; Y47-I73 HydrophobicContact CE1-CD1 3.42Å; Y47-I73 VanDerWaalsContact CE1-CD1 3.42Å; Y47-I73 HydrophobicContact CG-CD1 4.48Å
48	L	97	Very high	94.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.3	176.8	-174.4	71.7	0	0	0	108.7	L27 L29 I39 D40 L41 M59 Y60 L62 I345	L27-L48 HydrophobicContact CD1-CD2 4.33Å; L29-L48 HydrophobicContact CD1-CD2 4.2Å; I39-L48 HydrophobicContact CB-CD1 4.21Å; I39-L48 HydrophobicContact CD1-CD1 4.48Å; D40-L48 WeakPolarHBondContact O-CA 3.24Å; L41-L48 HydrophobicContact CD1-CD1 4.46Å; L48-M59 WeakPolarHBondContact O-CA 3.38Å; L48-Y60 PolarHBondContact N-O 3.4Å; L48-Y60 PolarHBondContact O-N 2.85Å; L48-L62 HydrophobicContact CB-CD1 4.39Å; L48-L62 HydrophobicContact CB-CD2 4.04Å; L48-L62 HydrophobicContact CB-CG 4.27Å; L48-L62 HydrophobicContact CD2-CD2 4.37Å; L48-I345 HydrophobicContact CD1-CD1 4.3Å; L48-I345 HydrophobicContact CD1-CG2 4.33Å; L48-I345 HydrophobicContact CD2-CG2 4.32Å
49	L	97.2	Very high	94.7	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	140.9	167.4	-74.5	171.6	0	0	0	109.7	I39 D40 I57 R58 M59 M90 W92 F100 M117	I39-L49 CarbonylContact C-O 3.54Å; I39-L49 WeakPolarHBondContact CA-O 3.4Å; D40-L49 PolarHBondContact N-O 3.26Å; D40-L49 PolarHBondContact O-N 2.97Å; L49-I57 HydrophobicContact CD2-CG2 4.12Å; L49-R58 WeakPolarHBondContact CA-O 3.44Å; L49-M59 HydrophobicContact CD2-CB 3.89Å; L49-M59 HydrophobicContact CD2-CG 4.25Å; L49-M90 HydrophobicContact CB-CE 3.77Å; L49-M90 HydrophobicContact CB-SD 3.92Å; L49-M90 HydrophobicContact CD1-SD 4.41Å; L49-W92 HydrophobicContact CD1-CD2 3.69Å; L49-W92 HydrophobicContact CD1-CE3 4.33Å; L49-W92 HydrophobicContact CD1-CG 4.07Å; L49-W92 HydrophobicContact CD1-CH2 4.23Å; L49-W92 HydrophobicContact CD1-CZ2 3.6Å; L49-W92 HydrophobicContact CD2-CZ2 3.97Å; L49-W92 HydrophobicContact CG-CD2 4.34Å; L49-W92 VanDerWaalsContact CG-CE2 3.41Å; L49-W92 HydrophobicContact CG-CH2 4.32Å; L49-W92 HydrophobicContact CG-CZ2 3.43Å; L49-W92 VanDerWaalsContact CG-CZ2 3.43Å; L49-F100 HydrophobicContact CD1-CB 3.67Å; L49-F100 HydrophobicContact CD1-CD1 3.69Å; L49-F100 HydrophobicContact CD1-CD2 3.74Å; L49-F100 HydrophobicContact CD1-CE1 4.21Å; L49-F100 HydrophobicContact CD1-CE2 4.25Å; L49-F100 HydrophobicContact CD1-CG 3.42Å; L49-F100 VanDerWaalsContact CD1-CG 3.42Å; L49-F100 HydrophobicContact CD1-CZ 4.46Å; L49-F100 HydrophobicContact CD2-CD1 4.36Å; L49-F100 HydrophobicContact CD2-CE1 4.1Å; L49-F100 HydrophobicContact CD2-CZ 4.24Å; L49-M117 HydrophobicContact CD2-CE 4.29Å; L49-M117 HydrophobicContact CD2-SD 4.49Å
50	C	95.9	Very high	94.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	140.4	177.1	-59.5	0	0	0	0	110.3	L32 I39 I57 R58 Y60	L32-C50 HydrophobicContact CD2-CB 3.74Å; I39-C50 HydrophobicContact CG2-CB 4.43Å; C50-I57 WeakPolarHBondContact O-CA 3.46Å; C50-R58 PolarHBondContact N-O 2.7Å; C50-R58 PolarHBondContact O-N 2.92Å; C50-Y60 HydrophobicContact CB-CD2 4.49Å; C50-Y60 HydrophobicContact CB-CE2 4.17Å
51	T	93.6	Very high	94.7	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.2	165.2	60.1	0	0	0	0	109.1	D33 L38 P87 M90	D33-T51 PolarHBondContact N-O 3.16Å; L38-T51 HydrophobicContact CB-CG2 4.09Å; L38-T51 WeakPolarHBondContact CB-OG1 3.3Å; L38-T51 PolarHBondContact N-OG1 3.31Å; L38-T51 PolarHBondContact O-N 3.36Å; L38-T51 PolarHBondContact O-OG1 2.78Å; T51-P87 HydrophobicContact CG2-CG 3.64Å; T51-M90 HydrophobicContact CG2-CE 4.03Å; T51-M90 HydrophobicContact CG2-SD 3.86Å
52	N	93.6	Very high	94.5	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-101.8	153.4	-174.7	-67.6	115.3	0	0	0	112.3	A30 P31 D54 G55 H56 R58 F86	A30-N52 PolarHBondContact O-ND2 2.97Å; P31-N52 CarbonylContact O-C 3.59Å; P31-N52 VanDerWaalsContact O-CA 3.24Å; P31-N52 WeakPolarHBondContact O-CA 3.47Å; P31-N52 WeakPolarHBondContact O-CB 3.24Å; P31-N52 PolarHBondContact O-ND2 2.88Å; N52-D54 VanDerWaalsContact CB-OD1 3.23Å; N52-D54 WeakPolarHBondContact CB-OD1 3.26Å; N52-D54 PolarHBondContact O-N 3.3Å; N52-G55 PolarHBondContact O-N 3.39Å; N52-H56 PolarHBondContact N-O 3.38Å; N52-R58 WeakPolarHBondContact OD1-CB 3.3Å; N52-R58 WeakPolarHBondContact OD1-CD 3.23Å; N52-R58 WeakPolarHBondContact OD1-CG 3.23Å; N52-R58 PolarHBondContact OD1-NH1 3.12Å; N52-F86 WeakPolarHBondContact O-CE1 3.39Å
53	A	91.4	Very high	94.2	Very high	30 Å²	30	24.7 Å²	24.7	25%	0.248	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-13.3	-177.7	0	0	0	0	0	114.9	P31 G55	P31-A53 PolarHBondContact O-N 3.12Å; A53-G55 VanDerWaalsContact C-N 3.31Å
54	D	91.1	Very high	93.7	Very high	68 Å²	68	26.2 Å²	26.2	36%	0.364	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	11.8	175.4	69.8	-16.3	0	0	0	113.6	N52 H56 R58	N52-D54 VanDerWaalsContact CB-OD1 3.23Å; N52-D54 WeakPolarHBondContact CB-OD1 3.26Å; N52-D54 PolarHBondContact O-N 3.3Å; D54-H56 VanDerWaalsContact C-N 3.29Å; D54-H56 PolarHBondContact O-N 3.36Å; D54-H56 IonicContact OD1-CD2 2.65Å; D54-H56 PolarHBondContact OD1-N 2.82Å; D54-H56 IonicContact OD2-CD2 3.67Å; D54-R58 IonicContact OD1-CZ 3.93Å; D54-R58 IonicContact OD1-NH1 3.43Å; D54-R58 PolarHBondContact OD1-NH1 3Å; D54-R58 IonicContact OD1-NH2 3.35Å; D54-R58 IonicContact OD2-CZ 3.81Å; D54-R58 IonicContact OD2-NH1 3.62Å; D54-R58 PolarHBondContact OD2-NH1 2.88Å; D54-R58 IonicContact OD2-NH2 3.19Å; D54-R58 PolarHBondContact OD2-NH2 3.43Å
55	G	90.4	Very high	93	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.01	14%	0.14	C	C	.	.	S	Bend	trans	82.6	1.5	175.1	0	0	0	0	0	114.8	N52 A53 V80 F81	N52-G55 PolarHBondContact O-N 3.39Å; A53-G55 VanDerWaalsContact C-N 3.31Å; G55-V80 PolarHBondContact O-N 2.98Å; G55-F81 VanDerWaalsContact CA-O 3.26Å; G55-F81 WeakPolarHBondContact CA-O 3.24Å; G55-F81 WeakPolarHBondContact O-CD2 3.09Å; G55-F81 PolarHBondContact O-N 3.11Å
56	H	93.5	Very high	92.1	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.037	16%	0.163	C	C	.	.			trans	-93.3	145.3	178	-73.9	-85	0	0	0	112.3	N52 D54 R75 S76 S78	N52-H56 PolarHBondContact N-O 3.38Å; D54-H56 VanDerWaalsContact C-N 3.29Å; D54-H56 PolarHBondContact O-N 3.36Å; D54-H56 IonicContact OD1-CD2 2.65Å; D54-H56 PolarHBondContact OD1-N 2.82Å; D54-H56 IonicContact OD2-CD2 3.67Å; H56-R75 HydrophobicContact CB-CG 4.35Å; H56-R75 PolarHBondContact CD2-NH2 2.96Å; H56-R75 VanDerWaalsContact CD2-NH2 3.32Å; H56-R75 PolarHBondContact CE1-NE 2.97Å; H56-R75 PolarHBondContact CE1-NH2 2.8Å; H56-R75 PolarHBondContact ND1-NE 2.88Å; H56-R75 PolarHBondContact NE2-NH2 2.88Å; H56-S76 WeakPolarHBondContact CA-OG 3.48Å; H56-S76 PolarHBondContact CE1-O 3.31Å; H56-S76 VanDerWaalsContact CE1-O 3.29Å; H56-S76 PolarHBondContact ND1-O 2.94Å; H56-S76 PolarHBondContact ND1-OG 3.21Å; H56-S76 VanDerWaalsContact ND1-OG 3.12Å; H56-S78 PolarHBondContact CE1-O 3Å; H56-S78 PolarHBondContact ND1-O 3.08Å
57	I	94.9	Very high	91.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.3	158.7	-51.2	177.4	0	0	0	108	L49 C50 R75 S76 V80 F81 M90 F100 T102 W112 M117	L49-I57 HydrophobicContact CD2-CG2 4.12Å; C50-I57 WeakPolarHBondContact O-CA 3.46Å; I57-R75 WeakPolarHBondContact O-CA 3.36Å; I57-S76 PolarHBondContact N-OG 3.24Å; I57-S76 PolarHBondContact O-N 3.37Å; I57-S76 PolarHBondContact O-OG 2.69Å; I57-V80 HydrophobicContact CG1-CG2 4.46Å; I57-F81 HydrophobicContact CD1-CE2 3.81Å; I57-F81 HydrophobicContact CD1-CZ 3.92Å; I57-F81 HydrophobicContact CG1-CE2 3.58Å; I57-F81 HydrophobicContact CG1-CZ 4.22Å; I57-M90 HydrophobicContact CG2-SD 4.29Å; I57-F100 HydrophobicContact CD1-CE2 4.05Å; I57-F100 HydrophobicContact CG2-CE2 4.22Å; I57-F100 HydrophobicContact CG2-CZ 4.24Å; I57-T102 HydrophobicContact CD1-CG2 3.76Å; I57-W112 HydrophobicContact CD1-CD2 4.4Å; I57-W112 HydrophobicContact CD1-CH2 4.07Å; I57-W112 HydrophobicContact CD1-CZ2 3.68Å; I57-M117 HydrophobicContact CB-CE 4.21Å; I57-M117 HydrophobicContact CG2-CE 3.88Å; I57-M117 WeakPolarHBondContact O-CE 3.44Å
58	R	96.3	Very high	90.2	Very high	17 Å²	17	34.5 Å²	34.5	6%	0.064	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145.4	175.5	-70.3	-176.1	-179.9	75.5	-0.5	110.9	L49 C50 N52 D54 Y60 L72 G74 R75	L49-R58 WeakPolarHBondContact CA-O 3.44Å; C50-R58 PolarHBondContact N-O 2.7Å; C50-R58 PolarHBondContact O-N 2.92Å; N52-R58 WeakPolarHBondContact OD1-CB 3.3Å; N52-R58 WeakPolarHBondContact OD1-CD 3.23Å; N52-R58 WeakPolarHBondContact OD1-CG 3.23Å; N52-R58 PolarHBondContact OD1-NH1 3.12Å; D54-R58 IonicContact OD1-CZ 3.93Å; D54-R58 IonicContact OD1-NH1 3.43Å; D54-R58 PolarHBondContact OD1-NH1 3Å; D54-R58 IonicContact OD1-NH2 3.35Å; D54-R58 IonicContact OD2-CZ 3.81Å; D54-R58 IonicContact OD2-NH1 3.62Å; D54-R58 PolarHBondContact OD2-NH1 2.88Å; D54-R58 IonicContact OD2-NH2 3.19Å; D54-R58 PolarHBondContact OD2-NH2 3.43Å; R58-Y60 HydrophobicContact CB-CD2 4.24Å; R58-Y60 HydrophobicContact CB-CE2 3.53Å; R58-Y60 VanDerWaalsContact CD-OH 3.22Å; R58-Y60 WeakPolarHBondContact CD-OH 3.48Å; R58-L72 HydrophobicContact CB-CD1 3.81Å; R58-L72 HydrophobicContact CG-CD1 3.95Å; R58-G74 WeakPolarHBondContact CA-O 3.29Å; R58-R75 HydrophobicContact CG-CB 4.3Å; R58-R75 HydrophobicContact CG-CG 4.09Å
59	M	97.4	Very high	89.6	Confident	16 Å²	16	40 Å²	40	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.2	172.9	-176.4	173.7	50.4	0	0	109.3	Y47 L48 L49 I73 G74 W92 A114 M117	Y47-M59 HydrophobicContact CD1-SD 4.47Å; Y47-M59 HydrophobicContact CG-SD 4.37Å; L48-M59 WeakPolarHBondContact O-CA 3.38Å; L49-M59 HydrophobicContact CD2-CB 3.89Å; L49-M59 HydrophobicContact CD2-CG 4.25Å; M59-I73 HydrophobicContact CB-CG1 4.29Å; M59-I73 HydrophobicContact CE-CD1 3.59Å; M59-I73 HydrophobicContact CE-CG1 3.92Å; M59-I73 HydrophobicContact CG-CD1 3.92Å; M59-I73 HydrophobicContact CG-CG1 3.92Å; M59-I73 VanDerWaalsContact O-CG1 3.29Å; M59-I73 WeakPolarHBondContact O-CG1 3.29Å; M59-I73 PolarHBondContact O-N 2.9Å; M59-I73 HydrophobicContact SD-CD1 3.95Å; M59-I73 HydrophobicContact SD-CG1 4.47Å; M59-G74 PolarHBondContact N-O 3.4Å; M59-G74 PolarHBondContact O-N 3.02Å; M59-W92 HydrophobicContact CG-CZ2 4.4Å; M59-W92 HydrophobicContact SD-CH2 3.67Å; M59-W92 HydrophobicContact SD-CZ2 3.86Å; M59-A114 WeakPolarHBondContact CE-O 3.37Å; M59-M117 HydrophobicContact CB-CE 4.25Å; M59-M117 HydrophobicContact CB-SD 3.9Å; M59-M117 HydrophobicContact CE-SD 4.22Å
60	Y	96.6	Very high	89.3	Confident	10 Å²	10	41.1 Å²	41.1	4%	0.039	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.7	178.1	-63.3	-93.3	0	0	0	110.2	L29 A30 Y47 L48 C50 R58 T71 L72	L29-Y60 HydrophobicContact CB-CE2 4.47Å; L29-Y60 HydrophobicContact CD2-CD1 3.44Å; L29-Y60 VanDerWaalsContact CD2-CD1 3.44Å; L29-Y60 HydrophobicContact CD2-CD2 3.73Å; L29-Y60 HydrophobicContact CD2-CE1 3.52Å; L29-Y60 HydrophobicContact CD2-CE2 3.8Å; L29-Y60 HydrophobicContact CD2-CG 3.54Å; A30-Y60 PolarHBondContact N-OH 2.96Å; Y47-Y60 CarbonylContact C-O 3.33Å; Y47-Y60 WeakPolarHBondContact CA-O 3.32Å; L48-Y60 PolarHBondContact N-O 3.4Å; L48-Y60 PolarHBondContact O-N 2.85Å; C50-Y60 HydrophobicContact CB-CD2 4.49Å; C50-Y60 HydrophobicContact CB-CE2 4.17Å; R58-Y60 HydrophobicContact CB-CD2 4.24Å; R58-Y60 HydrophobicContact CB-CE2 3.53Å; R58-Y60 VanDerWaalsContact CD-OH 3.22Å; R58-Y60 WeakPolarHBondContact CD-OH 3.48Å; Y60-T71 CarbonylContact C-O 3.48Å; Y60-T71 VanDerWaalsContact CA-O 3.3Å; Y60-T71 WeakPolarHBondContact CA-O 3.36Å; Y60-L72 HydrophobicContact CD1-CB 4.13Å; Y60-L72 HydrophobicContact CD1-CD1 4.25Å; Y60-L72 HydrophobicContact CE1-CB 3.99Å; Y60-L72 HydrophobicContact CE1-CD1 3.91Å; Y60-L72 HydrophobicContact CE2-CD1 4.45Å
61	Q	95.3	Very high	89.2	Confident	74 Å²	74	45.3 Å²	45.3	35%	0.346	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	126.8	167.1	-174.3	174.9	-19.9	0	0	109.4	K46 Y47 T70 T71 I73	K46-Q61 CarbonylContact O-C 3.56Å; K46-Q61 WeakPolarHBondContact O-CA 3.37Å; Y47-Q61 HydrophobicContact CD1-CB 4.19Å; Y47-Q61 HydrophobicContact CD1-CG 4.29Å; Y47-Q61 HydrophobicContact CE1-CB 4.17Å; Y47-Q61 HydrophobicContact CE1-CG 3.98Å; Q61-T70 CarbonylContact O-C 3.52Å; Q61-T70 VanDerWaalsContact O-CA 3.25Å; Q61-T70 WeakPolarHBondContact O-CA 3.42Å; Q61-T71 PolarHBondContact N-O 2.77Å; Q61-T71 PolarHBondContact O-N 3.5Å; Q61-I73 HydrophobicContact CB-CD1 4.16Å; Q61-I73 HydrophobicContact CB-CG1 4.37Å; Q61-I73 HydrophobicContact CB-CG2 3.82Å
62	L	93.6	Very high	89.3	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	140	175	-55	-177.8	0	0	0	110	L41 K46 L48 T70 I345 M355	L41-L62 HydrophobicContact CD1-CD1 3.65Å; K46-L62 PolarHBondContact O-N 3.39Å; L48-L62 HydrophobicContact CB-CD1 4.39Å; L48-L62 HydrophobicContact CB-CD2 4.04Å; L48-L62 HydrophobicContact CB-CG 4.27Å; L48-L62 HydrophobicContact CD2-CD2 4.37Å; L62-T70 HydrophobicContact CD2-CG2 3.72Å; L62-I345 HydrophobicContact CD1-CD1 3.6Å; L62-M355 HydrophobicContact CB-CE 4.49Å; L62-M355 HydrophobicContact CD1-CE 3.83Å; L62-M355 HydrophobicContact CD2-CE 3.74Å; L62-M355 HydrophobicContact CG-CE 4.23Å
63	S	89.3	Confident	89.4	Confident	20 Å²	20	52.8 Å²	52.8	14%	0.14	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-59.8	147.6	178.1	107.2	0	0	0	0	111.7	T65 R67 Q69 R338	S63-T65 PolarHBondContact O-N 2.84Å; S63-T65 PolarHBondContact OG-N 3.1Å; S63-T65 PolarHBondContact OG-O 3.39Å; S63-T65 VanDerWaalsContact OG-O 3.12Å; S63-T65 PolarHBondContact OG-OG1 2.88Å; S63-R67 PolarHBondContact OG-O 2.91Å; S63-Q69 WeakPolarHBondContact CB-O 3.45Å; S63-Q69 PolarHBondContact N-O 2.86Å; S63-R338 PolarHBondContact O-NH1 3.19Å; S63-R338 PolarHBondContact O-NH2 3.03Å
64	N	83.5	Confident	89.6	Confident	97 Å²	97	51.9 Å²	51.9	52%	0.519	27%	0.268	S	S	.	.	S	Bend	trans	-82.4	16.8	170.3	-68.2	-21	0	0	0	112.3	F341	N64-F341 HydrophobicContact CB-CZ 4.03Å; N64-F341 WeakPolarHBondContact O-CE1 3.44Å; N64-F341 WeakPolarHBondContact O-CZ 3.46Å
65	T	79.4	Confident	89.8	Confident	68 Å²	68	54.5 Å²	54.5	42%	0.417	27%	0.272	S	S	.	.	S	Bend	trans	-113	165.7	176	75.6	0	0	0	0	109.2	S63 R67	S63-T65 PolarHBondContact O-N 2.84Å; S63-T65 PolarHBondContact OG-N 3.1Å; S63-T65 PolarHBondContact OG-O 3.39Å; S63-T65 VanDerWaalsContact OG-O 3.12Å; S63-T65 PolarHBondContact OG-OG1 2.88Å; T65-R67 PolarHBondContact O-N 2.91Å; T65-R67 VanDerWaalsContact O-N 3.14Å; T65-R67 WeakPolarHBondContact OG1-CB 3.28Å; T65-R67 PolarHBondContact OG1-N 2.91Å
66	L	73.5	Confident	90	Very high	103 Å²	103	54.6 Å²	54.6	54%	0.539	27%	0.273	S	S	.	.	S	Bend	trans	-66.4	-10.6	172.9	-64.5	169.1	0	0	0	112.4	Q343 S358	L66-Q343 PolarHBondContact O-NE2 3.14Å; L66-S358 WeakPolarHBondContact CD1-O 3.19Å
67	R	74.9	Confident	89.7	Confident	174 Å²	174	62.4 Å²	62.4	66%	0.657	31%	0.309	S	S	*	.	S	Bend	trans	-75.6	139.4	176.6	-63.3	-173.6	178.7	-176.2	0.1	110.9	S63 T65 Q69	S63-R67 PolarHBondContact OG-O 2.91Å; T65-R67 PolarHBondContact O-N 2.91Å; T65-R67 VanDerWaalsContact O-N 3.14Å; T65-R67 WeakPolarHBondContact OG1-CB 3.28Å; T65-R67 PolarHBondContact OG1-N 2.91Å; R67-Q69 HydrophobicContact CB-CG 4.35Å; R67-Q69 PolarHBondContact O-N 3.37Å
68	P	75.7	Confident	89.2	Confident	37 Å²	37	65.9 Å²	65.9	24%	0.24	33%	0.334	C	S	.	.			trans	-75.9	51.9	-178.7	40.9	-48.5	0	0	0	111.9	P25 L27 M355	P25-P68 HydrophobicContact CB-CB 4.02Å; P25-P68 HydrophobicContact CB-CG 3.52Å; P25-P68 HydrophobicContact CG-CB 3.5Å; P25-P68 HydrophobicContact CG-CG 3.24Å; L27-P68 HydrophobicContact CD2-CB 3.84Å; P68-M355 HydrophobicContact CB-CB 4.37Å
69	Q	84.1	Confident	88.6	Confident	114 Å²	114	68.8 Å²	68.8	53%	0.533	36%	0.355	S	S	.	.			trans	-94.3	136.7	179.6	-70.7	179.6	-23.7	0	0	109.6	S63 R67	S63-Q69 WeakPolarHBondContact CB-O 3.45Å; S63-Q69 PolarHBondContact N-O 2.86Å; R67-Q69 HydrophobicContact CB-CG 4.35Å; R67-Q69 PolarHBondContact O-N 3.37Å
70	T	91.2	Very high	87.9	Confident	25 Å²	25	70 Å²	70	15%	0.153	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	157	173.7	79.8	0	0	0	0	110.1	L27 D28 L29 Q61 L62	L27-T70 HydrophobicContact CB-CG2 4.18Å; L27-T70 HydrophobicContact CD1-CG2 4.34Å; L27-T70 HydrophobicContact CD2-CG2 3.58Å; L27-T70 HydrophobicContact CG-CG2 4.25Å; D28-T70 PolarHBondContact O-OG1 3.2Å; L29-T70 HydrophobicContact CD2-CG2 4.03Å; L29-T70 WeakPolarHBondContact CD2-OG1 3.37Å; Q61-T70 CarbonylContact O-C 3.52Å; Q61-T70 VanDerWaalsContact O-CA 3.25Å; Q61-T70 WeakPolarHBondContact O-CA 3.42Å; L62-T70 HydrophobicContact CD2-CG2 3.72Å
71	T	93.9	Very high	87.2	Confident	88 Å²	88	69.9 Å²	69.9	54%	0.54	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.6	173.5	-55.7	0	0	0	0	107.8	Y60 Q61 I73	Y60-T71 CarbonylContact C-O 3.48Å; Y60-T71 VanDerWaalsContact CA-O 3.3Å; Y60-T71 WeakPolarHBondContact CA-O 3.36Å; Q61-T71 PolarHBondContact N-O 2.77Å; Q61-T71 PolarHBondContact O-N 3.5Å; T71-I73 HydrophobicContact CG2-CG2 4.42Å; T71-I73 PolarHBondContact O-N 2.88Å
72	L	95.9	Very high	86.1	Confident	87 Å²	87	69.7 Å²	69.7	46%	0.455	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	120.9	172.9	179.5	66.3	0	0	0	108.7	R58 Y60 G74	R58-L72 HydrophobicContact CB-CD1 3.81Å; R58-L72 HydrophobicContact CG-CD1 3.95Å; Y60-L72 HydrophobicContact CD1-CB 4.13Å; Y60-L72 HydrophobicContact CD1-CD1 4.25Å; Y60-L72 HydrophobicContact CE1-CB 3.99Å; Y60-L72 HydrophobicContact CE1-CD1 3.91Å; Y60-L72 HydrophobicContact CE2-CD1 4.45Å; L72-G74 VanDerWaalsContact CD1-O 3.29Å; L72-G74 WeakPolarHBondContact CD1-O 3.2Å
73	I	96.5	Very high	84.7	Confident	71 Å²	71	76.7 Å²	76.7	36%	0.364	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	-14.2	-179.5	58	159.2	0	0	0	113.1	Y47 M59 Q61 T71	Y47-I73 HydrophobicContact CD1-CD1 3.37Å; Y47-I73 HydrophobicContact CE1-CD1 3.42Å; Y47-I73 VanDerWaalsContact CE1-CD1 3.42Å; Y47-I73 HydrophobicContact CG-CD1 4.48Å; M59-I73 HydrophobicContact CB-CG1 4.29Å; M59-I73 HydrophobicContact CE-CD1 3.59Å; M59-I73 HydrophobicContact CE-CG1 3.92Å; M59-I73 HydrophobicContact CG-CD1 3.92Å; M59-I73 HydrophobicContact CG-CG1 3.92Å; M59-I73 VanDerWaalsContact O-CG1 3.29Å; M59-I73 WeakPolarHBondContact O-CG1 3.29Å; M59-I73 PolarHBondContact O-N 2.9Å; M59-I73 HydrophobicContact SD-CD1 3.95Å; M59-I73 HydrophobicContact SD-CG1 4.47Å; Q61-I73 HydrophobicContact CB-CD1 4.16Å; Q61-I73 HydrophobicContact CB-CG1 4.37Å; Q61-I73 HydrophobicContact CB-CG2 3.82Å; T71-I73 HydrophobicContact CG2-CG2 4.42Å; T71-I73 PolarHBondContact O-N 2.88Å
74	G	95	Very high	83.6	Confident	12 Å²	12	83.2 Å²	83.2	12%	0.124	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	144.4	179.7	0	0	0	0	0	112	R58 M59 L72	R58-G74 WeakPolarHBondContact CA-O 3.29Å; M59-G74 PolarHBondContact N-O 3.4Å; M59-G74 PolarHBondContact O-N 3.02Å; L72-G74 VanDerWaalsContact CD1-O 3.29Å; L72-G74 WeakPolarHBondContact CD1-O 3.2Å
75	R	95.6	Very high	83.2	Confident	123 Å²	123	79.6 Å²	79.6	46%	0.464	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	136.5	175.1	180	-170.9	169.8	178.1	-2.2	108.5	H56 I57 R58	H56-R75 HydrophobicContact CB-CG 4.35Å; H56-R75 PolarHBondContact CD2-NH2 2.96Å; H56-R75 VanDerWaalsContact CD2-NH2 3.32Å; H56-R75 PolarHBondContact CE1-NE 2.97Å; H56-R75 PolarHBondContact CE1-NH2 2.8Å; H56-R75 PolarHBondContact ND1-NE 2.88Å; H56-R75 PolarHBondContact NE2-NH2 2.88Å; I57-R75 WeakPolarHBondContact O-CA 3.36Å; R58-R75 HydrophobicContact CG-CB 4.3Å; R58-R75 HydrophobicContact CG-CG 4.09Å
76	S	94	Very high	83.4	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.021	40%	0.401	C	S	.	.			trans	-53.2	134.8	167.9	42.8	0	0	0	0	112.1	H56 I57 S78 V80	H56-S76 WeakPolarHBondContact CA-OG 3.48Å; H56-S76 PolarHBondContact CE1-O 3.31Å; H56-S76 VanDerWaalsContact CE1-O 3.29Å; H56-S76 PolarHBondContact ND1-O 2.94Å; H56-S76 PolarHBondContact ND1-OG 3.21Å; H56-S76 VanDerWaalsContact ND1-OG 3.12Å; I57-S76 PolarHBondContact N-OG 3.24Å; I57-S76 PolarHBondContact O-N 3.37Å; I57-S76 PolarHBondContact O-OG 2.69Å; S76-S78 PolarHBondContact O-N 3.3Å; S76-V80 VanDerWaalsContact CB-CG2 3.43Å
77	E	86.7	Confident	83.9	Confident	171 Å²	171	72.2 Å²	72.2	80%	0.799	38%	0.375	S	S	*	.	S	Bend	trans	-59.6	-46.4	-174.3	-65.6	-171.9	157.9	0	0	113
78	S	84.2	Confident	84.5	Confident	74 Å²	74	65 Å²	65	52%	0.517	35%	0.35	S	S	.	.	S	Bend	trans	-113.1	158.9	174.6	64.8	0	0	0	0	110.4	H56 S76 V80	H56-S78 PolarHBondContact CE1-O 3Å; H56-S78 PolarHBondContact ND1-O 3.08Å; S76-S78 PolarHBondContact O-N 3.3Å; S78-V80 PolarHBondContact O-N 3.08Å
79	P	84.7	Confident	85.3	Confident	78 Å²	78	63.3 Å²	63.3	51%	0.506	34%	0.339	S	S	.	.			trans	-52.9	118.4	163.6	-21.9	32.1	0	0	0	108.2	F81	P79-F81 VanDerWaalsContact C-N 3.28Å
80	V	83.3	Confident	85.8	Confident	40 Å²	40	58 Å²	58	24%	0.242	31%	0.314	C	S	.	.	S	Bend	trans	-79.1	-28.2	-178.8	-172.6	0	0	0	0	109.4	G55 I57 S76 S78 W112	G55-V80 PolarHBondContact O-N 2.98Å; I57-V80 HydrophobicContact CG1-CG2 4.46Å; S76-V80 VanDerWaalsContact CB-CG2 3.43Å; S78-V80 PolarHBondContact O-N 3.08Å; V80-W112 HydrophobicContact CB-CH2 4.15Å; V80-W112 HydrophobicContact CB-CZ2 4.47Å; V80-W112 HydrophobicContact CG1-CH2 3.56Å; V80-W112 HydrophobicContact CG1-CZ2 3.52Å; V80-W112 HydrophobicContact CG2-CH2 3.44Å; V80-W112 VanDerWaalsContact CG2-CH2 3.44Å; V80-W112 HydrophobicContact CG2-CZ2 4.18Å; V80-W112 HydrophobicContact CG2-CZ3 4.28Å
81	F	81.3	Confident	86	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.035	31%	0.311	C	S	.	.	S	Bend	trans	-125	139.6	-176	-45.6	-63.8	0	0	0	108.7	G55 I57 P79 S85 F86 P87 D104	G55-F81 VanDerWaalsContact CA-O 3.26Å; G55-F81 WeakPolarHBondContact CA-O 3.24Å; G55-F81 WeakPolarHBondContact O-CD2 3.09Å; G55-F81 PolarHBondContact O-N 3.11Å; I57-F81 HydrophobicContact CD1-CE2 3.81Å; I57-F81 HydrophobicContact CD1-CZ 3.92Å; I57-F81 HydrophobicContact CG1-CE2 3.58Å; I57-F81 HydrophobicContact CG1-CZ 4.22Å; P79-F81 VanDerWaalsContact C-N 3.28Å; F81-S85 WeakPolarHBondContact CB-O 3.22Å; F81-S85 WeakPolarHBondContact CD1-O 3.24Å; F81-F86 HydrophobicContact CB-CD1 4.17Å; F81-F86 HydrophobicContact CB-CE1 4.42Å; F81-F86 HydrophobicContact CD2-CD1 4.34Å; F81-P87 HydrophobicContact CD2-CG 4.27Å; F81-P87 HydrophobicContact CE1-CB 4Å; F81-P87 HydrophobicContact CE1-CG 4.06Å; F81-P87 HydrophobicContact CE2-CB 4.42Å; F81-P87 VanDerWaalsContact CE2-CD 3.42Å; F81-P87 HydrophobicContact CE2-CG 3.63Å; F81-P87 HydrophobicContact CZ-CB 3.8Å; F81-P87 HydrophobicContact CZ-CG 3.51Å; F81-D104 HydrophobicContact CE1-CB 4.38Å
82	S	71.8	Confident	86.2	Confident	71 Å²	71	53.9 Å²	53.9	50%	0.497	29%	0.287	S	S	.	.			trans	-77.6	166.6	159.6	69.4	0	0	0	0	110.2	D84 S85	S82-D84 PolarHBondContact O-N 2.83Å; S82-S85 WeakPolarHBondContact CA-OG 3.24Å; S82-S85 WeakPolarHBondContact CB-OG 3.27Å; S82-S85 PolarHBondContact N-OG 2.92Å; S82-S85 PolarHBondContact O-N 3.3Å; S82-S85 PolarHBondContact O-OG 3.12Å; S82-S85 WeakPolarHBondContact OG-CB 3.39Å; S82-S85 PolarHBondContact OG-OG 3.13Å
83	H	64.3	Low	86.2	Confident	147 Å²	147	50.9 Å²	50.9	68%	0.681	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-30	178.3	-75.7	-66.4	0	0	0	114.1	F86	H83-F86 WeakPolarHBondContact O-CD2 3.18Å; H83-F86 VanDerWaalsContact O-CE2 3.23Å; H83-F86 WeakPolarHBondContact O-CE2 3.27Å
84	D	66.6	Low	86	Confident	156 Å²	156	49.3 Å²	49.3	83%	0.834	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	3.3	-179.9	-57.9	-32.4	0	0	0	113.8	S82	S82-D84 PolarHBondContact O-N 2.83Å
85	S	75.3	Confident	85.8	Confident	21 Å²	21	52.9 Å²	52.9	15%	0.147	28%	0.283	C	S	.	.			trans	-125.3	27.6	-170.1	61.9	0	0	0	0	115.8	F81 S82	F81-S85 WeakPolarHBondContact CB-O 3.22Å; F81-S85 WeakPolarHBondContact CD1-O 3.24Å; S82-S85 WeakPolarHBondContact CA-OG 3.24Å; S82-S85 WeakPolarHBondContact CB-OG 3.27Å; S82-S85 PolarHBondContact N-OG 2.92Å; S82-S85 PolarHBondContact O-N 3.3Å; S82-S85 PolarHBondContact O-OG 3.12Å; S82-S85 WeakPolarHBondContact OG-CB 3.39Å; S82-S85 PolarHBondContact OG-OG 3.13Å
86	F	82.1	Confident	85.7	Confident	17 Å²	17	49.4 Å²	49.4	8%	0.075	27%	0.274	C	S	.	.			trans	-55.3	149.8	172.6	-72	-71.6	0	0	0	112.9	D33 N52 F81 H83	D33-F86 HydrophobicContact CB-CD1 4.13Å; D33-F86 HydrophobicContact CB-CD2 4.34Å; D33-F86 HydrophobicContact CB-CE1 4.25Å; D33-F86 HydrophobicContact CB-CE2 4.42Å; D33-F86 HydrophobicContact CB-CG 4.19Å; D33-F86 HydrophobicContact CB-CZ 4.39Å; D33-F86 VanDerWaalsContact CG-CD2 3.5Å; D33-F86 VanDerWaalsContact OD1-CD2 3.32Å; D33-F86 WeakPolarHBondContact OD1-CD2 3.5Å; D33-F86 WeakPolarHBondContact OD1-CE2 3.34Å; N52-F86 WeakPolarHBondContact O-CE1 3.39Å; F81-F86 HydrophobicContact CB-CD1 4.17Å; F81-F86 HydrophobicContact CB-CE1 4.42Å; F81-F86 HydrophobicContact CD2-CD1 4.34Å; H83-F86 WeakPolarHBondContact O-CD2 3.18Å; H83-F86 VanDerWaalsContact O-CE2 3.23Å; H83-F86 WeakPolarHBondContact O-CE2 3.27Å
87	P	85.5	Confident	85.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.286	C	S	.	.			trans	-69.4	142.7	178.7	30	-33.2	0	0	0	109.7	N36 L38 T51 F81 T103	N36-P87 PolarHBondContact ND2-O 3.01Å; L38-P87 HydrophobicContact CD1-CG 4.16Å; L38-P87 WeakPolarHBondContact CD1-O 3.4Å; T51-P87 HydrophobicContact CG2-CG 3.64Å; F81-P87 HydrophobicContact CD2-CG 4.27Å; F81-P87 HydrophobicContact CE1-CB 4Å; F81-P87 HydrophobicContact CE1-CG 4.06Å; F81-P87 HydrophobicContact CE2-CB 4.42Å; F81-P87 VanDerWaalsContact CE2-CD 3.42Å; F81-P87 HydrophobicContact CE2-CG 3.63Å; F81-P87 HydrophobicContact CZ-CB 3.8Å; F81-P87 HydrophobicContact CZ-CG 3.51Å; P87-T103 WeakPolarHBondContact CA-O 3.4Å; P87-T103 WeakPolarHBondContact CB-O 3.32Å
88	N	86.8	Confident	86.1	Confident	22 Å²	22	49.7 Å²	49.7	12%	0.118	28%	0.275	C	S	.	.	S	Bend	trans	-80.3	-25.7	174.5	-49.9	-67.2	0	0	0	111.4	N36 T103 K128 A129	N36-N88 PolarHBondContact ND2-O 3.26Å; N88-T103 PolarHBondContact N-O 3.15Å; N88-K128 WeakPolarHBondContact ND2-CE 3.19Å; N88-K128 WeakPolarHBondContact OD1-CE 3.4Å; N88-A129 VanDerWaalsContact CB-O 3.27Å; N88-A129 WeakPolarHBondContact CB-O 3.2Å; N88-A129 VanDerWaalsContact CG-O 3.31Å; N88-A129 PolarHBondContact ND2-O 2.91Å
89	A	91.8	Very high	86.6	Confident	2 Å²	2	48.4 Å²	48.4	2%	0.017	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	144.1	-176.2	0	0	0	0	0	111.6	T102 T103 L132	A89-T102 WeakPolarHBondContact O-CA 3.29Å; A89-T103 PolarHBondContact N-OG1 2.88Å; A89-T103 PolarHBondContact O-N 2.88Å; A89-T103 VanDerWaalsContact O-N 3.09Å; A89-L132 HydrophobicContact CB-CB 4.09Å; A89-L132 HydrophobicContact CB-CD2 3.48Å; A89-L132 VanDerWaalsContact CB-CD2 3.48Å; A89-L132 HydrophobicContact CB-CG 3.78Å
90	M	95.1	Very high	87.2	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	136.8	178.2	177.6	172.4	71.5	0	0	108.3	L38 D40 L49 T51 I57 L101 T102 R289	L38-M90 HydrophobicContact CB-CE 4.2Å; L38-M90 HydrophobicContact CD1-CB 4.33Å; D40-M90 HydrophobicContact CB-CE 4.47Å; L49-M90 HydrophobicContact CB-CE 3.77Å; L49-M90 HydrophobicContact CB-SD 3.92Å; L49-M90 HydrophobicContact CD1-SD 4.41Å; T51-M90 HydrophobicContact CG2-CE 4.03Å; T51-M90 HydrophobicContact CG2-SD 3.86Å; I57-M90 HydrophobicContact CG2-SD 4.29Å; M90-L101 WeakPolarHBondContact CA-O 3.35Å; M90-T102 HydrophobicContact CB-CG2 4.2Å; M90-T102 HydrophobicContact CG-CG2 3.96Å; M90-T102 HydrophobicContact SD-CG2 4.39Å; M90-R289 PolarHBondContact O-NH1 3.34Å; M90-R289 PolarHBondContact O-NH2 3.37Å
91	E	96.2	Very high	87.9	Confident	19 Å²	19	42.8 Å²	42.8	9%	0.089	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	134.1	176.8	-159.6	170.5	123.8	0	0	111	D40 F100 L101 L132 N133 I134	D40-E91 WeakPolarHBondContact OD2-CA 3.39Å; E91-F100 WeakPolarHBondContact O-CA 3.43Å; E91-F100 WeakPolarHBondContact O-CB 3.21Å; E91-L101 PolarHBondContact N-O 3.46Å; E91-L101 PolarHBondContact O-N 2.9Å; E91-L132 HydrophobicContact CB-CD1 3.53Å; E91-L132 HydrophobicContact CB-CG 4.39Å; E91-L132 VanDerWaalsContact OE2-O 3.13Å; E91-N133 PolarHBondContact OE1-ND2 2.82Å; E91-N133 WeakPolarHBondContact OE2-CA 3.47Å; E91-N133 PolarHBondContact OE2-ND2 3.43Å; E91-N133 VanDerWaalsContact OE2-ND2 3.12Å; E91-I134 HydrophobicContact CB-CD1 4.12Å; E91-I134 HydrophobicContact CG-CD1 4.26Å; E91-I134 PolarHBondContact OE1-N 2.57Å
92	W	97	Very high	88.5	Confident	7 Å²	7	42.4 Å²	42.4	3%	0.027	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	146.4	165.9	-84.7	106.8	0	0	0	111	D40 D42 L49 M59 N97 L99 F100 A114 I134	D40-W92 PolarHBondContact O-NE1 2.99Å; D40-W92 PolarHBondContact OD2-N 2.82Å; D42-W92 HydrophobicContact CB-CD2 3.85Å; D42-W92 HydrophobicContact CB-CE3 4.4Å; D42-W92 HydrophobicContact CB-CG 4.08Å; D42-W92 HydrophobicContact CB-CZ2 4.15Å; L49-W92 HydrophobicContact CD1-CD2 3.69Å; L49-W92 HydrophobicContact CD1-CE3 4.33Å; L49-W92 HydrophobicContact CD1-CG 4.07Å; L49-W92 HydrophobicContact CD1-CH2 4.23Å; L49-W92 HydrophobicContact CD1-CZ2 3.6Å; L49-W92 HydrophobicContact CD2-CZ2 3.97Å; L49-W92 HydrophobicContact CG-CD2 4.34Å; L49-W92 VanDerWaalsContact CG-CE2 3.41Å; L49-W92 HydrophobicContact CG-CH2 4.32Å; L49-W92 HydrophobicContact CG-CZ2 3.43Å; L49-W92 VanDerWaalsContact CG-CZ2 3.43Å; M59-W92 HydrophobicContact CG-CZ2 4.4Å; M59-W92 HydrophobicContact SD-CH2 3.67Å; M59-W92 HydrophobicContact SD-CZ2 3.86Å; W92-N97 WeakPolarHBondContact CZ3-O 3.3Å; W92-L99 VanDerWaalsContact CE3-O 3.29Å; W92-F100 HydrophobicContact CD2-CB 4.29Å; W92-F100 HydrophobicContact CE3-CB 4Å; W92-F100 HydrophobicContact CH2-CD1 4.46Å; W92-F100 HydrophobicContact CZ3-CB 4.45Å; W92-F100 HydrophobicContact CZ3-CD1 4.19Å; W92-A114 HydrophobicContact CH2-CB 3.59Å; W92-A114 HydrophobicContact CZ3-CB 3.57Å; W92-I134 WeakPolarHBondContact O-CD1 3.41Å
93	Y	95.6	Very high	89.5	Confident	24 Å²	24	39 Å²	39	9%	0.094	20%	0.201	C	C	.	.			trans	-63.5	126.7	170.1	-161.3	-93.1	0	0	0	110.1	T95 D96 L99 L101 I134 E141 I158	Y93-T95 VanDerWaalsContact C-N 3.25Å; Y93-T95 PolarHBondContact O-N 2.87Å; Y93-T95 VanDerWaalsContact O-N 3.08Å; Y93-D96 WeakPolarHBondContact CB-O 3.17Å; Y93-D96 HydrophobicContact CD1-CB 3.61Å; Y93-D96 HydrophobicContact CE1-CB 4.29Å; Y93-D96 HydrophobicContact CG-CB 4.37Å; Y93-D96 PolarHBondContact O-N 2.74Å; Y93-L99 WeakPolarHBondContact CB-O 3.47Å; Y93-L99 HydrophobicContact CG-CB 4.44Å; Y93-L99 PolarHBondContact N-O 3.21Å; Y93-L101 HydrophobicContact CD2-CD1 4.37Å; Y93-I134 HydrophobicContact CD2-CD1 4.38Å; Y93-I134 HydrophobicContact CD2-CG2 4.16Å; Y93-I134 HydrophobicContact CE2-CG2 4.12Å; Y93-E141 HydrophobicContact CE1-CB 4.14Å; Y93-E141 WeakPolarHBondContact CE2-O 3.46Å; Y93-E141 WeakPolarHBondContact OH-CB 3.37Å; Y93-E141 PolarHBondContact OH-O 3.07Å; Y93-I158 HydrophobicContact CD2-CD1 4.45Å; Y93-I158 HydrophobicContact CE2-CD1 3.69Å
94	P	93.5	Very high	90.7	Very high	38 Å²	38	32.4 Å²	32.4	25%	0.247	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.2	-162.6	-26.3	33.8	0	0	0	115.4	C43 I134 P136	C43-P94 VanDerWaalsContact CB-O 3.24Å; C43-P94 WeakPolarHBondContact CB-O 3.47Å; P94-I134 VanDerWaalsContact CD-CG2 3.49Å; P94-I134 HydrophobicContact CG-CB 3.85Å; P94-I134 HydrophobicContact CG-CG2 3.91Å; P94-P136 HydrophobicContact CB-CB 3.76Å; P94-P136 HydrophobicContact CG-CB 4.1Å
95	T	90.5	Very high	91.4	Very high	87 Å²	87	27.7 Å²	27.7	53%	0.534	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-0.5	-176	57.1	0	0	0	0	113.4	Y93	Y93-T95 VanDerWaalsContact C-N 3.25Å; Y93-T95 PolarHBondContact O-N 2.87Å; Y93-T95 VanDerWaalsContact O-N 3.08Å
96	D	92.5	Very high	91.9	Very high	50 Å²	50	29.5 Å²	29.5	27%	0.267	16%	0.164	S	C	.	.			trans	-139.2	119	-176.3	-168.1	-12.2	0	0	0	109.7	Y93 K98	Y93-D96 WeakPolarHBondContact CB-O 3.17Å; Y93-D96 HydrophobicContact CD1-CB 3.61Å; Y93-D96 HydrophobicContact CE1-CB 4.29Å; Y93-D96 HydrophobicContact CG-CB 4.37Å; Y93-D96 PolarHBondContact O-N 2.74Å; D96-K98 PolarHBondContact O-N 2.84Å; D96-K98 VanDerWaalsContact OD1-CB 3.22Å; D96-K98 WeakPolarHBondContact OD1-CB 3.11Å; D96-K98 VanDerWaalsContact OD1-CG 3.23Å; D96-K98 WeakPolarHBondContact OD1-CG 3.3Å; D96-K98 PolarHBondContact OD1-N 3.1Å
97	N	94.5	Very high	92.3	Very high	50 Å²	50	29.8 Å²	29.8	27%	0.267	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	13.4	178.3	69.3	-18	0	0	0	113.2	D42 W92	D42-N97 HydrophobicContact CB-CB 4.21Å; D42-N97 WeakPolarHBondContact OD2-CB 3.2Å; W92-N97 WeakPolarHBondContact CZ3-O 3.3Å
98	K	95.6	Very high	92.6	Very high	131 Å²	131	34.9 Å²	34.9	57%	0.57	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-13.1	176	-61	173.4	-176.9	179.9	0	113.4	D96 A114	D96-K98 PolarHBondContact O-N 2.84Å; D96-K98 VanDerWaalsContact OD1-CB 3.22Å; D96-K98 WeakPolarHBondContact OD1-CB 3.11Å; D96-K98 VanDerWaalsContact OD1-CG 3.23Å; D96-K98 WeakPolarHBondContact OD1-CG 3.3Å; D96-K98 PolarHBondContact OD1-N 3.1Å; K98-A114 WeakPolarHBondContact O-CB 3.41Å; K98-A114 PolarHBondContact O-N 2.78Å
99	L	95.6	Very high	93	Very high	47 Å²	47	33.8 Å²	33.8	25%	0.246	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	145.3	-175.5	-64.1	173.9	0	0	0	110.7	W92 Y93 V111 W112	W92-L99 VanDerWaalsContact CE3-O 3.29Å; Y93-L99 WeakPolarHBondContact CB-O 3.47Å; Y93-L99 HydrophobicContact CG-CB 4.44Å; Y93-L99 PolarHBondContact N-O 3.21Å; L99-V111 HydrophobicContact CD2-CG1 4.43Å; L99-W112 VanDerWaalsContact CA-O 3.32Å; L99-W112 WeakPolarHBondContact CA-O 3.48Å; L99-W112 VanDerWaalsContact CD2-O 3.26Å; L99-W112 WeakPolarHBondContact CD2-O 3.45Å
100	F	97	Very high	93.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	162.7	167.7	64.9	-89.8	0	0	0	110	L49 I57 E91 W92 T102 W112 A114 M117	L49-F100 HydrophobicContact CD1-CB 3.67Å; L49-F100 HydrophobicContact CD1-CD1 3.69Å; L49-F100 HydrophobicContact CD1-CD2 3.74Å; L49-F100 HydrophobicContact CD1-CE1 4.21Å; L49-F100 HydrophobicContact CD1-CE2 4.25Å; L49-F100 HydrophobicContact CD1-CG 3.42Å; L49-F100 VanDerWaalsContact CD1-CG 3.42Å; L49-F100 HydrophobicContact CD1-CZ 4.46Å; L49-F100 HydrophobicContact CD2-CD1 4.36Å; L49-F100 HydrophobicContact CD2-CE1 4.1Å; L49-F100 HydrophobicContact CD2-CZ 4.24Å; I57-F100 HydrophobicContact CD1-CE2 4.05Å; I57-F100 HydrophobicContact CG2-CE2 4.22Å; I57-F100 HydrophobicContact CG2-CZ 4.24Å; E91-F100 WeakPolarHBondContact O-CA 3.43Å; E91-F100 WeakPolarHBondContact O-CB 3.21Å; W92-F100 HydrophobicContact CD2-CB 4.29Å; W92-F100 HydrophobicContact CE3-CB 4Å; W92-F100 HydrophobicContact CH2-CD1 4.46Å; W92-F100 HydrophobicContact CZ3-CB 4.45Å; W92-F100 HydrophobicContact CZ3-CD1 4.19Å; F100-T102 HydrophobicContact CD2-CG2 4.14Å; F100-T102 HydrophobicContact CE2-CG2 4.09Å; F100-W112 HydrophobicContact CD1-CB 3.69Å; F100-W112 HydrophobicContact CD1-CG 4.49Å; F100-W112 HydrophobicContact CD2-CB 3.72Å; F100-W112 AromaticContact CD2-CD1 3.73Å; F100-W112 AromaticContact CD2-CG 3.73Å; F100-W112 HydrophobicContact CD2-CG 3.73Å; F100-W112 HydrophobicContact CE1-CB 3.38Å; F100-W112 HydrophobicContact CE1-CG 4.03Å; F100-W112 HydrophobicContact CE2-CB 3.42Å; F100-W112 VanDerWaalsContact CE2-CB 3.42Å; F100-W112 AromaticContact CE2-CD1 3.43Å; F100-W112 VanDerWaalsContact CE2-CD1 3.43Å; F100-W112 AromaticContact CE2-CD2 3.58Å; F100-W112 HydrophobicContact CE2-CD2 3.58Å; F100-W112 HydrophobicContact CE2-CE3 4.24Å; F100-W112 AromaticContact CE2-CG 3.16Å; F100-W112 HydrophobicContact CE2-CG 3.16Å; F100-W112 AromaticContact CE2-NE1 3.97Å; F100-W112 HydrophobicContact CG-CB 3.85Å; F100-W112 HydrophobicContact CG-CG 4.36Å; F100-W112 HydrophobicContact CZ-CB 3.24Å; F100-W112 AromaticContact CZ-CD2 3.57Å; F100-W112 HydrophobicContact CZ-CD2 3.57Å; F100-W112 AromaticContact CZ-CE3 3.8Å; F100-W112 HydrophobicContact CZ-CE3 3.8Å; F100-W112 AromaticContact CZ-CG 3.34Å; F100-W112 HydrophobicContact CZ-CG 3.34Å; F100-W112 PolarHBondContact N-O 2.83Å; F100-W112 PolarHBondContact O-N 3.04Å; F100-A114 HydrophobicContact CD1-CB 4.05Å; F100-A114 HydrophobicContact CE1-CB 4.17Å; F100-M117 HydrophobicContact CE1-SD 4.1Å; F100-M117 HydrophobicContact CZ-CE 4.27Å; F100-M117 HydrophobicContact CZ-SD 4.33Å
101	L	96.6	Very high	93.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	145.6	179	-72	98	0	0	0	111.2	M90 E91 Y93 M109 N110 V111 I134 V144 I158	M90-L101 WeakPolarHBondContact CA-O 3.35Å; E91-L101 PolarHBondContact N-O 3.46Å; E91-L101 PolarHBondContact O-N 2.9Å; Y93-L101 HydrophobicContact CD2-CD1 4.37Å; L101-M109 HydrophobicContact CD2-CE 4.4Å; L101-M109 HydrophobicContact CD2-CG 3.82Å; L101-M109 HydrophobicContact CD2-SD 3.77Å; L101-N110 VanDerWaalsContact CA-O 3.31Å; L101-N110 WeakPolarHBondContact CA-O 3.4Å; L101-V111 HydrophobicContact CD2-CG2 4.13Å; L101-V111 HydrophobicContact CG-CG2 4.44Å; L101-I134 HydrophobicContact CD1-CD1 3.35Å; L101-I134 HydrophobicContact CD1-CG1 3.99Å; L101-I134 HydrophobicContact CG-CD1 4.49Å; L101-V144 HydrophobicContact CD2-CG2 4.21Å; L101-I158 HydrophobicContact CD2-CG2 4.03Å
102	T	95.6	Very high	93.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.6	167.1	66.4	0	0	0	0	111	I57 A89 M90 F100 M109 N110 W112	I57-T102 HydrophobicContact CD1-CG2 3.76Å; A89-T102 WeakPolarHBondContact O-CA 3.29Å; M90-T102 HydrophobicContact CB-CG2 4.2Å; M90-T102 HydrophobicContact CG-CG2 3.96Å; M90-T102 HydrophobicContact SD-CG2 4.39Å; F100-T102 HydrophobicContact CD2-CG2 4.14Å; F100-T102 HydrophobicContact CE2-CG2 4.09Å; T102-M109 CarbonylContact O-C 3.56Å; T102-M109 WeakPolarHBondContact O-CA 3.41Å; T102-N110 PolarHBondContact N-O 2.91Å; T102-N110 PolarHBondContact O-N 2.99Å; T102-W112 PolarHBondContact OG1-NE1 2.86Å
103	T	93	Very high	93.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.6	169.4	59.9	0	0	0	0	110.2	P87 N88 A89 R108 M125 A129 L132	P87-T103 WeakPolarHBondContact CA-O 3.4Å; P87-T103 WeakPolarHBondContact CB-O 3.32Å; N88-T103 PolarHBondContact N-O 3.15Å; A89-T103 PolarHBondContact N-OG1 2.88Å; A89-T103 PolarHBondContact O-N 2.88Å; A89-T103 VanDerWaalsContact O-N 3.09Å; T103-R108 CarbonylContact C-O 3.52Å; T103-R108 VanDerWaalsContact CA-O 3.24Å; T103-R108 WeakPolarHBondContact CA-O 3.17Å; T103-M125 HydrophobicContact CG2-CE 3.98Å; T103-M125 HydrophobicContact CG2-SD 4.41Å; T103-A129 HydrophobicContact CG2-CB 3.68Å; T103-L132 HydrophobicContact CG2-CD2 3.85Å
104	D	87.7	Confident	93.2	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.043	19%	0.186	C	C	.	.			trans	-111.8	176.2	178.5	72.4	20.8	0	0	0	113.8	F81 A106 S107 R108	F81-D104 HydrophobicContact CE1-CB 4.38Å; D104-A106 VanDerWaalsContact C-N 3.28Å; D104-A106 PolarHBondContact O-N 3.41Å; D104-A106 WeakPolarHBondContact OD1-CA 3.18Å; D104-A106 WeakPolarHBondContact OD1-CB 3.39Å; D104-A106 PolarHBondContact OD1-N 3.26Å; D104-S107 PolarHBondContact O-N 2.78Å; D104-S107 PolarHBondContact OD1-N 3.33Å; D104-R108 PolarHBondContact N-O 2.78Å; D104-R108 WeakPolarHBondContact OD1-CB 3.43Å; D104-R108 PolarHBondContact OD1-N 3.49Å; D104-R108 IonicContact OD1-NE 3.65Å; D104-R108 IonicContact OD2-CZ 2.79Å; D104-R108 IonicContact OD2-NE 3.32Å; D104-R108 PolarHBondContact OD2-NE 3.42Å; D104-R108 IonicContact OD2-NH2 3.54Å; D104-R108 PolarHBondContact OD2-NH2 2.79Å
105	V	81.8	Confident	93.3	Very high	57 Å²	57	36.2 Å²	36.2	35%	0.345	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.1	178.6	-59.5	0	0	0	0	113.8	S107	V105-S107 PolarHBondContact O-N 3.24Å
106	A	85.5	Confident	93.5	Very high	59 Å²	59	39.1 Å²	39.1	49%	0.488	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	10.8	173.2	0	0	0	0	0	112	D104 R108	D104-A106 VanDerWaalsContact C-N 3.28Å; D104-A106 PolarHBondContact O-N 3.41Å; D104-A106 WeakPolarHBondContact OD1-CA 3.18Å; D104-A106 WeakPolarHBondContact OD1-CB 3.39Å; D104-A106 PolarHBondContact OD1-N 3.26Å; A106-R108 VanDerWaalsContact C-N 3.27Å; A106-R108 HydrophobicContact CB-CG 4.44Å; A106-R108 PolarHBondContact O-N 3.22Å
107	S	90.9	Very high	93.6	Very high	22 Å²	22	37 Å²	37	15%	0.154	20%	0.2	C	C	.	.	S	Bend	trans	59.9	36.3	-176.5	-51.6	0	0	0	0	112	D104 V105 M125 K128	D104-S107 PolarHBondContact O-N 2.78Å; D104-S107 PolarHBondContact OD1-N 3.33Å; V105-S107 PolarHBondContact O-N 3.24Å; S107-M125 WeakPolarHBondContact CB-O 3.48Å; S107-M125 VanDerWaalsContact O-CA 3.32Å; S107-M125 WeakPolarHBondContact O-CA 3.22Å; S107-M125 WeakPolarHBondContact O-CB 3.48Å; S107-M125 PolarHBondContact O-N 2.9Å; S107-K128 WeakPolarHBondContact OG-CA 3.32Å; S107-K128 PolarHBondContact OG-N 2.89Å; S107-K128 VanDerWaalsContact OG-N 3.15Å
108	R	92.1	Very high	93.7	Very high	107 Å²	107	36.7 Å²	36.7	40%	0.404	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	145.6	171	-59.1	177.5	-65	-174	1.7	111	T103 D104 A106 F123	T103-R108 CarbonylContact C-O 3.52Å; T103-R108 VanDerWaalsContact CA-O 3.24Å; T103-R108 WeakPolarHBondContact CA-O 3.17Å; D104-R108 PolarHBondContact N-O 2.78Å; D104-R108 WeakPolarHBondContact OD1-CB 3.43Å; D104-R108 PolarHBondContact OD1-N 3.49Å; D104-R108 IonicContact OD1-NE 3.65Å; D104-R108 IonicContact OD2-CZ 2.79Å; D104-R108 IonicContact OD2-NE 3.32Å; D104-R108 PolarHBondContact OD2-NE 3.42Å; D104-R108 IonicContact OD2-NH2 3.54Å; D104-R108 PolarHBondContact OD2-NH2 2.79Å; A106-R108 VanDerWaalsContact C-N 3.27Å; A106-R108 HydrophobicContact CB-CG 4.44Å; A106-R108 PolarHBondContact O-N 3.22Å; R108-F123 CarbonylContact C-O 3.59Å; R108-F123 VanDerWaalsContact CA-O 3.29Å; R108-F123 WeakPolarHBondContact CA-O 3.48Å
109	M	94.4	Very high	93.6	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	116	166.7	-178.1	169.6	67.8	0	0	107.7	L101 T102 S122 F123 M125 V144 V146 Y156 I158	L101-M109 HydrophobicContact CD2-CE 4.4Å; L101-M109 HydrophobicContact CD2-CG 3.82Å; L101-M109 HydrophobicContact CD2-SD 3.77Å; T102-M109 CarbonylContact O-C 3.56Å; T102-M109 WeakPolarHBondContact O-CA 3.41Å; M109-S122 WeakPolarHBondContact O-CA 3.09Å; M109-F123 HydrophobicContact CE-CD2 3.94Å; M109-F123 PolarHBondContact N-O 2.9Å; M109-F123 PolarHBondContact O-N 2.77Å; M109-M125 HydrophobicContact CB-CG 4.19Å; M109-M125 HydrophobicContact CB-SD 3.99Å; M109-V144 HydrophobicContact SD-CB 4.24Å; M109-V144 HydrophobicContact SD-CG1 3.81Å; M109-V146 HydrophobicContact SD-CG2 4.35Å; M109-Y156 HydrophobicContact CE-CG 4.18Å; M109-I158 HydrophobicContact CE-CG2 4.03Å
110	N	94.7	Very high	93.6	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.011	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130.2	-175.5	-57.7	-52.7	0	0	0	109.4	L101 T102 I119 S122	L101-N110 VanDerWaalsContact CA-O 3.31Å; L101-N110 WeakPolarHBondContact CA-O 3.4Å; T102-N110 PolarHBondContact N-O 2.91Å; T102-N110 PolarHBondContact O-N 2.99Å; N110-I119 HydrophobicContact CB-CD1 4.13Å; N110-I119 HydrophobicContact CB-CG1 4.28Å; N110-I119 HydrophobicContact CB-CG2 4.22Å; N110-S122 WeakPolarHBondContact OD1-CB 3.25Å; N110-S122 PolarHBondContact OD1-OG 3.48Å
111	V	95.5	Very high	93.4	Very high	16 Å²	16	39.5 Å²	39.5	10%	0.097	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.5	172.1	-173.6	0	0	0	0	107.9	L99 L101 I119 V120 D121 F123	L99-V111 HydrophobicContact CD2-CG1 4.43Å; L101-V111 HydrophobicContact CD2-CG2 4.13Å; L101-V111 HydrophobicContact CG-CG2 4.44Å; V111-I119 CarbonylContact O-C 3.54Å; V111-I119 WeakPolarHBondContact O-CA 3.35Å; V111-V120 HydrophobicContact CB-CG2 4.06Å; V111-V120 HydrophobicContact CG1-CG2 3.78Å; V111-V120 WeakPolarHBondContact O-CG2 3.49Å; V111-V120 PolarHBondContact O-N 2.78Å; V111-D121 HydrophobicContact CB-CB 4.21Å; V111-D121 HydrophobicContact CG2-CB 4.34Å; V111-D121 PolarHBondContact N-O 3.41Å; V111-D121 PolarHBondContact O-N 3.46Å; V111-F123 HydrophobicContact CG2-CD2 4.39Å; V111-F123 HydrophobicContact CG2-CE2 3.71Å
112	W	96.8	Very high	93.3	Very high	5 Å²	5	41.7 Å²	41.7	2%	0.019	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.7	-175.3	-66.4	77.5	0	0	0	111.6	I57 V80 L99 F100 T102 M117 T118 I119	I57-W112 HydrophobicContact CD1-CD2 4.4Å; I57-W112 HydrophobicContact CD1-CH2 4.07Å; I57-W112 HydrophobicContact CD1-CZ2 3.68Å; V80-W112 HydrophobicContact CB-CH2 4.15Å; V80-W112 HydrophobicContact CB-CZ2 4.47Å; V80-W112 HydrophobicContact CG1-CH2 3.56Å; V80-W112 HydrophobicContact CG1-CZ2 3.52Å; V80-W112 HydrophobicContact CG2-CH2 3.44Å; V80-W112 VanDerWaalsContact CG2-CH2 3.44Å; V80-W112 HydrophobicContact CG2-CZ2 4.18Å; V80-W112 HydrophobicContact CG2-CZ3 4.28Å; L99-W112 VanDerWaalsContact CA-O 3.32Å; L99-W112 WeakPolarHBondContact CA-O 3.48Å; L99-W112 VanDerWaalsContact CD2-O 3.26Å; L99-W112 WeakPolarHBondContact CD2-O 3.45Å; F100-W112 HydrophobicContact CD1-CB 3.69Å; F100-W112 HydrophobicContact CD1-CG 4.49Å; F100-W112 HydrophobicContact CD2-CB 3.72Å; F100-W112 AromaticContact CD2-CD1 3.73Å; F100-W112 AromaticContact CD2-CG 3.73Å; F100-W112 HydrophobicContact CD2-CG 3.73Å; F100-W112 HydrophobicContact CE1-CB 3.38Å; F100-W112 HydrophobicContact CE1-CG 4.03Å; F100-W112 HydrophobicContact CE2-CB 3.42Å; F100-W112 VanDerWaalsContact CE2-CB 3.42Å; F100-W112 AromaticContact CE2-CD1 3.43Å; F100-W112 VanDerWaalsContact CE2-CD1 3.43Å; F100-W112 AromaticContact CE2-CD2 3.58Å; F100-W112 HydrophobicContact CE2-CD2 3.58Å; F100-W112 HydrophobicContact CE2-CE3 4.24Å; F100-W112 AromaticContact CE2-CG 3.16Å; F100-W112 HydrophobicContact CE2-CG 3.16Å; F100-W112 AromaticContact CE2-NE1 3.97Å; F100-W112 HydrophobicContact CG-CB 3.85Å; F100-W112 HydrophobicContact CG-CG 4.36Å; F100-W112 HydrophobicContact CZ-CB 3.24Å; F100-W112 AromaticContact CZ-CD2 3.57Å; F100-W112 HydrophobicContact CZ-CD2 3.57Å; F100-W112 AromaticContact CZ-CE3 3.8Å; F100-W112 HydrophobicContact CZ-CE3 3.8Å; F100-W112 AromaticContact CZ-CG 3.34Å; F100-W112 HydrophobicContact CZ-CG 3.34Å; F100-W112 PolarHBondContact N-O 2.83Å; F100-W112 PolarHBondContact O-N 3.04Å; T102-W112 PolarHBondContact OG1-NE1 2.86Å; W112-M117 WeakPolarHBondContact CZ3-O 3.07Å; W112-T118 CarbonylContact C-O 3.52Å; W112-T118 VanDerWaalsContact CA-O 3.31Å; W112-T118 WeakPolarHBondContact CA-O 3.21Å; W112-T118 VanDerWaalsContact CE3-C 3.5Å; W112-I119 HydrophobicContact CD2-CG1 3.85Å; W112-I119 HydrophobicContact CE3-CG1 4.01Å; W112-I119 HydrophobicContact CH2-CD1 3.84Å; W112-I119 HydrophobicContact CH2-CG1 3.43Å; W112-I119 VanDerWaalsContact CH2-CG1 3.43Å; W112-I119 HydrophobicContact CZ2-CD1 3.57Å; W112-I119 HydrophobicContact CZ2-CG1 3.28Å; W112-I119 HydrophobicContact CZ3-CG1 3.83Å
113	D	96.5	Very high	93.2	Very high	36 Å²	36	42.7 Å²	42.7	19%	0.193	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	119.9	160.7	-173.7	-47.5	0	0	0	108.9	A115 F116 M117 T118 V120	D113-A115 WeakPolarHBondContact OD1-CA 3.3Å; D113-A115 VanDerWaalsContact OD1-CB 3.28Å; D113-A115 WeakPolarHBondContact OD1-CB 3.41Å; D113-A115 PolarHBondContact OD1-N 2.88Å; D113-F116 HydrophobicContact CB-CD2 4.35Å; D113-F116 PolarHBondContact OD1-N 2.96Å; D113-F116 WeakPolarHBondContact OD2-CD2 3.31Å; D113-M117 VanDerWaalsContact O-CA 3.23Å; D113-M117 WeakPolarHBondContact O-CA 3.27Å; D113-M117 PolarHBondContact O-N 2.8Å; D113-T118 PolarHBondContact N-O 3.23Å; D113-T118 PolarHBondContact O-N 2.78Å; D113-V120 HydrophobicContact CB-CG1 3.59Å
114	A	97	Very high	93.2	Very high	3 Å²	3	48.1 Å²	48.1	3%	0.025	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-25.4	-177.6	0	0	0	0	0	113.8	M59 W92 K98 F100	M59-A114 WeakPolarHBondContact CE-O 3.37Å; W92-A114 HydrophobicContact CH2-CB 3.59Å; W92-A114 HydrophobicContact CZ3-CB 3.57Å; K98-A114 WeakPolarHBondContact O-CB 3.41Å; K98-A114 PolarHBondContact O-N 2.78Å; F100-A114 HydrophobicContact CD1-CB 4.05Å; F100-A114 HydrophobicContact CE1-CB 4.17Å
115	A	95.2	Very high	93.4	Very high	80 Å²	80	48 Å²	48	66%	0.661	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-37.8	177.7	0	0	0	0	0	111	D113	D113-A115 WeakPolarHBondContact OD1-CA 3.3Å; D113-A115 VanDerWaalsContact OD1-CB 3.28Å; D113-A115 WeakPolarHBondContact OD1-CB 3.41Å; D113-A115 PolarHBondContact OD1-N 2.88Å
116	F	95	Very high	93.5	Very high	149 Å²	149	51.4 Å²	51.4	65%	0.654	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-13.3	180	-57.8	-67.7	0	0	0	113.7	D113 T118	D113-F116 HydrophobicContact CB-CD2 4.35Å; D113-F116 PolarHBondContact OD1-N 2.96Å; D113-F116 WeakPolarHBondContact OD2-CD2 3.31Å; F116-T118 VanDerWaalsContact C-N 3.26Å; F116-T118 HydrophobicContact CB-CG2 4.36Å; F116-T118 PolarHBondContact O-N 2.8Å
117	M	95.6	Very high	93.7	Very high	5 Å²	5	53.9 Å²	53.9	3%	0.025	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	42	-173.9	-65.1	-68.4	-62.7	0	0	112.6	L49 I57 M59 F100 W112 D113	L49-M117 HydrophobicContact CD2-CE 4.29Å; L49-M117 HydrophobicContact CD2-SD 4.49Å; I57-M117 HydrophobicContact CB-CE 4.21Å; I57-M117 HydrophobicContact CG2-CE 3.88Å; I57-M117 WeakPolarHBondContact O-CE 3.44Å; M59-M117 HydrophobicContact CB-CE 4.25Å; M59-M117 HydrophobicContact CB-SD 3.9Å; M59-M117 HydrophobicContact CE-SD 4.22Å; F100-M117 HydrophobicContact CE1-SD 4.1Å; F100-M117 HydrophobicContact CZ-CE 4.27Å; F100-M117 HydrophobicContact CZ-SD 4.33Å; W112-M117 WeakPolarHBondContact CZ3-O 3.07Å; D113-M117 VanDerWaalsContact O-CA 3.23Å; D113-M117 WeakPolarHBondContact O-CA 3.27Å; D113-M117 PolarHBondContact O-N 2.8Å
118	T	95	Very high	93.7	Very high	44 Å²	44	56.5 Å²	56.5	27%	0.27	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	154.2	-178.9	53.3	0	0	0	0	111.4	W112 D113 F116 V120	W112-T118 CarbonylContact C-O 3.52Å; W112-T118 VanDerWaalsContact CA-O 3.31Å; W112-T118 WeakPolarHBondContact CA-O 3.21Å; W112-T118 VanDerWaalsContact CE3-C 3.5Å; D113-T118 PolarHBondContact N-O 3.23Å; D113-T118 PolarHBondContact O-N 2.78Å; F116-T118 VanDerWaalsContact C-N 3.26Å; F116-T118 HydrophobicContact CB-CG2 4.36Å; F116-T118 PolarHBondContact O-N 2.8Å; T118-V120 PolarHBondContact O-N 2.79Å
119	I	94.3	Very high	93.7	Very high	73 Å²	73	51.4 Å²	51.4	37%	0.374	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	120.9	174	-61	174	0	0	0	108.2	N110 V111 W112 D121	N110-I119 HydrophobicContact CB-CD1 4.13Å; N110-I119 HydrophobicContact CB-CG1 4.28Å; N110-I119 HydrophobicContact CB-CG2 4.22Å; V111-I119 CarbonylContact O-C 3.54Å; V111-I119 WeakPolarHBondContact O-CA 3.35Å; W112-I119 HydrophobicContact CD2-CG1 3.85Å; W112-I119 HydrophobicContact CE3-CG1 4.01Å; W112-I119 HydrophobicContact CH2-CD1 3.84Å; W112-I119 HydrophobicContact CH2-CG1 3.43Å; W112-I119 VanDerWaalsContact CH2-CG1 3.43Å; W112-I119 HydrophobicContact CZ2-CD1 3.57Å; W112-I119 HydrophobicContact CZ2-CG1 3.28Å; W112-I119 HydrophobicContact CZ3-CG1 3.83Å; I119-D121 WeakPolarHBondContact CG2-O 3.44Å
120	V	94.5	Very high	93.5	Very high	83 Å²	83	52.4 Å²	52.4	50%	0.503	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-27.1	174.9	-68.8	0	0	0	0	112.7	V111 D113 T118	V111-V120 HydrophobicContact CB-CG2 4.06Å; V111-V120 HydrophobicContact CG1-CG2 3.78Å; V111-V120 WeakPolarHBondContact O-CG2 3.49Å; V111-V120 PolarHBondContact O-N 2.78Å; D113-V120 HydrophobicContact CB-CG1 3.59Å; T118-V120 PolarHBondContact O-N 2.79Å
121	D	94.7	Very high	93.4	Very high	80 Å²	80	53.2 Å²	53.2	43%	0.428	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	154.7	174.8	-150.3	-20.2	0	0	0	111.3	V111 I119 F123	V111-D121 HydrophobicContact CB-CB 4.21Å; V111-D121 HydrophobicContact CG2-CB 4.34Å; V111-D121 PolarHBondContact N-O 3.41Å; V111-D121 PolarHBondContact O-N 3.46Å; I119-D121 WeakPolarHBondContact CG2-O 3.44Å; D121-F123 HydrophobicContact CB-CE1 4.35Å; D121-F123 HydrophobicContact CB-CE2 4.41Å; D121-F123 HydrophobicContact CB-CZ 3.92Å; D121-F123 WeakPolarHBondContact OD1-CE1 3.29Å; D121-F123 VanDerWaalsContact OD2-CE1 3.22Å; D121-F123 WeakPolarHBondContact OD2-CE1 3.49Å; D121-F123 WeakPolarHBondContact OD2-CZ 3.23Å
122	S	93.6	Very high	93.4	Very high	46 Å²	46	52.6 Å²	52.6	32%	0.322	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	120.9	-179.2	-171	0	0	0	0	111.1	M109 N110	M109-S122 WeakPolarHBondContact O-CA 3.09Å; N110-S122 WeakPolarHBondContact OD1-CB 3.25Å; N110-S122 PolarHBondContact OD1-OG 3.48Å
123	F	93.1	Very high	93.4	Very high	21 Å²	21	53.5 Å²	53.5	9%	0.092	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.2	-177.2	-49.1	-61.5	0	0	0	111	R108 M109 V111 D121 M125 I158	R108-F123 CarbonylContact C-O 3.59Å; R108-F123 VanDerWaalsContact CA-O 3.29Å; R108-F123 WeakPolarHBondContact CA-O 3.48Å; M109-F123 HydrophobicContact CE-CD2 3.94Å; M109-F123 PolarHBondContact N-O 2.9Å; M109-F123 PolarHBondContact O-N 2.77Å; V111-F123 HydrophobicContact CG2-CD2 4.39Å; V111-F123 HydrophobicContact CG2-CE2 3.71Å; D121-F123 HydrophobicContact CB-CE1 4.35Å; D121-F123 HydrophobicContact CB-CE2 4.41Å; D121-F123 HydrophobicContact CB-CZ 3.92Å; D121-F123 WeakPolarHBondContact OD1-CE1 3.29Å; D121-F123 VanDerWaalsContact OD2-CE1 3.22Å; D121-F123 WeakPolarHBondContact OD2-CE1 3.49Å; D121-F123 WeakPolarHBondContact OD2-CZ 3.23Å; F123-M125 PolarHBondContact O-N 3.18Å; F123-I158 HydrophobicContact CE2-CB 4.42Å; F123-I158 WeakPolarHBondContact CZ-O 3.23Å
124	T	92.5	Very high	93.4	Very high	115 Å²	115	51.8 Å²	51.8	71%	0.706	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	117.9	174.3	-55	0	0	0	0	110.4
125	M	91.7	Very high	93.3	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.025	28%	0.279	C	S	.	.			trans	-85.5	152.2	170	-52.9	-179.6	-68.7	0	0	110.1	T103 S107 M109 F123 K127 A129 V146 Y156	T103-M125 HydrophobicContact CG2-CE 3.98Å; T103-M125 HydrophobicContact CG2-SD 4.41Å; S107-M125 WeakPolarHBondContact CB-O 3.48Å; S107-M125 VanDerWaalsContact O-CA 3.32Å; S107-M125 WeakPolarHBondContact O-CA 3.22Å; S107-M125 WeakPolarHBondContact O-CB 3.48Å; S107-M125 PolarHBondContact O-N 2.9Å; M109-M125 HydrophobicContact CB-CG 4.19Å; M109-M125 HydrophobicContact CB-SD 3.99Å; F123-M125 PolarHBondContact O-N 3.18Å; M125-K127 PolarHBondContact O-N 3.33Å; M125-A129 HydrophobicContact CE-CB 3.92Å; M125-A129 HydrophobicContact SD-CB 4.41Å; M125-V146 HydrophobicContact SD-CG1 3.92Å; M125-V146 HydrophobicContact SD-CG2 4.33Å; M125-Y156 WeakPolarHBondContact CB-OH 3.35Å; M125-Y156 HydrophobicContact CG-CE1 4.41Å; M125-Y156 HydrophobicContact CG-CE2 4.28Å; M125-Y156 HydrophobicContact SD-CE2 4.41Å
126	Q	85.3	Confident	93.3	Very high	128 Å²	128	50 Å²	50	60%	0.598	26%	0.261	S	S	*	.	S	Bend	trans	-69.9	-23.6	-179.9	-65.1	-173.9	-10.7	0	0	113.6	R163	Q126-R163 VanDerWaalsContact CD-NH1 3.32Å
127	K	89.5	Confident	93.2	Very high	111 Å²	111	42.9 Å²	42.9	48%	0.483	23%	0.23	S	C	.	.	S	Bend	trans	-148.6	155.7	-173.5	-62.2	-67	172.9	-172.2	0	109.8	M125 L148 S150	M125-K127 PolarHBondContact O-N 3.33Å; K127-L148 HydrophobicContact CB-CB 4.5Å; K127-L148 HydrophobicContact CB-CD1 4.35Å; K127-L148 HydrophobicContact CB-CD2 4.25Å; K127-S150 WeakPolarHBondContact CG-OG 3.31Å
128	K	90.8	Very high	92.7	Very high	78 Å²	78	47.7 Å²	47.7	34%	0.339	26%	0.264	S	S	.	.			trans	-62.4	136.3	177.4	-173.9	173.8	179.1	-179.1	0	110.6	N88 S107 V149	N88-K128 WeakPolarHBondContact ND2-CE 3.19Å; N88-K128 WeakPolarHBondContact OD1-CE 3.4Å; S107-K128 WeakPolarHBondContact OG-CA 3.32Å; S107-K128 PolarHBondContact OG-N 2.89Å; S107-K128 VanDerWaalsContact OG-N 3.15Å; K128-V149 HydrophobicContact CB-CG2 3.9Å; K128-V149 HydrophobicContact CD-CG2 4.32Å; K128-V149 HydrophobicContact CG-CG2 4Å; K128-V149 WeakPolarHBondContact O-CG2 3.45Å; K128-V149 PolarHBondContact O-N 2.73Å
129	A	91.9	Very high	92.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	139.5	174.7	0	0	0	0	0	111.2	N88 T103 M125 V146 G147	N88-A129 VanDerWaalsContact CB-O 3.27Å; N88-A129 WeakPolarHBondContact CB-O 3.2Å; N88-A129 VanDerWaalsContact CG-O 3.31Å; N88-A129 PolarHBondContact ND2-O 2.91Å; T103-A129 HydrophobicContact CG2-CB 3.68Å; M125-A129 HydrophobicContact CE-CB 3.92Å; M125-A129 HydrophobicContact SD-CB 4.41Å; A129-V146 HydrophobicContact CB-CG1 3.34Å; A129-G147 CarbonylContact C-O 3.43Å; A129-G147 WeakPolarHBondContact CA-O 3.32Å
130	L	90.6	Very high	91.3	Very high	21 Å²	21	44.4 Å²	44.4	11%	0.11	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-36	165.3	-72.9	174.6	0	0	0	111.6	G147 V149 I180 L286	L130-G147 PolarHBondContact N-O 3.14Å; L130-V149 HydrophobicContact CD1-CG2 4.42Å; L130-V149 HydrophobicContact CD2-CG2 3.66Å; L130-V149 HydrophobicContact CG-CB 4.37Å; L130-V149 HydrophobicContact CG-CG2 3.65Å; L130-I180 HydrophobicContact CD1-CG2 4.4Å; L130-L286 HydrophobicContact CD2-CD2 3.86Å
131	T	92.8	Very high	90.8	Very high	19 Å²	19	42.8 Å²	42.8	12%	0.117	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	156.9	-176.2	-173.7	0	0	0	0	109.3	V146 G147 I180 V182	T131-V146 WeakPolarHBondContact O-CA 3.41Å; T131-G147 PolarHBondContact O-N 3.12Å; T131-I180 WeakPolarHBondContact CG2-O 3.49Å; T131-V182 HydrophobicContact CG2-CB 4.25Å; T131-V182 HydrophobicContact CG2-CG1 3.93Å; T131-V182 HydrophobicContact CG2-CG2 3.6Å
132	L	95.1	Very high	90.6	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	150.7	174.2	80.3	93.3	0	0	0	108.5	A89 E91 T103 I134 V144 A145	A89-L132 HydrophobicContact CB-CB 4.09Å; A89-L132 HydrophobicContact CB-CD2 3.48Å; A89-L132 VanDerWaalsContact CB-CD2 3.48Å; A89-L132 HydrophobicContact CB-CG 3.78Å; E91-L132 HydrophobicContact CB-CD1 3.53Å; E91-L132 HydrophobicContact CB-CG 4.39Å; E91-L132 VanDerWaalsContact OE2-O 3.13Å; T103-L132 HydrophobicContact CG2-CD2 3.85Å; L132-I134 HydrophobicContact CD1-CG1 4.18Å; L132-V144 HydrophobicContact CD1-CG1 4.5Å; L132-A145 CarbonylContact C-O 3.58Å; L132-A145 VanDerWaalsContact CA-O 3.32Å; L132-A145 WeakPolarHBondContact CA-O 3.49Å
133	N	96.2	Very high	90.7	Very high	25 Å²	25	39.6 Å²	39.6	13%	0.134	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	130.1	168.4	-172	-124.6	0	0	0	111	E91 A145 V182 W184	E91-N133 PolarHBondContact OE1-ND2 2.82Å; E91-N133 WeakPolarHBondContact OE2-CA 3.47Å; E91-N133 PolarHBondContact OE2-ND2 3.43Å; E91-N133 VanDerWaalsContact OE2-ND2 3.12Å; N133-A145 PolarHBondContact N-O 3.18Å; N133-A145 PolarHBondContact O-N 2.76Å; N133-V182 HydrophobicContact CB-CG2 3.82Å; N133-V182 VanDerWaalsContact CB-O 3.32Å; N133-V182 WeakPolarHBondContact CB-O 3.39Å; N133-W184 VanDerWaalsContact O-CD1 3.27Å; N133-W184 PolarHBondContact O-NE1 3.49Å; N133-W184 VanDerWaalsContact O-NE1 3.14Å; N133-W184 PolarHBondContact OD1-N 2.77Å
134	I	96.4	Very high	90.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134	179	-52.9	162.7	0	0	0	107.5	E91 W92 Y93 P94 L101 L132 P136 V144	E91-I134 HydrophobicContact CB-CD1 4.12Å; E91-I134 HydrophobicContact CG-CD1 4.26Å; E91-I134 PolarHBondContact OE1-N 2.57Å; W92-I134 WeakPolarHBondContact O-CD1 3.41Å; Y93-I134 HydrophobicContact CD2-CD1 4.38Å; Y93-I134 HydrophobicContact CD2-CG2 4.16Å; Y93-I134 HydrophobicContact CE2-CG2 4.12Å; P94-I134 VanDerWaalsContact CD-CG2 3.49Å; P94-I134 HydrophobicContact CG-CB 3.85Å; P94-I134 HydrophobicContact CG-CG2 3.91Å; L101-I134 HydrophobicContact CD1-CD1 3.35Å; L101-I134 HydrophobicContact CD1-CG1 3.99Å; L101-I134 HydrophobicContact CG-CD1 4.49Å; L132-I134 HydrophobicContact CD1-CG1 4.18Å; I134-P136 WeakPolarHBondContact O-CD 3.48Å; I134-V144 HydrophobicContact CG1-CG2 4.12Å; I134-V144 HydrophobicContact CG2-CG2 4.36Å
135	C	96.1	Very high	91	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.187	C	C	.	.			trans	-66.8	117.9	-179.7	-173.9	0	0	0	0	109.8	A137 G140 E141 L143 W184	C135-A137 VanDerWaalsContact C-N 3.35Å; C135-G140 VanDerWaalsContact CB-O 3.27Å; C135-G140 WeakPolarHBondContact CB-O 3.41Å; C135-E141 WeakPolarHBondContact O-CA 3.46Å; C135-L143 HydrophobicContact CB-CB 4.06Å; C135-L143 WeakPolarHBondContact CB-O 3.32Å; C135-L143 PolarHBondContact N-O 2.83Å; C135-W184 HydrophobicContact CB-CB 4.31Å; C135-W184 HydrophobicContact CB-CD2 3.73Å; C135-W184 HydrophobicContact CB-CE3 4.29Å; C135-W184 HydrophobicContact CB-CG 3.74Å; C135-W184 HydrophobicContact CB-CZ2 4.49Å
136	P	94.3	Very high	91.2	Very high	44 Å²	44	32.9 Å²	32.9	29%	0.286	19%	0.185	S	C	.	.			trans	-87.3	-8	-179.1	17.5	-5.2	0	0	0	113	P94 I134 P186	P94-P136 HydrophobicContact CB-CB 3.76Å; P94-P136 HydrophobicContact CG-CB 4.1Å; I134-P136 WeakPolarHBondContact O-CD 3.48Å; P136-P186 HydrophobicContact CG-CB 4.17Å
137	A	92.3	Very high	91.6	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.008	16%	0.157	C	C	.	.	S	Bend	trans	-74.1	143.7	-175.5	0	0	0	0	0	111.4	C135 G139 G140 P186 R189	C135-A137 VanDerWaalsContact C-N 3.35Å; A137-G139 PolarHBondContact O-N 2.85Å; A137-G140 WeakPolarHBondContact O-CA 3.47Å; A137-G140 PolarHBondContact O-N 3.29Å; A137-P186 WeakPolarHBondContact CA-O 3.43Å; A137-R189 HydrophobicContact CB-CB 3.8Å
138	S	85	Confident	91.8	Very high	106 Å²	106	21.8 Å²	21.8	74%	0.741	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	133.4	-178.5	-171.8	0	0	0	0	112.5	G140 E141	S138-G140 PolarHBondContact O-N 3.24Å; S138-E141 VanDerWaalsContact CA-OE1 3.28Å; S138-E141 WeakPolarHBondContact CA-OE1 3.49Å
139	G	82.9	Confident	91.7	Very high	45 Å²	45	21.4 Å²	21.4	46%	0.464	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	13.5	-175.9	0	0	0	0	0	114.2	A137 E141 R189	A137-G139 PolarHBondContact O-N 2.85Å; G139-E141 WeakPolarHBondContact CA-OE2 3.36Å; G139-E141 PolarHBondContact N-OE1 2.78Å; G139-E141 PolarHBondContact N-OE2 2.75Å; G139-R189 PolarHBondContact O-NH1 3.35Å
140	G	78.6	Confident	91.4	Very high	2 Å²	2	23.4 Å²	23.4	2%	0.021	15%	0.154	C	C	.	.			trans	-123.1	0.5	173.8	0	0	0	0	0	112.9	C135 A137 S138 C142 L143	C135-G140 VanDerWaalsContact CB-O 3.27Å; C135-G140 WeakPolarHBondContact CB-O 3.41Å; A137-G140 WeakPolarHBondContact O-CA 3.47Å; A137-G140 PolarHBondContact O-N 3.29Å; S138-G140 PolarHBondContact O-N 3.24Å; G140-C142 PolarHBondContact O-N 3.28Å; G140-L143 WeakPolarHBondContact O-CB 3.44Å; G140-L143 PolarHBondContact O-N 2.91Å
141	E	82.3	Confident	91.2	Very high	49 Å²	49	22.4 Å²	22.4	23%	0.229	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-18.3	-166.2	-52.2	88.1	160	0	0	113.3	Y93 C135 S138 G139	Y93-E141 HydrophobicContact CE1-CB 4.14Å; Y93-E141 WeakPolarHBondContact CE2-O 3.46Å; Y93-E141 WeakPolarHBondContact OH-CB 3.37Å; Y93-E141 PolarHBondContact OH-O 3.07Å; C135-E141 WeakPolarHBondContact O-CA 3.46Å; S138-E141 VanDerWaalsContact CA-OE1 3.28Å; S138-E141 WeakPolarHBondContact CA-OE1 3.49Å; G139-E141 WeakPolarHBondContact CA-OE2 3.36Å; G139-E141 PolarHBondContact N-OE1 2.78Å; G139-E141 PolarHBondContact N-OE2 2.75Å
142	C	91.5	Very high	91.1	Very high	31 Å²	31	21.6 Å²	21.6	21%	0.209	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-8.1	176.8	-56.9	0	0	0	0	113.8	G140 D157 I158 R159	G140-C142 PolarHBondContact O-N 3.28Å; C142-D157 WeakPolarHBondContact O-CA 3.33Å; C142-I158 HydrophobicContact CB-CG1 4.13Å; C142-I158 WeakPolarHBondContact O-CG1 3.33Å; C142-I158 PolarHBondContact O-N 2.92Å; C142-R159 HydrophobicContact CB-CG 3.99Å; C142-R159 WeakPolarHBondContact SG-CD 3.48Å; C142-R159 VanDerWaalsContact SG-CG 3.59Å
143	L	95.3	Very high	91	Very high	28 Å²	28	21.5 Å²	21.5	15%	0.147	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.6	-177.9	-60.3	177.6	0	0	0	110.9	C135 G140 V155 Y156 D157 W184	C135-L143 HydrophobicContact CB-CB 4.06Å; C135-L143 WeakPolarHBondContact CB-O 3.32Å; C135-L143 PolarHBondContact N-O 2.83Å; G140-L143 WeakPolarHBondContact O-CB 3.44Å; G140-L143 PolarHBondContact O-N 2.91Å; L143-V155 HydrophobicContact CD2-CG1 4.4Å; L143-Y156 CarbonylContact C-O 3.6Å; L143-Y156 WeakPolarHBondContact CA-O 3.28Å; L143-D157 HydrophobicContact CD2-CB 4.39Å; L143-W184 HydrophobicContact CB-CH2 4.37Å; L143-W184 HydrophobicContact CB-CZ2 4.05Å; L143-W184 HydrophobicContact CD1-CH2 4.26Å
144	V	96.3	Very high	91	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	123.6	176.9	-177.8	0	0	0	0	109.2	L101 M109 L132 I134 V146 V155 Y156 I158	L101-V144 HydrophobicContact CD2-CG2 4.21Å; M109-V144 HydrophobicContact SD-CB 4.24Å; M109-V144 HydrophobicContact SD-CG1 3.81Å; L132-V144 HydrophobicContact CD1-CG1 4.5Å; I134-V144 HydrophobicContact CG1-CG2 4.12Å; I134-V144 HydrophobicContact CG2-CG2 4.36Å; V144-V146 HydrophobicContact CG1-CG2 4.03Å; V144-V155 CarbonylContact O-C 3.59Å; V144-V155 WeakPolarHBondContact O-CA 3.29Å; V144-Y156 PolarHBondContact N-O 3.14Å; V144-Y156 PolarHBondContact O-N 2.89Å; V144-I158 HydrophobicContact CB-CG2 4.32Å; V144-I158 HydrophobicContact CG2-CG2 3.4Å; V144-I158 VanDerWaalsContact CG2-CG2 3.4Å
145	A	96.3	Very high	90.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.7	171.3	0	0	0	0	0	108.9	L132 N133 T153 A154 V182 W184 L192	L132-A145 CarbonylContact C-O 3.58Å; L132-A145 VanDerWaalsContact CA-O 3.32Å; L132-A145 WeakPolarHBondContact CA-O 3.49Å; N133-A145 PolarHBondContact N-O 3.18Å; N133-A145 PolarHBondContact O-N 2.76Å; A145-T153 HydrophobicContact CB-CG2 3.95Å; A145-A154 CarbonylContact C-O 3.52Å; A145-A154 WeakPolarHBondContact CA-O 3.36Å; A145-V182 HydrophobicContact CB-CB 4.24Å; A145-V182 HydrophobicContact CB-CG2 4.42Å; A145-W184 HydrophobicContact CB-CZ2 4Å; A145-W184 VanDerWaalsContact CB-NE1 3.28Å; A145-L192 HydrophobicContact CB-CD1 3.74Å; A145-L192 HydrophobicContact CB-CD2 3.89Å
146	V	95.6	Very high	90.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	114.9	-178.1	-176.3	0	0	0	0	108.9	M109 M125 A129 T131 V144 L148 T153 A154 Y156	M109-V146 HydrophobicContact SD-CG2 4.35Å; M125-V146 HydrophobicContact SD-CG1 3.92Å; M125-V146 HydrophobicContact SD-CG2 4.33Å; A129-V146 HydrophobicContact CB-CG1 3.34Å; T131-V146 WeakPolarHBondContact O-CA 3.41Å; V144-V146 HydrophobicContact CG1-CG2 4.03Å; V146-L148 HydrophobicContact CG1-CD2 4Å; V146-T153 CarbonylContact O-C 3.58Å; V146-T153 VanDerWaalsContact O-CA 3.31Å; V146-T153 WeakPolarHBondContact O-CA 3.2Å; V146-A154 PolarHBondContact N-O 3.25Å; V146-A154 PolarHBondContact O-N 3.22Å; V146-Y156 HydrophobicContact CB-CD2 4.41Å; V146-Y156 HydrophobicContact CB-CE2 4.16Å; V146-Y156 HydrophobicContact CG2-CD2 3.79Å; V146-Y156 HydrophobicContact CG2-CE2 3.93Å
147	G	94.3	Very high	90.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	123.2	173.5	0	0	0	0	0	109.8	A129 L130 T131	A129-G147 CarbonylContact C-O 3.43Å; A129-G147 WeakPolarHBondContact CA-O 3.32Å; L130-G147 PolarHBondContact N-O 3.14Å; T131-G147 PolarHBondContact O-N 3.12Å
148	L	92.3	Very high	90.9	Very high	7 Å²	7	21.8 Å²	21.8	4%	0.037	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	146	-171.4	-56.7	177.6	0	0	0	111.8	K127 V146 S150 G151 G152 A154 L166 G178 D179	K127-L148 HydrophobicContact CB-CB 4.5Å; K127-L148 HydrophobicContact CB-CD1 4.35Å; K127-L148 HydrophobicContact CB-CD2 4.25Å; V146-L148 HydrophobicContact CG1-CD2 4Å; L148-S150 PolarHBondContact O-N 2.98Å; L148-G151 PolarHBondContact O-N 2.87Å; L148-G152 WeakPolarHBondContact CB-O 3.38Å; L148-G152 PolarHBondContact N-O 2.94Å; L148-A154 HydrophobicContact CD1-CB 4.11Å; L148-A154 HydrophobicContact CD2-CB 4.4Å; L148-A154 HydrophobicContact CG-CB 4.42Å; L148-L166 HydrophobicContact CD1-CD1 3.99Å; L148-G178 WeakPolarHBondContact O-CA 3.16Å; L148-D179 PolarHBondContact O-N 3.12Å
149	V	88.7	Confident	91.1	Very high	69 Å²	69	26.4 Å²	26.4	42%	0.418	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-36.7	173.4	177.6	0	0	0	0	111.9	K128 L130 G151 G178	K128-V149 HydrophobicContact CB-CG2 3.9Å; K128-V149 HydrophobicContact CD-CG2 4.32Å; K128-V149 HydrophobicContact CG-CG2 4Å; K128-V149 WeakPolarHBondContact O-CG2 3.45Å; K128-V149 PolarHBondContact O-N 2.73Å; L130-V149 HydrophobicContact CD1-CG2 4.42Å; L130-V149 HydrophobicContact CD2-CG2 3.66Å; L130-V149 HydrophobicContact CG-CB 4.37Å; L130-V149 HydrophobicContact CG-CG2 3.65Å; V149-G151 PolarHBondContact O-N 2.88Å; V149-G178 WeakPolarHBondContact O-CA 3.14Å
150	S	85.7	Confident	91.5	Very high	43 Å²	43	28.2 Å²	28.2	30%	0.301	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	8.5	179.4	60.4	0	0	0	0	114.4	K127 L148 R168	K127-S150 WeakPolarHBondContact CG-OG 3.31Å; L148-S150 PolarHBondContact O-N 2.98Å; S150-R168 PolarHBondContact O-NH2 2.95Å; S150-R168 VanDerWaalsContact O-NH2 3.13Å
151	G	86.9	Confident	91.9	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	80	151.1	-174.9	0	0	0	0	0	114.9	L148 V149 R168 Y177	L148-G151 PolarHBondContact O-N 2.87Å; V149-G151 PolarHBondContact O-N 2.88Å; G151-R168 PolarHBondContact O-NE 2.9Å; G151-R168 PolarHBondContact O-NH2 3.29Å; G151-Y177 WeakPolarHBondContact CA-O 3.26Å
152	G	90.6	Very high	92.3	Very high	2 Å²	2	30.2 Å²	30.2	2%	0.021	16%	0.164	C	C	.	.	S	Bend	trans	80.9	166.5	-172.1	0	0	0	0	0	113.6	L148 L167 D179	L148-G152 WeakPolarHBondContact CB-O 3.38Å; L148-G152 PolarHBondContact N-O 2.94Å; G152-L167 CarbonylContact C-O 3.6Å; G152-L167 VanDerWaalsContact CA-O 3.25Å; G152-L167 WeakPolarHBondContact CA-O 3.16Å; G152-D179 WeakPolarHBondContact CA-OD2 3.24Å
153	T	94.2	Very high	92.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	122.2	-175.5	-69	0	0	0	0	109.7	A145 V146 L167 D179 V182 L192 T194	A145-T153 HydrophobicContact CB-CG2 3.95Å; V146-T153 CarbonylContact O-C 3.58Å; V146-T153 VanDerWaalsContact O-CA 3.31Å; V146-T153 WeakPolarHBondContact O-CA 3.2Å; T153-L167 PolarHBondContact N-O 3.45Å; T153-L167 PolarHBondContact O-N 3.32Å; T153-D179 PolarHBondContact N-OD2 3.05Å; T153-D179 PolarHBondContact OG1-OD2 3.33Å; T153-V182 HydrophobicContact CG2-CG1 3.8Å; T153-V182 WeakPolarHBondContact OG1-CG1 3.37Å; T153-L192 HydrophobicContact CG2-CD2 3.93Å; T153-T194 HydrophobicContact CG2-CG2 4.1Å; T153-T194 VanDerWaalsContact OG1-CG2 3.29Å; T153-T194 WeakPolarHBondContact OG1-CG2 3.47Å
154	A	94.6	Very high	92.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	139.1	172.6	0	0	0	0	0	110.1	A145 V146 L148 Y156 R163 D165 L166	A145-A154 CarbonylContact C-O 3.52Å; A145-A154 WeakPolarHBondContact CA-O 3.36Å; V146-A154 PolarHBondContact N-O 3.25Å; V146-A154 PolarHBondContact O-N 3.22Å; L148-A154 HydrophobicContact CD1-CB 4.11Å; L148-A154 HydrophobicContact CD2-CB 4.4Å; L148-A154 HydrophobicContact CG-CB 4.42Å; A154-Y156 HydrophobicContact CB-CD2 4.23Å; A154-Y156 HydrophobicContact CB-CE2 3.46Å; A154-Y156 VanDerWaalsContact CB-CE2 3.46Å; A154-R163 HydrophobicContact CB-CG 4.37Å; A154-D165 WeakPolarHBondContact CA-O 3.46Å; A154-L166 HydrophobicContact CB-CD1 4.25Å
155	V	95.2	Very high	91.8	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.1	173.5	-178.7	0	0	0	0	108.4	L143 V144 R163 V164 D165 L167 W184 T206	L143-V155 HydrophobicContact CD2-CG1 4.4Å; V144-V155 CarbonylContact O-C 3.59Å; V144-V155 WeakPolarHBondContact O-CA 3.29Å; V155-R163 CarbonylContact O-C 3.53Å; V155-R163 WeakPolarHBondContact O-CA 3.25Å; V155-R163 WeakPolarHBondContact O-CG 3.43Å; V155-V164 PolarHBondContact O-N 2.96Å; V155-D165 HydrophobicContact CB-CB 4.26Å; V155-D165 PolarHBondContact N-O 2.93Å; V155-D165 PolarHBondContact O-N 2.96Å; V155-L167 HydrophobicContact CG2-CD1 4.13Å; V155-W184 HydrophobicContact CG1-CH2 4.2Å; V155-W184 HydrophobicContact CG1-CZ2 3.99Å; V155-W184 HydrophobicContact CG2-CZ2 4.35Å; V155-T206 HydrophobicContact CG2-CG2 4.42Å
156	Y	95.3	Very high	91.6	Very high	7 Å²	7	40.3 Å²	40.3	3%	0.027	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	148.5	178.8	-65.5	-93	0	0	0	110.4	M109 M125 L143 V144 V146 A154 T162 R163	M109-Y156 HydrophobicContact CE-CG 4.18Å; M125-Y156 WeakPolarHBondContact CB-OH 3.35Å; M125-Y156 HydrophobicContact CG-CE1 4.41Å; M125-Y156 HydrophobicContact CG-CE2 4.28Å; M125-Y156 HydrophobicContact SD-CE2 4.41Å; L143-Y156 CarbonylContact C-O 3.6Å; L143-Y156 WeakPolarHBondContact CA-O 3.28Å; V144-Y156 PolarHBondContact N-O 3.14Å; V144-Y156 PolarHBondContact O-N 2.89Å; V146-Y156 HydrophobicContact CB-CD2 4.41Å; V146-Y156 HydrophobicContact CB-CE2 4.16Å; V146-Y156 HydrophobicContact CG2-CD2 3.79Å; V146-Y156 HydrophobicContact CG2-CE2 3.93Å; A154-Y156 HydrophobicContact CB-CD2 4.23Å; A154-Y156 HydrophobicContact CB-CE2 3.46Å; A154-Y156 VanDerWaalsContact CB-CE2 3.46Å; Y156-T162 WeakPolarHBondContact CA-O 3.32Å; Y156-R163 HydrophobicContact CD1-CB 3.91Å; Y156-R163 HydrophobicContact CD1-CG 4.46Å; Y156-R163 HydrophobicContact CE1-CB 3.66Å; Y156-R163 HydrophobicContact CE1-CG 4.17Å
157	D	93.5	Very high	91.3	Very high	39 Å²	39	40.3 Å²	40.3	21%	0.209	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.1	163.8	-173.3	-27.8	0	0	0	108.3	C142 L143 R159 T160 G161 T162 V164	C142-D157 WeakPolarHBondContact O-CA 3.33Å; L143-D157 HydrophobicContact CD2-CB 4.39Å; D157-R159 PolarHBondContact O-N 2.88Å; D157-R159 VanDerWaalsContact OD1-CB 3.32Å; D157-R159 WeakPolarHBondContact OD1-CB 3.31Å; D157-R159 PolarHBondContact OD1-N 3.01Å; D157-T160 PolarHBondContact O-N 3.12Å; D157-T160 PolarHBondContact O-OG1 2.82Å; D157-G161 WeakPolarHBondContact O-CA 3.34Å; D157-G161 PolarHBondContact O-N 2.87Å; D157-T162 PolarHBondContact N-O 3.36Å; D157-T162 PolarHBondContact O-N 3.26Å; D157-V164 HydrophobicContact CB-CG2 3.81Å
158	I	93	Very high	90.9	Very high	26 Å²	26	45 Å²	45	13%	0.133	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.8	-176.3	68.2	-178.3	0	0	0	113	Y93 L101 M109 F123 C142 V144 T160	Y93-I158 HydrophobicContact CD2-CD1 4.45Å; Y93-I158 HydrophobicContact CE2-CD1 3.69Å; L101-I158 HydrophobicContact CD2-CG2 4.03Å; M109-I158 HydrophobicContact CE-CG2 4.03Å; F123-I158 HydrophobicContact CE2-CB 4.42Å; F123-I158 WeakPolarHBondContact CZ-O 3.23Å; C142-I158 HydrophobicContact CB-CG1 4.13Å; C142-I158 WeakPolarHBondContact O-CG1 3.33Å; C142-I158 PolarHBondContact O-N 2.92Å; V144-I158 HydrophobicContact CB-CG2 4.32Å; V144-I158 HydrophobicContact CG2-CG2 3.4Å; V144-I158 VanDerWaalsContact CG2-CG2 3.4Å; I158-T160 VanDerWaalsContact C-N 3.29Å
159	R	90.9	Very high	90.3	Very high	203 Å²	203	46 Å²	46	77%	0.766	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-30.3	177.1	-71.5	172.5	53.1	151.2	-0.2	112.1	C142 D157	C142-R159 HydrophobicContact CB-CG 3.99Å; C142-R159 WeakPolarHBondContact SG-CD 3.48Å; C142-R159 VanDerWaalsContact SG-CG 3.59Å; D157-R159 PolarHBondContact O-N 2.88Å; D157-R159 VanDerWaalsContact OD1-CB 3.32Å; D157-R159 WeakPolarHBondContact OD1-CB 3.31Å; D157-R159 PolarHBondContact OD1-N 3.01Å
160	T	90.2	Very high	89.6	Confident	83 Å²	83	51.6 Å²	51.6	51%	0.509	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-14.9	-177.4	59.4	0	0	0	0	112.2	D157 I158 T162	D157-T160 PolarHBondContact O-N 3.12Å; D157-T160 PolarHBondContact O-OG1 2.82Å; I158-T160 VanDerWaalsContact C-N 3.29Å; T160-T162 PolarHBondContact O-N 2.95Å; T160-T162 PolarHBondContact OG1-N 2.8Å; T160-T162 PolarHBondContact OG1-OG1 2.79Å
161	G	87.9	Confident	88.7	Confident	18 Å²	18	51 Å²	51	19%	0.186	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	70	7.9	-172.9	0	0	0	0	0	113.9	D157	D157-G161 WeakPolarHBondContact O-CA 3.34Å; D157-G161 PolarHBondContact O-N 2.87Å
162	T	91	Very high	87.2	Confident	76 Å²	76	56.2 Å²	56.2	47%	0.466	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	142.1	-172.3	59.6	0	0	0	0	111.7	Y156 D157 T160 V164	Y156-T162 WeakPolarHBondContact CA-O 3.32Å; D157-T162 PolarHBondContact N-O 3.36Å; D157-T162 PolarHBondContact O-N 3.26Å; T160-T162 PolarHBondContact O-N 2.95Å; T160-T162 PolarHBondContact OG1-N 2.8Å; T160-T162 PolarHBondContact OG1-OG1 2.79Å; T162-V164 PolarHBondContact O-N 3.39Å
163	R	92	Very high	85.9	Confident	97 Å²	97	62.8 Å²	62.8	37%	0.366	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	117	165.5	-171.4	-175.4	69.1	-172.9	-2.4	109.4	Q126 A154 V155 Y156 D165	Q126-R163 VanDerWaalsContact CD-NH1 3.32Å; A154-R163 HydrophobicContact CB-CG 4.37Å; V155-R163 CarbonylContact O-C 3.53Å; V155-R163 WeakPolarHBondContact O-CA 3.25Å; V155-R163 WeakPolarHBondContact O-CG 3.43Å; Y156-R163 HydrophobicContact CD1-CB 3.91Å; Y156-R163 HydrophobicContact CD1-CG 4.46Å; Y156-R163 HydrophobicContact CE1-CB 3.66Å; Y156-R163 HydrophobicContact CE1-CG 4.17Å; R163-D165 WeakPolarHBondContact CG-O 3.29Å
164	V	91.2	Very high	84.4	Confident	71 Å²	71	65.5 Å²	65.5	43%	0.43	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-47.7	175.1	-176.4	0	0	0	0	109.8	V155 D157 T162	V155-V164 PolarHBondContact O-N 2.96Å; D157-V164 HydrophobicContact CB-CG2 3.81Å; T162-V164 PolarHBondContact O-N 3.39Å
165	D	89.2	Confident	83	Confident	43 Å²	43	70.4 Å²	70.4	23%	0.23	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	164.2	-170.8	-85.4	-52.3	0	0	0	113.7	A154 V155 R163 T209	A154-D165 WeakPolarHBondContact CA-O 3.46Å; V155-D165 HydrophobicContact CB-CB 4.26Å; V155-D165 PolarHBondContact N-O 2.93Å; V155-D165 PolarHBondContact O-N 2.96Å; R163-D165 WeakPolarHBondContact CG-O 3.29Å; D165-T209 HydrophobicContact CB-CG2 3.81Å; D165-T209 WeakPolarHBondContact OD1-CG2 3.35Å
166	L	90.9	Very high	81.6	Confident	59 Å²	59	72.5 Å²	72.5	31%	0.309	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	111.1	170.3	179.9	66.5	0	0	0	109.5	L148 A154	L148-L166 HydrophobicContact CD1-CD1 3.99Å; A154-L166 HydrophobicContact CB-CD1 4.25Å
167	L	90.5	Very high	80.7	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.1	-179.9	-54.9	173	0	0	0	108.7	G152 T153 V155 L192 W204 T206 T209	G152-L167 CarbonylContact C-O 3.6Å; G152-L167 VanDerWaalsContact CA-O 3.25Å; G152-L167 WeakPolarHBondContact CA-O 3.16Å; T153-L167 PolarHBondContact N-O 3.45Å; T153-L167 PolarHBondContact O-N 3.32Å; V155-L167 HydrophobicContact CG2-CD1 4.13Å; L167-L192 HydrophobicContact CD1-CD2 3.57Å; L167-W204 HydrophobicContact CB-CD2 4.08Å; L167-W204 HydrophobicContact CB-CE3 4.24Å; L167-W204 HydrophobicContact CB-CZ2 4.35Å; L167-W204 HydrophobicContact CB-CZ3 4.46Å; L167-W204 HydrophobicContact CD1-CB 4.03Å; L167-W204 HydrophobicContact CD1-CD2 4.32Å; L167-W204 HydrophobicContact CD1-CG 3.98Å; L167-W204 HydrophobicContact CD2-CD2 4.35Å; L167-W204 HydrophobicContact CD2-CE3 4Å; L167-W204 HydrophobicContact CG-CD2 4.48Å; L167-T206 HydrophobicContact CD1-CG2 4.13Å; L167-T209 HydrophobicContact CD2-CG2 3.55Å
168	R	84.6	Confident	80.1	Confident	97 Å²	97	76.3 Å²	76.3	37%	0.366	40%	0.396	S	S	.	.			trans	-146.6	126.9	-177.3	-175.7	178.9	-84.8	-170.5	-8.4	110.2	S150 G151 L176	S150-R168 PolarHBondContact O-NH2 2.95Å; S150-R168 VanDerWaalsContact O-NH2 3.13Å; G151-R168 PolarHBondContact O-NE 2.9Å; G151-R168 PolarHBondContact O-NH2 3.29Å; R168-L176 HydrophobicContact CG-CD1 4.37Å; R168-L176 HydrophobicContact CG-CD2 4.27Å
169	L	79.8	Confident	79.6	Confident	30 Å²	30	75.3 Å²	75.3	16%	0.157	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-73.2	138.6	167.8	-74.3	154.1	0	0	0	109.4	S171 R199 V202 W204 P212	L169-S171 PolarHBondContact O-N 2.84Å; L169-R199 VanDerWaalsContact CB-NH1 3.29Å; L169-V202 HydrophobicContact CD1-CB 4.04Å; L169-V202 HydrophobicContact CD1-CG1 4.16Å; L169-V202 HydrophobicContact CD1-CG2 3.34Å; L169-V202 HydrophobicContact CD2-CG1 4.33Å; L169-V202 HydrophobicContact CG-CG1 4.48Å; L169-V202 HydrophobicContact CG-CG2 4.42Å; L169-W204 HydrophobicContact CD1-CZ2 4.42Å; L169-W204 HydrophobicContact CD2-CH2 4.33Å; L169-W204 HydrophobicContact CD2-CZ2 4.4Å; L169-W204 HydrophobicContact CG-CH2 4.07Å; L169-W204 HydrophobicContact CG-CZ2 3.85Å; L169-P212 HydrophobicContact CD2-CG 3.87Å
170	Q	73.8	Confident	79.5	Confident	185 Å²	185	66.1 Å²	66.1	86%	0.864	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-65.7	126.4	166.1	-64.9	-176.3	-7.1	0	0	108.6
171	S	68.2	Low	79.6	Confident	30 Å²	30	62.4 Å²	62.4	21%	0.21	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-93.5	122.8	169.4	179.3	0	0	0	0	107.5	L169 H173 G174 D175	L169-S171 PolarHBondContact O-N 2.84Å; S171-H173 PolarHBondContact O-N 2.93Å; S171-H173 VanDerWaalsContact O-N 3.15Å; S171-G174 PolarHBondContact O-N 2.95Å; S171-G174 VanDerWaalsContact O-N 3.12Å; S171-D175 VanDerWaalsContact CB-O 3.27Å; S171-D175 WeakPolarHBondContact CB-O 3.47Å; S171-D175 PolarHBondContact OG-O 3.05Å
172	P	53.8	Low	80	Confident	111 Å²	111	62 Å²	62	72%	0.721	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.7	176.7	-20	30.2	0	0	0	112.5
173	H	63.2	Low	80.3	Confident	140 Å²	140	58.9 Å²	58.9	65%	0.648	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	0.7	-176.4	-59.9	-56.8	0	0	0	113.3	S171 D175	S171-H173 PolarHBondContact O-N 2.93Å; S171-H173 VanDerWaalsContact O-N 3.15Å; H173-D175 PolarHBondContact O-N 3.29Å
174	G	63.7	Low	80.5	Confident	56 Å²	56	54.4 Å²	54.4	58%	0.577	29%	0.292	S	S	*	.	S	Bend	trans	71.2	-22.2	-176.9	0	0	0	0	0	114.5	S171 L176	S171-G174 PolarHBondContact O-N 2.95Å; S171-G174 VanDerWaalsContact O-N 3.12Å; G174-L176 PolarHBondContact O-N 2.81Å
175	D	64.9	Low	80.8	Confident	103 Å²	103	51 Å²	51	55%	0.551	27%	0.272	S	S	*	.			trans	-68.8	112.4	173.5	-67.7	-26.1	0	0	0	109.7	S171 H173	S171-D175 VanDerWaalsContact CB-O 3.27Å; S171-D175 WeakPolarHBondContact CB-O 3.47Å; S171-D175 PolarHBondContact OG-O 3.05Å; H173-D175 PolarHBondContact O-N 3.29Å
176	L	66.6	Low	81.1	Confident	48 Å²	48	50.5 Å²	50.5	25%	0.251	27%	0.271	S	S	.	.			trans	-107.6	121.6	174.4	-67.5	167.9	0	0	0	107.8	R168 G174	R168-L176 HydrophobicContact CG-CD1 4.37Å; R168-L176 HydrophobicContact CG-CD2 4.27Å; G174-L176 PolarHBondContact O-N 2.81Å
177	Y	76.7	Confident	81.2	Confident	114 Å²	114	52.5 Å²	52.5	45%	0.447	28%	0.281	S	S	.	.			trans	-90.5	152.4	171.6	-61.6	-76.1	0	0	0	109.5	G151 E196	G151-Y177 WeakPolarHBondContact CA-O 3.26Å; Y177-E196 WeakPolarHBondContact O-CG 3.39Å
178	G	80	Confident	81.4	Confident	12 Å²	12	56.2 Å²	56.2	12%	0.124	30%	0.298	C	S	.	.			trans	-61.7	141.2	179.1	0	0	0	0	0	112.6	L148 V149 I180	L148-G178 WeakPolarHBondContact O-CA 3.16Å; V149-G178 WeakPolarHBondContact O-CA 3.14Å; G178-I180 PolarHBondContact O-N 3.07Å
179	D	82	Confident	81.8	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	114.5	171.6	-82.2	-24.9	0	0	0	108.3	L148 G152 T153 E196	L148-D179 PolarHBondContact O-N 3.12Å; G152-D179 WeakPolarHBondContact CA-OD2 3.24Å; T153-D179 PolarHBondContact N-OD2 3.05Å; T153-D179 PolarHBondContact OG1-OD2 3.33Å; D179-E196 VanDerWaalsContact OD1-CG 3.23Å; D179-E196 WeakPolarHBondContact OD1-CG 3.09Å
180	I	89.1	Confident	82.5	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.056	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-25.7	-176.6	54.9	156.3	0	0	0	112.1	L130 T131 G178 S195 V238 T285 S287	L130-I180 HydrophobicContact CD1-CG2 4.4Å; T131-I180 WeakPolarHBondContact CG2-O 3.49Å; G178-I180 PolarHBondContact O-N 3.07Å; I180-S195 WeakPolarHBondContact CG1-O 3.28Å; I180-S195 PolarHBondContact N-O 3.08Å; I180-V238 HydrophobicContact CD1-CB 4.05Å; I180-V238 HydrophobicContact CD1-CG1 4.14Å; I180-V238 WeakPolarHBondContact CD1-O 3.46Å; I180-T285 WeakPolarHBondContact CG2-O 3.2Å; I180-S287 WeakPolarHBondContact O-CB 3.5Å
181	V	93.5	Very high	83.5	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.03	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.3	175.9	-173.5	0	0	0	0	108.6	T194 S195 V238 G241	V181-T194 CarbonylContact O-C 3.31Å; V181-T194 VanDerWaalsContact O-CA 3.28Å; V181-T194 WeakPolarHBondContact O-CA 3.48Å; V181-S195 VanDerWaalsContact CB-OG 3.23Å; V181-S195 WeakPolarHBondContact CB-OG 3.35Å; V181-S195 WeakPolarHBondContact CG2-OG 3.45Å; V181-S195 PolarHBondContact N-O 3Å; V181-S195 PolarHBondContact O-N 3.3Å; V181-V238 HydrophobicContact CG2-CG1 4.04Å; V181-G241 WeakPolarHBondContact CG1-O 3.44Å
182	V	95.6	Very high	84.9	Confident	8 Å²	8	48 Å²	48	5%	0.048	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	128.3	165.5	-62.9	0	0	0	0	106.8	T131 N133 A145 T153 T194	T131-V182 HydrophobicContact CG2-CB 4.25Å; T131-V182 HydrophobicContact CG2-CG1 3.93Å; T131-V182 HydrophobicContact CG2-CG2 3.6Å; N133-V182 HydrophobicContact CB-CG2 3.82Å; N133-V182 VanDerWaalsContact CB-O 3.32Å; N133-V182 WeakPolarHBondContact CB-O 3.39Å; A145-V182 HydrophobicContact CB-CB 4.24Å; A145-V182 HydrophobicContact CB-CG2 4.42Å; T153-V182 HydrophobicContact CG2-CG1 3.8Å; T153-V182 WeakPolarHBondContact OG1-CG1 3.37Å; V182-T194 HydrophobicContact CG1-CG2 4.29Å
183	S	96.6	Very high	86.9	Confident	11 Å²	11	42.7 Å²	42.7	8%	0.077	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	113.2	-176.3	-172.6	0	0	0	0	110.3	V193 F243	S183-V193 PolarHBondContact N-O 3.13Å; S183-V193 PolarHBondContact O-N 2.83Å; S183-F243 WeakPolarHBondContact O-CE2 3.45Å
184	W	97.2	Very high	88.5	Confident	3 Å²	3	36.1 Å²	36.1	1%	0.011	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	146.8	173	-72.8	103.3	0	0	0	111	N133 C135 L143 A145 V155 R189 L192 T206 F243	N133-W184 VanDerWaalsContact O-CD1 3.27Å; N133-W184 PolarHBondContact O-NE1 3.49Å; N133-W184 VanDerWaalsContact O-NE1 3.14Å; N133-W184 PolarHBondContact OD1-N 2.77Å; C135-W184 HydrophobicContact CB-CB 4.31Å; C135-W184 HydrophobicContact CB-CD2 3.73Å; C135-W184 HydrophobicContact CB-CE3 4.29Å; C135-W184 HydrophobicContact CB-CG 3.74Å; C135-W184 HydrophobicContact CB-CZ2 4.49Å; L143-W184 HydrophobicContact CB-CH2 4.37Å; L143-W184 HydrophobicContact CB-CZ2 4.05Å; L143-W184 HydrophobicContact CD1-CH2 4.26Å; A145-W184 HydrophobicContact CB-CZ2 4Å; A145-W184 VanDerWaalsContact CB-NE1 3.28Å; V155-W184 HydrophobicContact CG1-CH2 4.2Å; V155-W184 HydrophobicContact CG1-CZ2 3.99Å; V155-W184 HydrophobicContact CG2-CZ2 4.35Å; W184-R189 WeakPolarHBondContact CZ3-O 3.29Å; W184-L192 HydrophobicContact CB-CD1 4.44Å; W184-L192 HydrophobicContact CD2-CB 4.38Å; W184-L192 HydrophobicContact CD2-CD1 3.65Å; W184-L192 HydrophobicContact CE3-CB 3.95Å; W184-L192 HydrophobicContact CE3-CD1 4.1Å; W184-L192 HydrophobicContact CG-CD1 3.79Å; W184-L192 HydrophobicContact CZ2-CD1 4.48Å; W184-L192 HydrophobicContact CZ3-CB 4.07Å; W184-T206 HydrophobicContact CH2-CG2 3.43Å; W184-T206 VanDerWaalsContact CH2-CG2 3.43Å; W184-T206 HydrophobicContact CZ3-CG2 3.55Å; W184-F243 WeakPolarHBondContact O-CD2 3.13Å
185	S	96.6	Very high	89.8	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.007	16%	0.163	C	C	.	.			trans	-65.3	133.4	163.7	177.7	0	0	0	0	109.8	I187 Q188 L191	S185-I187 PolarHBondContact O-N 2.83Å; S185-I187 PolarHBondContact OG-N 2.78Å; S185-Q188 PolarHBondContact OG-N 2.86Å; S185-Q188 VanDerWaalsContact OG-N 3.12Å; S185-L191 PolarHBondContact N-O 3.37Å
186	P	94.9	Very high	91	Very high	31 Å²	31	29 Å²	29	20%	0.201	14%	0.139	C	C	.	.	S	Bend	trans	-73.5	-11	177.6	29.3	-34.2	0	0	0	113.9	P136 A137 F243 T244 R245	P136-P186 HydrophobicContact CG-CB 4.17Å; A137-P186 WeakPolarHBondContact CA-O 3.43Å; P186-F243 HydrophobicContact CG-CB 4.37Å; P186-T244 VanDerWaalsContact CG-O 3.31Å; P186-T244 WeakPolarHBondContact CG-O 3.25Å; P186-R245 WeakPolarHBondContact CG-O 3.34Å
187	I	94.4	Very high	91.8	Very high	101 Å²	101	28.6 Å²	28.6	52%	0.518	14%	0.14	S	C	.	.	S	Bend	trans	-118	-27.1	-178.8	23.1	160.8	0	0	0	113.2	S185 D246	S185-I187 PolarHBondContact O-N 2.83Å; S185-I187 PolarHBondContact OG-N 2.78Å; I187-D246 WeakPolarHBondContact CD1-O 3.25Å
188	Q	94.3	Very high	92.1	Very high	79 Å²	79	29.3 Å²	29.3	37%	0.369	15%	0.146	S	C	.	.			trans	-112.5	98	-178.3	-65.6	-175.6	-20.6	0	0	110.3	S185 H190 L191	S185-Q188 PolarHBondContact OG-N 2.86Å; S185-Q188 VanDerWaalsContact OG-N 3.12Å; Q188-H190 PolarHBondContact O-N 2.71Å; Q188-L191 HydrophobicContact CB-CB 3.73Å; Q188-L191 PolarHBondContact O-N 3.37Å
189	R	93.2	Very high	92.4	Very high	117 Å²	117	30.1 Å²	30.1	44%	0.442	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-18.7	-173.2	73.6	176.9	-173.7	179.3	-1.4	116.6	A137 G139 W184	A137-R189 HydrophobicContact CB-CB 3.8Å; G139-R189 PolarHBondContact O-NH1 3.35Å; W184-R189 WeakPolarHBondContact CZ3-O 3.29Å
190	H	94	Very high	92.7	Very high	43 Å²	43	30 Å²	30	20%	0.199	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-4.2	178.1	-60.4	-58.4	0	0	0	112.7	Q188 D205 T206 R207	Q188-H190 PolarHBondContact O-N 2.71Å; H190-D205 CarbonylContact O-C 3.55Å; H190-D205 VanDerWaalsContact O-CA 3.26Å; H190-D205 WeakPolarHBondContact O-CA 3.44Å; H190-T206 PolarHBondContact O-N 3.26Å; H190-T206 PolarHBondContact O-OG1 2.78Å; H190-R207 HydrophobicContact CB-CG 4.33Å
191	L	95.8	Very high	93	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.047	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120.2	-177.8	-168.6	123.9	0	0	0	110.1	S185 Q188 V203 W204 L213 F243 F264 M267	S185-L191 PolarHBondContact N-O 3.37Å; Q188-L191 HydrophobicContact CB-CB 3.73Å; Q188-L191 PolarHBondContact O-N 3.37Å; L191-V203 HydrophobicContact CD1-CG1 3.81Å; L191-V203 HydrophobicContact CD2-CG1 4.24Å; L191-V203 HydrophobicContact CG-CG1 3.96Å; L191-W204 WeakPolarHBondContact CA-O 3.36Å; L191-L213 HydrophobicContact CD1-CD1 4.05Å; L191-F243 HydrophobicContact CD2-CE1 4.19Å; L191-F243 HydrophobicContact CD2-CE2 4.34Å; L191-F243 HydrophobicContact CD2-CZ 3.54Å; L191-F264 HydrophobicContact CD1-CD1 4.41Å; L191-F264 HydrophobicContact CD1-CE1 4.28Å; L191-F264 HydrophobicContact CD2-CD1 3.81Å; L191-F264 HydrophobicContact CD2-CE1 3.63Å; L191-M267 HydrophobicContact CD1-CE 4.07Å
192	L	96.5	Very high	93	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139	-179.6	178.8	72.2	0	0	0	109.3	A145 T153 L167 W184 T194 W204 T206	A145-L192 HydrophobicContact CB-CD1 3.74Å; A145-L192 HydrophobicContact CB-CD2 3.89Å; T153-L192 HydrophobicContact CG2-CD2 3.93Å; L167-L192 HydrophobicContact CD1-CD2 3.57Å; W184-L192 HydrophobicContact CB-CD1 4.44Å; W184-L192 HydrophobicContact CD2-CB 4.38Å; W184-L192 HydrophobicContact CD2-CD1 3.65Å; W184-L192 HydrophobicContact CE3-CB 3.95Å; W184-L192 HydrophobicContact CE3-CD1 4.1Å; W184-L192 HydrophobicContact CG-CD1 3.79Å; W184-L192 HydrophobicContact CZ2-CD1 4.48Å; W184-L192 HydrophobicContact CZ3-CB 4.07Å; L192-T194 HydrophobicContact CD2-CG2 3.83Å; L192-T194 HydrophobicContact CG-CG2 3.99Å; L192-W204 HydrophobicContact CB-CB 4.49Å; L192-W204 PolarHBondContact N-O 3.35Å; L192-W204 PolarHBondContact O-N 3.23Å; L192-T206 HydrophobicContact CB-CG2 4.16Å
193	V	97.2	Very high	93	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.1	168.9	-176.4	0	0	0	0	109.3	S183 P201 V202 V203 F243 Y250 F264	S183-V193 PolarHBondContact N-O 3.13Å; S183-V193 PolarHBondContact O-N 2.83Å; V193-P201 HydrophobicContact CG1-CB 3.89Å; V193-V202 CarbonylContact C-O 3.54Å; V193-V202 VanDerWaalsContact CA-O 3.32Å; V193-V202 WeakPolarHBondContact CA-O 3.41Å; V193-V203 HydrophobicContact CG2-CB 4.5Å; V193-V203 HydrophobicContact CG2-CG1 4.28Å; V193-V203 HydrophobicContact CG2-CG2 4.14Å; V193-F243 HydrophobicContact CB-CE2 4.14Å; V193-F243 HydrophobicContact CB-CZ 4.46Å; V193-F243 HydrophobicContact CG2-CE2 3.6Å; V193-F243 HydrophobicContact CG2-CZ 3.47Å; V193-F243 VanDerWaalsContact CG2-CZ 3.47Å; V193-Y250 HydrophobicContact CB-CD2 4.39Å; V193-Y250 HydrophobicContact CB-CE1 4.15Å; V193-Y250 HydrophobicContact CB-CE2 3.91Å; V193-Y250 HydrophobicContact CG1-CD1 4.07Å; V193-Y250 HydrophobicContact CG1-CE1 3.4Å; V193-Y250 HydrophobicContact CG1-CE2 4.05Å; V193-Y250 HydrophobicContact CG2-CD2 4.33Å; V193-Y250 HydrophobicContact CG2-CE2 4.35Å; V193-Y250 HydrophobicContact CG2-CG 4.47Å; V193-F264 HydrophobicContact CG2-CZ 4.11Å
194	T	95.6	Very high	93	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.018	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	155.8	176.1	72.9	0	0	0	0	110	T153 V181 V182 L192 P201 V202 W204	T153-T194 HydrophobicContact CG2-CG2 4.1Å; T153-T194 VanDerWaalsContact OG1-CG2 3.29Å; T153-T194 WeakPolarHBondContact OG1-CG2 3.47Å; V181-T194 CarbonylContact O-C 3.31Å; V181-T194 VanDerWaalsContact O-CA 3.28Å; V181-T194 WeakPolarHBondContact O-CA 3.48Å; V182-T194 HydrophobicContact CG1-CG2 4.29Å; L192-T194 HydrophobicContact CD2-CG2 3.83Å; L192-T194 HydrophobicContact CG-CG2 3.99Å; T194-P201 CarbonylContact O-C 3.5Å; T194-P201 VanDerWaalsContact O-CA 3.27Å; T194-P201 WeakPolarHBondContact O-CA 3.42Å; T194-V202 PolarHBondContact N-O 2.86Å; T194-V202 PolarHBondContact O-N 3.45Å; T194-W204 PolarHBondContact OG1-NE1 2.83Å
195	S	92	Very high	92.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.014	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	138.6	169.4	66.8	0	0	0	0	112.6	I180 V181 V238	I180-S195 WeakPolarHBondContact CG1-O 3.28Å; I180-S195 PolarHBondContact N-O 3.08Å; V181-S195 VanDerWaalsContact CB-OG 3.23Å; V181-S195 WeakPolarHBondContact CB-OG 3.35Å; V181-S195 WeakPolarHBondContact CG2-OG 3.45Å; V181-S195 PolarHBondContact N-O 3Å; V181-S195 PolarHBondContact O-N 3.3Å; S195-V238 WeakPolarHBondContact OG-CG1 3.26Å
196	E	88.9	Confident	92.7	Very high	6 Å²	6	29.7 Å²	29.7	3%	0.028	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	158	163.5	-56.9	173.6	-142.7	0	0	109.6	Y177 D179 K198 R199	Y177-E196 WeakPolarHBondContact O-CG 3.39Å; D179-E196 VanDerWaalsContact OD1-CG 3.23Å; D179-E196 WeakPolarHBondContact OD1-CG 3.09Å; E196-K198 VanDerWaalsContact C-N 3.3Å; E196-K198 PolarHBondContact O-N 2.88Å; E196-R199 HydrophobicContact CB-CB 4.25Å; E196-R199 HydrophobicContact CB-CG 4.4Å; E196-R199 VanDerWaalsContact CD-CD 3.47Å; E196-R199 PolarHBondContact O-N 2.84Å; E196-R199 IonicContact OE1-CZ 2.78Å; E196-R199 IonicContact OE1-NH1 3.19Å; E196-R199 PolarHBondContact OE1-NH1 2.95Å; E196-R199 WeakPolarHBondContact OE2-CD 3.34Å; E196-R199 IonicContact OE2-NH1 3.59Å
197	S	84.5	Confident	92.4	Very high	41 Å²	41	36 Å²	36	29%	0.287	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-39.7	-176.1	179.2	0	0	0	0	113.7	A237 V238	S197-A237 CarbonylContact O-C 3.59Å; S197-A237 WeakPolarHBondContact O-CA 3.46Å; S197-A237 WeakPolarHBondContact O-CB 3.31Å; S197-V238 PolarHBondContact O-N 2.82Å
198	K	82.5	Confident	92.2	Very high	129 Å²	129	35.2 Å²	35.2	56%	0.561	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.1	7.8	-174.4	-64.8	-175.3	178.9	179	0	114.6	E196 L232	E196-K198 VanDerWaalsContact C-N 3.3Å; E196-K198 PolarHBondContact O-N 2.88Å; K198-L232 PolarHBondContact O-N 2.93Å
199	R	85.1	Confident	91.5	Very high	28 Å²	28	33.5 Å²	33.5	11%	0.106	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-121.8	147.4	-177	-63	179.6	71.8	179.4	9.1	111.4	L169 E196 L232	L169-R199 VanDerWaalsContact CB-NH1 3.29Å; E196-R199 HydrophobicContact CB-CB 4.25Å; E196-R199 HydrophobicContact CB-CG 4.4Å; E196-R199 VanDerWaalsContact CD-CD 3.47Å; E196-R199 PolarHBondContact O-N 2.84Å; E196-R199 IonicContact OE1-CZ 2.78Å; E196-R199 IonicContact OE1-NH1 3.19Å; E196-R199 PolarHBondContact OE1-NH1 2.95Å; E196-R199 WeakPolarHBondContact OE2-CD 3.34Å; E196-R199 IonicContact OE2-NH1 3.59Å; R199-L232 VanDerWaalsContact O-CD1 3.29Å; R199-L232 WeakPolarHBondContact O-CD1 3.43Å
200	H	89.5	Confident	91	Very high	3 Å²	3	39.6 Å²	39.6	1%	0.014	18%	0.176	C	C	.	.			trans	-57.3	140.6	172.4	-72.4	-80.7	0	0	0	110.8	V202 Q215 L216 L218 P230 L232	H200-V202 WeakPolarHBondContact O-CG2 3.36Å; H200-Q215 HydrophobicContact CB-CG 3.6Å; H200-Q215 PolarHBondContact O-NE2 2.85Å; H200-L216 WeakPolarHBondContact CB-O 3.32Å; H200-L216 PolarHBondContact ND1-O 3.26Å; H200-L218 PolarHBondContact CE1-N 3.02Å; H200-P230 PolarHBondContact CD2-O 2.92Å; H200-L232 WeakPolarHBondContact CE1-CD2 3Å; H200-L232 WeakPolarHBondContact ND1-CD2 3.32Å
201	P	94	Very high	90.7	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.197	C	C	.	.			trans	-55.9	146.5	176.3	-25.3	34.8	0	0	0	112.2	V193 T194 L216 V238 Y250 V252	V193-P201 HydrophobicContact CG1-CB 3.89Å; T194-P201 CarbonylContact O-C 3.5Å; T194-P201 VanDerWaalsContact O-CA 3.27Å; T194-P201 WeakPolarHBondContact O-CA 3.42Å; P201-L216 HydrophobicContact CB-CB 4.38Å; P201-L216 HydrophobicContact CB-CD1 4.31Å; P201-L216 WeakPolarHBondContact O-CB 3.5Å; P201-L216 PolarHBondContact O-N 3.28Å; P201-V238 HydrophobicContact CG-CG2 4.22Å; P201-Y250 HydrophobicContact CB-CE1 4.24Å; P201-V252 HydrophobicContact CG-CG1 4.04Å; P201-V252 HydrophobicContact CG-CG2 3.77Å
202	V	94.7	Very high	90.5	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.012	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.8	-173.2	-179.8	0	0	0	0	109.7	L169 V193 T194 H200 W204 P212 Q215	L169-V202 HydrophobicContact CD1-CB 4.04Å; L169-V202 HydrophobicContact CD1-CG1 4.16Å; L169-V202 HydrophobicContact CD1-CG2 3.34Å; L169-V202 HydrophobicContact CD2-CG1 4.33Å; L169-V202 HydrophobicContact CG-CG1 4.48Å; L169-V202 HydrophobicContact CG-CG2 4.42Å; V193-V202 CarbonylContact C-O 3.54Å; V193-V202 VanDerWaalsContact CA-O 3.32Å; V193-V202 WeakPolarHBondContact CA-O 3.41Å; T194-V202 PolarHBondContact N-O 2.86Å; T194-V202 PolarHBondContact O-N 3.45Å; H200-V202 WeakPolarHBondContact O-CG2 3.36Å; V202-W204 HydrophobicContact CG1-CD2 4.34Å; V202-W204 HydrophobicContact CG1-CZ2 3.86Å; V202-P212 HydrophobicContact CG1-CB 3.17Å; V202-P212 HydrophobicContact CG1-CG 3.85Å; V202-Q215 HydrophobicContact CG2-CB 4.28Å; V202-Q215 HydrophobicContact CG2-CG 3.97Å
203	V	96.4	Very high	90.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.3	178.9	-166.7	0	0	0	0	108.8	L191 V193 P212 L213 K214 L216 F264 M267	L191-V203 HydrophobicContact CD1-CG1 3.81Å; L191-V203 HydrophobicContact CD2-CG1 4.24Å; L191-V203 HydrophobicContact CG-CG1 3.96Å; V193-V203 HydrophobicContact CG2-CB 4.5Å; V193-V203 HydrophobicContact CG2-CG1 4.28Å; V193-V203 HydrophobicContact CG2-CG2 4.14Å; V203-P212 CarbonylContact O-C 3.53Å; V203-P212 WeakPolarHBondContact O-CB 3.25Å; V203-L213 HydrophobicContact CB-CB 4.47Å; V203-L213 HydrophobicContact CG1-CD1 4.31Å; V203-L213 PolarHBondContact O-N 2.75Å; V203-K214 PolarHBondContact N-O 3.45Å; V203-K214 PolarHBondContact O-N 3.05Å; V203-L216 HydrophobicContact CG2-CD1 4.05Å; V203-L216 HydrophobicContact CG2-CD2 3.66Å; V203-L216 HydrophobicContact CG2-CG 3.74Å; V203-F264 HydrophobicContact CG1-CE1 3.89Å; V203-F264 HydrophobicContact CG1-CZ 4.35Å; V203-F264 HydrophobicContact CG2-CE1 4.23Å; V203-F264 HydrophobicContact CG2-CZ 3.89Å; V203-M267 HydrophobicContact CB-CE 4.47Å; V203-M267 HydrophobicContact CB-SD 4.07Å; V203-M267 HydrophobicContact CG1-CE 3.81Å; V203-M267 HydrophobicContact CG1-SD 4.02Å; V203-M267 HydrophobicContact CG2-CG 4.49Å; V203-M267 HydrophobicContact CG2-SD 4Å
204	W	96	Very high	90.2	Very high	3 Å²	3	52.9 Å²	52.9	1%	0.011	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	143.9	179.7	-58.1	90.5	0	0	0	110.2	L167 L169 L191 L192 T194 V202 P212	L167-W204 HydrophobicContact CB-CD2 4.08Å; L167-W204 HydrophobicContact CB-CE3 4.24Å; L167-W204 HydrophobicContact CB-CZ2 4.35Å; L167-W204 HydrophobicContact CB-CZ3 4.46Å; L167-W204 HydrophobicContact CD1-CB 4.03Å; L167-W204 HydrophobicContact CD1-CD2 4.32Å; L167-W204 HydrophobicContact CD1-CG 3.98Å; L167-W204 HydrophobicContact CD2-CD2 4.35Å; L167-W204 HydrophobicContact CD2-CE3 4Å; L167-W204 HydrophobicContact CG-CD2 4.48Å; L169-W204 HydrophobicContact CD1-CZ2 4.42Å; L169-W204 HydrophobicContact CD2-CH2 4.33Å; L169-W204 HydrophobicContact CD2-CZ2 4.4Å; L169-W204 HydrophobicContact CG-CH2 4.07Å; L169-W204 HydrophobicContact CG-CZ2 3.85Å; L191-W204 WeakPolarHBondContact CA-O 3.36Å; L192-W204 HydrophobicContact CB-CB 4.49Å; L192-W204 PolarHBondContact N-O 3.35Å; L192-W204 PolarHBondContact O-N 3.23Å; T194-W204 PolarHBondContact OG1-NE1 2.83Å; V202-W204 HydrophobicContact CG1-CD2 4.34Å; V202-W204 HydrophobicContact CG1-CZ2 3.86Å; W204-P212 HydrophobicContact CD2-CB 4.06Å; W204-P212 HydrophobicContact CE3-CB 3.89Å; W204-P212 HydrophobicContact CH2-CB 4.14Å; W204-P212 HydrophobicContact CH2-CG 4.44Å; W204-P212 HydrophobicContact CZ2-CB 4.3Å; W204-P212 HydrophobicContact CZ3-CB 3.94Å; W204-P212 HydrophobicContact CZ3-CG 4.44Å
205	D	94.3	Very high	90.1	Very high	19 Å²	19	54.7 Å²	54.7	10%	0.102	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.4	151.5	-168	-47	0	0	0	106	H190 R207 L208 L213	H190-D205 CarbonylContact O-C 3.55Å; H190-D205 VanDerWaalsContact O-CA 3.26Å; H190-D205 WeakPolarHBondContact O-CA 3.44Å; D205-R207 PolarHBondContact O-N 2.85Å; D205-R207 VanDerWaalsContact O-N 3.1Å; D205-R207 VanDerWaalsContact OD1-CB 3.24Å; D205-R207 WeakPolarHBondContact OD1-CB 3.48Å; D205-R207 WeakPolarHBondContact OD1-CG 3.48Å; D205-R207 IonicContact OD1-CZ 3.44Å; D205-R207 PolarHBondContact OD1-N 2.96Å; D205-R207 IonicContact OD1-NE 3.38Å; D205-R207 PolarHBondContact OD1-NE 2.86Å; D205-R207 IonicContact OD1-NH2 3.73Å; D205-R207 IonicContact OD2-CZ 3.03Å; D205-R207 IonicContact OD2-NE 3.74Å; D205-R207 PolarHBondContact OD2-NE 3.01Å; D205-R207 IonicContact OD2-NH2 2.69Å; D205-R207 PolarHBondContact OD2-NH2 3.38Å; D205-L208 HydrophobicContact CB-CB 4.18Å; D205-L208 HydrophobicContact CB-CD1 4.11Å; D205-L208 HydrophobicContact CB-CG 4.15Å; D205-L208 CarbonylContact O-C 3.59Å; D205-L208 WeakPolarHBondContact O-CA 3.31Å; D205-L208 PolarHBondContact O-N 3.29Å; D205-L213 HydrophobicContact CB-CD1 3.95Å; D205-L213 HydrophobicContact CB-CD2 3.98Å; D205-L213 HydrophobicContact CB-CG 3.97Å
206	T	92	Very high	90.1	Very high	8 Å²	8	54.6 Å²	54.6	5%	0.049	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-13.6	-176.9	57.6	0	0	0	0	113.1	V155 L167 W184 H190 L192 L208 T209	V155-T206 HydrophobicContact CG2-CG2 4.42Å; L167-T206 HydrophobicContact CD1-CG2 4.13Å; W184-T206 HydrophobicContact CH2-CG2 3.43Å; W184-T206 VanDerWaalsContact CH2-CG2 3.43Å; W184-T206 HydrophobicContact CZ3-CG2 3.55Å; H190-T206 PolarHBondContact O-N 3.26Å; H190-T206 PolarHBondContact O-OG1 2.78Å; L192-T206 HydrophobicContact CB-CG2 4.16Å; T206-L208 VanDerWaalsContact C-N 3.29Å; T206-T209 VanDerWaalsContact O-CG2 3.3Å; T206-T209 WeakPolarHBondContact O-CG2 3.32Å
207	R	90	Very high	90.2	Very high	164 Å²	164	59.8 Å²	59.8	62%	0.619	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-14.7	170.6	-53.9	170.7	-67.1	173.5	3.2	112.6	H190 D205	H190-R207 HydrophobicContact CB-CG 4.33Å; D205-R207 PolarHBondContact O-N 2.85Å; D205-R207 VanDerWaalsContact O-N 3.1Å; D205-R207 VanDerWaalsContact OD1-CB 3.24Å; D205-R207 WeakPolarHBondContact OD1-CB 3.48Å; D205-R207 WeakPolarHBondContact OD1-CG 3.48Å; D205-R207 IonicContact OD1-CZ 3.44Å; D205-R207 PolarHBondContact OD1-N 2.96Å; D205-R207 IonicContact OD1-NE 3.38Å; D205-R207 PolarHBondContact OD1-NE 2.86Å; D205-R207 IonicContact OD1-NH2 3.73Å; D205-R207 IonicContact OD2-CZ 3.03Å; D205-R207 IonicContact OD2-NE 3.74Å; D205-R207 PolarHBondContact OD2-NE 3.01Å; D205-R207 IonicContact OD2-NH2 2.69Å; D205-R207 PolarHBondContact OD2-NH2 3.38Å
208	L	89.1	Confident	90.3	Very high	84 Å²	84	58.5 Å²	58.5	44%	0.44	26%	0.264	S	S	.	.			trans	-119.8	64.7	-175.4	-58.3	178.3	0	0	0	110.6	D205 T206 R210 Q211 L213	D205-L208 HydrophobicContact CB-CB 4.18Å; D205-L208 HydrophobicContact CB-CD1 4.11Å; D205-L208 HydrophobicContact CB-CG 4.15Å; D205-L208 CarbonylContact O-C 3.59Å; D205-L208 WeakPolarHBondContact O-CA 3.31Å; D205-L208 PolarHBondContact O-N 3.29Å; T206-L208 VanDerWaalsContact C-N 3.29Å; L208-R210 VanDerWaalsContact C-N 3.28Å; L208-R210 PolarHBondContact O-N 3.25Å; L208-Q211 PolarHBondContact O-N 2.88Å; L208-L213 HydrophobicContact CD1-CD2 4.17Å
209	T	80.5	Confident	90.1	Very high	43 Å²	43	59 Å²	59	26%	0.264	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-18	-170.1	56.1	0	0	0	0	115.9	D165 L167 T206	D165-T209 HydrophobicContact CB-CG2 3.81Å; D165-T209 WeakPolarHBondContact OD1-CG2 3.35Å; L167-T209 HydrophobicContact CD2-CG2 3.55Å; T206-T209 VanDerWaalsContact O-CG2 3.3Å; T206-T209 WeakPolarHBondContact O-CG2 3.32Å
210	R	83.2	Confident	89.2	Confident	245 Å²	245	62 Å²	62	93%	0.925	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-27.1	-178	-64.6	-173.3	-179.5	-169.3	0.5	113.7	L208	L208-R210 VanDerWaalsContact C-N 3.28Å; L208-R210 PolarHBondContact O-N 3.25Å
211	Q	87	Confident	87.6	Confident	136 Å²	136	73.3 Å²	73.3	64%	0.636	33%	0.327	S	S	*	.	S	Bend	trans	-147.1	134.6	-176	64.3	-174.1	5.6	0	0	110.6	L208	L208-Q211 PolarHBondContact O-N 2.88Å
212	P	92.4	Very high	85	Confident	43 Å²	43	77.5 Å²	77.5	28%	0.279	36%	0.362	S	S	.	.			trans	-67.2	156.8	174.4	32.5	-38.3	0	0	0	111	L169 V202 V203 W204	L169-P212 HydrophobicContact CD2-CG 3.87Å; V202-P212 HydrophobicContact CG1-CB 3.17Å; V202-P212 HydrophobicContact CG1-CG 3.85Å; V203-P212 CarbonylContact O-C 3.53Å; V203-P212 WeakPolarHBondContact O-CB 3.25Å; W204-P212 HydrophobicContact CD2-CB 4.06Å; W204-P212 HydrophobicContact CE3-CB 3.89Å; W204-P212 HydrophobicContact CH2-CB 4.14Å; W204-P212 HydrophobicContact CH2-CG 4.44Å; W204-P212 HydrophobicContact CZ2-CB 4.3Å; W204-P212 HydrophobicContact CZ3-CB 3.94Å; W204-P212 HydrophobicContact CZ3-CG 4.44Å
213	L	93.7	Very high	82.5	Confident	75 Å²	75	85.2 Å²	85.2	39%	0.393	40%	0.403	S	S	.	.	S	Bend	trans	-68.2	-44	172.6	-66.7	180	0	0	0	111.4	L191 V203 D205 L208 M267	L191-L213 HydrophobicContact CD1-CD1 4.05Å; V203-L213 HydrophobicContact CB-CB 4.47Å; V203-L213 HydrophobicContact CG1-CD1 4.31Å; V203-L213 PolarHBondContact O-N 2.75Å; D205-L213 HydrophobicContact CB-CD1 3.95Å; D205-L213 HydrophobicContact CB-CD2 3.98Å; D205-L213 HydrophobicContact CB-CG 3.97Å; L208-L213 HydrophobicContact CD1-CD2 4.17Å; L213-M267 HydrophobicContact CB-CE 4.19Å; L213-M267 HydrophobicContact CD1-CE 3.85Å
214	K	93.2	Very high	79.9	Confident	77 Å²	77	94 Å²	94	34%	0.335	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	146.3	-176.9	-159.6	178.1	-173.4	177.6	0	111.1	V203 M267	V203-K214 PolarHBondContact N-O 3.45Å; V203-K214 PolarHBondContact O-N 3.05Å; K214-M267 HydrophobicContact CB-SD 3.53Å; K214-M267 VanDerWaalsContact CB-SD 3.53Å; K214-M267 HydrophobicContact CD-CB 3.46Å; K214-M267 VanDerWaalsContact CD-CB 3.46Å; K214-M267 HydrophobicContact CD-CG 4.28Å; K214-M267 HydrophobicContact CD-SD 3.86Å; K214-M267 HydrophobicContact CG-SD 4.35Å; K214-M267 PolarHBondContact NZ-O 3.46Å
215	Q	92.1	Very high	76.9	Confident	40 Å²	40	105.5 Å²	105.5	19%	0.187	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.3	162.8	-175.9	166.8	36.5	0	0	109.4	H200 V202 Q217	H200-Q215 HydrophobicContact CB-CG 3.6Å; H200-Q215 PolarHBondContact O-NE2 2.85Å; V202-Q215 HydrophobicContact CG2-CB 4.28Å; V202-Q215 HydrophobicContact CG2-CG 3.97Å; Q215-Q217 VanDerWaalsContact C-N 3.32Å; Q215-Q217 HydrophobicContact CG-CG 4.29Å; Q215-Q217 PolarHBondContact O-N 2.94Å
216	L	93.4	Very high	74	Confident	1 Å²	1	112.3 Å²	112.3	1%	0.005	51%	0.513	C	S	.	.			trans	-78.9	78.8	-177.7	-60.5	-173.1	0	0	0	110.5	H200 P201 V203 Y250 W262 F264 M267	H200-L216 WeakPolarHBondContact CB-O 3.32Å; H200-L216 PolarHBondContact ND1-O 3.26Å; P201-L216 HydrophobicContact CB-CB 4.38Å; P201-L216 HydrophobicContact CB-CD1 4.31Å; P201-L216 WeakPolarHBondContact O-CB 3.5Å; P201-L216 PolarHBondContact O-N 3.28Å; V203-L216 HydrophobicContact CG2-CD1 4.05Å; V203-L216 HydrophobicContact CG2-CD2 3.66Å; V203-L216 HydrophobicContact CG2-CG 3.74Å; L216-Y250 HydrophobicContact CD1-CD1 3.81Å; L216-Y250 HydrophobicContact CD1-CE1 4.34Å; L216-W262 HydrophobicContact CB-CD2 4.18Å; L216-W262 HydrophobicContact CB-CG 4.48Å; L216-W262 HydrophobicContact CB-CZ2 3.97Å; L216-W262 HydrophobicContact CD1-CB 4.44Å; L216-W262 HydrophobicContact CD1-CD2 3.97Å; L216-W262 HydrophobicContact CD1-CE3 4.24Å; L216-W262 HydrophobicContact CD1-CG 4.07Å; L216-W262 HydrophobicContact CD2-CG 4.11Å; L216-W262 HydrophobicContact CG-CD2 4.49Å; L216-W262 HydrophobicContact CG-CG 4.46Å; L216-F264 HydrophobicContact CD1-CE2 4.48Å; L216-F264 HydrophobicContact CD1-CZ 4.36Å; L216-M267 HydrophobicContact CD2-CB 4.02Å
217	Q	89.6	Confident	71.5	Confident	115 Å²	115	118 Å²	118	54%	0.537	54%	0.542	S	S	.	.			trans	-74.8	143.3	178.6	-66	-178.5	2.5	0	0	111.3	Q215	Q215-Q217 VanDerWaalsContact C-N 3.32Å; Q215-Q217 HydrophobicContact CG-CG 4.29Å; Q215-Q217 PolarHBondContact O-N 2.94Å
218	L	86.9	Confident	69.2	Low	13 Å²	13	118.4 Å²	118.4	7%	0.068	56%	0.556	C	S	.	*			trans	-79.2	151	172.8	-66.1	168.7	0	0	0	109.5	H200 M220 L232 Y254 L258 A260 W262 Q272	H200-L218 PolarHBondContact CE1-N 3.02Å; L218-M220 PolarHBondContact O-N 3.47Å; L218-L232 HydrophobicContact CD1-CD2 3.7Å; L218-Y254 HydrophobicContact CD1-CE1 4.45Å; L218-Y254 HydrophobicContact CD1-CE2 4.24Å; L218-Y254 HydrophobicContact CD2-CE2 4.04Å; L218-L258 HydrophobicContact CD1-CD2 3.35Å; L218-L258 HydrophobicContact CD2-CD2 3.89Å; L218-L258 HydrophobicContact CG-CD2 4.23Å; L218-A260 HydrophobicContact CD2-CB 3.64Å; L218-W262 HydrophobicContact CD2-CH2 4.06Å; L218-W262 HydrophobicContact CD2-CZ2 3.9Å; L218-Q272 HydrophobicContact CD2-CG 4.36Å
219	E	79.5	Confident	67	Low	140 Å²	140	117 Å²	117	65%	0.654	55%	0.551	S	S	*	*			trans	-75.1	110.9	169.7	-76.2	179.1	-175.9	0	0	108.7	L269 Q272	E219-L269 HydrophobicContact CB-CD2 3.99Å; E219-L269 HydrophobicContact CG-CD2 3.7Å; E219-Q272 VanDerWaalsContact N-OE1 3.14Å; E219-Q272 PolarHBondContact O-NE2 3.42Å
220	M	66.7	Low	65.9	Low	92 Å²	92	116.8 Å²	116.8	45%	0.453	55%	0.55	S	S	.	*			trans	-79.8	129.1	168.6	-59.6	-161.6	-150.2	0	0	108.5	L218 A222	L218-M220 PolarHBondContact O-N 3.47Å; M220-A222 PolarHBondContact O-N 2.84Å
221	R	53.9	Low	64.8	Low	240 Å²	240	110.4 Å²	110.4	91%	0.906	53%	0.531	S	S	*	.			trans	-52.1	131.4	171.3	-82.8	-176.4	173.5	171.9	-1.5	108.7	N223	R221-N223 PolarHBondContact O-N 2.91Å
222	A	41.4	Very low	63.7	Low	88 Å²	88	104.8 Å²	104.8	73%	0.727	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	6.9	-161.8	0	0	0	0	0	118.8	M220	M220-A222 PolarHBondContact O-N 2.84Å
223	N	40.7	Very low	62.5	Low	163 Å²	163	104.4 Å²	104.4	87%	0.872	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	5.4	-179.4	-75.4	-0.5	0	0	0	114.8	R221	R221-N223 PolarHBondContact O-N 2.91Å
224	R	42.1	Very low	60.9	Low	186 Å²	186	107.7 Å²	107.7	70%	0.702	52%	0.521	S	S	*	.			trans	-116.4	79.8	166.5	-72.2	-170.7	-177.2	-171.9	1.2	110.3	M226	R224-M226 PolarHBondContact O-N 2.8Å
225	R	33.4	Very low	59.5	Low	244 Å²	244	110.8 Å²	110.8	92%	0.921	54%	0.541	S	S	*	.			trans	-73.3	16.1	170.2	-88.7	-172.6	173.6	-175.6	-1.8	114.3
226	M	33.1	Very low	58.8	Low	162 Å²	162	109 Å²	109	80%	0.798	53%	0.533	S	S	*	.			trans	-142.4	123.3	171.5	-55.9	-156.3	-129.2	0	0	104.2	R224	R224-M226 PolarHBondContact O-N 2.8Å
227	I	39	Very low	58.5	Low	128 Å²	128	110.2 Å²	110.2	66%	0.656	54%	0.543	S	S	*	.			cis	-154.5	153.6	41.5	-65.3	160.2	0	0	0	106.1	T229	I227-T229 HydrophobicContact CB-CG2 4.1Å; I227-T229 HydrophobicContact CG2-CG2 3.5Å; I227-T229 VanDerWaalsContact CG2-CG2 3.5Å; I227-T229 PolarHBondContact O-N 2.8Å
228	N	42.5	Very low	58.5	Low	172 Å²	172	104.7 Å²	104.7	92%	0.92	52%	0.517	S	S	*	.			trans	-65.3	47.3	164.9	-74.2	-25.3	0	0	0	112
229	T	43.8	Very low	58.6	Low	55 Å²	55	104.9 Å²	104.9	34%	0.337	52%	0.518	S	S	.	.			trans	-86.9	125.8	177.2	38	0	0	0	0	108.9	I227 E231	I227-T229 HydrophobicContact CB-CG2 4.1Å; I227-T229 HydrophobicContact CG2-CG2 3.5Å; I227-T229 VanDerWaalsContact CG2-CG2 3.5Å; I227-T229 PolarHBondContact O-N 2.8Å; T229-E231 PolarHBondContact O-N 2.9Å
230	P	56.7	Low	59.3	Low	38 Å²	38	98.2 Å²	98.2	25%	0.247	49%	0.487	C	S	.	.			trans	-70.6	8.6	175.2	31.1	-35.4	0	0	0	113.1	H200	H200-P230 PolarHBondContact CD2-O 2.92Å
231	E	59.1	Low	60.6	Low	111 Å²	111	94.5 Å²	94.5	52%	0.519	47%	0.472	S	S	.	.	B	Isolated β-bridge	trans	-89	138.3	-175.2	-62.9	-172.8	164.3	0	0	110.6	T229	T229-E231 PolarHBondContact O-N 2.9Å
232	L	64.8	Low	62.6	Low	17 Å²	17	86.4 Å²	86.4	9%	0.089	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-64.5	151.4	176.4	-83.9	153.3	0	0	0	110.8	K198 R199 H200 L218 N234 A236 V238 Y254	K198-L232 PolarHBondContact O-N 2.93Å; R199-L232 VanDerWaalsContact O-CD1 3.29Å; R199-L232 WeakPolarHBondContact O-CD1 3.43Å; H200-L232 WeakPolarHBondContact CE1-CD2 3Å; H200-L232 WeakPolarHBondContact ND1-CD2 3.32Å; L218-L232 HydrophobicContact CD1-CD2 3.7Å; L232-N234 PolarHBondContact O-N 2.95Å; L232-A236 HydrophobicContact CB-CB 4.14Å; L232-A236 VanDerWaalsContact CB-O 3.26Å; L232-A236 WeakPolarHBondContact CB-O 3.49Å; L232-A236 WeakPolarHBondContact CD1-O 3.29Å; L232-A236 HydrophobicContact CD2-CB 4.16Å; L232-A236 WeakPolarHBondContact CG-O 3.34Å; L232-V238 HydrophobicContact CD1-CG2 3.74Å; L232-Y254 HydrophobicContact CD1-CD1 4.25Å; L232-Y254 HydrophobicContact CD1-CE1 3.83Å; L232-Y254 HydrophobicContact CD2-CD1 3.98Å; L232-Y254 HydrophobicContact CD2-CE1 3.38Å; L232-Y254 HydrophobicContact CG-CE1 4.28Å
233	P	66.7	Low	65.3	Low	36 Å²	36	82.8 Å²	82.8	23%	0.234	41%	0.409	C	S	.	.	S	Bend	trans	-49.8	143.9	171.9	-23.3	31.1	0	0	0	111	N235 A236	P233-N235 PolarHBondContact O-N 2.9Å; P233-N235 VanDerWaalsContact O-N 3.13Å; P233-A236 HydrophobicContact CB-CB 4.33Å; P233-A236 HydrophobicContact CG-CB 4.46Å; P233-A236 VanDerWaalsContact O-CB 3.29Å; P233-A236 WeakPolarHBondContact O-CB 3.19Å; P233-A236 PolarHBondContact O-N 3.42Å
234	N	61.4	Low	67.8	Low	144 Å²	144	75.1 Å²	75.1	77%	0.77	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.5	124.3	178.8	-70.4	-0.1	0	0	0	110.7	L232	L232-N234 PolarHBondContact O-N 2.95Å
235	N	63.5	Low	70.2	Confident	141 Å²	141	74.8 Å²	74.8	75%	0.754	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-0.1	-175.8	-55.4	-13.9	0	0	0	118	P233 A237 N256	P233-N235 PolarHBondContact O-N 2.9Å; P233-N235 VanDerWaalsContact O-N 3.13Å; N235-A237 VanDerWaalsContact C-N 3.3Å; N235-A237 PolarHBondContact O-N 3.1Å; N235-A237 VanDerWaalsContact O-N 3.13Å; N235-N256 WeakPolarHBondContact O-CB 3.09Å
236	A	75.9	Confident	73	Confident	3 Å²	3	66.6 Å²	66.6	3%	0.025	34%	0.341	C	S	.	.			trans	-87.6	60	176.6	0	0	0	0	0	111.7	L232 P233 Y254 N256	L232-A236 HydrophobicContact CB-CB 4.14Å; L232-A236 VanDerWaalsContact CB-O 3.26Å; L232-A236 WeakPolarHBondContact CB-O 3.49Å; L232-A236 WeakPolarHBondContact CD1-O 3.29Å; L232-A236 HydrophobicContact CD2-CB 4.16Å; L232-A236 WeakPolarHBondContact CG-O 3.34Å; P233-A236 HydrophobicContact CB-CB 4.33Å; P233-A236 HydrophobicContact CG-CB 4.46Å; P233-A236 VanDerWaalsContact O-CB 3.29Å; P233-A236 WeakPolarHBondContact O-CB 3.19Å; P233-A236 PolarHBondContact O-N 3.42Å; A236-Y254 HydrophobicContact CB-CD1 4.44Å; A236-Y254 WeakPolarHBondContact O-CD1 3.45Å; A236-N256 WeakPolarHBondContact CB-ND2 3.47Å
237	A	87.1	Confident	75.9	Confident	26 Å²	26	59 Å²	59	22%	0.215	30%	0.304	C	S	.	.			trans	-70.2	135.8	175.9	0	0	0	0	0	110.7	S197 N235 M239 Y254 G255	S197-A237 CarbonylContact O-C 3.59Å; S197-A237 WeakPolarHBondContact O-CA 3.46Å; S197-A237 WeakPolarHBondContact O-CB 3.31Å; N235-A237 VanDerWaalsContact C-N 3.3Å; N235-A237 PolarHBondContact O-N 3.1Å; N235-A237 VanDerWaalsContact O-N 3.13Å; A237-M239 PolarHBondContact O-N 3.5Å; A237-Y254 CarbonylContact O-C 3.47Å; A237-Y254 WeakPolarHBondContact O-CA 3.27Å; A237-G255 PolarHBondContact O-N 3.32Å
238	V	90.4	Very high	78.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	131.4	169.6	180	0	0	0	0	108	I180 V181 S195 S197 P201 L232 V252 Y254	I180-V238 HydrophobicContact CD1-CB 4.05Å; I180-V238 HydrophobicContact CD1-CG1 4.14Å; I180-V238 WeakPolarHBondContact CD1-O 3.46Å; V181-V238 HydrophobicContact CG2-CG1 4.04Å; S195-V238 WeakPolarHBondContact OG-CG1 3.26Å; S197-V238 PolarHBondContact O-N 2.82Å; P201-V238 HydrophobicContact CG-CG2 4.22Å; L232-V238 HydrophobicContact CD1-CG2 3.74Å; V238-V252 HydrophobicContact CG1-CG1 3.87Å; V238-V252 HydrophobicContact CG2-CG1 4.26Å; V238-Y254 HydrophobicContact CG2-CD1 3.99Å; V238-Y254 HydrophobicContact CG2-CE1 3.59Å
239	M	89.9	Confident	81.2	Confident	17 Å²	17	49 Å²	49	8%	0.084	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	-29.5	177.5	-66.2	-59.3	-59.4	0	0	111.5	A237 I253 G255 P280 S287 I288	A237-M239 PolarHBondContact O-N 3.5Å; M239-I253 PolarHBondContact N-O 2.81Å; M239-G255 VanDerWaalsContact CG-N 3.29Å; M239-P280 HydrophobicContact CE-CB 3.82Å; M239-P280 HydrophobicContact SD-CB 4.07Å; M239-S287 CarbonylContact O-C 3.51Å; M239-S287 VanDerWaalsContact O-C 3.31Å; M239-S287 WeakPolarHBondContact O-CA 3.41Å; M239-S287 WeakPolarHBondContact O-CB 3.47Å; M239-S287 PolarHBondContact O-OG 2.84Å; M239-S287 VanDerWaalsContact O-OG 3.09Å; M239-I288 HydrophobicContact CB-CD1 4.04Å; M239-I288 HydrophobicContact CB-CG1 4.01Å; M239-I288 HydrophobicContact CE-CG2 4.16Å; M239-I288 WeakPolarHBondContact O-CG1 3.27Å; M239-I288 PolarHBondContact O-N 3.35Å
240	G	92.5	Very high	83.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169	161	175.3	0	0	0	0	0	111.6	V252 I253 S287	G240-V252 WeakPolarHBondContact O-CA 3.22Å; G240-I253 PolarHBondContact N-O 3.49Å; G240-I253 PolarHBondContact O-N 3.13Å; G240-S287 WeakPolarHBondContact CA-OG 3.34Å
241	G	95.2	Very high	85.6	Confident	13 Å²	13	44.6 Å²	44.6	13%	0.134	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	147.6	174.2	0	0	0	0	0	111.9	V181 I251	V181-G241 WeakPolarHBondContact CG1-O 3.44Å; G241-I251 CarbonylContact C-O 3.56Å; G241-I251 WeakPolarHBondContact CA-O 3.48Å
242	R	96.1	Very high	87.3	Confident	71 Å²	71	39.3 Å²	39.3	27%	0.268	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	143.6	-177.1	166.4	173.4	-72.3	-169.1	-0.3	110.9	Y250 I251 F290 D291	R242-Y250 VanDerWaalsContact C-CD2 3.49Å; R242-I251 PolarHBondContact N-O 3.27Å; R242-I251 PolarHBondContact O-N 2.83Å; R242-F290 HydrophobicContact CB-CE2 4.23Å; R242-F290 HydrophobicContact CB-CZ 4.08Å; R242-F290 PolarHBondContact NH1-O 2.84Å; R242-D291 VanDerWaalsContact NH1-CG 3.29Å; R242-D291 IonicContact NH1-OD1 2.75Å; R242-D291 PolarHBondContact NH1-OD1 2.94Å; R242-D291 VanDerWaalsContact NH1-OD1 3.15Å; R242-D291 IonicContact NH1-OD2 3.84Å
243	F	96.5	Very high	88.6	Confident	12 Å²	12	38.5 Å²	38.5	5%	0.053	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	145.7	166.4	-81.2	-79.6	0	0	0	112.2	S183 W184 P186 L191 V193 H249 Y250 F264	S183-F243 WeakPolarHBondContact O-CE2 3.45Å; W184-F243 WeakPolarHBondContact O-CD2 3.13Å; P186-F243 HydrophobicContact CG-CB 4.37Å; L191-F243 HydrophobicContact CD2-CE1 4.19Å; L191-F243 HydrophobicContact CD2-CE2 4.34Å; L191-F243 HydrophobicContact CD2-CZ 3.54Å; V193-F243 HydrophobicContact CB-CE2 4.14Å; V193-F243 HydrophobicContact CB-CZ 4.46Å; V193-F243 HydrophobicContact CG2-CE2 3.6Å; V193-F243 HydrophobicContact CG2-CZ 3.47Å; V193-F243 VanDerWaalsContact CG2-CZ 3.47Å; F243-H249 WeakPolarHBondContact CA-O 3.49Å; F243-H249 WeakPolarHBondContact CD1-O 3.49Å; F243-Y250 HydrophobicContact CB-CD2 4.48Å; F243-Y250 AromaticContact CD1-CD2 4Å; F243-Y250 HydrophobicContact CD1-CD2 4Å; F243-Y250 AromaticContact CD2-CD2 3.61Å; F243-Y250 HydrophobicContact CD2-CD2 3.61Å; F243-Y250 HydrophobicContact CD2-CE2 4.01Å; F243-Y250 HydrophobicContact CE1-CD2 4.06Å; F243-Y250 HydrophobicContact CE1-CG 4.37Å; F243-Y250 AromaticContact CE2-CD2 3.67Å; F243-Y250 HydrophobicContact CE2-CD2 3.67Å; F243-Y250 HydrophobicContact CE2-CE2 4.07Å; F243-Y250 AromaticContact CG-CD2 3.77Å; F243-Y250 HydrophobicContact CG-CD2 3.77Å; F243-Y250 AromaticContact CZ-CD2 3.9Å; F243-Y250 HydrophobicContact CZ-CD2 3.9Å; F243-Y250 HydrophobicContact CZ-CG 4.37Å; F243-F264 HydrophobicContact CE1-CD1 4Å; F243-F264 AromaticContact CE1-CD2 3.83Å; F243-F264 HydrophobicContact CE1-CD2 3.83Å; F243-F264 HydrophobicContact CE1-CE1 4.11Å; F243-F264 AromaticContact CE1-CE2 3.96Å; F243-F264 HydrophobicContact CE1-CE2 3.96Å; F243-F264 AromaticContact CE1-CG 3.87Å; F243-F264 HydrophobicContact CE1-CG 3.87Å; F243-F264 HydrophobicContact CE1-CZ 4.08Å; F243-F264 HydrophobicContact CZ-CD1 4.36Å; F243-F264 HydrophobicContact CZ-CE1 4.07Å; F243-F264 HydrophobicContact CZ-CE2 4.35Å; F243-F264 HydrophobicContact CZ-CZ 4.05Å
244	T	95.2	Very high	89.7	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	18%	0.182	C	C	.	.			trans	-60.9	149.2	156.7	52.1	0	0	0	0	109.3	P186 D246 G247 M248 H249 I251 I292 E294 F298	P186-T244 VanDerWaalsContact CG-O 3.31Å; P186-T244 WeakPolarHBondContact CG-O 3.25Å; T244-D246 VanDerWaalsContact CB-OD1 3.25Å; T244-D246 WeakPolarHBondContact CB-OD1 3.15Å; T244-D246 PolarHBondContact O-N 2.9Å; T244-D246 PolarHBondContact OG1-OD1 3.09Å; T244-G247 VanDerWaalsContact O-CA 3.24Å; T244-G247 WeakPolarHBondContact O-CA 3.4Å; T244-G247 PolarHBondContact O-N 3.25Å; T244-M248 PolarHBondContact OG1-N 3.14Å; T244-H249 HydrophobicContact CG2-CB 3.89Å; T244-H249 PolarHBondContact N-O 2.59Å; T244-H249 PolarHBondContact OG1-N 3.06Å; T244-H249 PolarHBondContact OG1-O 3Å; T244-H249 VanDerWaalsContact OG1-O 3.12Å; T244-I251 HydrophobicContact CG2-CD1 4.36Å; T244-I292 HydrophobicContact CG2-CD1 4.2Å; T244-E294 VanDerWaalsContact CA-OE1 3.3Å; T244-E294 WeakPolarHBondContact CA-OE1 3.47Å; T244-E294 HydrophobicContact CG2-CG 4.04Å; T244-F298 HydrophobicContact CG2-CD2 4.46Å; T244-F298 HydrophobicContact CG2-CE2 4.31Å
245	R	91.5	Very high	90.7	Very high	179 Å²	179	30.5 Å²	30.5	68%	0.675	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-33.3	179.9	-166.9	-178.3	-172.5	-178.6	5.4	112.1	P186 G247 E294	P186-R245 WeakPolarHBondContact CG-O 3.34Å; R245-G247 PolarHBondContact O-N 3.25Å; R245-E294 WeakPolarHBondContact CA-OE2 3.46Å; R245-E294 WeakPolarHBondContact CB-OE1 3.27Å; R245-E294 VanDerWaalsContact CB-OE2 3.24Å; R245-E294 WeakPolarHBondContact CB-OE2 3.43Å; R245-E294 PolarHBondContact N-OE1 3.45Å; R245-E294 PolarHBondContact N-OE2 3.42Å
246	D	92.4	Very high	91.5	Very high	72 Å²	72	25.3 Å²	25.3	39%	0.385	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-9.5	170.8	75.7	-5.7	0	0	0	113.8	I187 T244 M248 E294	I187-D246 WeakPolarHBondContact CD1-O 3.25Å; T244-D246 VanDerWaalsContact CB-OD1 3.25Å; T244-D246 WeakPolarHBondContact CB-OD1 3.15Å; T244-D246 PolarHBondContact O-N 2.9Å; T244-D246 PolarHBondContact OG1-OD1 3.09Å; D246-M248 HydrophobicContact CB-CG 4.18Å; D246-M248 PolarHBondContact O-N 2.79Å; D246-M248 WeakPolarHBondContact OD1-CB 3.44Å; D246-M248 PolarHBondContact OD1-N 2.62Å; D246-M248 WeakPolarHBondContact OD2-CB 3.42Å; D246-M248 WeakPolarHBondContact OD2-CG 3.17Å; D246-E294 PolarHBondContact N-OE2 3.31Å
247	G	94.6	Very high	91.7	Very high	2 Å²	2	25.2 Å²	25.2	2%	0.021	12%	0.123	C	C	.	.	S	Bend	trans	63.8	11	-177.9	0	0	0	0	0	115.3	T244 R245 F264	T244-G247 VanDerWaalsContact O-CA 3.24Å; T244-G247 WeakPolarHBondContact O-CA 3.4Å; T244-G247 PolarHBondContact O-N 3.25Å; R245-G247 PolarHBondContact O-N 3.25Å; G247-F264 WeakPolarHBondContact O-CB 3.02Å
248	M	95.2	Very high	91.7	Very high	72 Å²	72	24 Å²	24	36%	0.355	11%	0.113	S	C	.	.	S	Bend	trans	-83.1	-18.5	-177.4	-62.1	-61.8	-63.1	0	0	112.5	T244 D246 K263 F264	T244-M248 PolarHBondContact OG1-N 3.14Å; D246-M248 HydrophobicContact CB-CG 4.18Å; D246-M248 PolarHBondContact O-N 2.79Å; D246-M248 WeakPolarHBondContact OD1-CB 3.44Å; D246-M248 PolarHBondContact OD1-N 2.62Å; D246-M248 WeakPolarHBondContact OD2-CB 3.42Å; D246-M248 WeakPolarHBondContact OD2-CG 3.17Å; M248-K263 CarbonylContact O-C 3.55Å; M248-K263 WeakPolarHBondContact O-CA 3.07Å; M248-F264 PolarHBondContact O-N 3.13Å
249	H	96.2	Very high	91.7	Very high	19 Å²	19	24 Å²	24	9%	0.088	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	146.4	177.7	-56.5	82.2	0	0	0	111.5	F243 T244 W262 F298	F243-H249 WeakPolarHBondContact CA-O 3.49Å; F243-H249 WeakPolarHBondContact CD1-O 3.49Å; T244-H249 HydrophobicContact CG2-CB 3.89Å; T244-H249 PolarHBondContact N-O 2.59Å; T244-H249 PolarHBondContact OG1-N 3.06Å; T244-H249 PolarHBondContact OG1-O 3Å; T244-H249 VanDerWaalsContact OG1-O 3.12Å; H249-W262 CarbonylContact C-O 3.47Å; H249-W262 WeakPolarHBondContact CA-O 3.17Å; H249-F298 HydrophobicContact CB-CD2 4.15Å; H249-F298 HydrophobicContact CB-CE2 3.9Å; H249-F298 HydrophobicContact CB-CZ 4.45Å; H249-F298 AromaticContact CD2-CD1 3.98Å; H249-F298 AromaticContact CD2-CG 3.91Å; H249-F298 AromaticContact CE1-CD2 3.87Å; H249-F298 AromaticContact CE1-CG 3.59Å; H249-F298 AromaticContact CG-CD2 3.62Å; H249-F298 AromaticContact CG-CE2 3.79Å; H249-F298 AromaticContact CG-CG 3.96Å; H249-F298 AromaticContact ND1-CD2 3.52Å; H249-F298 AromaticContact ND1-CG 3.75Å; H249-F298 AromaticContact NE2-CD1 3.86Å; H249-F298 AromaticContact NE2-CG 3.69Å
250	Y	97.3	Very high	91.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.6	167.6	-174.2	-109	0	0	0	108.3	V193 P201 L216 R242 F243 V252 A261 W262 F264	V193-Y250 HydrophobicContact CB-CD2 4.39Å; V193-Y250 HydrophobicContact CB-CE1 4.15Å; V193-Y250 HydrophobicContact CB-CE2 3.91Å; V193-Y250 HydrophobicContact CG1-CD1 4.07Å; V193-Y250 HydrophobicContact CG1-CE1 3.4Å; V193-Y250 HydrophobicContact CG1-CE2 4.05Å; V193-Y250 HydrophobicContact CG2-CD2 4.33Å; V193-Y250 HydrophobicContact CG2-CE2 4.35Å; V193-Y250 HydrophobicContact CG2-CG 4.47Å; P201-Y250 HydrophobicContact CB-CE1 4.24Å; L216-Y250 HydrophobicContact CD1-CD1 3.81Å; L216-Y250 HydrophobicContact CD1-CE1 4.34Å; R242-Y250 VanDerWaalsContact C-CD2 3.49Å; F243-Y250 HydrophobicContact CB-CD2 4.48Å; F243-Y250 AromaticContact CD1-CD2 4Å; F243-Y250 HydrophobicContact CD1-CD2 4Å; F243-Y250 AromaticContact CD2-CD2 3.61Å; F243-Y250 HydrophobicContact CD2-CD2 3.61Å; F243-Y250 HydrophobicContact CD2-CE2 4.01Å; F243-Y250 HydrophobicContact CE1-CD2 4.06Å; F243-Y250 HydrophobicContact CE1-CG 4.37Å; F243-Y250 AromaticContact CE2-CD2 3.67Å; F243-Y250 HydrophobicContact CE2-CD2 3.67Å; F243-Y250 HydrophobicContact CE2-CE2 4.07Å; F243-Y250 AromaticContact CG-CD2 3.77Å; F243-Y250 HydrophobicContact CG-CD2 3.77Å; F243-Y250 AromaticContact CZ-CD2 3.9Å; F243-Y250 HydrophobicContact CZ-CD2 3.9Å; F243-Y250 HydrophobicContact CZ-CG 4.37Å; Y250-V252 HydrophobicContact CD1-CG2 3.62Å; Y250-V252 HydrophobicContact CE1-CG2 3.24Å; Y250-A261 CarbonylContact O-C 3.57Å; Y250-A261 VanDerWaalsContact O-CA 3.29Å; Y250-A261 WeakPolarHBondContact O-CA 3.46Å; Y250-W262 HydrophobicContact CD1-CE3 4.44Å; Y250-W262 PolarHBondContact N-O 2.76Å; Y250-W262 PolarHBondContact O-N 3.36Å; Y250-F264 HydrophobicContact CG-CE2 4.35Å
251	I	96.3	Very high	92	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.9	-178.7	-67.7	161.5	0	0	0	108.8	G241 R242 T244 T259 A260 A261 F290 I292 F298 L303 F316	G241-I251 CarbonylContact C-O 3.56Å; G241-I251 WeakPolarHBondContact CA-O 3.48Å; R242-I251 PolarHBondContact N-O 3.27Å; R242-I251 PolarHBondContact O-N 2.83Å; T244-I251 HydrophobicContact CG2-CD1 4.36Å; I251-T259 HydrophobicContact CG2-CG2 3.94Å; I251-A260 WeakPolarHBondContact CA-O 3.23Å; I251-A261 HydrophobicContact CG1-CB 3.94Å; I251-F290 HydrophobicContact CB-CE2 4.23Å; I251-F290 HydrophobicContact CB-CZ 4.28Å; I251-F290 HydrophobicContact CG2-CE2 3.87Å; I251-F290 HydrophobicContact CG2-CZ 3.92Å; I251-I292 HydrophobicContact CB-CD1 4.48Å; I251-I292 HydrophobicContact CD1-CD1 3.36Å; I251-I292 HydrophobicContact CD1-CG1 3.92Å; I251-I292 HydrophobicContact CG1-CD1 4.4Å; I251-F298 HydrophobicContact CD1-CE2 4Å; I251-F298 HydrophobicContact CD1-CZ 4.28Å; I251-L303 HydrophobicContact CG2-CD1 4.38Å; I251-F316 HydrophobicContact CD1-CE2 4.07Å; I251-F316 HydrophobicContact CD1-CZ 3.58Å; I251-F316 HydrophobicContact CG1-CZ 4.32Å
252	V	94.7	Very high	92	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.1	177.9	-176	0	0	0	0	108.5	P201 V238 G240 Y250 Y254 T259 A260 W262	P201-V252 HydrophobicContact CG-CG1 4.04Å; P201-V252 HydrophobicContact CG-CG2 3.77Å; V238-V252 HydrophobicContact CG1-CG1 3.87Å; V238-V252 HydrophobicContact CG2-CG1 4.26Å; G240-V252 WeakPolarHBondContact O-CA 3.22Å; Y250-V252 HydrophobicContact CD1-CG2 3.62Å; Y250-V252 HydrophobicContact CE1-CG2 3.24Å; V252-Y254 HydrophobicContact CB-CE2 4.03Å; V252-Y254 HydrophobicContact CG1-CD1 4.45Å; V252-Y254 HydrophobicContact CG1-CD2 4.23Å; V252-Y254 HydrophobicContact CG1-CE1 3.94Å; V252-Y254 HydrophobicContact CG1-CE2 3.69Å; V252-T259 VanDerWaalsContact O-CA 3.3Å; V252-T259 WeakPolarHBondContact O-CA 2.91Å; V252-A260 PolarHBondContact N-O 3.15Å; V252-A260 PolarHBondContact O-N 3.42Å; V252-W262 HydrophobicContact CB-CH2 4.04Å; V252-W262 HydrophobicContact CB-CZ3 3.61Å; V252-W262 HydrophobicContact CG2-CE3 4.11Å; V252-W262 HydrophobicContact CG2-CH2 3.93Å; V252-W262 HydrophobicContact CG2-CZ3 3.32Å
253	I	91.7	Very high	92	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	135.5	174.7	-58.1	-175.2	0	0	0	108.3	M239 G240 T259 L278 I288 F290 L303 C305	M239-I253 PolarHBondContact N-O 2.81Å; G240-I253 PolarHBondContact N-O 3.49Å; G240-I253 PolarHBondContact O-N 3.13Å; I253-T259 HydrophobicContact CG1-CG2 4.4Å; I253-L278 HydrophobicContact CG2-CD1 3.15Å; I253-I288 HydrophobicContact CG2-CD1 4.27Å; I253-F290 HydrophobicContact CB-CE1 4.33Å; I253-F290 HydrophobicContact CD1-CB 4.05Å; I253-F290 HydrophobicContact CD1-CD1 3.37Å; I253-F290 HydrophobicContact CD1-CD2 3.99Å; I253-F290 HydrophobicContact CD1-CE1 3.66Å; I253-F290 HydrophobicContact CD1-CE2 4.25Å; I253-F290 HydrophobicContact CD1-CG 3.54Å; I253-F290 HydrophobicContact CD1-CZ 4.09Å; I253-F290 HydrophobicContact CG1-CD1 3.96Å; I253-F290 HydrophobicContact CG1-CE1 3.7Å; I253-F290 HydrophobicContact CG1-CG 4.46Å; I253-F290 HydrophobicContact CG1-CZ 4Å; I253-L303 HydrophobicContact CD1-CD2 4.38Å; I253-C305 HydrophobicContact CD1-CB 3.69Å
254	Y	89.5	Confident	92	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	152.3	-179.2	-59.3	-89.3	0	0	0	111.7	L218 L232 A236 A237 V238 V252 N256 G257 L258 A260 W262	L218-Y254 HydrophobicContact CD1-CE1 4.45Å; L218-Y254 HydrophobicContact CD1-CE2 4.24Å; L218-Y254 HydrophobicContact CD2-CE2 4.04Å; L232-Y254 HydrophobicContact CD1-CD1 4.25Å; L232-Y254 HydrophobicContact CD1-CE1 3.83Å; L232-Y254 HydrophobicContact CD2-CD1 3.98Å; L232-Y254 HydrophobicContact CD2-CE1 3.38Å; L232-Y254 HydrophobicContact CG-CE1 4.28Å; A236-Y254 HydrophobicContact CB-CD1 4.44Å; A236-Y254 WeakPolarHBondContact O-CD1 3.45Å; A237-Y254 CarbonylContact O-C 3.47Å; A237-Y254 WeakPolarHBondContact O-CA 3.27Å; V238-Y254 HydrophobicContact CG2-CD1 3.99Å; V238-Y254 HydrophobicContact CG2-CE1 3.59Å; V252-Y254 HydrophobicContact CB-CE2 4.03Å; V252-Y254 HydrophobicContact CG1-CD1 4.45Å; V252-Y254 HydrophobicContact CG1-CD2 4.23Å; V252-Y254 HydrophobicContact CG1-CE1 3.94Å; V252-Y254 HydrophobicContact CG1-CE2 3.69Å; Y254-N256 WeakPolarHBondContact CB-OD1 3.15Å; Y254-N256 PolarHBondContact O-N 2.89Å; Y254-N256 VanDerWaalsContact O-N 3.12Å; Y254-G257 PolarHBondContact O-N 3.23Å; Y254-L258 WeakPolarHBondContact CB-O 3.33Å; Y254-L258 HydrophobicContact CD2-CB 3.93Å; Y254-L258 HydrophobicContact CD2-CD2 3.91Å; Y254-L258 HydrophobicContact CD2-CG 3.87Å; Y254-L258 WeakPolarHBondContact CD2-O 3.31Å; Y254-L258 HydrophobicContact CE2-CD2 4.15Å; Y254-L258 HydrophobicContact CE2-CG 4.38Å; Y254-L258 HydrophobicContact CG-CB 4.32Å; Y254-L258 PolarHBondContact N-O 3.2Å; Y254-A260 HydrophobicContact CE2-CB 4.16Å; Y254-W262 HydrophobicContact CE2-CH2 4.34Å; Y254-W262 WeakPolarHBondContact OH-CH2 3.29Å
255	G	83.6	Confident	91.9	Very high	12 Å²	12	27.6 Å²	27.6	12%	0.124	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-4.2	-176.7	0	0	0	0	0	115.1	A237 M239 G257 L278	A237-G255 PolarHBondContact O-N 3.32Å; M239-G255 VanDerWaalsContact CG-N 3.29Å; G255-G257 VanDerWaalsContact C-N 3.32Å; G255-L278 CarbonylContact C-O 3.43Å
256	N	79.4	Confident	92	Very high	33 Å²	33	21.4 Å²	21.4	18%	0.176	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	15.5	169.8	64	-8.7	0	0	0	112.5	N235 A236 Y254 L258	N235-N256 WeakPolarHBondContact O-CB 3.09Å; A236-N256 WeakPolarHBondContact CB-ND2 3.47Å; Y254-N256 WeakPolarHBondContact CB-OD1 3.15Å; Y254-N256 PolarHBondContact O-N 2.89Å; Y254-N256 VanDerWaalsContact O-N 3.12Å; N256-L258 PolarHBondContact O-N 2.83Å; N256-L258 WeakPolarHBondContact OD1-CB 3.42Å; N256-L258 PolarHBondContact OD1-N 3.33Å
257	G	80.2	Confident	92.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	78.4	-3.9	-174.1	0	0	0	0	0	113.7	Y254 G255 T259 F275	Y254-G257 PolarHBondContact O-N 3.23Å; G255-G257 VanDerWaalsContact C-N 3.32Å; G257-T259 PolarHBondContact O-N 3.37Å; G257-F275 WeakPolarHBondContact O-CA 3.15Å; G257-F275 VanDerWaalsContact O-CB 3.25Å; G257-F275 WeakPolarHBondContact O-CB 3.29Å; G257-F275 VanDerWaalsContact O-CD2 3.25Å; G257-F275 WeakPolarHBondContact O-CD2 3.48Å; G257-F275 PolarHBondContact O-N 2.8Å
258	L	87.1	Confident	92.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	138.2	175.5	-177.2	66.2	0	0	0	110.2	L218 Y254 N256 Q272 H273 Y274	L218-L258 HydrophobicContact CD1-CD2 3.35Å; L218-L258 HydrophobicContact CD2-CD2 3.89Å; L218-L258 HydrophobicContact CG-CD2 4.23Å; Y254-L258 WeakPolarHBondContact CB-O 3.33Å; Y254-L258 HydrophobicContact CD2-CB 3.93Å; Y254-L258 HydrophobicContact CD2-CD2 3.91Å; Y254-L258 HydrophobicContact CD2-CG 3.87Å; Y254-L258 WeakPolarHBondContact CD2-O 3.31Å; Y254-L258 HydrophobicContact CE2-CD2 4.15Å; Y254-L258 HydrophobicContact CE2-CG 4.38Å; Y254-L258 HydrophobicContact CG-CB 4.32Å; Y254-L258 PolarHBondContact N-O 3.2Å; N256-L258 PolarHBondContact O-N 2.83Å; N256-L258 WeakPolarHBondContact OD1-CB 3.42Å; N256-L258 PolarHBondContact OD1-N 3.33Å; L258-Q272 HydrophobicContact CD1-CG 3.39Å; L258-Q272 HydrophobicContact CD2-CG 4.26Å; L258-Q272 HydrophobicContact CG-CG 4.27Å; L258-H273 CarbonylContact C-O 3.54Å; L258-H273 WeakPolarHBondContact CA-O 3.43Å; L258-H273 VanDerWaalsContact CD1-O 3.29Å; L258-H273 WeakPolarHBondContact CD1-O 3.42Å; L258-Y274 HydrophobicContact CB-CD1 3.97Å; L258-Y274 HydrophobicContact CB-CE1 3.82Å; L258-Y274 HydrophobicContact CD1-CD1 4.05Å; L258-Y274 HydrophobicContact CD1-CD2 3.71Å; L258-Y274 HydrophobicContact CD1-CE1 3.94Å; L258-Y274 HydrophobicContact CD1-CE2 3.58Å; L258-Y274 HydrophobicContact CD1-CG 3.95Å; L258-Y274 HydrophobicContact CD2-CE1 4.47Å; L258-Y274 HydrophobicContact CG-CE1 4.29Å
259	T	90.2	Very high	92.1	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.6	165.3	-69.6	0	0	0	0	109.3	I251 V252 I253 G257 Q272 H273 F275 L303	I251-T259 HydrophobicContact CG2-CG2 3.94Å; V252-T259 VanDerWaalsContact O-CA 3.3Å; V252-T259 WeakPolarHBondContact O-CA 2.91Å; I253-T259 HydrophobicContact CG1-CG2 4.4Å; G257-T259 PolarHBondContact O-N 3.37Å; T259-Q272 WeakPolarHBondContact O-CA 3.43Å; T259-H273 PolarHBondContact N-O 2.95Å; T259-H273 PolarHBondContact O-N 3.28Å; T259-F275 HydrophobicContact CG2-CE2 4.06Å; T259-F275 WeakPolarHBondContact OG1-CD2 3.23Å; T259-F275 WeakPolarHBondContact OG1-CE2 3.4Å; T259-L303 HydrophobicContact CG2-CD2 3.89Å
260	A	93.3	Very high	91.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.9	178.8	0	0	0	0	0	110.4	L218 I251 V252 Y254 W262 L269 L271	L218-A260 HydrophobicContact CD2-CB 3.64Å; I251-A260 WeakPolarHBondContact CA-O 3.23Å; V252-A260 PolarHBondContact N-O 3.15Å; V252-A260 PolarHBondContact O-N 3.42Å; Y254-A260 HydrophobicContact CE2-CB 4.16Å; A260-W262 HydrophobicContact CB-CE3 4.28Å; A260-W262 HydrophobicContact CB-CH2 3.22Å; A260-W262 HydrophobicContact CB-CZ2 3.86Å; A260-W262 HydrophobicContact CB-CZ3 3.44Å; A260-W262 VanDerWaalsContact CB-CZ3 3.44Å; A260-W262 VanDerWaalsContact O-CZ3 3.31Å; A260-W262 WeakPolarHBondContact O-CZ3 3.3Å; A260-L269 HydrophobicContact CB-CD1 3.99Å; A260-L271 CarbonylContact C-O 3.53Å; A260-L271 WeakPolarHBondContact CA-O 3.44Å
261	A	95.3	Very high	91.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131.3	177.2	0	0	0	0	0	109.1	Y250 I251 K270 L271 F298	Y250-A261 CarbonylContact O-C 3.57Å; Y250-A261 VanDerWaalsContact O-CA 3.29Å; Y250-A261 WeakPolarHBondContact O-CA 3.46Å; I251-A261 HydrophobicContact CG1-CB 3.94Å; A261-K270 WeakPolarHBondContact O-CA 3.47Å; A261-K270 WeakPolarHBondContact O-CB 3.44Å; A261-K270 PolarHBondContact O-N 3.12Å; A261-L271 HydrophobicContact CB-CB 4.18Å; A261-L271 PolarHBondContact N-O 2.83Å; A261-L271 PolarHBondContact O-N 3.15Å; A261-F298 HydrophobicContact CB-CE1 4.27Å; A261-F298 HydrophobicContact CB-CZ 3.81Å
262	W	96.5	Very high	91.2	Very high	3 Å²	3	30.6 Å²	30.6	1%	0.011	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139.4	176.4	-66.8	-101.6	0	0	0	110	L216 L218 H249 Y250 V252 Y254 A260 F264 N268 L269	L216-W262 HydrophobicContact CB-CD2 4.18Å; L216-W262 HydrophobicContact CB-CG 4.48Å; L216-W262 HydrophobicContact CB-CZ2 3.97Å; L216-W262 HydrophobicContact CD1-CB 4.44Å; L216-W262 HydrophobicContact CD1-CD2 3.97Å; L216-W262 HydrophobicContact CD1-CE3 4.24Å; L216-W262 HydrophobicContact CD1-CG 4.07Å; L216-W262 HydrophobicContact CD2-CG 4.11Å; L216-W262 HydrophobicContact CG-CD2 4.49Å; L216-W262 HydrophobicContact CG-CG 4.46Å; L218-W262 HydrophobicContact CD2-CH2 4.06Å; L218-W262 HydrophobicContact CD2-CZ2 3.9Å; H249-W262 CarbonylContact C-O 3.47Å; H249-W262 WeakPolarHBondContact CA-O 3.17Å; Y250-W262 HydrophobicContact CD1-CE3 4.44Å; Y250-W262 PolarHBondContact N-O 2.76Å; Y250-W262 PolarHBondContact O-N 3.36Å; V252-W262 HydrophobicContact CB-CH2 4.04Å; V252-W262 HydrophobicContact CB-CZ3 3.61Å; V252-W262 HydrophobicContact CG2-CE3 4.11Å; V252-W262 HydrophobicContact CG2-CH2 3.93Å; V252-W262 HydrophobicContact CG2-CZ3 3.32Å; Y254-W262 HydrophobicContact CE2-CH2 4.34Å; Y254-W262 WeakPolarHBondContact OH-CH2 3.29Å; A260-W262 HydrophobicContact CB-CE3 4.28Å; A260-W262 HydrophobicContact CB-CH2 3.22Å; A260-W262 HydrophobicContact CB-CZ2 3.86Å; A260-W262 HydrophobicContact CB-CZ3 3.44Å; A260-W262 VanDerWaalsContact CB-CZ3 3.44Å; A260-W262 VanDerWaalsContact O-CZ3 3.31Å; A260-W262 WeakPolarHBondContact O-CZ3 3.3Å; W262-F264 HydrophobicContact CB-CE2 4.15Å; W262-N268 CarbonylContact C-O 3.17Å; W262-N268 VanDerWaalsContact CA-O 3.3Å; W262-N268 WeakPolarHBondContact CA-O 3.15Å; W262-L269 HydrophobicContact CD2-CD1 4.15Å; W262-L269 HydrophobicContact CG-CD1 4.46Å; W262-L269 HydrophobicContact CZ2-CD1 4Å
263	K	95.8	Very high	90.8	Very high	98 Å²	98	33 Å²	33	43%	0.426	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.8	175.3	-178.8	-177.4	178.6	-176.5	0	110.8	M248 S266 M267 N268	M248-K263 CarbonylContact O-C 3.55Å; M248-K263 WeakPolarHBondContact O-CA 3.07Å; K263-S266 CarbonylContact O-C 3.58Å; K263-S266 PolarHBondContact O-N 3.18Å; K263-S266 PolarHBondContact O-OG 3.37Å; K263-M267 VanDerWaalsContact O-CA 3.23Å; K263-M267 WeakPolarHBondContact O-CA 3.41Å; K263-M267 PolarHBondContact O-N 2.82Å; K263-N268 PolarHBondContact N-O 2.8Å; K263-N268 PolarHBondContact O-N 2.9Å
264	F	95.8	Very high	90.4	Very high	4 Å²	4	39 Å²	39	2%	0.018	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	149	172	-81.1	-102.3	0	0	0	111.5	L191 V193 V203 L216 F243 G247 M248 Y250 W262 M267	L191-F264 HydrophobicContact CD1-CD1 4.41Å; L191-F264 HydrophobicContact CD1-CE1 4.28Å; L191-F264 HydrophobicContact CD2-CD1 3.81Å; L191-F264 HydrophobicContact CD2-CE1 3.63Å; V193-F264 HydrophobicContact CG2-CZ 4.11Å; V203-F264 HydrophobicContact CG1-CE1 3.89Å; V203-F264 HydrophobicContact CG1-CZ 4.35Å; V203-F264 HydrophobicContact CG2-CE1 4.23Å; V203-F264 HydrophobicContact CG2-CZ 3.89Å; L216-F264 HydrophobicContact CD1-CE2 4.48Å; L216-F264 HydrophobicContact CD1-CZ 4.36Å; F243-F264 HydrophobicContact CE1-CD1 4Å; F243-F264 AromaticContact CE1-CD2 3.83Å; F243-F264 HydrophobicContact CE1-CD2 3.83Å; F243-F264 HydrophobicContact CE1-CE1 4.11Å; F243-F264 AromaticContact CE1-CE2 3.96Å; F243-F264 HydrophobicContact CE1-CE2 3.96Å; F243-F264 AromaticContact CE1-CG 3.87Å; F243-F264 HydrophobicContact CE1-CG 3.87Å; F243-F264 HydrophobicContact CE1-CZ 4.08Å; F243-F264 HydrophobicContact CZ-CD1 4.36Å; F243-F264 HydrophobicContact CZ-CE1 4.07Å; F243-F264 HydrophobicContact CZ-CE2 4.35Å; F243-F264 HydrophobicContact CZ-CZ 4.05Å; G247-F264 WeakPolarHBondContact O-CB 3.02Å; M248-F264 PolarHBondContact O-N 3.13Å; Y250-F264 HydrophobicContact CG-CE2 4.35Å; W262-F264 HydrophobicContact CB-CE2 4.15Å; F264-M267 HydrophobicContact CD1-CG 4.16Å; F264-M267 HydrophobicContact CE1-CE 4.35Å; F264-M267 HydrophobicContact CE1-CG 3.75Å; F264-M267 HydrophobicContact CZ-CG 4.06Å
265	P	92.7	Very high	89.6	Confident	84 Å²	84	39.8 Å²	39.8	55%	0.545	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	cis	-83.6	-1.1	0.6	35	-36.5	0	0	0	114.2	M267	P265-M267 WeakPolarHBondContact O-CG 3.22Å; P265-M267 PolarHBondContact O-N 2.79Å; P265-M267 VanDerWaalsContact O-N 3.13Å
266	S	93.8	Very high	88.8	Confident	49 Å²	49	48.1 Å²	48.1	34%	0.343	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.1	-177.8	52	0	0	0	0	114.8	K263 N268	K263-S266 CarbonylContact O-C 3.58Å; K263-S266 PolarHBondContact O-N 3.18Å; K263-S266 PolarHBondContact O-OG 3.37Å; S266-N268 PolarHBondContact O-N 3.36Å; S266-N268 PolarHBondContact O-OD1 3.23Å
267	M	95.1	Very high	87.9	Confident	24 Å²	24	50.9 Å²	50.9	12%	0.118	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	34.1	-173.4	-52.1	170.9	-161.2	0	0	112.8	L191 V203 L213 K214 L216 K263 F264 P265	L191-M267 HydrophobicContact CD1-CE 4.07Å; V203-M267 HydrophobicContact CB-CE 4.47Å; V203-M267 HydrophobicContact CB-SD 4.07Å; V203-M267 HydrophobicContact CG1-CE 3.81Å; V203-M267 HydrophobicContact CG1-SD 4.02Å; V203-M267 HydrophobicContact CG2-CG 4.49Å; V203-M267 HydrophobicContact CG2-SD 4Å; L213-M267 HydrophobicContact CB-CE 4.19Å; L213-M267 HydrophobicContact CD1-CE 3.85Å; K214-M267 HydrophobicContact CB-SD 3.53Å; K214-M267 VanDerWaalsContact CB-SD 3.53Å; K214-M267 HydrophobicContact CD-CB 3.46Å; K214-M267 VanDerWaalsContact CD-CB 3.46Å; K214-M267 HydrophobicContact CD-CG 4.28Å; K214-M267 HydrophobicContact CD-SD 3.86Å; K214-M267 HydrophobicContact CG-SD 4.35Å; K214-M267 PolarHBondContact NZ-O 3.46Å; L216-M267 HydrophobicContact CD2-CB 4.02Å; K263-M267 VanDerWaalsContact O-CA 3.23Å; K263-M267 WeakPolarHBondContact O-CA 3.41Å; K263-M267 PolarHBondContact O-N 2.82Å; F264-M267 HydrophobicContact CD1-CG 4.16Å; F264-M267 HydrophobicContact CE1-CE 4.35Å; F264-M267 HydrophobicContact CE1-CG 3.75Å; F264-M267 HydrophobicContact CZ-CG 4.06Å; P265-M267 WeakPolarHBondContact O-CG 3.22Å; P265-M267 PolarHBondContact O-N 2.79Å; P265-M267 VanDerWaalsContact O-N 3.13Å
268	N	94.5	Very high	87.1	Confident	91 Å²	91	51.2 Å²	51.2	49%	0.487	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	139	-179.2	-73.1	-18.8	0	0	0	109.9	W262 K263 S266 K270	W262-N268 CarbonylContact C-O 3.17Å; W262-N268 VanDerWaalsContact CA-O 3.3Å; W262-N268 WeakPolarHBondContact CA-O 3.15Å; K263-N268 PolarHBondContact N-O 2.8Å; K263-N268 PolarHBondContact O-N 2.9Å; S266-N268 PolarHBondContact O-N 3.36Å; S266-N268 PolarHBondContact O-OD1 3.23Å; N268-K270 PolarHBondContact O-N 3.21Å
269	L	94.3	Very high	86	Confident	42 Å²	42	53 Å²	53	22%	0.22	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	123.9	175.9	-173.5	67.8	0	0	0	109.2	E219 A260 W262 L271 Q272	E219-L269 HydrophobicContact CB-CD2 3.99Å; E219-L269 HydrophobicContact CG-CD2 3.7Å; A260-L269 HydrophobicContact CB-CD1 3.99Å; W262-L269 HydrophobicContact CD2-CD1 4.15Å; W262-L269 HydrophobicContact CG-CD1 4.46Å; W262-L269 HydrophobicContact CZ2-CD1 4Å; L269-L271 WeakPolarHBondContact CD1-O 3.17Å; L269-Q272 HydrophobicContact CD1-CB 4.49Å; L269-Q272 HydrophobicContact CD2-CB 4.15Å
270	K	91.4	Very high	84.5	Confident	123 Å²	123	56.5 Å²	56.5	54%	0.535	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-36.5	-179.7	179.4	60	179	177.4	0	111.5	A261 N268 F298	A261-K270 WeakPolarHBondContact O-CA 3.47Å; A261-K270 WeakPolarHBondContact O-CB 3.44Å; A261-K270 PolarHBondContact O-N 3.12Å; N268-K270 PolarHBondContact O-N 3.21Å; K270-F298 HydrophobicContact CG-CE1 4.39Å
271	L	91	Very high	82.8	Confident	22 Å²	22	57 Å²	57	12%	0.115	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	142.6	-178.9	-177.6	76.3	0	0	0	109.5	A260 A261 L269 H273 F314 F316 K319	A260-L271 CarbonylContact C-O 3.53Å; A260-L271 WeakPolarHBondContact CA-O 3.44Å; A261-L271 HydrophobicContact CB-CB 4.18Å; A261-L271 PolarHBondContact N-O 2.83Å; A261-L271 PolarHBondContact O-N 3.15Å; L269-L271 WeakPolarHBondContact CD1-O 3.17Å; L271-H273 HydrophobicContact CG-CB 4.44Å; L271-F314 HydrophobicContact CD2-CE1 4.08Å; L271-F314 HydrophobicContact CD2-CZ 4.34Å; L271-F316 HydrophobicContact CD2-CD1 3.46Å; L271-F316 VanDerWaalsContact CD2-CD1 3.46Å; L271-F316 HydrophobicContact CD2-CE1 3.66Å; L271-K319 HydrophobicContact CD1-CD 4.38Å
272	Q	89.8	Confident	80.7	Confident	56 Å²	56	61.4 Å²	61.4	26%	0.262	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	120	164.7	-177.9	175.5	-34.4	0	0	107.1	L218 E219 L258 T259 L269	L218-Q272 HydrophobicContact CD2-CG 4.36Å; E219-Q272 VanDerWaalsContact N-OE1 3.14Å; E219-Q272 PolarHBondContact O-NE2 3.42Å; L258-Q272 HydrophobicContact CD1-CG 3.39Å; L258-Q272 HydrophobicContact CD2-CG 4.26Å; L258-Q272 HydrophobicContact CG-CG 4.27Å; T259-Q272 WeakPolarHBondContact O-CA 3.43Å; L269-Q272 HydrophobicContact CD1-CB 4.49Å; L269-Q272 HydrophobicContact CD2-CB 4.15Å
273	H	86.7	Confident	78.6	Confident	51 Å²	51	69.3 Å²	69.3	24%	0.236	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	138.5	-175.5	-173.2	84.8	0	0	0	110.4	L258 T259 L271 F275 F314 K319	L258-H273 CarbonylContact C-O 3.54Å; L258-H273 WeakPolarHBondContact CA-O 3.43Å; L258-H273 VanDerWaalsContact CD1-O 3.29Å; L258-H273 WeakPolarHBondContact CD1-O 3.42Å; T259-H273 PolarHBondContact N-O 2.95Å; T259-H273 PolarHBondContact O-N 3.28Å; L271-H273 HydrophobicContact CG-CB 4.44Å; H273-F275 AromaticContact CD2-CD1 3.65Å; H273-F275 AromaticContact CD2-CE1 3.24Å; H273-F275 WeakPolarHBondContact CD2-CE1 3.33Å; H273-F275 AromaticContact CD2-CZ 3.91Å; H273-F275 AromaticContact NE2-CE1 3.81Å; H273-F314 HydrophobicContact CB-CZ 4.42Å; H273-F314 AromaticContact CD2-CE2 3.78Å; H273-F314 AromaticContact NE2-CE2 3.96Å; H273-K319 PolarHBondContact CE1-O 2.96Å; H273-K319 PolarHBondContact NE2-O 3.21Å
274	Y	82.3	Confident	76.8	Confident	125 Å²	125	66 Å²	66	49%	0.49	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	120.9	177	-74.9	-92.5	0	0	0	109.8	L258	L258-Y274 HydrophobicContact CB-CD1 3.97Å; L258-Y274 HydrophobicContact CB-CE1 3.82Å; L258-Y274 HydrophobicContact CD1-CD1 4.05Å; L258-Y274 HydrophobicContact CD1-CD2 3.71Å; L258-Y274 HydrophobicContact CD1-CE1 3.94Å; L258-Y274 HydrophobicContact CD1-CE2 3.58Å; L258-Y274 HydrophobicContact CD1-CG 3.95Å; L258-Y274 HydrophobicContact CD2-CE1 4.47Å; L258-Y274 HydrophobicContact CG-CE1 4.29Å
275	F	73.1	Confident	75.6	Confident	17 Å²	17	70.8 Å²	70.8	8%	0.075	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-82.3	171.3	163.3	-57.2	-51.6	0	0	0	110.9	G257 T259 H273 L303 F314 V321	G257-F275 WeakPolarHBondContact O-CA 3.15Å; G257-F275 VanDerWaalsContact O-CB 3.25Å; G257-F275 WeakPolarHBondContact O-CB 3.29Å; G257-F275 VanDerWaalsContact O-CD2 3.25Å; G257-F275 WeakPolarHBondContact O-CD2 3.48Å; G257-F275 PolarHBondContact O-N 2.8Å; T259-F275 HydrophobicContact CG2-CE2 4.06Å; T259-F275 WeakPolarHBondContact OG1-CD2 3.23Å; T259-F275 WeakPolarHBondContact OG1-CE2 3.4Å; H273-F275 AromaticContact CD2-CD1 3.65Å; H273-F275 AromaticContact CD2-CE1 3.24Å; H273-F275 WeakPolarHBondContact CD2-CE1 3.33Å; H273-F275 AromaticContact CD2-CZ 3.91Å; H273-F275 AromaticContact NE2-CE1 3.81Å; F275-L303 HydrophobicContact CE2-CD2 4.47Å; F275-F314 HydrophobicContact CD1-CD2 4.21Å; F275-F314 HydrophobicContact CD1-CE2 4.47Å; F275-F314 HydrophobicContact CE1-CB 4.11Å; F275-F314 HydrophobicContact CE1-CD1 4.3Å; F275-F314 AromaticContact CE1-CD2 3.04Å; F275-F314 HydrophobicContact CE1-CD2 3.04Å; F275-F314 HydrophobicContact CE1-CE1 4.45Å; F275-F314 AromaticContact CE1-CE2 3.25Å; F275-F314 HydrophobicContact CE1-CE2 3.25Å; F275-F314 AromaticContact CE1-CG 3.59Å; F275-F314 HydrophobicContact CE1-CG 3.59Å; F275-F314 AromaticContact CE1-CZ 3.98Å; F275-F314 HydrophobicContact CE1-CZ 3.98Å; F275-F314 HydrophobicContact CE2-CG 4.49Å; F275-F314 HydrophobicContact CZ-CB 3.88Å; F275-F314 AromaticContact CZ-CD1 3.72Å; F275-F314 HydrophobicContact CZ-CD1 3.72Å; F275-F314 AromaticContact CZ-CD2 3.35Å; F275-F314 HydrophobicContact CZ-CD2 3.35Å; F275-F314 AromaticContact CZ-CE1 3.95Å; F275-F314 HydrophobicContact CZ-CE1 3.95Å; F275-F314 AromaticContact CZ-CE2 3.59Å; F275-F314 HydrophobicContact CZ-CE2 3.59Å; F275-F314 AromaticContact CZ-CG 3.36Å; F275-F314 HydrophobicContact CZ-CG 3.36Å; F275-F314 AromaticContact CZ-CZ 3.88Å; F275-F314 HydrophobicContact CZ-CZ 3.88Å; F275-V321 HydrophobicContact CD1-CG2 4.02Å; F275-V321 HydrophobicContact CE1-CG2 4.39Å
276	Y	66.3	Low	75	Confident	187 Å²	187	67.9 Å²	67.9	73%	0.733	36%	0.361	S	S	*	.	S	Bend	trans	-51.2	142.4	159.6	-77.9	-81.9	0	0	0	109.1	L278	Y276-L278 PolarHBondContact O-N 2.82Å; Y276-L278 VanDerWaalsContact O-N 3.08Å
277	P	61.4	Low	74.7	Confident	91 Å²	91	66.3 Å²	66.3	59%	0.591	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-53.7	122.3	-173	-22.3	31.6	0	0	0	110	A279	P277-A279 PolarHBondContact O-N 2.91Å
278	L	62.9	Low	74.5	Confident	7 Å²	7	65.7 Å²	65.7	4%	0.037	35%	0.347	C	S	.	.			trans	-74.1	102.6	170.4	-72.2	163.5	0	0	0	106.6	I253 G255 Y276 P280 P306 N307	I253-L278 HydrophobicContact CG2-CD1 3.15Å; G255-L278 CarbonylContact C-O 3.43Å; Y276-L278 PolarHBondContact O-N 2.82Å; Y276-L278 VanDerWaalsContact O-N 3.08Å; L278-P280 VanDerWaalsContact O-CD 3.29Å; L278-P280 WeakPolarHBondContact O-CD 3.32Å; L278-P280 VanDerWaalsContact O-N 3.12Å; L278-P306 VanDerWaalsContact CD2-O 3.25Å; L278-P306 WeakPolarHBondContact CD2-O 3.14Å; L278-N307 HydrophobicContact CD2-CB 3.54Å; L278-N307 WeakPolarHBondContact CD2-OD1 3.24Å
279	A	62.9	Low	74.5	Confident	39 Å²	39	62.8 Å²	62.8	32%	0.322	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-62.1	120.5	173.3	0	0	0	0	0	107.9	P277 E308	P277-A279 PolarHBondContact O-N 2.91Å; A279-E308 HydrophobicContact CB-CG 3.88Å; A279-E308 WeakPolarHBondContact CB-OE1 3.08Å
280	P	59.6	Low	74.5	Confident	74 Å²	74	61 Å²	61	48%	0.481	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-59.5	138.4	174.1	24.4	-31.4	0	0	0	108	M239 L278	M239-P280 HydrophobicContact CE-CB 3.82Å; M239-P280 HydrophobicContact SD-CB 4.07Å; L278-P280 VanDerWaalsContact O-CD 3.29Å; L278-P280 WeakPolarHBondContact O-CD 3.32Å; L278-P280 VanDerWaalsContact O-N 3.12Å
281	P	58	Low	74.6	Confident	10 Å²	10	55.2 Å²	55.2	7%	0.065	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-55.1	131.3	176.6	8.8	-13.9	0	0	0	108.8	N283 S284 I288 Y349	P281-N283 PolarHBondContact O-N 2.84Å; P281-N283 VanDerWaalsContact O-N 3.14Å; P281-S284 PolarHBondContact O-N 2.9Å; P281-I288 HydrophobicContact CG-CG2 4.43Å; P281-Y349 HydrophobicContact CB-CD2 4.31Å; P281-Y349 HydrophobicContact CB-CE2 3.53Å; P281-Y349 HydrophobicContact CG-CE2 4.07Å
282	P	51.2	Low	74.8	Confident	92 Å²	92	54.2 Å²	54.2	60%	0.597	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	125.4	-176	19.9	-30.1	0	0	0	109.1	S284	P282-S284 PolarHBondContact O-N 3.35Å
283	N	51.1	Low	74.9	Confident	169 Å²	169	52.2 Å²	52.2	90%	0.904	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	9.5	176.5	-51.3	-27.9	0	0	0	117.8	P281	P281-N283 PolarHBondContact O-N 2.84Å; P281-N283 VanDerWaalsContact O-N 3.14Å
284	S	59.8	Low	74.9	Confident	28 Å²	28	52 Å²	52	20%	0.196	28%	0.279	C	S	.	.			trans	-91	114.5	176.8	175.5	0	0	0	0	112.4	P281 P282 L286 Y349	P281-S284 PolarHBondContact O-N 2.9Å; P282-S284 PolarHBondContact O-N 3.35Å; S284-L286 PolarHBondContact OG-N 2.84Å; S284-L286 VanDerWaalsContact OG-N 3.13Å; S284-L286 PolarHBondContact OG-O 3.02Å; S284-Y349 WeakPolarHBondContact CB-OH 3.49Å; S284-Y349 PolarHBondContact OG-OH 2.88Å
285	T	69.5	Low	75	Confident	106 Å²	106	46.9 Å²	46.9	65%	0.65	26%	0.26	S	S	*	.			trans	-80.9	-0.9	164.7	55.2	0	0	0	0	112.7	I180	I180-T285 WeakPolarHBondContact CG2-O 3.2Å
286	L	81.1	Confident	75.3	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.12	29%	0.286	C	S	.	.	S	Bend	trans	-92.6	147.5	-174.4	-57.2	176.3	0	0	0	112.2	N36 L130 S284	N36-L286 HydrophobicContact CB-CD1 4.32Å; N36-L286 VanDerWaalsContact OD1-CD1 3.25Å; N36-L286 WeakPolarHBondContact OD1-CD1 3.18Å; L130-L286 HydrophobicContact CD2-CD2 3.86Å; S284-L286 PolarHBondContact OG-N 2.84Å; S284-L286 VanDerWaalsContact OG-N 3.13Å; S284-L286 PolarHBondContact OG-O 3.02Å
287	S	87.4	Confident	76.3	Confident	15 Å²	15	44.8 Å²	44.8	11%	0.105	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-70.6	127.7	178.1	166.3	0	0	0	0	111.9	I180 M239 G240 R333	I180-S287 WeakPolarHBondContact O-CB 3.5Å; M239-S287 CarbonylContact O-C 3.51Å; M239-S287 VanDerWaalsContact O-C 3.31Å; M239-S287 WeakPolarHBondContact O-CA 3.41Å; M239-S287 WeakPolarHBondContact O-CB 3.47Å; M239-S287 PolarHBondContact O-OG 2.84Å; M239-S287 VanDerWaalsContact O-OG 3.09Å; G240-S287 WeakPolarHBondContact CA-OG 3.34Å; S287-R333 PolarHBondContact O-NH1 2.82Å; S287-R333 PolarHBondContact O-NH2 3.45Å
288	I	90.5	Very high	77.5	Confident	11 Å²	11	41.5 Å²	41.5	6%	0.056	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-60.2	145.3	167.2	66.8	173.9	0	0	0	110.6	M239 I253 P281	M239-I288 HydrophobicContact CB-CD1 4.04Å; M239-I288 HydrophobicContact CB-CG1 4.01Å; M239-I288 HydrophobicContact CE-CG2 4.16Å; M239-I288 WeakPolarHBondContact O-CG1 3.27Å; M239-I288 PolarHBondContact O-N 3.35Å; I253-I288 HydrophobicContact CG2-CD1 4.27Å; P281-I288 HydrophobicContact CG-CG2 4.43Å
289	R	93.6	Very high	78.6	Confident	31 Å²	31	43.9 Å²	43.9	12%	0.117	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-103.5	131.3	170.3	-67.7	-151.8	-171.1	160.2	-6.2	109.8	D40 M90 P306 R333 M334 C335	D40-R289 IonicContact OD1-NH1 3.66Å; D40-R289 PolarHBondContact OD1-NH1 3.29Å; M90-R289 PolarHBondContact O-NH1 3.34Å; M90-R289 PolarHBondContact O-NH2 3.37Å; R289-P306 WeakPolarHBondContact O-CG 3.25Å; R289-R333 PolarHBondContact N-O 3.09Å; R289-R333 VanDerWaalsContact N-O 3.14Å; R289-M334 HydrophobicContact CB-CB 4.08Å; R289-M334 HydrophobicContact CB-CE 4.29Å; R289-M334 HydrophobicContact CB-CG 4.22Å; R289-M334 HydrophobicContact CG-CE 3.86Å; R289-M334 HydrophobicContact CG-CG 4.49Å; R289-M334 WeakPolarHBondContact O-CA 3.5Å; R289-C335 PolarHBondContact O-N 3.03Å
290	F	94.8	Very high	79.8	Confident	3 Å²	3	46.9 Å²	46.9	1%	0.013	27%	0.269	C	S	.	.			trans	-129.7	165.9	176.8	65.4	-94.9	0	0	0	109.4	R242 I251 I253 I292 L303 F304 C335	R242-F290 HydrophobicContact CB-CE2 4.23Å; R242-F290 HydrophobicContact CB-CZ 4.08Å; R242-F290 PolarHBondContact NH1-O 2.84Å; I251-F290 HydrophobicContact CB-CE2 4.23Å; I251-F290 HydrophobicContact CB-CZ 4.28Å; I251-F290 HydrophobicContact CG2-CE2 3.87Å; I251-F290 HydrophobicContact CG2-CZ 3.92Å; I253-F290 HydrophobicContact CB-CE1 4.33Å; I253-F290 HydrophobicContact CD1-CB 4.05Å; I253-F290 HydrophobicContact CD1-CD1 3.37Å; I253-F290 HydrophobicContact CD1-CD2 3.99Å; I253-F290 HydrophobicContact CD1-CE1 3.66Å; I253-F290 HydrophobicContact CD1-CE2 4.25Å; I253-F290 HydrophobicContact CD1-CG 3.54Å; I253-F290 HydrophobicContact CD1-CZ 4.09Å; I253-F290 HydrophobicContact CG1-CD1 3.96Å; I253-F290 HydrophobicContact CG1-CE1 3.7Å; I253-F290 HydrophobicContact CG1-CG 4.46Å; I253-F290 HydrophobicContact CG1-CZ 4Å; F290-I292 HydrophobicContact CE2-CD1 4.28Å; F290-I292 HydrophobicContact CE2-CG1 4.38Å; F290-L303 HydrophobicContact CD2-CD1 3.38Å; F290-L303 HydrophobicContact CE2-CD1 3.65Å; F290-L303 HydrophobicContact CG-CD1 4.35Å; F290-F304 VanDerWaalsContact CB-O 3.31Å; F290-F304 WeakPolarHBondContact CB-O 3.32Å; F290-C335 CarbonylContact C-O 3.5Å
291	D	94.7	Very high	81.4	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	164.9	179	-147.6	-11.1	0	0	0	112.5	R242 F304 L337 R339	R242-D291 VanDerWaalsContact NH1-CG 3.29Å; R242-D291 IonicContact NH1-OD1 2.75Å; R242-D291 PolarHBondContact NH1-OD1 2.94Å; R242-D291 VanDerWaalsContact NH1-OD1 3.15Å; R242-D291 IonicContact NH1-OD2 3.84Å; D291-F304 PolarHBondContact N-O 3.4Å; D291-F304 PolarHBondContact O-N 3.07Å; D291-L337 HydrophobicContact CB-CB 3.91Å; D291-L337 VanDerWaalsContact OD2-CB 3.3Å; D291-L337 WeakPolarHBondContact OD2-CB 3.43Å; D291-L337 PolarHBondContact OD2-N 2.8Å; D291-R339 IonicContact OD1-CZ 3.8Å; D291-R339 IonicContact OD1-NH1 3.07Å; D291-R339 IonicContact OD1-NH2 3.65Å; D291-R339 PolarHBondContact OD1-NH2 3.43Å; D291-R339 IonicContact OD2-CZ 2.88Å; D291-R339 IonicContact OD2-NH1 2.82Å; D291-R339 PolarHBondContact OD2-NH1 3.06Å; D291-R339 VanDerWaalsContact OD2-NH1 3.07Å; D291-R339 IonicContact OD2-NH2 3.7Å
292	I	93.4	Very high	83	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.7	-173.4	-53.7	147.6	0	0	0	108.6	T244 I251 F290 E294 L302 L303 R339	T244-I292 HydrophobicContact CG2-CD1 4.2Å; I251-I292 HydrophobicContact CB-CD1 4.48Å; I251-I292 HydrophobicContact CD1-CD1 3.36Å; I251-I292 HydrophobicContact CD1-CG1 3.92Å; I251-I292 HydrophobicContact CG1-CD1 4.4Å; F290-I292 HydrophobicContact CE2-CD1 4.28Å; F290-I292 HydrophobicContact CE2-CG1 4.38Å; I292-E294 HydrophobicContact CB-CG 4.5Å; I292-E294 HydrophobicContact CG2-CG 3.95Å; I292-E294 PolarHBondContact O-N 2.89Å; I292-L302 CarbonylContact C-O 3.59Å; I292-L302 WeakPolarHBondContact CA-O 3.39Å; I292-L302 WeakPolarHBondContact CG2-O 3.32Å; I292-L303 HydrophobicContact CG1-CD1 3.81Å; I292-R339 PolarHBondContact O-NH2 2.89Å
293	L	92.2	Very high	85	Confident	15 Å²	15	39.1 Å²	39.1	8%	0.079	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	102.7	161.7	177.8	69.2	0	0	0	107.7	A17 S301 L302 F304 L337	A17-L293 HydrophobicContact CB-CD2 4.02Å; L293-S301 CarbonylContact O-C 3.52Å; L293-S301 VanDerWaalsContact O-CA 3.23Å; L293-S301 WeakPolarHBondContact O-CA 3.24Å; L293-S301 VanDerWaalsContact O-CB 3.23Å; L293-S301 WeakPolarHBondContact O-CB 3.46Å; L293-L302 HydrophobicContact CB-CB 4.32Å; L293-L302 HydrophobicContact CD2-CD1 4.27Å; L293-L302 PolarHBondContact N-O 2.9Å; L293-L302 PolarHBondContact O-N 3.39Å; L293-F304 HydrophobicContact CB-CE2 3.71Å; L293-F304 HydrophobicContact CB-CZ 4.24Å; L293-L337 HydrophobicContact CB-CD2 3.84Å; L293-L337 HydrophobicContact CD1-CD2 3.96Å
294	E	87.2	Confident	87	Confident	45 Å²	45	31.1 Å²	31.1	21%	0.21	17%	0.174	C	C	.	.			trans	-81.1	133.3	-179.6	-74.5	160.8	-130.1	0	0	112	T244 R245 D246 I292	T244-E294 VanDerWaalsContact CA-OE1 3.3Å; T244-E294 WeakPolarHBondContact CA-OE1 3.47Å; T244-E294 HydrophobicContact CG2-CG 4.04Å; R245-E294 WeakPolarHBondContact CA-OE2 3.46Å; R245-E294 WeakPolarHBondContact CB-OE1 3.27Å; R245-E294 VanDerWaalsContact CB-OE2 3.24Å; R245-E294 WeakPolarHBondContact CB-OE2 3.43Å; R245-E294 PolarHBondContact N-OE1 3.45Å; R245-E294 PolarHBondContact N-OE2 3.42Å; D246-E294 PolarHBondContact N-OE2 3.31Å; I292-E294 HydrophobicContact CB-CG 4.5Å; I292-E294 HydrophobicContact CG2-CG 3.95Å; I292-E294 PolarHBondContact O-N 2.89Å
295	E	83.6	Confident	88.5	Confident	19 Å²	19	29.8 Å²	29.8	9%	0.089	17%	0.165	C	C	.	.			trans	-110.4	152.6	173	-74.3	-66.7	140.7	0	0	109.5	Q10 C297 K300 S301	Q10-E295 WeakPolarHBondContact CB-OE2 3.41Å; E295-C297 WeakPolarHBondContact CB-O 3.09Å; E295-C297 CarbonylContact O-C 3.31Å; E295-C297 VanDerWaalsContact O-C 3.31Å; E295-C297 PolarHBondContact O-N 3.32Å; E295-K300 HydrophobicContact CB-CB 3.76Å; E295-K300 HydrophobicContact CG-CB 3.88Å; E295-K300 WeakPolarHBondContact CG-O 3.26Å; E295-S301 PolarHBondContact N-OG 2.76Å
296	P	81.1	Confident	89.5	Confident	95 Å²	95	25 Å²	25	62%	0.617	14%	0.136	S	C	*	.	S	Bend	trans	-54.5	-28.6	178.1	-23.7	31.3	0	0	0	113.2	Q10	Q10-P296 VanDerWaalsContact OE1-CD 3.24Å
297	C	85.8	Confident	89.8	Confident	64 Å²	64	24.7 Å²	24.7	43%	0.432	13%	0.134	S	C	.	.	S	Bend	trans	-101.2	115.6	164.9	-168.5	0	0	0	0	109	E295 T299 K300	E295-C297 WeakPolarHBondContact CB-O 3.09Å; E295-C297 CarbonylContact O-C 3.31Å; E295-C297 VanDerWaalsContact O-C 3.31Å; E295-C297 PolarHBondContact O-N 3.32Å; C297-T299 PolarHBondContact O-N 3.26Å; C297-T299 PolarHBondContact SG-OG1 3.19Å; C297-K300 HydrophobicContact CB-CG 4.38Å; C297-K300 PolarHBondContact O-N 3.49Å
298	F	86.5	Confident	89.8	Confident	23 Å²	23	28.6 Å²	28.6	10%	0.101	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-49.7	-36.2	178.7	175.4	-103.4	0	0	0	113.3	T244 H249 I251 A261 K270 K300 S301 F316	T244-F298 HydrophobicContact CG2-CD2 4.46Å; T244-F298 HydrophobicContact CG2-CE2 4.31Å; H249-F298 HydrophobicContact CB-CD2 4.15Å; H249-F298 HydrophobicContact CB-CE2 3.9Å; H249-F298 HydrophobicContact CB-CZ 4.45Å; H249-F298 AromaticContact CD2-CD1 3.98Å; H249-F298 AromaticContact CD2-CG 3.91Å; H249-F298 AromaticContact CE1-CD2 3.87Å; H249-F298 AromaticContact CE1-CG 3.59Å; H249-F298 AromaticContact CG-CD2 3.62Å; H249-F298 AromaticContact CG-CE2 3.79Å; H249-F298 AromaticContact CG-CG 3.96Å; H249-F298 AromaticContact ND1-CD2 3.52Å; H249-F298 AromaticContact ND1-CG 3.75Å; H249-F298 AromaticContact NE2-CD1 3.86Å; H249-F298 AromaticContact NE2-CG 3.69Å; I251-F298 HydrophobicContact CD1-CE2 4Å; I251-F298 HydrophobicContact CD1-CZ 4.28Å; A261-F298 HydrophobicContact CB-CE1 4.27Å; A261-F298 HydrophobicContact CB-CZ 3.81Å; K270-F298 HydrophobicContact CG-CE1 4.39Å; F298-K300 PolarHBondContact O-N 2.86Å; F298-S301 WeakPolarHBondContact O-CB 3.41Å; F298-S301 PolarHBondContact O-N 3.29Å; F298-S301 PolarHBondContact O-OG 3.13Å; F298-F316 HydrophobicContact CE1-CD1 4.02Å; F298-F316 HydrophobicContact CE1-CE1 4.34Å; F298-F316 HydrophobicContact CE1-CG 4.27Å; F298-F316 HydrophobicContact CE2-CD2 4.42Å; F298-F316 HydrophobicContact CE2-CE2 4.25Å; F298-F316 HydrophobicContact CE2-CZ 4.35Å; F298-F316 AromaticContact CZ-CD1 3.86Å; F298-F316 HydrophobicContact CZ-CD1 3.86Å; F298-F316 HydrophobicContact CZ-CD2 4.26Å; F298-F316 AromaticContact CZ-CE1 3.76Å; F298-F316 HydrophobicContact CZ-CE1 3.76Å; F298-F316 HydrophobicContact CZ-CE2 4.17Å; F298-F316 HydrophobicContact CZ-CG 4.14Å; F298-F316 AromaticContact CZ-CZ 3.93Å; F298-F316 HydrophobicContact CZ-CZ 3.93Å
299	T	87.1	Confident	89.8	Confident	56 Å²	56	29.6 Å²	29.6	34%	0.344	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-62.3	-28.1	179.6	60.6	0	0	0	0	112.5	C297 S301 F316 E317	C297-T299 PolarHBondContact O-N 3.26Å; C297-T299 PolarHBondContact SG-OG1 3.19Å; T299-S301 VanDerWaalsContact C-N 3.3Å; T299-F316 CarbonylContact O-C 3.57Å; T299-F316 VanDerWaalsContact O-CB 3.31Å; T299-F316 WeakPolarHBondContact O-CB 3.34Å; T299-E317 WeakPolarHBondContact O-CA 3.12Å; T299-E317 WeakPolarHBondContact O-CB 3.2Å; T299-E317 PolarHBondContact O-N 2.99Å
300	K	88.5	Confident	89.6	Confident	103 Å²	103	30.7 Å²	30.7	45%	0.448	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-84.5	-5.5	178.1	-64.1	-174	174.6	-174.7	0	113.6	E295 C297 F298	E295-K300 HydrophobicContact CB-CB 3.76Å; E295-K300 HydrophobicContact CG-CB 3.88Å; E295-K300 WeakPolarHBondContact CG-O 3.26Å; C297-K300 HydrophobicContact CB-CG 4.38Å; C297-K300 PolarHBondContact O-N 3.49Å; F298-K300 PolarHBondContact O-N 2.86Å
301	S	91.6	Very high	89.4	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.007	16%	0.162	C	C	.	.			trans	-66.6	156.7	-178.7	-57.6	0	0	0	0	110.7	L293 E295 F298 T299 F316	L293-S301 CarbonylContact O-C 3.52Å; L293-S301 VanDerWaalsContact O-CA 3.23Å; L293-S301 WeakPolarHBondContact O-CA 3.24Å; L293-S301 VanDerWaalsContact O-CB 3.23Å; L293-S301 WeakPolarHBondContact O-CB 3.46Å; E295-S301 PolarHBondContact N-OG 2.76Å; F298-S301 WeakPolarHBondContact O-CB 3.41Å; F298-S301 PolarHBondContact O-N 3.29Å; F298-S301 PolarHBondContact O-OG 3.13Å; T299-S301 VanDerWaalsContact C-N 3.3Å; S301-F316 VanDerWaalsContact O-CD2 3.28Å; S301-F316 WeakPolarHBondContact O-CD2 3.5Å; S301-F316 PolarHBondContact O-N 3.35Å
302	L	92.7	Very high	89.2	Confident	11 Å²	11	31 Å²	31	6%	0.058	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	135.3	175.2	-59.4	177.2	0	0	0	109.9	A17 I292 L293 F304 V313 F314	A17-L302 HydrophobicContact CB-CD1 3.65Å; I292-L302 CarbonylContact C-O 3.59Å; I292-L302 WeakPolarHBondContact CA-O 3.39Å; I292-L302 WeakPolarHBondContact CG2-O 3.32Å; L293-L302 HydrophobicContact CB-CB 4.32Å; L293-L302 HydrophobicContact CD2-CD1 4.27Å; L293-L302 PolarHBondContact N-O 2.9Å; L293-L302 PolarHBondContact O-N 3.39Å; L302-F304 HydrophobicContact CB-CE2 4.5Å; L302-F304 HydrophobicContact CB-CZ 4.28Å; L302-V313 HydrophobicContact CB-CG1 4.22Å; L302-V313 HydrophobicContact CD1-CG1 4.25Å; L302-F314 WeakPolarHBondContact CA-O 3.13Å
303	L	92.9	Very high	89.1	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.7	174.7	172.6	70.2	0	0	0	109.3	I251 I253 T259 F275 F290 I292 C305 V313 F314 F316	I251-L303 HydrophobicContact CG2-CD1 4.38Å; I253-L303 HydrophobicContact CD1-CD2 4.38Å; T259-L303 HydrophobicContact CG2-CD2 3.89Å; F275-L303 HydrophobicContact CE2-CD2 4.47Å; F290-L303 HydrophobicContact CD2-CD1 3.38Å; F290-L303 HydrophobicContact CE2-CD1 3.65Å; F290-L303 HydrophobicContact CG-CD1 4.35Å; I292-L303 HydrophobicContact CG1-CD1 3.81Å; L303-C305 HydrophobicContact CG-CB 4.49Å; L303-V313 CarbonylContact O-C 3.46Å; L303-V313 WeakPolarHBondContact O-CA 3.39Å; L303-F314 HydrophobicContact CB-CB 4.18Å; L303-F314 HydrophobicContact CB-CD1 4.32Å; L303-F314 HydrophobicContact CD2-CD1 4.45Å; L303-F314 PolarHBondContact N-O 3.2Å; L303-F314 PolarHBondContact O-N 3.19Å; L303-F316 HydrophobicContact CB-CE2 3.81Å; L303-F316 HydrophobicContact CB-CZ 3.94Å; L303-F316 HydrophobicContact CD2-CZ 4.34Å
304	F	93	Very high	88.9	Confident	1 Å²	1	30.3 Å²	30.3	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	99.7	174.5	-56.3	-77.9	0	0	0	109.4	A17 I20 F290 D291 L293 L302 V311 Q312 V313 L337 I344	A17-F304 HydrophobicContact CB-CZ 4.09Å; I20-F304 HydrophobicContact CD1-CE1 4.09Å; F290-F304 VanDerWaalsContact CB-O 3.31Å; F290-F304 WeakPolarHBondContact CB-O 3.32Å; D291-F304 PolarHBondContact N-O 3.4Å; D291-F304 PolarHBondContact O-N 3.07Å; L293-F304 HydrophobicContact CB-CE2 3.71Å; L293-F304 HydrophobicContact CB-CZ 4.24Å; L302-F304 HydrophobicContact CB-CE2 4.5Å; L302-F304 HydrophobicContact CB-CZ 4.28Å; F304-V311 HydrophobicContact CB-CG1 4.33Å; F304-Q312 WeakPolarHBondContact CA-O 3.4Å; F304-V313 HydrophobicContact CD1-CB 4.37Å; F304-V313 HydrophobicContact CD1-CG1 4.04Å; F304-V313 HydrophobicContact CD1-CG2 3.81Å; F304-V313 HydrophobicContact CE1-CB 4.38Å; F304-V313 HydrophobicContact CE1-CG1 3.69Å; F304-V313 HydrophobicContact CE1-CG2 3.89Å; F304-L337 HydrophobicContact CD2-CD1 4.48Å; F304-L337 HydrophobicContact CE2-CD1 3.94Å; F304-L337 HydrophobicContact CE2-CD2 4.1Å; F304-L337 HydrophobicContact CZ-CD1 4.39Å; F304-I344 HydrophobicContact CB-CD1 4.4Å; F304-I344 HydrophobicContact CD1-CD1 3.22Å; F304-I344 HydrophobicContact CD1-CG1 4.23Å; F304-I344 HydrophobicContact CE1-CD1 3.48Å; F304-I344 VanDerWaalsContact CE1-CD1 3.48Å; F304-I344 HydrophobicContact CE1-CG1 4.37Å; F304-I344 HydrophobicContact CG-CD1 3.82Å; F304-I344 HydrophobicContact CG-CG1 4.47Å; F304-I344 HydrophobicContact CZ-CD1 4.24Å
305	C	91.3	Very high	89.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.2	-177.2	48.9	0	0	0	0	111.7	I253 L303 N307 Q312	I253-C305 HydrophobicContact CD1-CB 3.69Å; L303-C305 HydrophobicContact CG-CB 4.49Å; C305-N307 PolarHBondContact O-N 3.07Å; C305-Q312 PolarHBondContact N-O 2.72Å; C305-Q312 PolarHBondContact O-N 3.29Å; C305-Q312 VanDerWaalsContact SG-CB 3.6Å
306	P	90.8	Very high	89.3	Confident	5 Å²	5	27.8 Å²	27.8	3%	0.032	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	129.2	163.3	-25.5	36.2	0	0	0	111.1	L278 R289 I332 C335	L278-P306 VanDerWaalsContact CD2-O 3.25Å; L278-P306 WeakPolarHBondContact CD2-O 3.14Å; R289-P306 WeakPolarHBondContact O-CG 3.25Å; P306-I332 HydrophobicContact CB-CB 3.92Å; P306-I332 HydrophobicContact CB-CG2 3.82Å; P306-I332 HydrophobicContact CG-CG2 3.93Å; P306-C335 HydrophobicContact CG-CB 3.83Å
307	N	87.6	Confident	89.7	Confident	18 Å²	18	28.8 Å²	28.8	10%	0.096	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	107.1	167	178.1	40.9	0	0	0	109.2	L278 C305 N309 E310 Q312	L278-N307 HydrophobicContact CD2-CB 3.54Å; L278-N307 WeakPolarHBondContact CD2-OD1 3.24Å; C305-N307 PolarHBondContact O-N 3.07Å; N307-N309 PolarHBondContact O-N 3.13Å; N307-N309 VanDerWaalsContact O-N 3.15Å; N307-E310 PolarHBondContact N-O 3.45Å; N307-E310 PolarHBondContact O-N 2.92Å; N307-Q312 HydrophobicContact CB-CG 4.04Å; N307-Q312 PolarHBondContact ND2-NE2 3.22Å
308	E	87.9	Confident	89.7	Confident	96 Å²	96	30.8 Å²	30.8	45%	0.449	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.6	-123.8	-171.4	-61.6	-176.1	-175.8	0	0	110.3	A279 E310 S331 I332	A279-E308 HydrophobicContact CB-CG 3.88Å; A279-E308 WeakPolarHBondContact CB-OE1 3.08Å; E308-E310 VanDerWaalsContact C-N 3.3Å; E308-E310 PolarHBondContact O-N 2.75Å; E308-S331 CarbonylContact O-C 3.54Å; E308-S331 WeakPolarHBondContact O-CA 3.47Å; E308-I332 PolarHBondContact O-N 3.23Å
309	N	88.8	Confident	89.7	Confident	32 Å²	32	35.4 Å²	35.4	17%	0.171	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	8	-178.8	62.4	-17.2	0	0	0	114.6	N307 Q326 V327 H328 R330	N307-N309 PolarHBondContact O-N 3.13Å; N307-N309 VanDerWaalsContact O-N 3.15Å; N309-Q326 PolarHBondContact ND2-NE2 3.25Å; N309-Q326 VanDerWaalsContact ND2-NE2 3.1Å; N309-V327 PolarHBondContact O-N 3.38Å; N309-V327 VanDerWaalsContact O-N 3.13Å; N309-H328 WeakPolarHBondContact CB-O 3.22Å; N309-H328 PolarHBondContact O-N 3.24Å; N309-R330 WeakPolarHBondContact CA-O 3.33Å; N309-R330 WeakPolarHBondContact CB-O 3.48Å
310	E	89.6	Confident	89.7	Confident	54 Å²	54	38 Å²	38	25%	0.252	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	151.7	-175.8	-46.6	-172.9	145.7	0	0	112.3	N307 E308 C324 H325 Q326	N307-E310 PolarHBondContact N-O 3.45Å; N307-E310 PolarHBondContact O-N 2.92Å; E308-E310 VanDerWaalsContact C-N 3.3Å; E308-E310 PolarHBondContact O-N 2.75Å; E310-C324 PolarHBondContact OE2-SG 3.05Å; E310-H325 CarbonylContact C-O 3.42Å; E310-H325 WeakPolarHBondContact CA-O 3.46Å; E310-H325 WeakPolarHBondContact CB-O 3.43Å; E310-Q326 HydrophobicContact CG-CB 4.12Å; E310-Q326 HydrophobicContact CG-CG 4.19Å
311	V	91	Very high	89.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.2	166.6	-176.7	0	0	0	0	108.4	F304 C324 H325 V327 I332 I344 T346 L356	F304-V311 HydrophobicContact CB-CG1 4.33Å; V311-C324 WeakPolarHBondContact O-CA 3.2Å; V311-H325 PolarHBondContact N-O 2.99Å; V311-H325 PolarHBondContact O-N 2.83Å; V311-V327 HydrophobicContact CG2-CG2 3.9Å; V311-I332 HydrophobicContact CG2-CD1 3.51Å; V311-I344 HydrophobicContact CG1-CD1 4.4Å; V311-T346 HydrophobicContact CG2-CG2 3.49Å; V311-T346 VanDerWaalsContact CG2-CG2 3.49Å; V311-L356 HydrophobicContact CG2-CD1 4.48Å
312	Q	89.9	Confident	89.5	Confident	13 Å²	13	37.8 Å²	37.8	6%	0.061	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.6	173.1	-74.3	179.5	-4.2	0	0	110.3	F304 C305 N307 V321 C324	F304-Q312 WeakPolarHBondContact CA-O 3.4Å; C305-Q312 PolarHBondContact N-O 2.72Å; C305-Q312 PolarHBondContact O-N 3.29Å; C305-Q312 VanDerWaalsContact SG-CB 3.6Å; N307-Q312 HydrophobicContact CB-CG 4.04Å; N307-Q312 PolarHBondContact ND2-NE2 3.22Å; Q312-V321 HydrophobicContact CB-CG1 4.17Å; Q312-V321 HydrophobicContact CG-CG1 4.26Å; Q312-C324 VanDerWaalsContact CG-SG 3.55Å
313	V	91.1	Very high	89.3	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	109.9	173.5	-169.2	0	0	0	0	108.3	L302 L303 F304 V321 V322 A323	L302-V313 HydrophobicContact CB-CG1 4.22Å; L302-V313 HydrophobicContact CD1-CG1 4.25Å; L303-V313 CarbonylContact O-C 3.46Å; L303-V313 WeakPolarHBondContact O-CA 3.39Å; F304-V313 HydrophobicContact CD1-CB 4.37Å; F304-V313 HydrophobicContact CD1-CG1 4.04Å; F304-V313 HydrophobicContact CD1-CG2 3.81Å; F304-V313 HydrophobicContact CE1-CB 4.38Å; F304-V313 HydrophobicContact CE1-CG1 3.69Å; F304-V313 HydrophobicContact CE1-CG2 3.89Å; V313-V321 CarbonylContact O-C 3.56Å; V313-V321 WeakPolarHBondContact O-CA 3.29Å; V313-V322 HydrophobicContact CB-CG2 4.16Å; V313-V322 HydrophobicContact CG1-CG2 3.94Å; V313-V322 WeakPolarHBondContact O-CG2 3.41Å; V313-V322 PolarHBondContact O-N 2.98Å; V313-A323 HydrophobicContact CB-CB 4.08Å; V313-A323 HydrophobicContact CG2-CB 3.96Å; V313-A323 PolarHBondContact N-O 3.1Å
314	F	89.7	Confident	89	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.9	176.6	173.2	-106.9	0	0	0	111.5	L271 H273 F275 L302 L303 F316 K319 K320	L271-F314 HydrophobicContact CD2-CE1 4.08Å; L271-F314 HydrophobicContact CD2-CZ 4.34Å; H273-F314 HydrophobicContact CB-CZ 4.42Å; H273-F314 AromaticContact CD2-CE2 3.78Å; H273-F314 AromaticContact NE2-CE2 3.96Å; F275-F314 HydrophobicContact CD1-CD2 4.21Å; F275-F314 HydrophobicContact CD1-CE2 4.47Å; F275-F314 HydrophobicContact CE1-CB 4.11Å; F275-F314 HydrophobicContact CE1-CD1 4.3Å; F275-F314 AromaticContact CE1-CD2 3.04Å; F275-F314 HydrophobicContact CE1-CD2 3.04Å; F275-F314 HydrophobicContact CE1-CE1 4.45Å; F275-F314 AromaticContact CE1-CE2 3.25Å; F275-F314 HydrophobicContact CE1-CE2 3.25Å; F275-F314 AromaticContact CE1-CG 3.59Å; F275-F314 HydrophobicContact CE1-CG 3.59Å; F275-F314 AromaticContact CE1-CZ 3.98Å; F275-F314 HydrophobicContact CE1-CZ 3.98Å; F275-F314 HydrophobicContact CE2-CG 4.49Å; F275-F314 HydrophobicContact CZ-CB 3.88Å; F275-F314 AromaticContact CZ-CD1 3.72Å; F275-F314 HydrophobicContact CZ-CD1 3.72Å; F275-F314 AromaticContact CZ-CD2 3.35Å; F275-F314 HydrophobicContact CZ-CD2 3.35Å; F275-F314 AromaticContact CZ-CE1 3.95Å; F275-F314 HydrophobicContact CZ-CE1 3.95Å; F275-F314 AromaticContact CZ-CE2 3.59Å; F275-F314 HydrophobicContact CZ-CE2 3.59Å; F275-F314 AromaticContact CZ-CG 3.36Å; F275-F314 HydrophobicContact CZ-CG 3.36Å; F275-F314 AromaticContact CZ-CZ 3.88Å; F275-F314 HydrophobicContact CZ-CZ 3.88Å; L302-F314 WeakPolarHBondContact CA-O 3.13Å; L303-F314 HydrophobicContact CB-CB 4.18Å; L303-F314 HydrophobicContact CB-CD1 4.32Å; L303-F314 HydrophobicContact CD2-CD1 4.45Å; L303-F314 PolarHBondContact N-O 3.2Å; L303-F314 PolarHBondContact O-N 3.19Å; F314-F316 HydrophobicContact CD1-CD1 4.02Å; F314-F316 HydrophobicContact CD1-CE1 4.04Å; F314-F316 HydrophobicContact CD1-CG 4.31Å; F314-F316 HydrophobicContact CD1-CZ 4.35Å; F314-F316 AromaticContact CE1-CD1 3.48Å; F314-F316 HydrophobicContact CE1-CD1 3.48Å; F314-F316 VanDerWaalsContact CE1-CD1 3.48Å; F314-F316 AromaticContact CE1-CE1 3.73Å; F314-F316 HydrophobicContact CE1-CE1 3.73Å; F314-F316 HydrophobicContact CE1-CG 4.04Å; F314-F316 HydrophobicContact CE1-CZ 4.48Å; F314-K319 HydrophobicContact CZ-CB 4.45Å; F314-K320 WeakPolarHBondContact CD2-O 3.42Å
315	S	90	Very high	88.8	Confident	4 Å²	4	41.1 Å²	41.1	3%	0.028	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.1	170.7	172.2	0	0	0	0	110.5	E317 E318 K319 K320	S315-E317 PolarHBondContact O-N 2.86Å; S315-E317 PolarHBondContact OG-N 2.66Å; S315-E318 PolarHBondContact OG-N 3.05Å; S315-E318 VanDerWaalsContact OG-N 3.14Å; S315-K319 VanDerWaalsContact O-CA 3.29Å; S315-K319 WeakPolarHBondContact O-CA 3.43Å; S315-K319 PolarHBondContact O-N 3.41Å; S315-K320 PolarHBondContact N-O 2.9Å
316	F	88.8	Confident	88.6	Confident	8 Å²	8	45.9 Å²	45.9	4%	0.035	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-23.7	173.6	-74	-69.4	0	0	0	112.5	I251 L271 F298 T299 S301 L303 F314	I251-F316 HydrophobicContact CD1-CE2 4.07Å; I251-F316 HydrophobicContact CD1-CZ 3.58Å; I251-F316 HydrophobicContact CG1-CZ 4.32Å; L271-F316 HydrophobicContact CD2-CD1 3.46Å; L271-F316 VanDerWaalsContact CD2-CD1 3.46Å; L271-F316 HydrophobicContact CD2-CE1 3.66Å; F298-F316 HydrophobicContact CE1-CD1 4.02Å; F298-F316 HydrophobicContact CE1-CE1 4.34Å; F298-F316 HydrophobicContact CE1-CG 4.27Å; F298-F316 HydrophobicContact CE2-CD2 4.42Å; F298-F316 HydrophobicContact CE2-CE2 4.25Å; F298-F316 HydrophobicContact CE2-CZ 4.35Å; F298-F316 AromaticContact CZ-CD1 3.86Å; F298-F316 HydrophobicContact CZ-CD1 3.86Å; F298-F316 HydrophobicContact CZ-CD2 4.26Å; F298-F316 AromaticContact CZ-CE1 3.76Å; F298-F316 HydrophobicContact CZ-CE1 3.76Å; F298-F316 HydrophobicContact CZ-CE2 4.17Å; F298-F316 HydrophobicContact CZ-CG 4.14Å; F298-F316 AromaticContact CZ-CZ 3.93Å; F298-F316 HydrophobicContact CZ-CZ 3.93Å; T299-F316 CarbonylContact O-C 3.57Å; T299-F316 VanDerWaalsContact O-CB 3.31Å; T299-F316 WeakPolarHBondContact O-CB 3.34Å; S301-F316 VanDerWaalsContact O-CD2 3.28Å; S301-F316 WeakPolarHBondContact O-CD2 3.5Å; S301-F316 PolarHBondContact O-N 3.35Å; L303-F316 HydrophobicContact CB-CE2 3.81Å; L303-F316 HydrophobicContact CB-CZ 3.94Å; L303-F316 HydrophobicContact CD2-CZ 4.34Å; F314-F316 HydrophobicContact CD1-CD1 4.02Å; F314-F316 HydrophobicContact CD1-CE1 4.04Å; F314-F316 HydrophobicContact CD1-CG 4.31Å; F314-F316 HydrophobicContact CD1-CZ 4.35Å; F314-F316 AromaticContact CE1-CD1 3.48Å; F314-F316 HydrophobicContact CE1-CD1 3.48Å; F314-F316 VanDerWaalsContact CE1-CD1 3.48Å; F314-F316 AromaticContact CE1-CE1 3.73Å; F314-F316 HydrophobicContact CE1-CE1 3.73Å; F314-F316 HydrophobicContact CE1-CG 4.04Å; F314-F316 HydrophobicContact CE1-CZ 4.48Å
317	E	89	Confident	88.5	Confident	116 Å²	116	46.4 Å²	46.4	54%	0.542	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-52.5	-177.9	179.1	165.7	-142.2	0	0	109.5	T299 S315 K319	T299-E317 WeakPolarHBondContact O-CA 3.12Å; T299-E317 WeakPolarHBondContact O-CB 3.2Å; T299-E317 PolarHBondContact O-N 2.99Å; S315-E317 PolarHBondContact O-N 2.86Å; S315-E317 PolarHBondContact OG-N 2.66Å; E317-K319 VanDerWaalsContact C-N 3.27Å; E317-K319 PolarHBondContact O-N 3.17Å
318	E	86.1	Confident	88.6	Confident	106 Å²	106	45.9 Å²	45.9	50%	0.495	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-14.2	-178.9	-59.1	-175.1	-139.3	0	0	112.4	S315 K320	S315-E318 PolarHBondContact OG-N 3.05Å; S315-E318 VanDerWaalsContact OG-N 3.14Å; E318-K320 HydrophobicContact CB-CD 4.48Å; E318-K320 HydrophobicContact CB-CG 3.89Å; E318-K320 PolarHBondContact O-N 3.12Å; E318-K320 WeakPolarHBondContact OE2-CE 3.38Å; E318-K320 IonicContact OE2-NZ 3.8Å; E318-K320 PolarHBondContact OE2-NZ 3.03Å
319	K	87.5	Confident	88.7	Confident	120 Å²	120	48.8 Å²	48.8	52%	0.522	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	43.3	-175.6	-58.6	178.6	-178.4	176	0	112.1	L271 H273 F314 S315 E317	L271-K319 HydrophobicContact CD1-CD 4.38Å; H273-K319 PolarHBondContact CE1-O 2.96Å; H273-K319 PolarHBondContact NE2-O 3.21Å; F314-K319 HydrophobicContact CZ-CB 4.45Å; S315-K319 VanDerWaalsContact O-CA 3.29Å; S315-K319 WeakPolarHBondContact O-CA 3.43Å; S315-K319 PolarHBondContact O-N 3.41Å; E317-K319 VanDerWaalsContact C-N 3.27Å; E317-K319 PolarHBondContact O-N 3.17Å
320	K	85.9	Confident	88.7	Confident	110 Å²	110	53.2 Å²	53.2	48%	0.478	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	163.1	173.5	64.2	176.1	178.9	179.9	0	110.8	F314 S315 E318 V322	F314-K320 WeakPolarHBondContact CD2-O 3.42Å; S315-K320 PolarHBondContact N-O 2.9Å; E318-K320 HydrophobicContact CB-CD 4.48Å; E318-K320 HydrophobicContact CB-CG 3.89Å; E318-K320 PolarHBondContact O-N 3.12Å; E318-K320 WeakPolarHBondContact OE2-CE 3.38Å; E318-K320 IonicContact OE2-NZ 3.8Å; E318-K320 PolarHBondContact OE2-NZ 3.03Å; K320-V322 HydrophobicContact CG-CG1 4.38Å; K320-V322 PolarHBondContact O-N 3.34Å
321	V	86.6	Confident	88.8	Confident	48 Å²	48	51.7 Å²	51.7	29%	0.291	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	122.1	167.3	-179.7	0	0	0	0	107.8	F275 Q312 V313 A323	F275-V321 HydrophobicContact CD1-CG2 4.02Å; F275-V321 HydrophobicContact CE1-CG2 4.39Å; Q312-V321 HydrophobicContact CB-CG1 4.17Å; Q312-V321 HydrophobicContact CG-CG1 4.26Å; V313-V321 CarbonylContact O-C 3.56Å; V313-V321 WeakPolarHBondContact O-CA 3.29Å; V321-A323 WeakPolarHBondContact CG1-O 3.47Å
322	V	89.3	Confident	88.8	Confident	51 Å²	51	51.9 Å²	51.9	31%	0.309	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-21.9	-177.9	-66.7	0	0	0	0	112.5	V313 K320	V313-V322 HydrophobicContact CB-CG2 4.16Å; V313-V322 HydrophobicContact CG1-CG2 3.94Å; V313-V322 WeakPolarHBondContact O-CG2 3.41Å; V313-V322 PolarHBondContact O-N 2.98Å; K320-V322 HydrophobicContact CG-CG1 4.38Å; K320-V322 PolarHBondContact O-N 3.34Å
323	A	87.7	Confident	88.9	Confident	17 Å²	17	51.8 Å²	51.8	14%	0.14	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	151.9	174	0	0	0	0	0	110.5	V313 V321	V313-A323 HydrophobicContact CB-CB 4.08Å; V313-A323 HydrophobicContact CG2-CB 3.96Å; V313-A323 PolarHBondContact N-O 3.1Å; V321-A323 WeakPolarHBondContact CG1-O 3.47Å
324	C	87.6	Confident	89	Confident	54 Å²	54	51.9 Å²	51.9	37%	0.365	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.5	170	-156.3	0	0	0	0	108.8	E310 V311 Q312	E310-C324 PolarHBondContact OE2-SG 3.05Å; V311-C324 WeakPolarHBondContact O-CA 3.2Å; Q312-C324 VanDerWaalsContact CG-SG 3.55Å
325	H	87.9	Confident	89.2	Confident	11 Å²	11	51.9 Å²	51.9	5%	0.051	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	117	-179.8	-55.1	-64.5	0	0	0	108.6	I20 E310 V311 V327 L356	I20-H325 PolarHBondContact O-CE1 3.42Å; I20-H325 PolarHBondContact O-ND1 3.32Å; E310-H325 CarbonylContact C-O 3.42Å; E310-H325 WeakPolarHBondContact CA-O 3.46Å; E310-H325 WeakPolarHBondContact CB-O 3.43Å; V311-H325 PolarHBondContact N-O 2.99Å; V311-H325 PolarHBondContact O-N 2.83Å; H325-V327 HydrophobicContact CB-CG2 4.1Å; H325-V327 WeakPolarHBondContact O-CG2 3.21Å; H325-V327 PolarHBondContact O-N 3.33Å; H325-L356 HydrophobicContact CB-CD2 4.46Å
326	Q	88.8	Confident	89.4	Confident	101 Å²	101	52.2 Å²	52.2	47%	0.472	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	109.4	172.8	-171.7	172.4	25.1	0	0	108.9	S22 N309 E310	S22-Q326 VanDerWaalsContact O-O 3.09Å; N309-Q326 PolarHBondContact ND2-NE2 3.25Å; N309-Q326 VanDerWaalsContact ND2-NE2 3.1Å; E310-Q326 HydrophobicContact CG-CB 4.12Å; E310-Q326 HydrophobicContact CG-CG 4.19Å
327	V	87.9	Confident	89.6	Confident	15 Å²	15	52.1 Å²	52.1	9%	0.091	26%	0.257	C	S	.	.			trans	-110.1	-38	-166.7	-169.1	0	0	0	0	111.7	N309 V311 H325 I332 H354 L356	N309-V327 PolarHBondContact O-N 3.38Å; N309-V327 VanDerWaalsContact O-N 3.13Å; V311-V327 HydrophobicContact CG2-CG2 3.9Å; H325-V327 HydrophobicContact CB-CG2 4.1Å; H325-V327 WeakPolarHBondContact O-CG2 3.21Å; H325-V327 PolarHBondContact O-N 3.33Å; V327-I332 HydrophobicContact CB-CD1 4.46Å; V327-H354 HydrophobicContact CG1-CB 3.38Å; V327-L356 HydrophobicContact CG1-CD1 4.28Å; V327-L356 HydrophobicContact CG1-CD2 4.32Å; V327-L356 HydrophobicContact CG1-CG 4.46Å; V327-L356 HydrophobicContact CG2-CD1 3.78Å; V327-L356 HydrophobicContact CG2-CD2 3.95Å; V327-L356 HydrophobicContact CG2-CG 4.41Å
328	H	90.5	Very high	89.8	Confident	7 Å²	7	46.6 Å²	46.6	3%	0.032	23%	0.231	C	C	.	.			trans	-120.1	169.3	-167.6	-75.5	-80.7	0	0	0	111.9	N309 R330 I332 T346 S348 D350 T352 H354	N309-H328 WeakPolarHBondContact CB-O 3.22Å; N309-H328 PolarHBondContact O-N 3.24Å; H328-R330 WeakPolarHBondContact CB-O 3.29Å; H328-I332 HydrophobicContact CB-CG1 4.25Å; H328-T346 PolarHBondContact CD2-OG1 3.44Å; H328-T346 WeakPolarHBondContact NE2-CB 3.41Å; H328-T346 PolarHBondContact NE2-O 2.92Å; H328-T346 PolarHBondContact NE2-OG1 3.39Å; H328-S348 WeakPolarHBondContact ND1-CB 3.41Å; H328-D350 VanDerWaalsContact CB-OD2 3.28Å; H328-D350 WeakPolarHBondContact CB-OD2 3.2Å; H328-D350 IonicContact CG-OD2 2.83Å; H328-D350 IonicContact ND1-OD1 3.29Å; H328-D350 PolarHBondContact ND1-OD1 2.71Å; H328-D350 IonicContact ND1-OD2 3.15Å; H328-D350 PolarHBondContact ND1-OD2 3.43Å; H328-T352 PolarHBondContact CE1-O 2.95Å; H328-T352 PolarHBondContact CE1-OG1 3.17Å; H328-T352 VanDerWaalsContact CE1-OG1 3.26Å; H328-T352 PolarHBondContact ND1-OG1 2.83Å; H328-H354 AromaticContact CE1-CD2 3.29Å; H328-H354 PolarHBondContact CE1-CD2 3.33Å; H328-H354 AromaticContact ND1-CD2 3.65Å; H328-H354 AromaticContact NE2-CD2 3.92Å
329	L	89.1	Confident	89.8	Confident	157 Å²	157	45.8 Å²	45.8	82%	0.822	22%	0.224	S	C	*	.	S	Bend	trans	-90	-25	172.9	-64.4	176.1	0	0	0	112	D350	L329-D350 HydrophobicContact CB-CB 4.32Å; L329-D350 PolarHBondContact N-OD2 2.78Å
330	R	89.7	Confident	89.7	Confident	125 Å²	125	43.6 Å²	43.6	47%	0.472	22%	0.223	S	C	.	.	S	Bend	trans	-125.1	176.6	177.5	-61.5	-171.1	74.4	-159.6	8	111.2	N309 H328 I332 S348 Y349 D350	N309-R330 WeakPolarHBondContact CA-O 3.33Å; N309-R330 WeakPolarHBondContact CB-O 3.48Å; H328-R330 WeakPolarHBondContact CB-O 3.29Å; R330-I332 PolarHBondContact O-N 2.95Å; R330-S348 PolarHBondContact O-OG 3.32Å; R330-Y349 WeakPolarHBondContact CD-O 3.13Å; R330-Y349 PolarHBondContact NH1-O 3.32Å; R330-D350 HydrophobicContact CB-CB 4.06Å; R330-D350 HydrophobicContact CG-CB 4.05Å
331	S	90.2	Very high	89.6	Confident	23 Å²	23	40.6 Å²	40.6	16%	0.161	21%	0.21	C	C	.	.			trans	-60.8	133.2	-175.5	-49	0	0	0	0	112.8	E308 S348 Y349	E308-S331 CarbonylContact O-C 3.54Å; E308-S331 WeakPolarHBondContact O-CA 3.47Å; S331-S348 WeakPolarHBondContact O-CA 3.46Å; S331-S348 PolarHBondContact O-OG 2.65Å; S331-Y349 WeakPolarHBondContact O-CD2 3.23Å; S331-Y349 PolarHBondContact O-N 3.2Å
332	I	91.8	Very high	89.5	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	129.1	177.2	-60.3	-178.3	0	0	0	108.9	P306 E308 V311 V327 H328 R330 M334 T346	P306-I332 HydrophobicContact CB-CB 3.92Å; P306-I332 HydrophobicContact CB-CG2 3.82Å; P306-I332 HydrophobicContact CG-CG2 3.93Å; E308-I332 PolarHBondContact O-N 3.23Å; V311-I332 HydrophobicContact CG2-CD1 3.51Å; V327-I332 HydrophobicContact CB-CD1 4.46Å; H328-I332 HydrophobicContact CB-CG1 4.25Å; R330-I332 PolarHBondContact O-N 2.95Å; I332-M334 WeakPolarHBondContact CG2-O 3.41Å; I332-T346 HydrophobicContact CD1-CG2 4.5Å; I332-T346 HydrophobicContact CG2-CG2 4.34Å
333	R	91.2	Very high	89.4	Confident	11 Å²	11	37 Å²	37	4%	0.042	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-41	179.7	175.8	68	-170.2	82.7	-7.7	111.7	N36 P37 S287 R289 C347 Y349	N36-R333 PolarHBondContact OD1-NE 2.94Å; P37-R333 HydrophobicContact CG-CB 3.76Å; P37-R333 HydrophobicContact CG-CG 3.99Å; P37-R333 WeakPolarHBondContact O-CG 3.34Å; S287-R333 PolarHBondContact O-NH1 2.82Å; S287-R333 PolarHBondContact O-NH2 3.45Å; R289-R333 PolarHBondContact N-O 3.09Å; R289-R333 VanDerWaalsContact N-O 3.14Å; R333-C347 PolarHBondContact N-O 3.37Å; R333-Y349 HydrophobicContact CB-CE2 4.34Å; R333-Y349 VanDerWaalsContact CD-OH 3.26Å; R333-Y349 WeakPolarHBondContact CD-OH 3.24Å
334	M	93.6	Very high	89.6	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	140	-175.6	-45.3	176.2	79.6	0	0	110.3	L38 I39 R289 I332 T346 C347	L38-M334 HydrophobicContact CD2-CE 4.49Å; L38-M334 HydrophobicContact CD2-SD 4.07Å; I39-M334 HydrophobicContact CG1-CB 4.28Å; I39-M334 HydrophobicContact CG1-SD 3.9Å; I39-M334 PolarHBondContact N-SD 2.71Å; I39-M334 WeakPolarHBondContact O-CE 2.99Å; R289-M334 HydrophobicContact CB-CB 4.08Å; R289-M334 HydrophobicContact CB-CE 4.29Å; R289-M334 HydrophobicContact CB-CG 4.22Å; R289-M334 HydrophobicContact CG-CE 3.86Å; R289-M334 HydrophobicContact CG-CG 4.49Å; R289-M334 WeakPolarHBondContact O-CA 3.5Å; I332-M334 WeakPolarHBondContact CG2-O 3.41Å; M334-T346 VanDerWaalsContact O-CA 3.27Å; M334-T346 WeakPolarHBondContact O-CA 3.34Å; M334-C347 VanDerWaalsContact CB-SG 3.53Å; M334-C347 WeakPolarHBondContact CG-SG 3.34Å; M334-C347 PolarHBondContact N-O 3.47Å; M334-C347 PolarHBondContact O-N 3.42Å; M334-C347 VanDerWaalsContact O-N 3.1Å
335	C	94.2	Very high	90	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.007	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.7	170.5	175.8	0	0	0	0	108.1	R289 F290 P306 I344 I345 T346	R289-C335 PolarHBondContact O-N 3.03Å; F290-C335 CarbonylContact C-O 3.5Å; P306-C335 HydrophobicContact CG-CB 3.83Å; C335-I344 WeakPolarHBondContact SG-CG2 3.42Å; C335-I345 WeakPolarHBondContact CA-O 3.4Å; C335-T346 HydrophobicContact CB-CG2 4.13Å
336	I	94.9	Very high	90.3	Very high	11 Å²	11	33.1 Å²	33.1	6%	0.056	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.4	-175.2	-56.3	178.3	0	0	0	109.4	I39 L41 I344 I345	I39-I336 HydrophobicContact CD1-CD1 4.09Å; I39-I336 HydrophobicContact CG1-CD1 3.91Å; L41-I336 HydrophobicContact CB-CG2 3.82Å; L41-I336 HydrophobicContact CD2-CG2 4.13Å; I336-I344 WeakPolarHBondContact O-CA 3.37Å; I336-I345 PolarHBondContact N-O 3.29Å; I336-I345 PolarHBondContact O-N 3.43Å
337	L	93	Very high	90.5	Very high	5 Å²	5	28.3 Å²	28.3	3%	0.026	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.8	177.9	-178.1	71.1	0	0	0	110.9	D291 L293 F304 R339 I344	D291-L337 HydrophobicContact CB-CB 3.91Å; D291-L337 VanDerWaalsContact OD2-CB 3.3Å; D291-L337 WeakPolarHBondContact OD2-CB 3.43Å; D291-L337 PolarHBondContact OD2-N 2.8Å; L293-L337 HydrophobicContact CB-CD2 3.84Å; L293-L337 HydrophobicContact CD1-CD2 3.96Å; F304-L337 HydrophobicContact CD2-CD1 4.48Å; F304-L337 HydrophobicContact CE2-CD1 3.94Å; F304-L337 HydrophobicContact CE2-CD2 4.1Å; F304-L337 HydrophobicContact CZ-CD1 4.39Å; L337-R339 HydrophobicContact CD2-CG 3.76Å; L337-R339 HydrophobicContact CG-CG 3.95Å; L337-R339 PolarHBondContact O-N 3.37Å; L337-R339 VanDerWaalsContact O-N 3.12Å; L337-R339 PolarHBondContact O-NH1 3.42Å; L337-I344 HydrophobicContact CD1-CG1 4.15Å
338	R	92.1	Very high	90.8	Very high	1 Å²	1	27.6 Å²	27.6	0%	0.004	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	87.1	166.7	-174.4	-174.4	-172.6	-153.1	5.1	109.8	L41 G45 S63 C340 F341 N342 Q343 I345	L41-R338 HydrophobicContact CD2-CB 3.83Å; L41-R338 HydrophobicContact CD2-CG 4.06Å; G45-R338 PolarHBondContact O-NE 3.03Å; G45-R338 PolarHBondContact O-NH2 2.75Å; S63-R338 PolarHBondContact O-NH1 3.19Å; S63-R338 PolarHBondContact O-NH2 3.03Å; R338-C340 VanDerWaalsContact C-N 3.34Å; R338-C340 PolarHBondContact O-N 2.97Å; R338-F341 HydrophobicContact CG-CD2 4.47Å; R338-F341 VanDerWaalsContact CZ-CE2 3.48Å; R338-F341 PolarHBondContact O-N 2.94Å; R338-N342 PolarHBondContact O-N 2.99Å; R338-Q343 WeakPolarHBondContact CA-O 3Å; R338-Q343 HydrophobicContact CB-CB 4.14Å; R338-Q343 WeakPolarHBondContact CB-O 3.47Å; R338-Q343 PolarHBondContact N-O 3.4Å; R338-Q343 PolarHBondContact O-N 3.15Å; R338-Q343 VanDerWaalsContact O-N 3.13Å; R338-I345 HydrophobicContact CB-CD1 4.35Å
339	R	87.2	Confident	90.8	Very high	89 Å²	89	28.2 Å²	28.2	34%	0.336	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-35.8	-172.2	-68.7	168.5	176	73.3	0.2	114.5	D291 I292 L337 F341 N342	D291-R339 IonicContact OD1-CZ 3.8Å; D291-R339 IonicContact OD1-NH1 3.07Å; D291-R339 IonicContact OD1-NH2 3.65Å; D291-R339 PolarHBondContact OD1-NH2 3.43Å; D291-R339 IonicContact OD2-CZ 2.88Å; D291-R339 IonicContact OD2-NH1 2.82Å; D291-R339 PolarHBondContact OD2-NH1 3.06Å; D291-R339 VanDerWaalsContact OD2-NH1 3.07Å; D291-R339 IonicContact OD2-NH2 3.7Å; I292-R339 PolarHBondContact O-NH2 2.89Å; L337-R339 HydrophobicContact CD2-CG 3.76Å; L337-R339 HydrophobicContact CG-CG 3.95Å; L337-R339 PolarHBondContact O-N 3.37Å; L337-R339 VanDerWaalsContact O-N 3.12Å; L337-R339 PolarHBondContact O-NH1 3.42Å; R339-F341 PolarHBondContact O-N 3.09Å; R339-F341 VanDerWaalsContact O-N 3.16Å; R339-N342 PolarHBondContact O-N 2.57Å
340	C	84.4	Confident	90.9	Very high	73 Å²	73	22.1 Å²	22.1	49%	0.493	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.2	-178.4	46.4	0	0	0	0	114.1	R338	R338-C340 VanDerWaalsContact C-N 3.34Å; R338-C340 PolarHBondContact O-N 2.97Å
341	F	83.2	Confident	91.1	Very high	48 Å²	48	17.1 Å²	17.1	21%	0.211	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.8	3.3	178.4	-64.9	-84	0	0	0	113.4	N64 R338 R339 Q343	N64-F341 HydrophobicContact CB-CZ 4.03Å; N64-F341 WeakPolarHBondContact O-CE1 3.44Å; N64-F341 WeakPolarHBondContact O-CZ 3.46Å; R338-F341 HydrophobicContact CG-CD2 4.47Å; R338-F341 VanDerWaalsContact CZ-CE2 3.48Å; R338-F341 PolarHBondContact O-N 2.94Å; R339-F341 PolarHBondContact O-N 3.09Å; R339-F341 VanDerWaalsContact O-N 3.16Å; F341-Q343 HydrophobicContact CB-CG 3.95Å; F341-Q343 PolarHBondContact O-N 3.43Å
342	N	84.7	Confident	91.2	Very high	22 Å²	22	17.8 Å²	17.8	12%	0.118	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	44.5	-170.5	-53.4	-62.1	0	0	0	112.9	H13 R338 R339	H13-N342 PolarHBondContact CE1-ND2 2.99Å; H13-N342 VanDerWaalsContact CE1-ND2 3.26Å; H13-N342 PolarHBondContact ND1-ND2 3.18Å; R338-N342 PolarHBondContact O-N 2.99Å; R339-N342 PolarHBondContact O-N 2.57Å
343	Q	88.7	Confident	91.3	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	145.1	177.2	-72.8	169.2	-29.2	0	0	109.9	L66 R338 F341 M355 L356	L66-Q343 PolarHBondContact O-NE2 3.14Å; R338-Q343 WeakPolarHBondContact CA-O 3Å; R338-Q343 HydrophobicContact CB-CB 4.14Å; R338-Q343 WeakPolarHBondContact CB-O 3.47Å; R338-Q343 PolarHBondContact N-O 3.4Å; R338-Q343 PolarHBondContact O-N 3.15Å; R338-Q343 VanDerWaalsContact O-N 3.13Å; F341-Q343 HydrophobicContact CB-CG 3.95Å; F341-Q343 PolarHBondContact O-N 3.43Å; Q343-M355 HydrophobicContact CB-CG 4.06Å; Q343-M355 HydrophobicContact CB-SD 4.41Å; Q343-M355 VanDerWaalsContact CD-SD 3.58Å; Q343-M355 HydrophobicContact CG-CG 4.37Å; Q343-M355 HydrophobicContact CG-SD 4.43Å; Q343-M355 PolarHBondContact OE1-SD 2.68Å; Q343-L356 CarbonylContact C-O 3.58Å; Q343-L356 WeakPolarHBondContact CA-O 2.97Å; Q343-L356 WeakPolarHBondContact CB-O 3.02Å
344	I	91.8	Very high	91.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	130.4	171.2	-61.9	173.8	0	0	0	107.8	I20 F304 V311 C335 I336 L337 T346 M355 L356	I20-I344 HydrophobicContact CD1-CD1 3.43Å; I20-I344 VanDerWaalsContact CD1-CD1 3.43Å; I20-I344 HydrophobicContact CD1-CG1 3.89Å; F304-I344 HydrophobicContact CB-CD1 4.4Å; F304-I344 HydrophobicContact CD1-CD1 3.22Å; F304-I344 HydrophobicContact CD1-CG1 4.23Å; F304-I344 HydrophobicContact CE1-CD1 3.48Å; F304-I344 VanDerWaalsContact CE1-CD1 3.48Å; F304-I344 HydrophobicContact CE1-CG1 4.37Å; F304-I344 HydrophobicContact CG-CD1 3.82Å; F304-I344 HydrophobicContact CG-CG1 4.47Å; F304-I344 HydrophobicContact CZ-CD1 4.24Å; V311-I344 HydrophobicContact CG1-CD1 4.4Å; C335-I344 WeakPolarHBondContact SG-CG2 3.42Å; I336-I344 WeakPolarHBondContact O-CA 3.37Å; L337-I344 HydrophobicContact CD1-CG1 4.15Å; I344-T346 HydrophobicContact CG2-CG2 3.76Å; I344-M355 CarbonylContact O-C 3.58Å; I344-M355 VanDerWaalsContact O-CA 3.32Å; I344-M355 WeakPolarHBondContact O-CA 3.48Å; I344-L356 HydrophobicContact CB-CB 4.42Å; I344-L356 HydrophobicContact CB-CD1 4.1Å; I344-L356 HydrophobicContact CG2-CD1 4.12Å; I344-L356 PolarHBondContact N-O 2.98Å; I344-L356 PolarHBondContact O-N 3.32Å
345	I	94.2	Very high	91.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.9	172.6	-55	173.3	0	0	0	107.4	L27 I39 L41 L48 L62 C335 I336 R338 C353 H354 M355	L27-I345 HydrophobicContact CD1-CG2 4.4Å; I39-I345 HydrophobicContact CD1-CG2 3.76Å; L41-I345 HydrophobicContact CD1-CD1 4.12Å; L48-I345 HydrophobicContact CD1-CD1 4.3Å; L48-I345 HydrophobicContact CD1-CG2 4.33Å; L48-I345 HydrophobicContact CD2-CG2 4.32Å; L62-I345 HydrophobicContact CD1-CD1 3.6Å; C335-I345 WeakPolarHBondContact CA-O 3.4Å; I336-I345 PolarHBondContact N-O 3.29Å; I336-I345 PolarHBondContact O-N 3.43Å; R338-I345 HydrophobicContact CB-CD1 4.35Å; I345-C353 WeakPolarHBondContact CG2-SG 3.28Å; I345-H354 WeakPolarHBondContact CA-O 3.46Å; I345-M355 HydrophobicContact CD1-CE 3.97Å; I345-M355 HydrophobicContact CG1-CE 4.04Å; I345-M355 HydrophobicContact CG1-CG 4.22Å
346	T	94.7	Very high	90.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	144.1	178.6	56.3	0	0	0	0	111.7	V311 H328 I332 M334 C335 I344 C353 H354 L356	V311-T346 HydrophobicContact CG2-CG2 3.49Å; V311-T346 VanDerWaalsContact CG2-CG2 3.49Å; H328-T346 PolarHBondContact CD2-OG1 3.44Å; H328-T346 WeakPolarHBondContact NE2-CB 3.41Å; H328-T346 PolarHBondContact NE2-O 2.92Å; H328-T346 PolarHBondContact NE2-OG1 3.39Å; I332-T346 HydrophobicContact CD1-CG2 4.5Å; I332-T346 HydrophobicContact CG2-CG2 4.34Å; M334-T346 VanDerWaalsContact O-CA 3.27Å; M334-T346 WeakPolarHBondContact O-CA 3.34Å; C335-T346 HydrophobicContact CB-CG2 4.13Å; I344-T346 HydrophobicContact CG2-CG2 3.76Å; T346-C353 CarbonylContact O-C 3.56Å; T346-C353 WeakPolarHBondContact O-CA 3.16Å; T346-C353 PolarHBondContact O-SG 3.03Å; T346-H354 PolarHBondContact N-O 2.93Å; T346-H354 PolarHBondContact O-N 3.5Å; T346-L356 HydrophobicContact CG2-CD1 4.46Å
347	C	94.3	Very high	90	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	153.2	166.8	70.7	0	0	0	0	111.2	L32 P37 I39 R333 M334 T352	L32-C347 HydrophobicContact CD1-CB 3.55Å; P37-C347 HydrophobicContact CB-CB 4.45Å; P37-C347 PolarHBondContact O-SG 2.84Å; I39-C347 HydrophobicContact CD1-CB 3.93Å; I39-C347 HydrophobicContact CG1-CB 4.14Å; I39-C347 HydrophobicContact CG2-CB 4.09Å; R333-C347 PolarHBondContact N-O 3.37Å; M334-C347 VanDerWaalsContact CB-SG 3.53Å; M334-C347 WeakPolarHBondContact CG-SG 3.34Å; M334-C347 PolarHBondContact N-O 3.47Å; M334-C347 PolarHBondContact O-N 3.42Å; M334-C347 VanDerWaalsContact O-N 3.1Å; C347-T352 WeakPolarHBondContact CA-O 3.31Å
348	S	92.6	Very high	88.5	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	162.9	-173.2	172.2	0	0	0	0	112.1	P37 H328 R330 S331 D350 S351 T352	P37-S348 WeakPolarHBondContact CG-O 3.31Å; H328-S348 WeakPolarHBondContact ND1-CB 3.41Å; R330-S348 PolarHBondContact O-OG 3.32Å; S331-S348 WeakPolarHBondContact O-CA 3.46Å; S331-S348 PolarHBondContact O-OG 2.65Å; S348-D350 WeakPolarHBondContact CB-OD1 3.26Å; S348-D350 PolarHBondContact O-N 2.79Å; S348-D350 PolarHBondContact OG-N 2.92Å; S348-S351 PolarHBondContact O-N 3.2Å; S348-S351 VanDerWaalsContact O-N 3.09Å; S348-T352 PolarHBondContact N-O 2.85Å
349	Y	91.2	Very high	88.3	Confident	20 Å²	20	22.8 Å²	22.8	8%	0.078	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	4.4	173	-61.7	-73.5	0	0	0	113.9	L34 D35 P37 P281 S284 R330 S331 R333	L34-Y349 WeakPolarHBondContact O-CD1 3.46Å; D35-Y349 WeakPolarHBondContact O-CE1 3.22Å; P37-Y349 HydrophobicContact CG-CD1 4.05Å; P37-Y349 HydrophobicContact CG-CE1 4.35Å; P37-Y349 HydrophobicContact CG-CG 4.49Å; P281-Y349 HydrophobicContact CB-CD2 4.31Å; P281-Y349 HydrophobicContact CB-CE2 3.53Å; P281-Y349 HydrophobicContact CG-CE2 4.07Å; S284-Y349 WeakPolarHBondContact CB-OH 3.49Å; S284-Y349 PolarHBondContact OG-OH 2.88Å; R330-Y349 WeakPolarHBondContact CD-O 3.13Å; R330-Y349 PolarHBondContact NH1-O 3.32Å; S331-Y349 WeakPolarHBondContact O-CD2 3.23Å; S331-Y349 PolarHBondContact O-N 3.2Å; R333-Y349 HydrophobicContact CB-CE2 4.34Å; R333-Y349 VanDerWaalsContact CD-OH 3.26Å; R333-Y349 WeakPolarHBondContact CD-OH 3.24Å
350	D	92	Very high	88.4	Confident	29 Å²	29	19.3 Å²	19.3	16%	0.155	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	8.2	165.7	64	14.9	0	0	0	113	H328 L329 R330 S348 T352	H328-D350 VanDerWaalsContact CB-OD2 3.28Å; H328-D350 WeakPolarHBondContact CB-OD2 3.2Å; H328-D350 IonicContact CG-OD2 2.83Å; H328-D350 IonicContact ND1-OD1 3.29Å; H328-D350 PolarHBondContact ND1-OD1 2.71Å; H328-D350 IonicContact ND1-OD2 3.15Å; H328-D350 PolarHBondContact ND1-OD2 3.43Å; L329-D350 HydrophobicContact CB-CB 4.32Å; L329-D350 PolarHBondContact N-OD2 2.78Å; R330-D350 HydrophobicContact CB-CB 4.06Å; R330-D350 HydrophobicContact CG-CB 4.05Å; S348-D350 WeakPolarHBondContact CB-OD1 3.26Å; S348-D350 PolarHBondContact O-N 2.79Å; S348-D350 PolarHBondContact OG-N 2.92Å; D350-T352 VanDerWaalsContact CG-OG1 3.23Å; D350-T352 PolarHBondContact O-N 3.41Å; D350-T352 WeakPolarHBondContact OD1-CB 3.23Å; D350-T352 PolarHBondContact OD1-N 2.95Å; D350-T352 PolarHBondContact OD1-OG1 2.75Å; D350-T352 PolarHBondContact OD2-OG1 2.99Å
351	S	92.5	Very high	88.6	Confident	20 Å²	20	16.3 Å²	16.3	14%	0.14	10%	0.096	C	C	.	.	S	Bend	trans	68.1	14	-179.2	-49.4	0	0	0	0	115.3	L32 L34 S348	L32-S351 PolarHBondContact N-O 3.39Å; L32-S351 VanDerWaalsContact O-CB 3.31Å; L32-S351 WeakPolarHBondContact O-CB 3.48Å; L32-S351 PolarHBondContact O-OG 3.2Å; L34-S351 WeakPolarHBondContact CD2-OG 3.32Å; L34-S351 VanDerWaalsContact CG-OG 3.24Å; L34-S351 WeakPolarHBondContact CG-OG 3.37Å; S348-S351 PolarHBondContact O-N 3.2Å; S348-S351 VanDerWaalsContact O-N 3.09Å
352	T	93.7	Very high	88.9	Confident	37 Å²	37	14.5 Å²	14.5	23%	0.227	9%	0.089	C	C	.	.			trans	-110.9	160.8	-176.8	70.1	0	0	0	0	113.1	L26 H328 C347 S348 D350	L26-T352 HydrophobicContact CD1-CG2 3.99Å; H328-T352 PolarHBondContact CE1-O 2.95Å; H328-T352 PolarHBondContact CE1-OG1 3.17Å; H328-T352 VanDerWaalsContact CE1-OG1 3.26Å; H328-T352 PolarHBondContact ND1-OG1 2.83Å; C347-T352 WeakPolarHBondContact CA-O 3.31Å; S348-T352 PolarHBondContact N-O 2.85Å; D350-T352 VanDerWaalsContact CG-OG1 3.23Å; D350-T352 PolarHBondContact O-N 3.41Å; D350-T352 WeakPolarHBondContact OD1-CB 3.23Å; D350-T352 PolarHBondContact OD1-N 2.95Å; D350-T352 PolarHBondContact OD1-OG1 2.75Å; D350-T352 PolarHBondContact OD2-OG1 2.99Å
353	C	94	Very high	89.2	Confident	3 Å²	3	14 Å²	14	2%	0.02	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.4	171	-165.5	0	0	0	0	109.7	L27 L29 L32 I345 T346	L27-C353 WeakPolarHBondContact CB-O 3.44Å; L27-C353 HydrophobicContact CD1-CB 4.33Å; L27-C353 PolarHBondContact N-O 3.32Å; L29-C353 HydrophobicContact CD1-CB 3.54Å; L32-C353 HydrophobicContact CD1-CB 4.24Å; I345-C353 WeakPolarHBondContact CG2-SG 3.28Å; T346-C353 CarbonylContact O-C 3.56Å; T346-C353 WeakPolarHBondContact O-CA 3.16Å; T346-C353 PolarHBondContact O-SG 3.03Å
354	H	92.1	Very high	89.2	Confident	27 Å²	27	14.9 Å²	14.9	13%	0.125	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	151.5	178.7	-74.9	-115.6	0	0	0	110.6	G24 L26 V327 H328 I345 T346	G24-H354 PolarHBondContact O-ND1 3.13Å; L26-H354 WeakPolarHBondContact CD1-NE2 3.39Å; V327-H354 HydrophobicContact CG1-CB 3.38Å; H328-H354 AromaticContact CE1-CD2 3.29Å; H328-H354 PolarHBondContact CE1-CD2 3.33Å; H328-H354 AromaticContact ND1-CD2 3.65Å; H328-H354 AromaticContact NE2-CD2 3.92Å; I345-H354 WeakPolarHBondContact CA-O 3.46Å; T346-H354 PolarHBondContact N-O 2.93Å; T346-H354 PolarHBondContact O-N 3.5Å
355	M	90.4	Very high	89	Confident	4 Å²	4	15.9 Å²	15.9	2%	0.02	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	117.6	172.1	-174	-177.4	-65.5	0	0	109.6	P25 L27 L62 P68 Q343 I344 I345	P25-M355 VanDerWaalsContact CD-O 3.29Å; P25-M355 WeakPolarHBondContact CD-O 3.43Å; P25-M355 PolarHBondContact O-N 2.75Å; L27-M355 HydrophobicContact CD1-CB 4.13Å; L27-M355 HydrophobicContact CD1-CE 4.09Å; L27-M355 HydrophobicContact CD2-CB 3.75Å; L27-M355 HydrophobicContact CD2-CE 3.81Å; L27-M355 HydrophobicContact CD2-SD 4.41Å; L27-M355 HydrophobicContact CG-CB 4Å; L62-M355 HydrophobicContact CB-CE 4.49Å; L62-M355 HydrophobicContact CD1-CE 3.83Å; L62-M355 HydrophobicContact CD2-CE 3.74Å; L62-M355 HydrophobicContact CG-CE 4.23Å; P68-M355 HydrophobicContact CB-CB 4.37Å; Q343-M355 HydrophobicContact CB-CG 4.06Å; Q343-M355 HydrophobicContact CB-SD 4.41Å; Q343-M355 VanDerWaalsContact CD-SD 3.58Å; Q343-M355 HydrophobicContact CG-CG 4.37Å; Q343-M355 HydrophobicContact CG-SD 4.43Å; Q343-M355 PolarHBondContact OE1-SD 2.68Å; I344-M355 CarbonylContact O-C 3.58Å; I344-M355 VanDerWaalsContact O-CA 3.32Å; I344-M355 WeakPolarHBondContact O-CA 3.48Å; I345-M355 HydrophobicContact CD1-CE 3.97Å; I345-M355 HydrophobicContact CG1-CE 4.04Å; I345-M355 HydrophobicContact CG1-CG 4.22Å
356	L	86.6	Confident	88.6	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.005	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	134.5	177	-50.7	132.5	0	0	0	108.6	I20 F21 G24 V311 H325 V327 Q343 I344 T346	I20-L356 HydrophobicContact CG2-CB 3.39Å; I20-L356 HydrophobicContact CG2-CD2 4.35Å; I20-L356 HydrophobicContact CG2-CG 4.31Å; F21-L356 WeakPolarHBondContact O-CD2 3.24Å; G24-L356 VanDerWaalsContact CA-CD2 3.4Å; G24-L356 VanDerWaalsContact N-CD2 3.35Å; V311-L356 HydrophobicContact CG2-CD1 4.48Å; H325-L356 HydrophobicContact CB-CD2 4.46Å; V327-L356 HydrophobicContact CG1-CD1 4.28Å; V327-L356 HydrophobicContact CG1-CD2 4.32Å; V327-L356 HydrophobicContact CG1-CG 4.46Å; V327-L356 HydrophobicContact CG2-CD1 3.78Å; V327-L356 HydrophobicContact CG2-CD2 3.95Å; V327-L356 HydrophobicContact CG2-CG 4.41Å; Q343-L356 CarbonylContact C-O 3.58Å; Q343-L356 WeakPolarHBondContact CA-O 2.97Å; Q343-L356 WeakPolarHBondContact CB-O 3.02Å; I344-L356 HydrophobicContact CB-CB 4.42Å; I344-L356 HydrophobicContact CB-CD1 4.1Å; I344-L356 HydrophobicContact CG2-CD1 4.12Å; I344-L356 PolarHBondContact N-O 2.98Å; I344-L356 PolarHBondContact O-N 3.32Å; T346-L356 HydrophobicContact CG2-CD1 4.46Å
357	G	77.4	Confident	88.1	Confident	16 Å²	16	18.6 Å²	18.6	17%	0.165	12%	0.116	C	C	.	.			trans	-154.5	163.2	178.8	0	0	0	0	0	111.1	F21	F21-G357 WeakPolarHBondContact CD2-O 3.44Å
358	S	61.1	Low	87.6	Confident	66 Å²	66	20.3 Å²	20.3	46%	0.462	13%	0.127	S	C	.	.			trans	-89.7	0	176.2	66.4	0	0	0	0	113.2	F21 L66	F21-S358 WeakPolarHBondContact CE2-OXT 3.45Å; L66-S358 WeakPolarHBondContact CD1-O 3.19Å

Retrieved 358 of 358 residues in 245.4 ms (Link to these results)

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