A0A5K4F5D6_SCHMA Loading...

WD_REPEATS_REGION domain-containing protein

AlphaFold DB (A0A5K4F7D5), UniProt , Accession A0A5K4F5D6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 343 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	51.9	Low	76.6	Confident	80 Å²	80	77.4 Å²	77.4	39%	0.394	46%	0.457	S	S	.	.				0	133.3	0	-117.1	-179	-121.5	0	0	109.2	S22 M28 W32	M1-S22 WeakPolarHBondContact CE-OG 3.34Å; M1-M28 HydrophobicContact CE-CB 4.3Å; M1-W32 HydrophobicContact CE-CZ2 4.2Å; M1-W32 HydrophobicContact SD-CZ2 3.78Å
2	S	49.8	Very low	78.3	Confident	82 Å²	82	83.8 Å²	83.8	57%	0.573	47%	0.467	S	S	*	.			trans	-71.9	136.8	172.5	55.7	0	0	0	0	110.2	G4	S2-G4 PolarHBondContact O-N 3.39Å
3	K	54.3	Low	79.6	Confident	219 Å²	219	82.2 Å²	82.2	95%	0.952	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	118.7	173.9	-70.8	-177.8	176.6	-179.5	0	108.5
4	G	65.1	Low	80.6	Confident	79 Å²	79	79.9 Å²	79.9	81%	0.814	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.9	-0.1	167.4	0	0	0	0	0	118.3	S2	S2-G4 PolarHBondContact O-N 3.39Å
5	S	75.6	Confident	81.2	Confident	24 Å²	24	81.2 Å²	81.2	17%	0.168	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-74.7	132.4	171.9	-173.1	0	0	0	0	111.2	L7 S24 N26	S5-L7 PolarHBondContact O-N 3.21Å; S5-S24 WeakPolarHBondContact CB-OG 3.5Å; S5-S24 PolarHBondContact OG-OG 3.3Å; S5-N26 WeakPolarHBondContact CB-ND2 3.5Å; S5-N26 PolarHBondContact OG-N 2.96Å; S5-N26 PolarHBondContact OG-ND2 2.83Å; S5-N26 PolarHBondContact OG-OD1 3.23Å
6	P	83.8	Confident	81.9	Confident	93 Å²	93	81.6 Å²	81.6	60%	0.604	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-56	137.4	174.1	-24.7	33.7	0	0	0	111.9	A25	P6-A25 HydrophobicContact CB-CB 4.36Å; P6-A25 WeakPolarHBondContact O-CB 3.4Å; P6-A25 PolarHBondContact O-N 2.92Å
7	L	86.7	Confident	82.7	Confident	99 Å²	99	82.2 Å²	82.2	52%	0.518	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	141	172.3	-62.9	-179.7	0	0	0	110.2	S5 V10	S5-L7 PolarHBondContact O-N 3.21Å; L7-V10 HydrophobicContact CD1-CG1 3.89Å
8	V	89.7	Confident	83.4	Confident	54 Å²	54	78.6 Å²	78.6	33%	0.327	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-45.1	178.6	180	0	0	0	0	110.2	A23 A25 S50	V8-A23 HydrophobicContact CB-CB 4.36Å; V8-A23 PolarHBondContact N-O 2.92Å; V8-A25 HydrophobicContact CG2-CB 4.45Å; V8-S50 WeakPolarHBondContact CG1-O 3.43Å
9	C	92.8	Very high	84	Confident	9 Å²	9	76.3 Å²	76.3	6%	0.061	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	146.8	-177.5	-173.1	0	0	0	0	110	S22 A23 W51 L52 R254	C9-S22 CarbonylContact O-C 3.56Å; C9-S22 WeakPolarHBondContact O-CA 3.4Å; C9-A23 HydrophobicContact CB-CB 4.44Å; C9-A23 PolarHBondContact O-N 2.94Å; C9-W51 HydrophobicContact CB-CD2 4.43Å; C9-L52 HydrophobicContact CB-CD1 4.43Å; C9-L52 HydrophobicContact CB-CG 4.08Å; C9-R254 PolarHBondContact SG-NH2 3.37Å
10	V	96.1	Very high	84.7	Confident	65 Å²	65	75.3 Å²	75.3	39%	0.394	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	150	172.3	-64.7	0	0	0	0	109.8	L7 I21 R254	L7-V10 HydrophobicContact CD1-CG1 3.89Å; V10-I21 VanDerWaalsContact CA-O 3.3Å; V10-I21 WeakPolarHBondContact CA-O 3.43Å; V10-R254 PolarHBondContact O-NH2 3Å
11	Q	97.1	Very high	85.3	Confident	47 Å²	47	71.7 Å²	71.7	22%	0.22	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	133.5	174.1	-162.7	-170	5.5	0	0	109.8	F20 I21 L52 S53	Q11-F20 WeakPolarHBondContact O-CA 3.36Å; Q11-F20 WeakPolarHBondContact O-CB 3.14Å; Q11-I21 HydrophobicContact CB-CG1 4.08Å; Q11-I21 PolarHBondContact N-O 3.45Å; Q11-I21 WeakPolarHBondContact O-CG1 3.36Å; Q11-I21 PolarHBondContact O-N 3.18Å; Q11-L52 HydrophobicContact CB-CD1 3.73Å; Q11-S53 VanDerWaalsContact OE1-CA 3.23Å
12	W	96.8	Very high	87.4	Confident	154 Å²	154	68 Å²	68	58%	0.583	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	151	165.7	-73.1	104.9	0	0	0	110.8	P14 F20 T34	W12-P14 WeakPolarHBondContact O-CD 3.35Å; W12-F20 HydrophobicContact CD2-CB 4.19Å; W12-F20 HydrophobicContact CE3-CB 3.89Å; W12-F20 HydrophobicContact CH2-CD1 4.32Å; W12-F20 HydrophobicContact CZ3-CB 4.32Å; W12-F20 HydrophobicContact CZ3-CD1 4.15Å; W12-T34 HydrophobicContact CE3-CG2 4.44Å; W12-T34 HydrophobicContact CH2-CG2 3.9Å; W12-T34 HydrophobicContact CZ3-CG2 3.4Å; W12-T34 VanDerWaalsContact CZ3-CG2 3.4Å
13	Y	95.4	Very high	89.6	Confident	64 Å²	64	64 Å²	64	25%	0.251	36%	0.359	S	S	.	.			trans	-59.7	127.6	166.2	-177.4	-137.1	0	0	0	108.9	V15 L19 M54	Y13-V15 HydrophobicContact CD1-CB 4.03Å; Y13-V15 HydrophobicContact CE1-CB 3.52Å; Y13-V15 HydrophobicContact CE1-CG1 4.38Å; Y13-V15 HydrophobicContact CE1-CG2 3.92Å; Y13-V15 HydrophobicContact CE2-CB 4.42Å; Y13-V15 HydrophobicContact CE2-CG2 4Å; Y13-V15 PolarHBondContact O-N 2.63Å; Y13-V15 WeakPolarHBondContact OH-CG2 3.49Å; Y13-L19 VanDerWaalsContact CB-O 3.29Å; Y13-L19 WeakPolarHBondContact CB-O 3.38Å; Y13-L19 HydrophobicContact CG-CB 4.43Å; Y13-L19 HydrophobicContact CG-CD2 4.35Å; Y13-L19 PolarHBondContact N-O 3.47Å; Y13-M54 HydrophobicContact CD2-CE 3.71Å; Y13-M54 HydrophobicContact CD2-SD 3.98Å; Y13-M54 HydrophobicContact CE2-CE 3.9Å
14	P	93.7	Very high	91.4	Very high	50 Å²	50	53.7 Å²	53.7	33%	0.325	31%	0.314	S	S	.	.	S	Bend	trans	-67.5	-16.5	-172.9	-27.8	37.9	0	0	0	115.6	W12 M54 P56	W12-P14 WeakPolarHBondContact O-CD 3.35Å; P14-M54 HydrophobicContact CG-CB 4.01Å; P14-P56 HydrophobicContact CB-CB 4.03Å
15	V	90	Very high	92.5	Very high	99 Å²	99	51.9 Å²	51.9	60%	0.6	29%	0.292	S	S	*	.	S	Bend	trans	-90.7	-42.2	-174.6	-177.2	0	0	0	0	111.9	Y13	Y13-V15 HydrophobicContact CD1-CB 4.03Å; Y13-V15 HydrophobicContact CE1-CB 3.52Å; Y13-V15 HydrophobicContact CE1-CG1 4.38Å; Y13-V15 HydrophobicContact CE1-CG2 3.92Å; Y13-V15 HydrophobicContact CE2-CB 4.42Å; Y13-V15 HydrophobicContact CE2-CG2 4Å; Y13-V15 PolarHBondContact O-N 2.63Å; Y13-V15 WeakPolarHBondContact OH-CG2 3.49Å
16	D	92.6	Very high	93.2	Very high	88 Å²	88	54.9 Å²	54.9	47%	0.471	31%	0.306	S	S	.	.			trans	-151.7	175.9	-179.4	67.7	51.7	0	0	0	112.5	G18	D16-G18 WeakPolarHBondContact OD1-CA 3.23Å; D16-G18 PolarHBondContact OD1-N 3.07Å
17	S	94.5	Very high	93.7	Very high	91 Å²	91	54.4 Å²	54.4	64%	0.636	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	7.2	-177.6	62.2	0	0	0	0	114.8	L19 T34	S17-L19 VanDerWaalsContact C-N 3.3Å; S17-L19 PolarHBondContact O-N 3.02Å; S17-T34 WeakPolarHBondContact O-CB 3.05Å; S17-T34 PolarHBondContact O-OG1 3.07Å
18	G	95.8	Very high	94.1	Very high	17 Å²	17	51.3 Å²	51.3	18%	0.175	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.4	-175.8	0	0	0	0	0	114.3	D16 T34	D16-G18 WeakPolarHBondContact OD1-CA 3.23Å; D16-G18 PolarHBondContact OD1-N 3.07Å; G18-T34 VanDerWaalsContact CA-OG1 3.23Å; G18-T34 WeakPolarHBondContact CA-OG1 3.29Å; G18-T34 PolarHBondContact O-N 2.9Å; G18-T34 PolarHBondContact O-OG1 2.91Å; G18-T34 VanDerWaalsContact O-OG1 3.07Å
19	L	95.3	Very high	94.4	Very high	36 Å²	36	48.8 Å²	48.8	19%	0.188	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	146.9	-174.2	-178.5	80.9	0	0	0	111.7	Y13 S17 I31 W32	Y13-L19 VanDerWaalsContact CB-O 3.29Å; Y13-L19 WeakPolarHBondContact CB-O 3.38Å; Y13-L19 HydrophobicContact CG-CB 4.43Å; Y13-L19 HydrophobicContact CG-CD2 4.35Å; Y13-L19 PolarHBondContact N-O 3.47Å; S17-L19 VanDerWaalsContact C-N 3.3Å; S17-L19 PolarHBondContact O-N 3.02Å; L19-I31 HydrophobicContact CD1-CG2 3.42Å; L19-I31 VanDerWaalsContact CD1-CG2 3.42Å; L19-I31 HydrophobicContact CD2-CG2 4.36Å; L19-I31 HydrophobicContact CG-CG2 4.39Å; L19-W32 VanDerWaalsContact CA-O 3.27Å; L19-W32 WeakPolarHBondContact CA-O 3.45Å; L19-W32 WeakPolarHBondContact CD1-O 3.41Å
20	F	97.1	Very high	94.6	Very high	56 Å²	56	48.3 Å²	48.3	25%	0.246	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	162	157.9	70.6	-89.2	0	0	0	111.8	Q11 W12 W32 T34	Q11-F20 WeakPolarHBondContact O-CA 3.36Å; Q11-F20 WeakPolarHBondContact O-CB 3.14Å; W12-F20 HydrophobicContact CD2-CB 4.19Å; W12-F20 HydrophobicContact CE3-CB 3.89Å; W12-F20 HydrophobicContact CH2-CD1 4.32Å; W12-F20 HydrophobicContact CZ3-CB 4.32Å; W12-F20 HydrophobicContact CZ3-CD1 4.15Å; F20-W32 HydrophobicContact CD1-CB 3.86Å; F20-W32 HydrophobicContact CD2-CB 4.12Å; F20-W32 AromaticContact CD2-CD1 3.78Å; F20-W32 HydrophobicContact CD2-CG 4.1Å; F20-W32 HydrophobicContact CE1-CB 3.48Å; F20-W32 VanDerWaalsContact CE1-CB 3.48Å; F20-W32 HydrophobicContact CE1-CG 4.03Å; F20-W32 HydrophobicContact CE2-CB 3.77Å; F20-W32 AromaticContact CE2-CD1 3.33Å; F20-W32 HydrophobicContact CE2-CD2 4.07Å; F20-W32 AromaticContact CE2-CG 3.46Å; F20-W32 HydrophobicContact CE2-CG 3.46Å; F20-W32 VanDerWaalsContact CE2-CG 3.46Å; F20-W32 AromaticContact CE2-NE1 3.85Å; F20-W32 HydrophobicContact CG-CB 4.15Å; F20-W32 HydrophobicContact CZ-CB 3.42Å; F20-W32 VanDerWaalsContact CZ-CB 3.42Å; F20-W32 AromaticContact CZ-CD1 3.82Å; F20-W32 AromaticContact CZ-CD2 3.84Å; F20-W32 HydrophobicContact CZ-CD2 3.84Å; F20-W32 HydrophobicContact CZ-CE3 4.35Å; F20-W32 AromaticContact CZ-CG 3.42Å; F20-W32 HydrophobicContact CZ-CG 3.42Å; F20-W32 VanDerWaalsContact CZ-CG 3.42Å; F20-W32 PolarHBondContact N-O 3.2Å; F20-W32 PolarHBondContact O-N 3.04Å; F20-T34 HydrophobicContact CD1-CG2 3.54Å; F20-T34 HydrophobicContact CE1-CG2 3.97Å
21	I	97.3	Very high	94.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	149.9	177.5	59.4	166.9	0	0	0	111.4	V10 Q11 L29 G30 I31 L52 M54 I64	V10-I21 VanDerWaalsContact CA-O 3.3Å; V10-I21 WeakPolarHBondContact CA-O 3.43Å; Q11-I21 HydrophobicContact CB-CG1 4.08Å; Q11-I21 PolarHBondContact N-O 3.45Å; Q11-I21 WeakPolarHBondContact O-CG1 3.36Å; Q11-I21 PolarHBondContact O-N 3.18Å; I21-L29 HydrophobicContact CB-CD1 4.29Å; I21-G30 VanDerWaalsContact CA-O 3.31Å; I21-G30 WeakPolarHBondContact CA-O 3.4Å; I21-I31 HydrophobicContact CG2-CG1 4.36Å; I21-L52 HydrophobicContact CB-CD2 4.4Å; I21-L52 HydrophobicContact CD1-CB 4.32Å; I21-L52 HydrophobicContact CD1-CD1 3.68Å; I21-L52 HydrophobicContact CD1-CD2 4.01Å; I21-L52 HydrophobicContact CD1-CG 4.22Å; I21-L52 HydrophobicContact CG1-CD1 3.9Å; I21-L52 HydrophobicContact CG1-CD2 4.08Å; I21-M54 HydrophobicContact CD1-CG 3.59Å; I21-M54 HydrophobicContact CD1-SD 3.92Å; I21-M54 HydrophobicContact CG1-CG 4.49Å; I21-M54 HydrophobicContact CG1-SD 4.28Å; I21-M54 HydrophobicContact CG2-SD 3.95Å; I21-I64 HydrophobicContact CD1-CG1 4.33Å; I21-I64 HydrophobicContact CD1-CG2 3.54Å; I21-I64 HydrophobicContact CG2-CD1 3.75Å; I21-I64 HydrophobicContact CG2-CG1 4.46Å
22	S	96.8	Very high	94.6	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.9	-178.9	68.1	0	0	0	0	112.3	M1 C9 L29 G30 W32 L52	M1-S22 WeakPolarHBondContact CE-OG 3.34Å; C9-S22 CarbonylContact O-C 3.56Å; C9-S22 WeakPolarHBondContact O-CA 3.4Å; S22-L29 CarbonylContact O-C 3.52Å; S22-L29 WeakPolarHBondContact O-CA 3.41Å; S22-G30 PolarHBondContact N-O 3.16Å; S22-G30 PolarHBondContact O-N 2.88Å; S22-W32 PolarHBondContact OG-NE1 3.46Å; S22-L52 VanDerWaalsContact C-CD2 3.46Å
23	A	94.9	Very high	94.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	127.2	168.3	0	0	0	0	0	109.5	V8 C9 L49 L52	V8-A23 HydrophobicContact CB-CB 4.36Å; V8-A23 PolarHBondContact N-O 2.92Å; C9-A23 HydrophobicContact CB-CB 4.44Å; C9-A23 PolarHBondContact O-N 2.94Å; A23-L49 HydrophobicContact CB-CB 3.92Å; A23-L49 HydrophobicContact CB-CD2 3.91Å; A23-L52 HydrophobicContact CB-CD2 3.73Å; A23-L52 HydrophobicContact CB-CG 4.26Å; A23-L52 VanDerWaalsContact N-CD2 3.26Å
24	S	92.3	Very high	94.6	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	149.4	178.5	166.6	0	0	0	0	111.7	S5 N26 K27 M28	S5-S24 WeakPolarHBondContact CB-OG 3.5Å; S5-S24 PolarHBondContact OG-OG 3.3Å; S24-N26 PolarHBondContact O-N 2.85Å; S24-N26 VanDerWaalsContact O-N 3.16Å; S24-N26 PolarHBondContact OG-N 2.95Å; S24-N26 VanDerWaalsContact OG-N 3.12Å; S24-K27 PolarHBondContact O-N 2.85Å; S24-K27 VanDerWaalsContact O-N 3.12Å; S24-M28 PolarHBondContact N-O 3.5Å
25	A	88.2	Confident	94.7	Very high	42 Å²	42	42.9 Å²	42.9	35%	0.347	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.3	171.4	0	0	0	0	0	113.1	P6 V8 K27	P6-A25 HydrophobicContact CB-CB 4.36Å; P6-A25 WeakPolarHBondContact O-CB 3.4Å; P6-A25 PolarHBondContact O-N 2.92Å; V8-A25 HydrophobicContact CG2-CB 4.45Å; A25-K27 PolarHBondContact O-N 3.4Å; A25-K27 VanDerWaalsContact O-N 3.16Å
26	N	90.5	Very high	95	Very high	87 Å²	87	46.5 Å²	46.5	47%	0.465	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	22.1	174.7	-70.7	4	0	0	0	113.6	S5 S24 M28	S5-N26 WeakPolarHBondContact CB-ND2 3.5Å; S5-N26 PolarHBondContact OG-N 2.96Å; S5-N26 PolarHBondContact OG-ND2 2.83Å; S5-N26 PolarHBondContact OG-OD1 3.23Å; S24-N26 PolarHBondContact O-N 2.85Å; S24-N26 VanDerWaalsContact O-N 3.16Å; S24-N26 PolarHBondContact OG-N 2.95Å; S24-N26 VanDerWaalsContact OG-N 3.12Å; N26-M28 VanDerWaalsContact C-N 3.29Å; N26-M28 PolarHBondContact O-N 3.28Å
27	K	93.2	Very high	95.1	Very high	83 Å²	83	49.5 Å²	49.5	36%	0.361	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	30.2	176.1	-40.7	-178	177	179.2	0	114.1	S24 A25 F45 A46	S24-K27 PolarHBondContact O-N 2.85Å; S24-K27 VanDerWaalsContact O-N 3.12Å; A25-K27 PolarHBondContact O-N 3.4Å; A25-K27 VanDerWaalsContact O-N 3.16Å; K27-F45 VanDerWaalsContact CB-O 3.28Å; K27-F45 WeakPolarHBondContact CB-O 3.42Å; K27-F45 WeakPolarHBondContact CD-O 3.36Å; K27-F45 PolarHBondContact O-N 3.14Å; K27-A46 WeakPolarHBondContact CD-O 3.27Å; K27-A46 PolarHBondContact NZ-O 3.06Å
28	M	95.3	Very high	95.2	Very high	34 Å²	34	51 Å²	51	17%	0.167	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.4	-178.9	-60.8	-62.4	-60.4	0	0	111.1	M1 S24 N26 S42 V43 S44	M1-M28 HydrophobicContact CE-CB 4.3Å; S24-M28 PolarHBondContact N-O 3.5Å; N26-M28 VanDerWaalsContact C-N 3.29Å; N26-M28 PolarHBondContact O-N 3.28Å; M28-S42 WeakPolarHBondContact CE-OG 3.31Å; M28-V43 WeakPolarHBondContact CA-O 3.37Å; M28-S44 VanDerWaalsContact SD-CA 3.56Å; M28-S44 WeakPolarHBondContact SD-CB 3.33Å
29	L	96.9	Very high	95.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.7	158.9	173.7	64.3	0	0	0	108.2	I21 S22 S42 V43 F45 L49 L52 I64 V66 V82	I21-L29 HydrophobicContact CB-CD1 4.29Å; S22-L29 CarbonylContact O-C 3.52Å; S22-L29 WeakPolarHBondContact O-CA 3.41Å; L29-S42 CarbonylContact O-C 3.59Å; L29-S42 WeakPolarHBondContact O-CA 3.28Å; L29-S42 WeakPolarHBondContact O-CB 3.3Å; L29-V43 HydrophobicContact CB-CB 4.31Å; L29-V43 PolarHBondContact N-O 3.42Å; L29-V43 PolarHBondContact O-N 3.16Å; L29-F45 HydrophobicContact CB-CE2 3.79Å; L29-L49 HydrophobicContact CB-CD2 4.04Å; L29-L52 HydrophobicContact CD1-CD2 4Å; L29-I64 HydrophobicContact CD1-CG2 4.42Å; L29-I64 HydrophobicContact CD2-CD1 4.01Å; L29-I64 HydrophobicContact CD2-CG2 4.26Å; L29-V66 HydrophobicContact CD2-CG2 4.23Å; L29-V82 HydrophobicContact CD2-CB 4.05Å; L29-V82 HydrophobicContact CD2-CG1 3.88Å; L29-V82 HydrophobicContact CD2-CG2 3.96Å
30	G	96.1	Very high	95.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.4	171.2	0	0	0	0	0	111.1	I21 S22	I21-G30 VanDerWaalsContact CA-O 3.31Å; I21-G30 WeakPolarHBondContact CA-O 3.4Å; S22-G30 PolarHBondContact N-O 3.16Å; S22-G30 PolarHBondContact O-N 2.88Å
31	I	96.5	Very high	94.9	Very high	7 Å²	7	54.1 Å²	54.1	4%	0.036	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	117.5	175.2	-60.3	161.5	0	0	0	106.3	L19 I21 C39 V40 T41 I64 P84	L19-I31 HydrophobicContact CD1-CG2 3.42Å; L19-I31 VanDerWaalsContact CD1-CG2 3.42Å; L19-I31 HydrophobicContact CD2-CG2 4.36Å; L19-I31 HydrophobicContact CG-CG2 4.39Å; I21-I31 HydrophobicContact CG2-CG1 4.36Å; I31-C39 CarbonylContact O-C 3.46Å; I31-C39 WeakPolarHBondContact O-CA 3.46Å; I31-V40 PolarHBondContact O-N 2.86Å; I31-T41 HydrophobicContact CD1-CG2 4.23Å; I31-T41 PolarHBondContact N-O 2.8Å; I31-T41 PolarHBondContact O-N 2.92Å; I31-I64 HydrophobicContact CD1-CD1 4.23Å; I31-I64 HydrophobicContact CG1-CD1 4.1Å; I31-P84 HydrophobicContact CD1-CB 3.7Å; I31-P84 HydrophobicContact CG1-CB 4.5Å
32	W	96.8	Very high	94.8	Very high	60 Å²	60	56.6 Å²	56.6	23%	0.227	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.8	-166.8	-59.4	85.2	0	0	0	111.8	M1 L19 F20 S22 E38 C39	M1-W32 HydrophobicContact CE-CZ2 4.2Å; M1-W32 HydrophobicContact SD-CZ2 3.78Å; L19-W32 VanDerWaalsContact CA-O 3.27Å; L19-W32 WeakPolarHBondContact CA-O 3.45Å; L19-W32 WeakPolarHBondContact CD1-O 3.41Å; F20-W32 HydrophobicContact CD1-CB 3.86Å; F20-W32 HydrophobicContact CD2-CB 4.12Å; F20-W32 AromaticContact CD2-CD1 3.78Å; F20-W32 HydrophobicContact CD2-CG 4.1Å; F20-W32 HydrophobicContact CE1-CB 3.48Å; F20-W32 VanDerWaalsContact CE1-CB 3.48Å; F20-W32 HydrophobicContact CE1-CG 4.03Å; F20-W32 HydrophobicContact CE2-CB 3.77Å; F20-W32 AromaticContact CE2-CD1 3.33Å; F20-W32 HydrophobicContact CE2-CD2 4.07Å; F20-W32 AromaticContact CE2-CG 3.46Å; F20-W32 HydrophobicContact CE2-CG 3.46Å; F20-W32 VanDerWaalsContact CE2-CG 3.46Å; F20-W32 AromaticContact CE2-NE1 3.85Å; F20-W32 HydrophobicContact CG-CB 4.15Å; F20-W32 HydrophobicContact CZ-CB 3.42Å; F20-W32 VanDerWaalsContact CZ-CB 3.42Å; F20-W32 AromaticContact CZ-CD1 3.82Å; F20-W32 AromaticContact CZ-CD2 3.84Å; F20-W32 HydrophobicContact CZ-CD2 3.84Å; F20-W32 HydrophobicContact CZ-CE3 4.35Å; F20-W32 AromaticContact CZ-CG 3.42Å; F20-W32 HydrophobicContact CZ-CG 3.42Å; F20-W32 VanDerWaalsContact CZ-CG 3.42Å; F20-W32 PolarHBondContact N-O 3.2Å; F20-W32 PolarHBondContact O-N 3.04Å; S22-W32 PolarHBondContact OG-NE1 3.46Å; W32-E38 WeakPolarHBondContact CA-O 3.4Å; W32-C39 HydrophobicContact CD2-CB 3.88Å; W32-C39 HydrophobicContact CE3-CB 3.64Å; W32-C39 HydrophobicContact CH2-CB 3.84Å; W32-C39 HydrophobicContact CZ2-CB 4.06Å; W32-C39 HydrophobicContact CZ3-CB 3.62Å
33	D	96.4	Very high	94.8	Very high	35 Å²	35	57 Å²	57	19%	0.187	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	122.3	169.9	179.4	-31.5	0	0	0	108.6	N35 R36 L37 E38 V40	D33-N35 WeakPolarHBondContact OD1-CA 3.34Å; D33-N35 WeakPolarHBondContact OD1-CB 3.38Å; D33-N35 PolarHBondContact OD1-N 3.12Å; D33-R36 HydrophobicContact CB-CB 4.2Å; D33-R36 PolarHBondContact OD1-N 3.31Å; D33-R36 WeakPolarHBondContact OD2-CD 3.46Å; D33-R36 IonicContact OD2-NE 3.61Å; D33-L37 WeakPolarHBondContact O-CA 3.41Å; D33-L37 PolarHBondContact O-N 3.45Å; D33-E38 PolarHBondContact N-O 3.21Å; D33-E38 PolarHBondContact O-N 2.77Å; D33-V40 HydrophobicContact CB-CG2 3.5Å; D33-V40 VanDerWaalsContact CB-CG2 3.5Å
34	T	96.1	Very high	94.8	Very high	26 Å²	26	61.1 Å²	61.1	16%	0.16	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-24.1	-175.4	59.3	0	0	0	0	113.3	W12 S17 G18 F20 R36 L37	W12-T34 HydrophobicContact CE3-CG2 4.44Å; W12-T34 HydrophobicContact CH2-CG2 3.9Å; W12-T34 HydrophobicContact CZ3-CG2 3.4Å; W12-T34 VanDerWaalsContact CZ3-CG2 3.4Å; S17-T34 WeakPolarHBondContact O-CB 3.05Å; S17-T34 PolarHBondContact O-OG1 3.07Å; G18-T34 VanDerWaalsContact CA-OG1 3.23Å; G18-T34 WeakPolarHBondContact CA-OG1 3.29Å; G18-T34 PolarHBondContact O-N 2.9Å; G18-T34 PolarHBondContact O-OG1 2.91Å; G18-T34 VanDerWaalsContact O-OG1 3.07Å; F20-T34 HydrophobicContact CD1-CG2 3.54Å; F20-T34 HydrophobicContact CE1-CG2 3.97Å; T34-R36 VanDerWaalsContact C-N 3.35Å; T34-L37 WeakPolarHBondContact O-CD2 3.27Å
35	N	96	Very high	94.8	Very high	138 Å²	138	62 Å²	62	74%	0.738	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-31.7	175	-64.2	-48.9	0	0	0	110.8	D33	D33-N35 WeakPolarHBondContact OD1-CA 3.34Å; D33-N35 WeakPolarHBondContact OD1-CB 3.38Å; D33-N35 PolarHBondContact OD1-N 3.12Å
36	R	96.4	Very high	94.9	Very high	174 Å²	174	64.3 Å²	64.3	66%	0.657	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-16.2	177.2	-62.5	-178.7	-177.9	-85.1	-3.5	113.8	D33 T34 E38	D33-R36 HydrophobicContact CB-CB 4.2Å; D33-R36 PolarHBondContact OD1-N 3.31Å; D33-R36 WeakPolarHBondContact OD2-CD 3.46Å; D33-R36 IonicContact OD2-NE 3.61Å; T34-R36 VanDerWaalsContact C-N 3.35Å; R36-E38 HydrophobicContact CB-CB 4.22Å; R36-E38 HydrophobicContact CB-CG 4.47Å; R36-E38 WeakPolarHBondContact O-CG 3.39Å; R36-E38 PolarHBondContact O-N 2.95Å
37	L	94.7	Very high	94.9	Very high	152 Å²	152	61.3 Å²	61.3	80%	0.796	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	36.5	-173	-57.1	175	0	0	0	112.7	D33 T34	D33-L37 WeakPolarHBondContact O-CA 3.41Å; D33-L37 PolarHBondContact O-N 3.45Å; T34-L37 WeakPolarHBondContact O-CD2 3.27Å
38	E	95.5	Very high	94.8	Very high	122 Å²	122	60 Å²	60	57%	0.57	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	146.4	-172.3	-76.7	177.1	177.8	0	0	112	W32 D33 R36 V40	W32-E38 WeakPolarHBondContact CA-O 3.4Å; D33-E38 PolarHBondContact N-O 3.21Å; D33-E38 PolarHBondContact O-N 2.77Å; R36-E38 HydrophobicContact CB-CB 4.22Å; R36-E38 HydrophobicContact CB-CG 4.47Å; R36-E38 WeakPolarHBondContact O-CG 3.39Å; R36-E38 PolarHBondContact O-N 2.95Å; E38-V40 PolarHBondContact O-N 2.87Å
39	C	94.6	Very high	94.7	Very high	40 Å²	40	58.6 Å²	58.6	27%	0.27	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	96.9	169.3	-173.6	0	0	0	0	108.1	I31 W32 T41	I31-C39 CarbonylContact O-C 3.46Å; I31-C39 WeakPolarHBondContact O-CA 3.46Å; W32-C39 HydrophobicContact CD2-CB 3.88Å; W32-C39 HydrophobicContact CE3-CB 3.64Å; W32-C39 HydrophobicContact CH2-CB 3.84Å; W32-C39 HydrophobicContact CZ2-CB 4.06Å; W32-C39 HydrophobicContact CZ3-CB 3.62Å; C39-T41 VanDerWaalsContact C-N 3.33Å; C39-T41 PolarHBondContact O-N 2.88Å; C39-T41 PolarHBondContact SG-O 2.97Å
40	V	94.6	Very high	94.5	Very high	91 Å²	91	59.4 Å²	59.4	55%	0.552	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.4	-48.3	-178.9	179.6	0	0	0	0	110.9	I31 D33 E38	I31-V40 PolarHBondContact O-N 2.86Å; D33-V40 HydrophobicContact CB-CG2 3.5Å; D33-V40 VanDerWaalsContact CB-CG2 3.5Å; E38-V40 PolarHBondContact O-N 2.87Å
41	T	94.2	Very high	94.5	Very high	43 Å²	43	60.7 Å²	60.7	26%	0.264	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.7	-177.6	-69.5	0	0	0	0	109.8	I31 C39 V43	I31-T41 HydrophobicContact CD1-CG2 4.23Å; I31-T41 PolarHBondContact N-O 2.8Å; I31-T41 PolarHBondContact O-N 2.92Å; C39-T41 VanDerWaalsContact C-N 3.33Å; C39-T41 PolarHBondContact O-N 2.88Å; C39-T41 PolarHBondContact SG-O 2.97Å; T41-V43 HydrophobicContact CG2-CG2 4.38Å
42	S	94.6	Very high	94.6	Very high	52 Å²	52	60.5 Å²	60.5	36%	0.364	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134.5	168.6	67.6	0	0	0	0	111.3	M28 L29	M28-S42 WeakPolarHBondContact CE-OG 3.31Å; L29-S42 CarbonylContact O-C 3.59Å; L29-S42 WeakPolarHBondContact O-CA 3.28Å; L29-S42 WeakPolarHBondContact O-CB 3.3Å
43	V	96.4	Very high	94.6	Very high	10 Å²	10	58 Å²	58	6%	0.061	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	127.4	179.3	-169.9	0	0	0	0	108.8	M28 L29 T41 F45 V82 G87	M28-V43 WeakPolarHBondContact CA-O 3.37Å; L29-V43 HydrophobicContact CB-CB 4.31Å; L29-V43 PolarHBondContact N-O 3.42Å; L29-V43 PolarHBondContact O-N 3.16Å; T41-V43 HydrophobicContact CG2-CG2 4.38Å; V43-F45 HydrophobicContact CB-CE2 3.89Å; V43-F45 HydrophobicContact CB-CZ 4.15Å; V43-F45 HydrophobicContact CG1-CE1 4.43Å; V43-F45 HydrophobicContact CG1-CE2 3.8Å; V43-F45 HydrophobicContact CG1-CZ 3.69Å; V43-F45 WeakPolarHBondContact O-CD2 3.48Å; V43-F45 WeakPolarHBondContact O-CE2 3.44Å; V43-V82 HydrophobicContact CG2-CG1 3.91Å; V43-G87 WeakPolarHBondContact CG2-O 3.36Å
44	S	94.9	Very high	94.7	Very high	87 Å²	87	56.5 Å²	56.5	61%	0.608	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	143.1	179.8	-174.6	0	0	0	0	111.4	M28	M28-S44 VanDerWaalsContact SD-CA 3.56Å; M28-S44 WeakPolarHBondContact SD-CB 3.33Å
45	F	93.3	Very high	94.7	Very high	19 Å²	19	55.8 Å²	55.8	8%	0.083	32%	0.315	C	S	.	.			trans	-126	148.1	-179.3	-62.2	-94	0	0	0	111.1	K27 L29 V43 Q47 L49 L68 V80 V82	K27-F45 VanDerWaalsContact CB-O 3.28Å; K27-F45 WeakPolarHBondContact CB-O 3.42Å; K27-F45 WeakPolarHBondContact CD-O 3.36Å; K27-F45 PolarHBondContact O-N 3.14Å; L29-F45 HydrophobicContact CB-CE2 3.79Å; V43-F45 HydrophobicContact CB-CE2 3.89Å; V43-F45 HydrophobicContact CB-CZ 4.15Å; V43-F45 HydrophobicContact CG1-CE1 4.43Å; V43-F45 HydrophobicContact CG1-CE2 3.8Å; V43-F45 HydrophobicContact CG1-CZ 3.69Å; V43-F45 WeakPolarHBondContact O-CD2 3.48Å; V43-F45 WeakPolarHBondContact O-CE2 3.44Å; F45-Q47 WeakPolarHBondContact CB-O 3.39Å; F45-Q47 PolarHBondContact O-N 2.85Å; F45-L49 HydrophobicContact CB-CD1 3.97Å; F45-L49 HydrophobicContact CD2-CD1 3.56Å; F45-L49 HydrophobicContact CD2-CD2 4.28Å; F45-L49 HydrophobicContact CD2-CG 4.31Å; F45-L49 HydrophobicContact CE2-CD1 4.29Å; F45-L49 HydrophobicContact CE2-CD2 4.21Å; F45-L49 HydrophobicContact CG-CD1 3.91Å; F45-L68 HydrophobicContact CD1-CD2 4.13Å; F45-L68 HydrophobicContact CG-CD2 4.4Å; F45-V80 HydrophobicContact CD1-CG2 4.3Å; F45-V80 HydrophobicContact CE1-CG2 3.62Å; F45-V80 HydrophobicContact CZ-CG2 4.36Å; F45-V82 HydrophobicContact CE1-CG2 4.25Å; F45-V82 HydrophobicContact CZ-CG2 3.68Å
46	A	90.2	Very high	94.7	Very high	91 Å²	91	52.4 Å²	52.4	75%	0.752	30%	0.301	S	S	*	.	S	Bend	trans	-66.6	-29.3	173.5	0	0	0	0	0	112.4	K27	K27-A46 WeakPolarHBondContact CD-O 3.27Å; K27-A46 PolarHBondContact NZ-O 3.06Å
47	Q	89.9	Confident	94.7	Very high	23 Å²	23	47 Å²	47	11%	0.107	29%	0.287	C	S	.	.	S	Bend	trans	-110.2	153.4	-177.8	-64.2	174.5	77.3	0	0	110.9	F45 L68 G69	F45-Q47 WeakPolarHBondContact CB-O 3.39Å; F45-Q47 PolarHBondContact O-N 2.85Å; Q47-L68 HydrophobicContact CB-CB 4.22Å; Q47-G69 PolarHBondContact OE1-O 3.12Å
48	S	90.6	Very high	94.7	Very high	55 Å²	55	40.6 Å²	40.6	39%	0.385	26%	0.256	S	S	.	.			trans	-68	138.4	174.9	-57.3	0	0	0	0	111.1	G69	S48-G69 PolarHBondContact O-N 3Å
49	L	94.2	Very high	94.6	Very high	5 Å²	5	41 Å²	41	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.6	174.4	-71.2	67.5	0	0	0	108.2	A23 L29 F45 V66 L68	A23-L49 HydrophobicContact CB-CB 3.92Å; A23-L49 HydrophobicContact CB-CD2 3.91Å; L29-L49 HydrophobicContact CB-CD2 4.04Å; F45-L49 HydrophobicContact CB-CD1 3.97Å; F45-L49 HydrophobicContact CD2-CD1 3.56Å; F45-L49 HydrophobicContact CD2-CD2 4.28Å; F45-L49 HydrophobicContact CD2-CG 4.31Å; F45-L49 HydrophobicContact CE2-CD1 4.29Å; F45-L49 HydrophobicContact CE2-CD2 4.21Å; F45-L49 HydrophobicContact CG-CD1 3.91Å; L49-V66 HydrophobicContact CB-CG1 4.23Å; L49-V66 HydrophobicContact CD2-CG1 3.57Å; L49-V66 HydrophobicContact CG-CG1 3.53Å; L49-L68 HydrophobicContact CD1-CD2 4.48Å; L49-L68 HydrophobicContact CG-CD2 4.33Å
50	S	92.8	Very high	94.6	Very high	17 Å²	17	42.8 Å²	42.8	12%	0.119	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-35.7	175.7	56.3	0	0	0	0	112.5	V8 S67 L102	V8-S50 WeakPolarHBondContact CG1-O 3.43Å; S50-S67 PolarHBondContact N-O 2.97Å; S50-S67 WeakPolarHBondContact OG-CB 3.14Å; S50-S67 PolarHBondContact OG-O 2.87Å; S50-S67 VanDerWaalsContact OG-O 3.13Å; S50-S67 PolarHBondContact OG-OG 2.89Å; S50-L102 WeakPolarHBondContact CB-O 3.17Å; S50-L102 PolarHBondContact OG-O 2.93Å
51	W	96.2	Very high	94.6	Very high	28 Å²	28	40 Å²	40	11%	0.106	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	167.6	-179.1	-144.9	-99.5	0	0	0	110.6	C9 S67 Q104 I105 P252 R254	C9-W51 HydrophobicContact CB-CD2 4.43Å; W51-S67 WeakPolarHBondContact CA-OG 3.4Å; W51-S67 WeakPolarHBondContact CB-OG 3.45Å; W51-S67 PolarHBondContact N-OG 3.24Å; W51-S67 PolarHBondContact O-N 2.84Å; W51-S67 VanDerWaalsContact O-N 3.09Å; W51-S67 PolarHBondContact O-OG 3.23Å; W51-Q104 VanDerWaalsContact CE2-OE1 3.26Å; W51-I105 HydrophobicContact CB-CG2 4.18Å; W51-P252 HydrophobicContact CE3-CB 4.15Å; W51-P252 HydrophobicContact CZ3-CB 3.91Å; W51-R254 HydrophobicContact CH2-CB 3.92Å; W51-R254 HydrophobicContact CZ2-CB 3.95Å; W51-R254 HydrophobicContact CZ2-CG 4.45Å
52	L	97.6	Very high	94.6	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	156.7	175.7	55.6	67.9	0	0	0	110.9	C9 Q11 I21 S22 A23 L29 A65	C9-L52 HydrophobicContact CB-CD1 4.43Å; C9-L52 HydrophobicContact CB-CG 4.08Å; Q11-L52 HydrophobicContact CB-CD1 3.73Å; I21-L52 HydrophobicContact CB-CD2 4.4Å; I21-L52 HydrophobicContact CD1-CB 4.32Å; I21-L52 HydrophobicContact CD1-CD1 3.68Å; I21-L52 HydrophobicContact CD1-CD2 4.01Å; I21-L52 HydrophobicContact CD1-CG 4.22Å; I21-L52 HydrophobicContact CG1-CD1 3.9Å; I21-L52 HydrophobicContact CG1-CD2 4.08Å; S22-L52 VanDerWaalsContact C-CD2 3.46Å; A23-L52 HydrophobicContact CB-CD2 3.73Å; A23-L52 HydrophobicContact CB-CG 4.26Å; A23-L52 VanDerWaalsContact N-CD2 3.26Å; L29-L52 HydrophobicContact CD1-CD2 4Å; L52-A65 CarbonylContact C-O 3.57Å; L52-A65 VanDerWaalsContact CA-O 3.29Å; L52-A65 WeakPolarHBondContact CA-O 3.37Å
53	S	97.9	Very high	94.7	Very high	7 Å²	7	38.9 Å²	38.9	5%	0.049	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	138.8	175.7	-166.7	0	0	0	0	111.8	Q11 A65 W107	Q11-S53 VanDerWaalsContact OE1-CA 3.23Å; S53-A65 PolarHBondContact N-O 2.82Å; S53-A65 PolarHBondContact O-N 3.45Å; S53-W107 VanDerWaalsContact C-CD1 3.48Å; S53-W107 VanDerWaalsContact O-CD1 3.29Å; S53-W107 PolarHBondContact O-NE1 2.73Å; S53-W107 PolarHBondContact OG-N 2.78Å
54	M	97.6	Very high	94.8	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.02	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	144.9	163.2	-70.2	-176.8	90.2	0	0	110.2	Y13 P14 I21 I64	Y13-M54 HydrophobicContact CD2-CE 3.71Å; Y13-M54 HydrophobicContact CD2-SD 3.98Å; Y13-M54 HydrophobicContact CE2-CE 3.9Å; P14-M54 HydrophobicContact CG-CB 4.01Å; I21-M54 HydrophobicContact CD1-CG 3.59Å; I21-M54 HydrophobicContact CD1-SD 3.92Å; I21-M54 HydrophobicContact CG1-CG 4.49Å; I21-M54 HydrophobicContact CG1-SD 4.28Å; I21-M54 HydrophobicContact CG2-SD 3.95Å; M54-I64 HydrophobicContact CE-CG1 3.95Å; M54-I64 HydrophobicContact CG-CB 4.43Å; M54-I64 HydrophobicContact CG-CG1 3.84Å; M54-I64 HydrophobicContact CG-CG2 4.44Å; M54-I64 HydrophobicContact SD-CG1 4.03Å
55	S	97.1	Very high	94.9	Very high	12 Å²	12	34.2 Å²	34.2	8%	0.084	22%	0.221	C	C	.	.			trans	-70.6	131.7	-179	-175.7	0	0	0	0	110.9	V57 A58 W107	S55-V57 VanDerWaalsContact C-N 3.28Å; S55-V57 PolarHBondContact OG-N 3.04Å; S55-A58 WeakPolarHBondContact OG-CB 3.49Å; S55-A58 PolarHBondContact OG-N 2.75Å; S55-A58 VanDerWaalsContact OG-N 3.16Å; S55-W107 VanDerWaalsContact CA-CG 3.5Å
56	P	95.1	Very high	95.1	Very high	67 Å²	67	33.3 Å²	33.3	44%	0.435	22%	0.217	S	C	.	.	S	Bend	trans	-78.7	-9.8	173.5	32.5	-34.4	0	0	0	113.7	P14 P109	P14-P56 HydrophobicContact CB-CB 4.03Å; P56-P109 HydrophobicContact CG-CB 3.97Å
57	V	95.9	Very high	95.4	Very high	60 Å²	60	29 Å²	29	36%	0.364	18%	0.181	S	C	.	.	S	Bend	trans	-129.4	-2	-171.8	-64.4	0	0	0	0	114.7	S55 C59 P109	S55-V57 VanDerWaalsContact C-N 3.28Å; S55-V57 PolarHBondContact OG-N 3.04Å; V57-C59 PolarHBondContact O-N 3.48Å; V57-P109 WeakPolarHBondContact CG1-O 3.29Å
58	A	95.3	Very high	95.6	Very high	17 Å²	17	28.3 Å²	28.3	14%	0.14	18%	0.178	C	C	.	.			trans	-75.7	120.5	177.7	0	0	0	0	0	111	S55 H61 A112	S55-A58 WeakPolarHBondContact OG-CB 3.49Å; S55-A58 PolarHBondContact OG-N 2.75Å; S55-A58 VanDerWaalsContact OG-N 3.16Å; A58-H61 VanDerWaalsContact CB-CE1 3.43Å; A58-H61 WeakPolarHBondContact CB-CE1 3.41Å; A58-H61 WeakPolarHBondContact CB-O 3.36Å; A58-A112 HydrophobicContact CB-CB 4.16Å
59	C	93.2	Very high	95.5	Very high	132 Å²	132	25.9 Å²	25.9	89%	0.892	16%	0.162	S	C	*	.	S	Bend	trans	-108.8	-15	175.5	-56.6	0	0	0	0	113.1	V57	V57-C59 PolarHBondContact O-N 3.48Å
60	S	94.1	Very high	95.2	Very high	77 Å²	77	29 Å²	29	54%	0.538	18%	0.182	S	C	.	.	S	Bend	trans	-98.1	-10.2	-178.8	54.9	0	0	0	0	113.7	Y113	S60-Y113 WeakPolarHBondContact CB-OH 3.43Å; S60-Y113 PolarHBondContact OG-OH 3.34Å
61	H	95.1	Very high	94.5	Very high	31 Å²	31	29.5 Å²	29.5	14%	0.144	19%	0.186	C	C	.	.			trans	-151.7	161	174.4	70.1	75.8	0	0	0	110.5	A58 L63 W107 A112 Y113	A58-H61 VanDerWaalsContact CB-CE1 3.43Å; A58-H61 WeakPolarHBondContact CB-CE1 3.41Å; A58-H61 WeakPolarHBondContact CB-O 3.36Å; H61-L63 HydrophobicContact CB-CD1 4.38Å; H61-L63 HydrophobicContact CB-CG 4.18Å; H61-L63 PolarHBondContact ND1-N 2.82Å; H61-W107 AromaticContact CE1-CH2 3.33Å; H61-W107 WeakPolarHBondContact CE1-CH2 3.39Å; H61-W107 AromaticContact CE1-CZ2 4Å; H61-W107 AromaticContact CE1-CZ3 3.58Å; H61-W107 AromaticContact NE2-CH2 3.97Å; H61-W107 AromaticContact NE2-CZ3 3.91Å; H61-A112 PolarHBondContact NE2-O 3Å; H61-Y113 AromaticContact CD2-CD1 3.99Å; H61-Y113 AromaticContact CD2-CE1 3.77Å
62	N	93.6	Very high	93.6	Very high	48 Å²	48	33.6 Å²	33.6	26%	0.257	22%	0.219	S	C	.	.			trans	-122.9	22.6	179	60	-21.4	0	0	0	112.4	P84 L85	N62-P84 HydrophobicContact CB-CG 4.37Å; N62-P84 WeakPolarHBondContact ND2-CG 3.49Å; N62-P84 WeakPolarHBondContact O-CD 3.47Å; N62-P84 WeakPolarHBondContact O-CG 3.46Å; N62-L85 WeakPolarHBondContact ND2-CG 3.47Å
63	L	97.7	Very high	92.3	Very high	24 Å²	24	36 Å²	36	13%	0.126	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-56.2	138.1	-178.4	-62.3	171.7	0	0	0	113	H61 L81 V82 D83 A90 W107 I129	H61-L63 HydrophobicContact CB-CD1 4.38Å; H61-L63 HydrophobicContact CB-CG 4.18Å; H61-L63 PolarHBondContact ND1-N 2.82Å; L63-L81 HydrophobicContact CB-CB 4.48Å; L63-L81 HydrophobicContact CD1-CB 4.33Å; L63-L81 HydrophobicContact CD1-CD1 4.16Å; L63-V82 WeakPolarHBondContact CA-O 3.4Å; L63-D83 HydrophobicContact CD2-CB 4.15Å; L63-A90 HydrophobicContact CD2-CB 4.02Å; L63-W107 HydrophobicContact CB-CZ2 4.23Å; L63-I129 HydrophobicContact CD1-CD1 3.96Å
64	I	98.2	Very high	90.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.6	171.8	-56.7	164.2	0	0	0	108	I21 L29 I31 M54 V66 L81 V82 P84	I21-I64 HydrophobicContact CD1-CG1 4.33Å; I21-I64 HydrophobicContact CD1-CG2 3.54Å; I21-I64 HydrophobicContact CG2-CD1 3.75Å; I21-I64 HydrophobicContact CG2-CG1 4.46Å; L29-I64 HydrophobicContact CD1-CG2 4.42Å; L29-I64 HydrophobicContact CD2-CD1 4.01Å; L29-I64 HydrophobicContact CD2-CG2 4.26Å; I31-I64 HydrophobicContact CD1-CD1 4.23Å; I31-I64 HydrophobicContact CG1-CD1 4.1Å; M54-I64 HydrophobicContact CE-CG1 3.95Å; M54-I64 HydrophobicContact CG-CB 4.43Å; M54-I64 HydrophobicContact CG-CG1 3.84Å; M54-I64 HydrophobicContact CG-CG2 4.44Å; M54-I64 HydrophobicContact SD-CG1 4.03Å; I64-V66 HydrophobicContact CG2-CG2 3.95Å; I64-L81 WeakPolarHBondContact O-CA 3.5Å; I64-V82 HydrophobicContact CB-CB 4.32Å; I64-V82 PolarHBondContact N-O 2.83Å; I64-V82 PolarHBondContact O-N 2.91Å; I64-P84 HydrophobicContact CD1-CB 3.88Å; I64-P84 HydrophobicContact CD1-CG 4.4Å
65	A	98.3	Very high	89.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.2	172.8	0	0	0	0	0	109.6	L52 S53 L81 I105 W107 V115	L52-A65 CarbonylContact C-O 3.57Å; L52-A65 VanDerWaalsContact CA-O 3.29Å; L52-A65 WeakPolarHBondContact CA-O 3.37Å; S53-A65 PolarHBondContact N-O 2.82Å; S53-A65 PolarHBondContact O-N 3.45Å; A65-L81 HydrophobicContact CB-CD2 3.84Å; A65-I105 HydrophobicContact CB-CD1 3.68Å; A65-I105 HydrophobicContact CB-CG1 4.02Å; A65-W107 HydrophobicContact CB-CZ2 4Å; A65-V115 HydrophobicContact CB-CG1 4.34Å; A65-V115 HydrophobicContact CB-CG2 4.18Å
66	V	97.5	Very high	88.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	126.8	-177.7	178	0	0	0	0	109.1	L29 L49 I64 L68 A79 V80 V82	L29-V66 HydrophobicContact CD2-CG2 4.23Å; L49-V66 HydrophobicContact CB-CG1 4.23Å; L49-V66 HydrophobicContact CD2-CG1 3.57Å; L49-V66 HydrophobicContact CG-CG1 3.53Å; I64-V66 HydrophobicContact CG2-CG2 3.95Å; V66-L68 HydrophobicContact CG1-CD2 4.06Å; V66-A79 CarbonylContact O-C 3.51Å; V66-A79 VanDerWaalsContact O-CA 3.3Å; V66-A79 WeakPolarHBondContact O-CA 3.28Å; V66-V80 HydrophobicContact CB-CG2 3.75Å; V66-V80 HydrophobicContact CG1-CG2 4.22Å; V66-V80 PolarHBondContact N-O 3.18Å; V66-V80 PolarHBondContact O-N 3.33Å; V66-V82 HydrophobicContact CG2-CG2 4.15Å
67	S	95.8	Very high	87.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	133.9	170.9	55.6	0	0	0	0	110.5	S50 W51	S50-S67 PolarHBondContact N-O 2.97Å; S50-S67 WeakPolarHBondContact OG-CB 3.14Å; S50-S67 PolarHBondContact OG-O 2.87Å; S50-S67 VanDerWaalsContact OG-O 3.13Å; S50-S67 PolarHBondContact OG-OG 2.89Å; W51-S67 WeakPolarHBondContact CA-OG 3.4Å; W51-S67 WeakPolarHBondContact CB-OG 3.45Å; W51-S67 PolarHBondContact N-OG 3.24Å; W51-S67 PolarHBondContact O-N 2.84Å; W51-S67 VanDerWaalsContact O-N 3.09Å; W51-S67 PolarHBondContact O-OG 3.23Å
68	L	93.8	Very high	87.1	Confident	8 Å²	8	45.5 Å²	45.5	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	144	178	-55.2	177.7	0	0	0	110.4	F45 Q47 L49 V66 R78 V80 L102	F45-L68 HydrophobicContact CD1-CD2 4.13Å; F45-L68 HydrophobicContact CG-CD2 4.4Å; Q47-L68 HydrophobicContact CB-CB 4.22Å; L49-L68 HydrophobicContact CD1-CD2 4.48Å; L49-L68 HydrophobicContact CG-CD2 4.33Å; V66-L68 HydrophobicContact CG1-CD2 4.06Å; L68-R78 WeakPolarHBondContact CB-O 3.28Å; L68-R78 HydrophobicContact CD1-CB 4.35Å; L68-R78 PolarHBondContact N-O 2.85Å; L68-R78 VanDerWaalsContact N-O 3.14Å; L68-V80 HydrophobicContact CD1-CG1 3.94Å; L68-V80 HydrophobicContact CD1-CG2 4.44Å; L68-V80 HydrophobicContact CD2-CG2 4.44Å; L68-V80 HydrophobicContact CG-CG2 4.47Å; L68-L102 WeakPolarHBondContact O-CB 3.42Å; L68-L102 PolarHBondContact O-N 3.16Å
69	G	89.1	Confident	87.1	Confident	5 Å²	5	44.8 Å²	44.8	5%	0.052	28%	0.275	C	S	.	.			trans	-70.6	-162.8	175.6	0	0	0	0	0	113.3	Q47 S48	Q47-G69 PolarHBondContact OE1-O 3.12Å; S48-G69 PolarHBondContact O-N 3Å
70	P	87.1	Confident	87.2	Confident	69 Å²	69	38.8 Å²	38.8	45%	0.448	24%	0.235	S	C	.	.			trans	-59.4	141.8	179.8	-15.7	24.7	0	0	0	112.3	S100	P70-S100 VanDerWaalsContact CG-O 3.3Å; P70-S100 WeakPolarHBondContact CG-O 3.44Å
71	C	78.1	Confident	87.4	Confident	29 Å²	29	35.2 Å²	35.2	20%	0.196	21%	0.209	C	C	.	.			trans	-104.6	147.9	170.1	-157.5	0	0	0	0	110	Q99	C71-Q99 PolarHBondContact N-O 3.35Å
72	S	76.8	Confident	87.6	Confident	114 Å²	114	33.7 Å²	33.7	80%	0.797	20%	0.203	S	C	*	.	S	Bend	trans	-81.5	140.3	165.1	53.7	0	0	0	0	110.2
73	G	71.9	Confident	87.7	Confident	51 Å²	51	32.9 Å²	32.9	53%	0.526	20%	0.198	S	C	.	.	S	Bend	trans	88.9	-166.6	179.3	0	0	0	0	0	113.6	S75	G73-S75 PolarHBondContact O-N 2.97Å; G73-S75 VanDerWaalsContact O-N 3.14Å
74	E	62.1	Low	87.6	Confident	200 Å²	200	32.5 Å²	32.5	94%	0.935	20%	0.197	S	C	*	.	S	Bend	trans	-78.3	9	-171.8	-62.8	175.4	179.7	0	0	114.2	S76	E74-S76 PolarHBondContact O-N 3.16Å
75	S	71.1	Confident	87.3	Confident	36 Å²	36	39.3 Å²	39.3	25%	0.252	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-75.9	123.5	179.4	-73.1	0	0	0	0	110.9	G73 R78	G73-S75 PolarHBondContact O-N 2.97Å; G73-S75 VanDerWaalsContact O-N 3.14Å; S75-R78 VanDerWaalsContact CB-NH2 3.33Å; S75-R78 PolarHBondContact OG-NH2 2.83Å
76	S	75.7	Confident	87	Confident	37 Å²	37	45.9 Å²	45.9	26%	0.259	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-57.6	156.8	170.2	49.9	0	0	0	0	112.3	E74 R78 H97	E74-S76 PolarHBondContact O-N 3.16Å; S76-R78 WeakPolarHBondContact O-CG 3.45Å; S76-R78 PolarHBondContact O-N 2.86Å; S76-H97 WeakPolarHBondContact CB-O 3.39Å
77	G	76.6	Confident	86.8	Confident	2 Å²	2	46.9 Å²	46.9	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	132.5	171.6	0	0	0	0	0	110.2	H97 S98	G77-H97 PolarHBondContact N-O 3.41Å; G77-S98 WeakPolarHBondContact CA-O 3.39Å; G77-S98 PolarHBondContact N-O 2.85Å
78	R	88	Confident	86.7	Confident	75 Å²	75	49.3 Å²	49.3	28%	0.283	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	141	-172.1	-70.1	170.6	-165.9	166.9	6.4	111.8	L68 S75 S76 T92 L102	L68-R78 WeakPolarHBondContact CB-O 3.28Å; L68-R78 HydrophobicContact CD1-CB 4.35Å; L68-R78 PolarHBondContact N-O 2.85Å; L68-R78 VanDerWaalsContact N-O 3.14Å; S75-R78 VanDerWaalsContact CB-NH2 3.33Å; S75-R78 PolarHBondContact OG-NH2 2.83Å; S76-R78 WeakPolarHBondContact O-CG 3.45Å; S76-R78 PolarHBondContact O-N 2.86Å; R78-T92 HydrophobicContact CB-CG2 4.13Å; R78-T92 HydrophobicContact CG-CG2 4.08Å; R78-L102 WeakPolarHBondContact O-CD1 3.41Å
79	A	95.4	Very high	86.8	Confident	2 Å²	2	51.7 Å²	51.7	2%	0.017	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	147	158.1	0	0	0	0	0	108.8	V66 L93 L102 I105 T117	V66-A79 CarbonylContact O-C 3.51Å; V66-A79 VanDerWaalsContact O-CA 3.3Å; V66-A79 WeakPolarHBondContact O-CA 3.28Å; A79-L93 HydrophobicContact CB-CB 4.16Å; A79-L93 HydrophobicContact CB-CD1 4.02Å; A79-L93 HydrophobicContact CB-CG 4.35Å; A79-L93 PolarHBondContact O-N 3.48Å; A79-L102 HydrophobicContact CB-CD1 3.7Å; A79-I105 HydrophobicContact CB-CD1 3.59Å; A79-T117 HydrophobicContact CB-CG2 4Å
80	V	96.2	Very high	87.1	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.042	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.9	178.2	-63.3	0	0	0	0	109.8	F45 V66 L68 V82 T89 T92	F45-V80 HydrophobicContact CD1-CG2 4.3Å; F45-V80 HydrophobicContact CE1-CG2 3.62Å; F45-V80 HydrophobicContact CZ-CG2 4.36Å; V66-V80 HydrophobicContact CB-CG2 3.75Å; V66-V80 HydrophobicContact CG1-CG2 4.22Å; V66-V80 PolarHBondContact N-O 3.18Å; V66-V80 PolarHBondContact O-N 3.33Å; L68-V80 HydrophobicContact CD1-CG1 3.94Å; L68-V80 HydrophobicContact CD1-CG2 4.44Å; L68-V80 HydrophobicContact CD2-CG2 4.44Å; L68-V80 HydrophobicContact CG-CG2 4.47Å; V80-V82 HydrophobicContact CG2-CG2 4.45Å; V80-T89 HydrophobicContact CB-CG2 3.96Å; V80-T89 HydrophobicContact CG1-CG2 4.22Å; V80-T92 HydrophobicContact CG1-CG2 4.06Å
81	L	98.1	Very high	87.5	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.2	173.1	-55.9	179.5	0	0	0	107.5	L63 I64 A65 A90 T91 L93 W107 I129	L63-L81 HydrophobicContact CB-CB 4.48Å; L63-L81 HydrophobicContact CD1-CB 4.33Å; L63-L81 HydrophobicContact CD1-CD1 4.16Å; I64-L81 WeakPolarHBondContact O-CA 3.5Å; A65-L81 HydrophobicContact CB-CD2 3.84Å; L81-A90 PolarHBondContact O-N 2.78Å; L81-T91 PolarHBondContact N-O 3.19Å; L81-T91 PolarHBondContact O-N 3.41Å; L81-L93 HydrophobicContact CD1-CD2 4.33Å; L81-W107 HydrophobicContact CD2-CH2 4.38Å; L81-W107 HydrophobicContact CD2-CZ2 4.11Å; L81-I129 HydrophobicContact CD1-CB 3.53Å; L81-I129 HydrophobicContact CD1-CD1 4.29Å; L81-I129 HydrophobicContact CD1-CG1 4.47Å; L81-I129 HydrophobicContact CD1-CG2 3.5Å; L81-I129 VanDerWaalsContact CD1-CG2 3.5Å; L81-I129 HydrophobicContact CD2-CG2 4.33Å
82	V	98	Very high	88.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.7	-179.7	-179.7	0	0	0	0	108.5	L29 V43 F45 L63 I64 V66 V80 P84 C88	L29-V82 HydrophobicContact CD2-CB 4.05Å; L29-V82 HydrophobicContact CD2-CG1 3.88Å; L29-V82 HydrophobicContact CD2-CG2 3.96Å; V43-V82 HydrophobicContact CG2-CG1 3.91Å; F45-V82 HydrophobicContact CE1-CG2 4.25Å; F45-V82 HydrophobicContact CZ-CG2 3.68Å; L63-V82 WeakPolarHBondContact CA-O 3.4Å; I64-V82 HydrophobicContact CB-CB 4.32Å; I64-V82 PolarHBondContact N-O 2.83Å; I64-V82 PolarHBondContact O-N 2.91Å; V66-V82 HydrophobicContact CG2-CG2 4.15Å; V80-V82 HydrophobicContact CG2-CG2 4.45Å; V82-P84 WeakPolarHBondContact O-CD 3.46Å; V82-C88 WeakPolarHBondContact CA-O 3.29Å; V82-C88 WeakPolarHBondContact CG1-O 3.43Å
83	D	96.4	Very high	89.2	Confident	30 Å²	30	48.2 Å²	48.2	16%	0.16	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	114.7	167.8	-174.9	-38.9	0	0	0	108.5	L63 L85 M86 G87 C88 A90	L63-D83 HydrophobicContact CD2-CB 4.15Å; D83-L85 VanDerWaalsContact C-N 3.27Å; D83-L85 PolarHBondContact O-N 3.33Å; D83-L85 WeakPolarHBondContact OD1-CA 3.42Å; D83-L85 VanDerWaalsContact OD1-CB 3.29Å; D83-L85 WeakPolarHBondContact OD1-CB 3.42Å; D83-L85 PolarHBondContact OD1-N 2.94Å; D83-M86 HydrophobicContact CB-CB 4.11Å; D83-M86 HydrophobicContact CB-CG 4.27Å; D83-M86 PolarHBondContact OD1-N 3.19Å; D83-M86 VanDerWaalsContact OD1-N 3.08Å; D83-G87 PolarHBondContact O-N 3.2Å; D83-C88 PolarHBondContact N-O 2.86Å; D83-C88 PolarHBondContact O-N 3.45Å; D83-A90 HydrophobicContact CB-CB 4.13Å
84	P	94.6	Very high	89.8	Confident	17 Å²	17	49.5 Å²	49.5	11%	0.11	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-20.8	-178.3	29.6	-34.8	0	0	0	113.6	I31 N62 I64 V82	I31-P84 HydrophobicContact CD1-CB 3.7Å; I31-P84 HydrophobicContact CG1-CB 4.5Å; N62-P84 HydrophobicContact CB-CG 4.37Å; N62-P84 WeakPolarHBondContact ND2-CG 3.49Å; N62-P84 WeakPolarHBondContact O-CD 3.47Å; N62-P84 WeakPolarHBondContact O-CG 3.46Å; I64-P84 HydrophobicContact CD1-CB 3.88Å; I64-P84 HydrophobicContact CD1-CG 4.4Å; V82-P84 WeakPolarHBondContact O-CD 3.46Å
85	L	92	Very high	90.3	Very high	142 Å²	142	40.9 Å²	40.9	74%	0.743	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-41.9	176.7	-59.2	173.4	0	0	0	110.8	N62 D83	N62-L85 WeakPolarHBondContact ND2-CG 3.47Å; D83-L85 VanDerWaalsContact C-N 3.27Å; D83-L85 PolarHBondContact O-N 3.33Å; D83-L85 WeakPolarHBondContact OD1-CA 3.42Å; D83-L85 VanDerWaalsContact OD1-CB 3.29Å; D83-L85 WeakPolarHBondContact OD1-CB 3.42Å; D83-L85 PolarHBondContact OD1-N 2.94Å
86	M	92.7	Very high	90.9	Very high	139 Å²	139	41 Å²	41	69%	0.685	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-21.2	176.9	-61	-171.5	69.6	0	0	113	D83 C88	D83-M86 HydrophobicContact CB-CB 4.11Å; D83-M86 HydrophobicContact CB-CG 4.27Å; D83-M86 PolarHBondContact OD1-N 3.19Å; D83-M86 VanDerWaalsContact OD1-N 3.08Å; M86-C88 VanDerWaalsContact C-N 3.29Å; M86-C88 VanDerWaalsContact CB-SG 3.56Å; M86-C88 PolarHBondContact O-N 3.03Å
87	G	92.9	Very high	91.7	Very high	21 Å²	21	39.5 Å²	39.5	22%	0.216	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	29	-177.1	0	0	0	0	0	113.3	V43 D83	V43-G87 WeakPolarHBondContact CG2-O 3.36Å; D83-G87 PolarHBondContact O-N 3.2Å
88	C	94.6	Very high	92.4	Very high	50 Å²	50	41.7 Å²	41.7	34%	0.338	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	164.8	-176.6	70.4	0	0	0	0	112.3	V82 D83 M86 A90	V82-C88 WeakPolarHBondContact CA-O 3.29Å; V82-C88 WeakPolarHBondContact CG1-O 3.43Å; D83-C88 PolarHBondContact N-O 2.86Å; D83-C88 PolarHBondContact O-N 3.45Å; M86-C88 VanDerWaalsContact C-N 3.29Å; M86-C88 VanDerWaalsContact CB-SG 3.56Å; M86-C88 PolarHBondContact O-N 3.03Å; C88-A90 PolarHBondContact O-N 2.82Å
89	T	95.5	Very high	92.4	Very high	59 Å²	59	43.9 Å²	43.9	36%	0.362	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	117.8	173.1	-59.2	0	0	0	0	109.7	V80	V80-T89 HydrophobicContact CB-CG2 3.96Å; V80-T89 HydrophobicContact CG1-CG2 4.22Å
90	A	96.3	Very high	92.2	Very high	49 Å²	49	44.9 Å²	44.9	41%	0.405	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-39.3	176.4	0	0	0	0	0	112.2	L63 L81 D83 C88	L63-A90 HydrophobicContact CD2-CB 4.02Å; L81-A90 PolarHBondContact O-N 2.78Å; D83-A90 HydrophobicContact CB-CB 4.13Å; C88-A90 PolarHBondContact O-N 2.82Å
91	T	95.5	Very high	91.9	Very high	49 Å²	49	44.6 Å²	44.6	30%	0.301	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	149.6	-176.6	-63.6	0	0	0	0	110.4	L81 P132	L81-T91 PolarHBondContact N-O 3.19Å; L81-T91 PolarHBondContact O-N 3.41Å; T91-P132 HydrophobicContact CG2-CB 3.58Å; T91-P132 HydrophobicContact CG2-CG 3.84Å
92	T	95	Very high	91.8	Very high	44 Å²	44	44.7 Å²	44.7	27%	0.27	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.4	171.7	-60.5	0	0	0	0	108.8	R78 V80 L94	R78-T92 HydrophobicContact CB-CG2 4.13Å; R78-T92 HydrophobicContact CG-CG2 4.08Å; V80-T92 HydrophobicContact CG1-CG2 4.06Å; T92-L94 HydrophobicContact CG2-CD2 3.63Å; T92-L94 HydrophobicContact CG2-CG 4.23Å; T92-L94 PolarHBondContact O-N 3.08Å
93	L	95.1	Very high	91.6	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	109.9	170.2	-54	-177.4	0	0	0	107.7	A79 L81 W127 P132	A79-L93 HydrophobicContact CB-CB 4.16Å; A79-L93 HydrophobicContact CB-CD1 4.02Å; A79-L93 HydrophobicContact CB-CG 4.35Å; A79-L93 PolarHBondContact O-N 3.48Å; L81-L93 HydrophobicContact CD1-CD2 4.33Å; L93-W127 HydrophobicContact CB-CD2 4.18Å; L93-W127 HydrophobicContact CB-CE3 3.94Å; L93-W127 HydrophobicContact CB-CH2 4.4Å; L93-W127 HydrophobicContact CB-CZ3 4.06Å; L93-W127 HydrophobicContact CD1-CB 3.89Å; L93-W127 HydrophobicContact CD1-CD2 4.11Å; L93-W127 HydrophobicContact CD1-CE3 4.48Å; L93-W127 HydrophobicContact CD1-CG 3.86Å; L93-W127 HydrophobicContact CD2-CE3 4.48Å; L93-P132 WeakPolarHBondContact CA-O 3.39Å; L93-P132 HydrophobicContact CD2-CB 3.7Å
94	L	84.9	Confident	91.7	Very high	79 Å²	79	43.3 Å²	43.3	41%	0.414	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	133.1	-168.7	-67.4	172.4	0	0	0	111.6	T92 W127 P132	T92-L94 HydrophobicContact CG2-CD2 3.63Å; T92-L94 HydrophobicContact CG2-CG 4.23Å; T92-L94 PolarHBondContact O-N 3.08Å; L94-W127 WeakPolarHBondContact O-CH2 3.43Å; L94-P132 PolarHBondContact N-O 2.95Å
95	G	71.3	Confident	91.8	Very high	19 Å²	19	42.6 Å²	42.6	20%	0.196	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87	-176.4	160.1	0	0	0	0	0	115.7	H97 W127	G95-H97 PolarHBondContact O-N 2.91Å; G95-W127 VanDerWaalsContact O-CH2 3.27Å; G95-W127 WeakPolarHBondContact O-CH2 3.27Å
96	S	84.7	Confident	92.1	Very high	38 Å²	38	36.9 Å²	36.9	27%	0.266	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	72.3	-41.2	178.6	-50.3	0	0	0	0	116.8	R123 P135 Y151	S96-R123 PolarHBondContact O-NH1 3.27Å; S96-P135 WeakPolarHBondContact OG-CD 3.3Å; S96-P135 VanDerWaalsContact OG-CG 3.29Å; S96-P135 WeakPolarHBondContact OG-CG 3.39Å; S96-Y151 VanDerWaalsContact CB-OH 3.26Å; S96-Y151 WeakPolarHBondContact CB-OH 3.37Å; S96-Y151 PolarHBondContact OG-OH 3.43Å; S96-Y151 VanDerWaalsContact OG-OH 3.08Å
97	H	92.6	Very high	92.4	Very high	5 Å²	5	30.4 Å²	30.4	2%	0.023	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	145.1	169.4	-77.2	-74.8	0	0	0	111.6	S76 G77 G95 L102 T117 D121 R123 L125	S76-H97 WeakPolarHBondContact CB-O 3.39Å; G77-H97 PolarHBondContact N-O 3.41Å; G95-H97 PolarHBondContact O-N 2.91Å; H97-L102 HydrophobicContact CB-CD2 3.72Å; H97-L102 WeakPolarHBondContact CD2-CD2 3.48Å; H97-T117 PolarHBondContact NE2-OG1 2.7Å; H97-D121 VanDerWaalsContact CA-OD2 3.31Å; H97-D121 WeakPolarHBondContact CA-OD2 3.38Å; H97-D121 IonicContact CE1-OD1 3.85Å; H97-D121 IonicContact CG-OD2 3.93Å; H97-D121 IonicContact ND1-OD1 3.04Å; H97-D121 PolarHBondContact ND1-OD1 3.49Å; H97-D121 IonicContact ND1-OD2 2.7Å; H97-D121 PolarHBondContact ND1-OD2 2.91Å; H97-D121 VanDerWaalsContact ND1-OD2 3.15Å; H97-R123 PolarHBondContact CE1-O 2.92Å; H97-L125 WeakPolarHBondContact NE2-CD1 3.37Å
98	S	90.8	Very high	92.5	Very high	49 Å²	49	30 Å²	30	34%	0.343	19%	0.186	S	C	.	.			trans	-65.4	164.7	175.4	68.5	0	0	0	0	112.2	G77 S100 G101 D121	G77-S98 WeakPolarHBondContact CA-O 3.39Å; G77-S98 PolarHBondContact N-O 2.85Å; S98-S100 PolarHBondContact O-N 3.49Å; S98-S100 PolarHBondContact OG-OG 2.84Å; S98-G101 PolarHBondContact O-N 2.98Å; S98-G101 VanDerWaalsContact O-N 3.14Å; S98-D121 PolarHBondContact N-OD2 3.22Å; S98-D121 WeakPolarHBondContact OG-CB 3.37Å; S98-D121 PolarHBondContact OG-OD2 2.81Å
99	Q	88.6	Confident	92.6	Very high	120 Å²	120	29 Å²	29	56%	0.561	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-11.6	175.8	69.5	-171	60.8	0	0	114.4	C71 G101	C71-Q99 PolarHBondContact N-O 3.35Å; Q99-G101 PolarHBondContact O-N 3.3Å
100	S	89.7	Confident	92.5	Very high	24 Å²	24	33.8 Å²	33.8	17%	0.168	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.6	174.1	67.9	0	0	0	0	112.5	P70 S98 R120	P70-S100 VanDerWaalsContact CG-O 3.3Å; P70-S100 WeakPolarHBondContact CG-O 3.44Å; S98-S100 PolarHBondContact O-N 3.49Å; S98-S100 PolarHBondContact OG-OG 2.84Å; S100-R120 VanDerWaalsContact O-CD 3.23Å; S100-R120 WeakPolarHBondContact O-CD 3.48Å; S100-R120 VanDerWaalsContact OG-CB 3.26Å; S100-R120 WeakPolarHBondContact OG-CB 3.19Å
101	G	90.9	Very high	92.4	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.			trans	85.4	173.1	171	0	0	0	0	0	113.9	S98 Q99 R120	S98-G101 PolarHBondContact O-N 2.98Å; S98-G101 VanDerWaalsContact O-N 3.14Å; Q99-G101 PolarHBondContact O-N 3.3Å; G101-R120 PolarHBondContact O-N 2.84Å
102	L	95	Very high	92.4	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.016	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	153.4	-176.2	-59.2	-176	0	0	0	111.5	S50 L68 R78 A79 H97 T117	S50-L102 WeakPolarHBondContact CB-O 3.17Å; S50-L102 PolarHBondContact OG-O 2.93Å; L68-L102 WeakPolarHBondContact O-CB 3.42Å; L68-L102 PolarHBondContact O-N 3.16Å; R78-L102 WeakPolarHBondContact O-CD1 3.41Å; A79-L102 HydrophobicContact CB-CD1 3.7Å; H97-L102 HydrophobicContact CB-CD2 3.72Å; H97-L102 WeakPolarHBondContact CD2-CD2 3.48Å; L102-T117 HydrophobicContact CD1-CG2 4.13Å
103	T	95.2	Very high	92.5	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	-28.1	177.7	47.4	0	0	0	0	112.8	G118 R120 V162 P252	T103-G118 PolarHBondContact N-O 2.88Å; T103-G118 PolarHBondContact OG1-O 3.44Å; T103-R120 HydrophobicContact CG2-CG 3.5Å; T103-V162 WeakPolarHBondContact CB-O 3.34Å; T103-V162 PolarHBondContact OG1-O 2.8Å; T103-P252 HydrophobicContact CG2-CG 4.11Å
104	Q	97.1	Very high	92.6	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	148.3	-172.3	-70.6	-67.5	-16.6	0	0	110.6	W51 G118 L163 L165 I253	W51-Q104 VanDerWaalsContact CE2-OE1 3.26Å; Q104-G118 PolarHBondContact N-O 2.83Å; Q104-G118 PolarHBondContact O-N 2.91Å; Q104-L163 PolarHBondContact NE2-O 3.32Å; Q104-L165 HydrophobicContact CB-CB 3.79Å; Q104-L165 HydrophobicContact CB-CD2 4.24Å; Q104-L165 HydrophobicContact CG-CB 3.99Å; Q104-I253 PolarHBondContact NE2-O 3.42Å
105	I	97.9	Very high	93.2	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	137	168.6	-163	160.9	0	0	0	109.3	W51 A65 A79 V115 V116 T117	W51-I105 HydrophobicContact CB-CG2 4.18Å; A65-I105 HydrophobicContact CB-CD1 3.68Å; A65-I105 HydrophobicContact CB-CG1 4.02Å; A79-I105 HydrophobicContact CB-CD1 3.59Å; I105-V115 HydrophobicContact CD1-CG1 3.73Å; I105-V115 HydrophobicContact CG1-CG1 3.36Å; I105-V116 CarbonylContact C-O 3.57Å; I105-V116 WeakPolarHBondContact CA-O 3.33Å; I105-T117 HydrophobicContact CD1-CG2 4.01Å; I105-T117 HydrophobicContact CG1-CG2 4.03Å
106	T	97.9	Very high	94.4	Very high	22 Å²	22	29.8 Å²	29.8	14%	0.135	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	140.9	175.6	-173.6	0	0	0	0	110.4	V116 L165 F167	T106-V116 HydrophobicContact CG2-CB 4.14Å; T106-V116 PolarHBondContact N-O 2.81Å; T106-V116 PolarHBondContact O-N 2.93Å; T106-L165 HydrophobicContact CG2-CD2 4.04Å; T106-L165 HydrophobicContact CG2-CG 4.21Å; T106-F167 HydrophobicContact CG2-CD2 3.91Å; T106-F167 HydrophobicContact CG2-CE2 3.85Å
107	W	98.1	Very high	95	Very high	4 Å²	4	28 Å²	28	2%	0.015	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	149.8	167.3	-72.2	91.3	0	0	0	111	S53 S55 H61 L63 A65 L81 A112 V115 I129 F167	S53-W107 VanDerWaalsContact C-CD1 3.48Å; S53-W107 VanDerWaalsContact O-CD1 3.29Å; S53-W107 PolarHBondContact O-NE1 2.73Å; S53-W107 PolarHBondContact OG-N 2.78Å; S55-W107 VanDerWaalsContact CA-CG 3.5Å; H61-W107 AromaticContact CE1-CH2 3.33Å; H61-W107 WeakPolarHBondContact CE1-CH2 3.39Å; H61-W107 AromaticContact CE1-CZ2 4Å; H61-W107 AromaticContact CE1-CZ3 3.58Å; H61-W107 AromaticContact NE2-CH2 3.97Å; H61-W107 AromaticContact NE2-CZ3 3.91Å; L63-W107 HydrophobicContact CB-CZ2 4.23Å; A65-W107 HydrophobicContact CB-CZ2 4Å; L81-W107 HydrophobicContact CD2-CH2 4.38Å; L81-W107 HydrophobicContact CD2-CZ2 4.11Å; W107-A112 WeakPolarHBondContact CZ3-O 3.33Å; W107-V115 HydrophobicContact CD2-CG2 3.49Å; W107-V115 VanDerWaalsContact CD2-CG2 3.49Å; W107-V115 HydrophobicContact CE3-CG2 3.4Å; W107-V115 HydrophobicContact CG-CG2 4.24Å; W107-V115 HydrophobicContact CH2-CG2 3.69Å; W107-V115 HydrophobicContact CZ2-CG2 3.8Å; W107-V115 HydrophobicContact CZ3-CG2 3.49Å; W107-V115 VanDerWaalsContact CZ3-CG2 3.49Å; W107-I129 HydrophobicContact CH2-CD1 3.7Å; W107-I129 HydrophobicContact CH2-CG2 3.91Å; W107-I129 HydrophobicContact CZ3-CD1 3.99Å; W107-I129 HydrophobicContact CZ3-CG2 4.05Å; W107-F167 WeakPolarHBondContact O-CD2 3.48Å; W107-F167 WeakPolarHBondContact O-CE2 3.43Å
108	S	96.4	Very high	95.3	Very high	11 Å²	11	27.8 Å²	27.8	8%	0.077	14%	0.144	C	C	.	.			trans	-70.1	129.4	165.1	174.6	0	0	0	0	109.7	R110 A111 V114	S108-R110 PolarHBondContact O-N 2.86Å; S108-R110 PolarHBondContact OG-N 2.79Å; S108-A111 PolarHBondContact OG-N 3.25Å; S108-V114 PolarHBondContact N-O 2.82Å
109	P	95.2	Very high	95.5	Very high	30 Å²	30	25.4 Å²	25.4	20%	0.195	13%	0.128	C	C	.	.	S	Bend	trans	-77.6	1.5	173.3	34.4	-37.3	0	0	0	113	P56 V57 F167 G171	P56-P109 HydrophobicContact CG-CB 3.97Å; V57-P109 WeakPolarHBondContact CG1-O 3.29Å; P109-F167 VanDerWaalsContact CD-CG 3.5Å; P109-F167 HydrophobicContact CG-CB 3.87Å; P109-F167 HydrophobicContact CG-CD2 4.5Å; P109-F167 HydrophobicContact CG-CG 4.07Å; P109-G171 VanDerWaalsContact CG-CA 3.42Å
110	R	93.6	Very high	95.7	Very high	160 Å²	160	22.7 Å²	22.7	60%	0.604	11%	0.113	S	C	*	.	S	Bend	trans	-118.5	-13	178.8	-62.6	-176.7	73.2	94	-0.5	114.2	S108 D170 G171	S108-R110 PolarHBondContact O-N 2.86Å; S108-R110 PolarHBondContact OG-N 2.79Å; R110-D170 VanDerWaalsContact CD-O 3.32Å; R110-D170 WeakPolarHBondContact CD-O 3.42Å; R110-D170 PolarHBondContact NH1-O 3.46Å; R110-G171 WeakPolarHBondContact CD-O 3.46Å
111	A	94.6	Very high	95.9	Very high	33 Å²	33	23.3 Å²	23.3	27%	0.273	11%	0.114	S	C	.	.			trans	-137.7	106.5	-176	0	0	0	0	0	109.8	S108 Y113 V114	S108-A111 PolarHBondContact OG-N 3.25Å; A111-Y113 PolarHBondContact O-N 2.62Å; A111-V114 HydrophobicContact CB-CB 3.82Å; A111-V114 HydrophobicContact CB-CG2 3.62Å; A111-V114 PolarHBondContact O-N 2.93Å
112	A	95.6	Very high	96.2	Very high	24 Å²	24	23.3 Å²	23.3	20%	0.198	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-33	-173.7	0	0	0	0	0	113.7	A58 H61 W107	A58-A112 HydrophobicContact CB-CB 4.16Å; H61-A112 PolarHBondContact NE2-O 3Å; W107-A112 WeakPolarHBondContact CZ3-O 3.33Å
113	Y	96.9	Very high	96.2	Very high	81 Å²	81	23.9 Å²	23.9	32%	0.318	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	6.9	-176.4	-59.3	-76.9	0	0	0	114	S60 H61 A111 D128 I129 R130	S60-Y113 WeakPolarHBondContact CB-OH 3.43Å; S60-Y113 PolarHBondContact OG-OH 3.34Å; H61-Y113 AromaticContact CD2-CD1 3.99Å; H61-Y113 AromaticContact CD2-CE1 3.77Å; A111-Y113 PolarHBondContact O-N 2.62Å; Y113-D128 WeakPolarHBondContact O-CA 3.43Å; Y113-I129 HydrophobicContact CD1-CD1 3.9Å; Y113-I129 HydrophobicContact CD1-CG1 3.95Å; Y113-I129 PolarHBondContact O-N 2.75Å; Y113-R130 HydrophobicContact CD1-CG 3.94Å; Y113-R130 HydrophobicContact CG-CG 4.22Å
114	V	96.7	Very high	96.3	Very high	19 Å²	19	23.9 Å²	23.9	12%	0.115	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.2	-175.3	176.7	0	0	0	0	111.8	S108 A111 Y126 W127 I136	S108-V114 PolarHBondContact N-O 2.82Å; A111-V114 HydrophobicContact CB-CB 3.82Å; A111-V114 HydrophobicContact CB-CG2 3.62Å; A111-V114 PolarHBondContact O-N 2.93Å; V114-Y126 HydrophobicContact CG1-CD1 3.93Å; V114-W127 CarbonylContact C-O 3.44Å; V114-W127 VanDerWaalsContact CA-O 3.26Å; V114-W127 WeakPolarHBondContact CA-O 3.47Å; V114-I136 HydrophobicContact CG2-CD1 4.46Å
115	V	97.5	Very high	96.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.6	172.3	172.9	0	0	0	0	109.4	A65 I105 W107 T117 W127 I129	A65-V115 HydrophobicContact CB-CG1 4.34Å; A65-V115 HydrophobicContact CB-CG2 4.18Å; I105-V115 HydrophobicContact CD1-CG1 3.73Å; I105-V115 HydrophobicContact CG1-CG1 3.36Å; W107-V115 HydrophobicContact CD2-CG2 3.49Å; W107-V115 VanDerWaalsContact CD2-CG2 3.49Å; W107-V115 HydrophobicContact CE3-CG2 3.4Å; W107-V115 HydrophobicContact CG-CG2 4.24Å; W107-V115 HydrophobicContact CH2-CG2 3.69Å; W107-V115 HydrophobicContact CZ2-CG2 3.8Å; W107-V115 HydrophobicContact CZ3-CG2 3.49Å; W107-V115 VanDerWaalsContact CZ3-CG2 3.49Å; V115-T117 HydrophobicContact CG1-CG2 4.38Å; V115-W127 PolarHBondContact N-O 3.11Å; V115-W127 PolarHBondContact O-N 3.09Å; V115-I129 HydrophobicContact CG2-CG2 3.95Å
116	V	97.6	Very high	96.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129	173	-168	0	0	0	0	109.7	I105 T106 V124 L125 Y126 L165 F167 L174	I105-V116 CarbonylContact C-O 3.57Å; I105-V116 WeakPolarHBondContact CA-O 3.33Å; T106-V116 HydrophobicContact CG2-CB 4.14Å; T106-V116 PolarHBondContact N-O 2.81Å; T106-V116 PolarHBondContact O-N 2.93Å; V116-V124 HydrophobicContact CG1-CG1 3.46Å; V116-V124 VanDerWaalsContact CG1-CG1 3.46Å; V116-L125 CarbonylContact C-O 3.57Å; V116-L125 VanDerWaalsContact CA-O 3.28Å; V116-L125 WeakPolarHBondContact CA-O 3.4Å; V116-Y126 HydrophobicContact CG1-CD2 4.14Å; V116-Y126 HydrophobicContact CG1-CE2 3.99Å; V116-Y126 HydrophobicContact CG2-CD1 3.55Å; V116-Y126 HydrophobicContact CG2-CD2 4.32Å; V116-Y126 HydrophobicContact CG2-CE1 3.44Å; V116-Y126 VanDerWaalsContact CG2-CE1 3.44Å; V116-Y126 HydrophobicContact CG2-CE2 4.23Å; V116-Y126 HydrophobicContact CG2-CG 3.99Å; V116-L165 HydrophobicContact CB-CD2 4.32Å; V116-L165 HydrophobicContact CG1-CD2 3.92Å; V116-F167 HydrophobicContact CB-CE2 4.43Å; V116-F167 HydrophobicContact CG2-CE2 3.71Å; V116-F167 HydrophobicContact CG2-CZ 3.55Å; V116-L174 HydrophobicContact CG1-CD2 4.06Å
117	T	98	Very high	96	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144.3	177.6	58.3	0	0	0	0	111	A79 H97 L102 I105 V115 V124 L125 W127	A79-T117 HydrophobicContact CB-CG2 4Å; H97-T117 PolarHBondContact NE2-OG1 2.7Å; L102-T117 HydrophobicContact CD1-CG2 4.13Å; I105-T117 HydrophobicContact CD1-CG2 4.01Å; I105-T117 HydrophobicContact CG1-CG2 4.03Å; V115-T117 HydrophobicContact CG1-CG2 4.38Å; T117-V124 CarbonylContact O-C 3.5Å; T117-V124 VanDerWaalsContact O-CA 3.26Å; T117-V124 WeakPolarHBondContact O-CA 3.21Å; T117-L125 PolarHBondContact N-O 2.99Å; T117-L125 PolarHBondContact O-N 3.39Å; T117-W127 PolarHBondContact OG1-NE1 2.85Å
118	G	97.4	Very high	95.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.8	169.1	0	0	0	0	0	110.4	T103 Q104	T103-G118 PolarHBondContact N-O 2.88Å; T103-G118 PolarHBondContact OG1-O 3.44Å; Q104-G118 PolarHBondContact N-O 2.83Å; Q104-G118 PolarHBondContact O-N 2.91Å
119	G	95.5	Very high	95.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	163.9	-175.1	0	0	0	0	0	114.7	D121 G122 R123 V162	G119-D121 WeakPolarHBondContact CA-OD1 3.42Å; G119-D121 PolarHBondContact O-N 3.3Å; G119-G122 PolarHBondContact O-N 2.85Å; G119-G122 VanDerWaalsContact O-N 3.15Å; G119-R123 PolarHBondContact N-O 3.1Å; G119-V162 PolarHBondContact O-N 2.75Å
120	R	94.1	Very high	95.9	Very high	62 Å²	62	29.7 Å²	29.7	23%	0.234	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18	167.5	-73.1	-163.9	-173	-105.5	-3.5	113.3	S100 G101 T103 G122 P161	S100-R120 VanDerWaalsContact O-CD 3.23Å; S100-R120 WeakPolarHBondContact O-CD 3.48Å; S100-R120 VanDerWaalsContact OG-CB 3.26Å; S100-R120 WeakPolarHBondContact OG-CB 3.19Å; G101-R120 PolarHBondContact O-N 2.84Å; T103-R120 HydrophobicContact CG2-CG 3.5Å; R120-G122 PolarHBondContact O-N 2.86Å; R120-P161 HydrophobicContact CB-CG 4.48Å; R120-P161 WeakPolarHBondContact O-CA 3.43Å
121	D	93.7	Very high	95.9	Very high	37 Å²	37	28 Å²	28	20%	0.198	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-2.4	170.6	49	23.6	0	0	0	114.1	H97 S98 G119 R123	H97-D121 VanDerWaalsContact CA-OD2 3.31Å; H97-D121 WeakPolarHBondContact CA-OD2 3.38Å; H97-D121 IonicContact CE1-OD1 3.85Å; H97-D121 IonicContact CG-OD2 3.93Å; H97-D121 IonicContact ND1-OD1 3.04Å; H97-D121 PolarHBondContact ND1-OD1 3.49Å; H97-D121 IonicContact ND1-OD2 2.7Å; H97-D121 PolarHBondContact ND1-OD2 2.91Å; H97-D121 VanDerWaalsContact ND1-OD2 3.15Å; S98-D121 PolarHBondContact N-OD2 3.22Å; S98-D121 WeakPolarHBondContact OG-CB 3.37Å; S98-D121 PolarHBondContact OG-OD2 2.81Å; G119-D121 WeakPolarHBondContact CA-OD1 3.42Å; G119-D121 PolarHBondContact O-N 3.3Å; D121-R123 HydrophobicContact CB-CG 4.3Å; D121-R123 PolarHBondContact O-N 2.84Å; D121-R123 WeakPolarHBondContact OD1-CB 3.29Å; D121-R123 PolarHBondContact OD1-N 2.87Å; D121-R123 VanDerWaalsContact OD1-N 3.1Å
122	G	95.5	Very high	95.9	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	77.3	6.3	-179	0	0	0	0	0	114.4	G119 R120 A157 H158 G160	G119-G122 PolarHBondContact O-N 2.85Å; G119-G122 VanDerWaalsContact O-N 3.15Å; R120-G122 PolarHBondContact O-N 2.86Å; G122-A157 WeakPolarHBondContact O-CA 3.48Å; G122-A157 WeakPolarHBondContact O-CB 3.45Å; G122-A157 PolarHBondContact O-N 2.79Å; G122-H158 WeakPolarHBondContact CA-O 3.4Å; G122-H158 PolarHBondContact O-N 2.79Å; G122-G160 WeakPolarHBondContact CA-O 3.13Å; G122-G160 PolarHBondContact N-O 2.81Å
123	R	96.3	Very high	95.7	Very high	16 Å²	16	32 Å²	32	6%	0.06	15%	0.148	C	C	.	.			trans	-82	146.1	175.4	-56.5	-172.8	71.3	-161.9	-3.3	110.4	S96 H97 G119 D121 L125 Y151 S152 A155 I156 V162	S96-R123 PolarHBondContact O-NH1 3.27Å; H97-R123 PolarHBondContact CE1-O 2.92Å; G119-R123 PolarHBondContact N-O 3.1Å; D121-R123 HydrophobicContact CB-CG 4.3Å; D121-R123 PolarHBondContact O-N 2.84Å; D121-R123 WeakPolarHBondContact OD1-CB 3.29Å; D121-R123 PolarHBondContact OD1-N 2.87Å; D121-R123 VanDerWaalsContact OD1-N 3.1Å; R123-L125 HydrophobicContact CB-CD2 4.31Å; R123-L125 HydrophobicContact CB-CG 4.32Å; R123-Y151 PolarHBondContact NH1-OH 3.31Å; R123-Y151 VanDerWaalsContact NH2-CE2 3.27Å; R123-Y151 PolarHBondContact NH2-OH 3.2Å; R123-S152 PolarHBondContact NH2-O 2.88Å; R123-A155 WeakPolarHBondContact CG-O 3.18Å; R123-A155 PolarHBondContact NE-O 2.76Å; R123-I156 HydrophobicContact CG-CG2 4.23Å; R123-V162 WeakPolarHBondContact O-CG2 3.32Å
124	V	96.8	Very high	95.4	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.2	167.2	176.8	0	0	0	0	108.2	V116 T117 L139 A157 V162 L165 L174	V116-V124 HydrophobicContact CG1-CG1 3.46Å; V116-V124 VanDerWaalsContact CG1-CG1 3.46Å; T117-V124 CarbonylContact O-C 3.5Å; T117-V124 VanDerWaalsContact O-CA 3.26Å; T117-V124 WeakPolarHBondContact O-CA 3.21Å; V124-L139 HydrophobicContact CB-CB 4.18Å; V124-L139 HydrophobicContact CB-CD1 3.81Å; V124-L139 HydrophobicContact CB-CG 4.18Å; V124-L139 HydrophobicContact CG1-CD1 3.46Å; V124-L139 VanDerWaalsContact CG1-CD1 3.46Å; V124-L139 HydrophobicContact CG1-CG 4.07Å; V124-L139 PolarHBondContact O-N 3.4Å; V124-A157 HydrophobicContact CB-CB 3.9Å; V124-A157 HydrophobicContact CG2-CB 3.54Å; V124-V162 HydrophobicContact CG2-CG1 4.17Å; V124-V162 HydrophobicContact CG2-CG2 3.73Å; V124-L165 HydrophobicContact CG1-CD1 4.17Å; V124-L165 HydrophobicContact CG1-CD2 4.45Å; V124-L165 HydrophobicContact CG2-CD1 4.26Å; V124-L174 HydrophobicContact CG1-CD2 3.95Å
125	L	95.9	Very high	95.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.6	-169.5	-56.2	-176.3	0	0	0	110.7	H97 V116 T117 R123 W127 P135 Y151	H97-L125 WeakPolarHBondContact NE2-CD1 3.37Å; V116-L125 CarbonylContact C-O 3.57Å; V116-L125 VanDerWaalsContact CA-O 3.28Å; V116-L125 WeakPolarHBondContact CA-O 3.4Å; T117-L125 PolarHBondContact N-O 2.99Å; T117-L125 PolarHBondContact O-N 3.39Å; R123-L125 HydrophobicContact CB-CD2 4.31Å; R123-L125 HydrophobicContact CB-CG 4.32Å; L125-W127 HydrophobicContact CD1-CZ2 4.22Å; L125-P135 HydrophobicContact CB-CB 4.12Å; L125-P135 HydrophobicContact CB-CG 4.28Å; L125-P135 HydrophobicContact CD1-CB 4.47Å; L125-P135 HydrophobicContact CD1-CG 3.78Å; L125-P135 HydrophobicContact CG-CG 4.48Å; L125-Y151 HydrophobicContact CD2-CD2 4.48Å; L125-Y151 HydrophobicContact CD2-CE2 3.96Å
126	Y	95.6	Very high	95	Very high	10 Å²	10	35 Å²	35	4%	0.039	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.9	173.5	-73.3	-112.7	0	0	0	109.2	V114 V116 P135 I136 Y137 L139 F167 L174 L208	V114-Y126 HydrophobicContact CG1-CD1 3.93Å; V116-Y126 HydrophobicContact CG1-CD2 4.14Å; V116-Y126 HydrophobicContact CG1-CE2 3.99Å; V116-Y126 HydrophobicContact CG2-CD1 3.55Å; V116-Y126 HydrophobicContact CG2-CD2 4.32Å; V116-Y126 HydrophobicContact CG2-CE1 3.44Å; V116-Y126 VanDerWaalsContact CG2-CE1 3.44Å; V116-Y126 HydrophobicContact CG2-CE2 4.23Å; V116-Y126 HydrophobicContact CG2-CG 3.99Å; Y126-P135 CarbonylContact O-C 3.59Å; Y126-P135 VanDerWaalsContact O-CA 3.29Å; Y126-P135 WeakPolarHBondContact O-CA 3.39Å; Y126-P135 VanDerWaalsContact O-CB 3.32Å; Y126-P135 WeakPolarHBondContact O-CB 3.5Å; Y126-I136 WeakPolarHBondContact O-CG1 3.48Å; Y126-I136 PolarHBondContact O-N 2.78Å; Y126-Y137 AromaticContact CD2-CD1 3.62Å; Y126-Y137 HydrophobicContact CD2-CD1 3.62Å; Y126-Y137 HydrophobicContact CD2-CE1 4.47Å; Y126-Y137 HydrophobicContact CD2-CG 4.48Å; Y126-Y137 AromaticContact CE2-CD1 3.9Å; Y126-Y137 HydrophobicContact CE2-CD1 3.9Å; Y126-Y137 HydrophobicContact CE2-CE1 4.35Å; Y126-Y137 HydrophobicContact CG-CD1 4.1Å; Y126-Y137 PolarHBondContact N-O 2.94Å; Y126-Y137 PolarHBondContact O-N 3.05Å; Y126-L139 HydrophobicContact CE2-CD1 4.09Å; Y126-L139 HydrophobicContact CE2-CD2 3.91Å; Y126-L139 HydrophobicContact CE2-CG 3.9Å; Y126-F167 HydrophobicContact CE1-CZ 4.18Å; Y126-L174 HydrophobicContact CE2-CD2 4.5Å; Y126-L208 WeakPolarHBondContact OH-CD1 3.5Å
127	W	96	Very high	94.8	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.011	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.4	-177	-59.5	85.1	0	0	0	109	L93 L94 G95 V114 V115 T117 L125 P135	L93-W127 HydrophobicContact CB-CD2 4.18Å; L93-W127 HydrophobicContact CB-CE3 3.94Å; L93-W127 HydrophobicContact CB-CH2 4.4Å; L93-W127 HydrophobicContact CB-CZ3 4.06Å; L93-W127 HydrophobicContact CD1-CB 3.89Å; L93-W127 HydrophobicContact CD1-CD2 4.11Å; L93-W127 HydrophobicContact CD1-CE3 4.48Å; L93-W127 HydrophobicContact CD1-CG 3.86Å; L93-W127 HydrophobicContact CD2-CE3 4.48Å; L94-W127 WeakPolarHBondContact O-CH2 3.43Å; G95-W127 VanDerWaalsContact O-CH2 3.27Å; G95-W127 WeakPolarHBondContact O-CH2 3.27Å; V114-W127 CarbonylContact C-O 3.44Å; V114-W127 VanDerWaalsContact CA-O 3.26Å; V114-W127 WeakPolarHBondContact CA-O 3.47Å; V115-W127 PolarHBondContact N-O 3.11Å; V115-W127 PolarHBondContact O-N 3.09Å; T117-W127 PolarHBondContact OG1-NE1 2.85Å; L125-W127 HydrophobicContact CD1-CZ2 4.22Å; W127-P135 HydrophobicContact CD2-CB 4.22Å; W127-P135 HydrophobicContact CD2-CG 4.24Å; W127-P135 HydrophobicContact CE3-CB 4.35Å; W127-P135 HydrophobicContact CE3-CG 4.18Å; W127-P135 HydrophobicContact CH2-CG 3.59Å; W127-P135 HydrophobicContact CZ2-CB 4.41Å; W127-P135 HydrophobicContact CZ2-CG 3.62Å; W127-P135 HydrophobicContact CZ3-CG 3.88Å
128	D	95	Very high	94.5	Very high	13 Å²	13	36.7 Å²	36.7	7%	0.07	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	118.3	158.9	-171.2	-37.6	0	0	0	107.3	Y113 R130 F131 I136	Y113-D128 WeakPolarHBondContact O-CA 3.43Å; D128-R130 PolarHBondContact O-N 3.14Å; D128-R130 VanDerWaalsContact O-N 3.09Å; D128-R130 WeakPolarHBondContact OD1-CB 3.41Å; D128-R130 VanDerWaalsContact OD1-CG 3.27Å; D128-R130 WeakPolarHBondContact OD1-CG 3.15Å; D128-R130 IonicContact OD1-CZ 3.7Å; D128-R130 PolarHBondContact OD1-N 2.87Å; D128-R130 IonicContact OD1-NE 3.92Å; D128-R130 PolarHBondContact OD1-NE 2.73Å; D128-R130 IonicContact OD1-NH2 3.65Å; D128-R130 IonicContact OD2-CZ 2.94Å; D128-R130 IonicContact OD2-NE 3.55Å; D128-R130 PolarHBondContact OD2-NE 2.87Å; D128-R130 IonicContact OD2-NH2 3.15Å; D128-R130 PolarHBondContact OD2-NH2 3.13Å; D128-F131 HydrophobicContact CB-CD2 4.04Å; D128-F131 CarbonylContact O-C 3.59Å; D128-F131 PolarHBondContact O-N 2.89Å; D128-I136 HydrophobicContact CB-CD1 4.01Å; D128-I136 HydrophobicContact CB-CG2 3.86Å
129	I	96.4	Very high	94.4	Very high	17 Å²	17	36.7 Å²	36.7	9%	0.087	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.7	-175.5	69.8	176.3	0	0	0	113	L63 L81 W107 Y113 V115 F131	L63-I129 HydrophobicContact CD1-CD1 3.96Å; L81-I129 HydrophobicContact CD1-CB 3.53Å; L81-I129 HydrophobicContact CD1-CD1 4.29Å; L81-I129 HydrophobicContact CD1-CG1 4.47Å; L81-I129 HydrophobicContact CD1-CG2 3.5Å; L81-I129 VanDerWaalsContact CD1-CG2 3.5Å; L81-I129 HydrophobicContact CD2-CG2 4.33Å; W107-I129 HydrophobicContact CH2-CD1 3.7Å; W107-I129 HydrophobicContact CH2-CG2 3.91Å; W107-I129 HydrophobicContact CZ3-CD1 3.99Å; W107-I129 HydrophobicContact CZ3-CG2 4.05Å; Y113-I129 HydrophobicContact CD1-CD1 3.9Å; Y113-I129 HydrophobicContact CD1-CG1 3.95Å; Y113-I129 PolarHBondContact O-N 2.75Å; V115-I129 HydrophobicContact CG2-CG2 3.95Å; I129-F131 PolarHBondContact O-N 3.04Å
130	R	95.1	Very high	94.3	Very high	148 Å²	148	38.6 Å²	38.6	56%	0.558	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-18.1	175.2	-55.2	173.6	-65.2	171.4	2	111.8	Y113 D128	Y113-R130 HydrophobicContact CD1-CG 3.94Å; Y113-R130 HydrophobicContact CG-CG 4.22Å; D128-R130 PolarHBondContact O-N 3.14Å; D128-R130 VanDerWaalsContact O-N 3.09Å; D128-R130 WeakPolarHBondContact OD1-CB 3.41Å; D128-R130 VanDerWaalsContact OD1-CG 3.27Å; D128-R130 WeakPolarHBondContact OD1-CG 3.15Å; D128-R130 IonicContact OD1-CZ 3.7Å; D128-R130 PolarHBondContact OD1-N 2.87Å; D128-R130 IonicContact OD1-NE 3.92Å; D128-R130 PolarHBondContact OD1-NE 2.73Å; D128-R130 IonicContact OD1-NH2 3.65Å; D128-R130 IonicContact OD2-CZ 2.94Å; D128-R130 IonicContact OD2-NE 3.55Å; D128-R130 PolarHBondContact OD2-NE 2.87Å; D128-R130 IonicContact OD2-NH2 3.15Å; D128-R130 PolarHBondContact OD2-NH2 3.13Å
131	F	93.9	Very high	94.2	Very high	123 Å²	123	37.5 Å²	37.5	54%	0.539	18%	0.178	S	C	.	.	S	Bend	trans	-127.2	67.7	179	-53.7	-71.1	0	0	0	110.7	D128 I129 T133	D128-F131 HydrophobicContact CB-CD2 4.04Å; D128-F131 CarbonylContact O-C 3.59Å; D128-F131 PolarHBondContact O-N 2.89Å; I129-F131 PolarHBondContact O-N 3.04Å; F131-T133 PolarHBondContact O-N 3.31Å; F131-T133 VanDerWaalsContact O-N 3.08Å
132	P	93.8	Very high	94	Very high	33 Å²	33	42 Å²	42	21%	0.214	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-3	-164.3	32	-38.9	0	0	0	115.2	T91 L93 L94	T91-P132 HydrophobicContact CG2-CB 3.58Å; T91-P132 HydrophobicContact CG2-CG 3.84Å; L93-P132 WeakPolarHBondContact CA-O 3.39Å; L93-P132 HydrophobicContact CD2-CB 3.7Å; L94-P132 PolarHBondContact N-O 2.95Å
133	T	92.3	Very high	92.9	Very high	108 Å²	108	45.1 Å²	45.1	66%	0.663	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-17.4	-173.8	54.5	0	0	0	0	113.7	F131	F131-T133 PolarHBondContact O-N 3.31Å; F131-T133 VanDerWaalsContact O-N 3.08Å
134	K	90.7	Very high	91.4	Very high	117 Å²	117	47.8 Å²	47.8	51%	0.509	23%	0.23	S	C	.	.	S	Bend	trans	-151.3	140.8	-179.9	-168.8	-175.3	172.6	-178.5	0	110.9
135	P	93.8	Very high	89.4	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.019	26%	0.263	C	S	.	.			trans	-61.4	147.4	168	-12.9	23.1	0	0	0	111.6	S96 L125 Y126 W127 Y151	S96-P135 WeakPolarHBondContact OG-CD 3.3Å; S96-P135 VanDerWaalsContact OG-CG 3.29Å; S96-P135 WeakPolarHBondContact OG-CG 3.39Å; L125-P135 HydrophobicContact CB-CB 4.12Å; L125-P135 HydrophobicContact CB-CG 4.28Å; L125-P135 HydrophobicContact CD1-CB 4.47Å; L125-P135 HydrophobicContact CD1-CG 3.78Å; L125-P135 HydrophobicContact CG-CG 4.48Å; Y126-P135 CarbonylContact O-C 3.59Å; Y126-P135 VanDerWaalsContact O-CA 3.29Å; Y126-P135 WeakPolarHBondContact O-CA 3.39Å; Y126-P135 VanDerWaalsContact O-CB 3.32Å; Y126-P135 WeakPolarHBondContact O-CB 3.5Å; W127-P135 HydrophobicContact CD2-CB 4.22Å; W127-P135 HydrophobicContact CD2-CG 4.24Å; W127-P135 HydrophobicContact CE3-CB 4.35Å; W127-P135 HydrophobicContact CE3-CG 4.18Å; W127-P135 HydrophobicContact CH2-CG 3.59Å; W127-P135 HydrophobicContact CZ2-CB 4.41Å; W127-P135 HydrophobicContact CZ2-CG 3.62Å; W127-P135 HydrophobicContact CZ3-CG 3.88Å; P135-Y151 HydrophobicContact CB-CD2 3.68Å; P135-Y151 HydrophobicContact CB-CE2 3.76Å; P135-Y151 HydrophobicContact CG-CD2 4Å; P135-Y151 HydrophobicContact CG-CE2 3.54Å
136	I	92.2	Very high	87.3	Confident	44 Å²	44	60.9 Å²	60.9	23%	0.226	30%	0.301	C	S	.	.	S	Bend	trans	-89.3	-25.1	178.3	62.2	173.3	0	0	0	112.1	V114 Y126 D128 I205	V114-I136 HydrophobicContact CG2-CD1 4.46Å; Y126-I136 WeakPolarHBondContact O-CG1 3.48Å; Y126-I136 PolarHBondContact O-N 2.78Å; D128-I136 HydrophobicContact CB-CD1 4.01Å; D128-I136 HydrophobicContact CB-CG2 3.86Å; I136-I205 HydrophobicContact CB-CD1 3.78Å; I136-I205 HydrophobicContact CD1-CD1 3.66Å; I136-I205 HydrophobicContact CD1-CG1 4Å; I136-I205 HydrophobicContact CG1-CD1 3.81Å
137	Y	92.1	Very high	85.6	Confident	27 Å²	27	62.9 Å²	62.9	11%	0.106	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	151.6	-178.2	-177.4	-111.7	0	0	0	112.3	Y126 L139 G150 I205 L208	Y126-Y137 AromaticContact CD2-CD1 3.62Å; Y126-Y137 HydrophobicContact CD2-CD1 3.62Å; Y126-Y137 HydrophobicContact CD2-CE1 4.47Å; Y126-Y137 HydrophobicContact CD2-CG 4.48Å; Y126-Y137 AromaticContact CE2-CD1 3.9Å; Y126-Y137 HydrophobicContact CE2-CD1 3.9Å; Y126-Y137 HydrophobicContact CE2-CE1 4.35Å; Y126-Y137 HydrophobicContact CG-CD1 4.1Å; Y126-Y137 PolarHBondContact N-O 2.94Å; Y126-Y137 PolarHBondContact O-N 3.05Å; Y137-L139 HydrophobicContact CD1-CD2 4.28Å; Y137-L139 HydrophobicContact CE1-CD2 3.52Å; Y137-G150 VanDerWaalsContact CA-O 3.25Å; Y137-G150 WeakPolarHBondContact CA-O 3.35Å; Y137-G150 WeakPolarHBondContact CD2-O 3.22Å; Y137-I205 VanDerWaalsContact CB-CG2 3.46Å; Y137-I205 HydrophobicContact CD1-CG2 3.9Å; Y137-I205 HydrophobicContact CD2-CG2 3.74Å; Y137-I205 HydrophobicContact CG-CG2 3.45Å; Y137-I205 VanDerWaalsContact CG-CG2 3.45Å; Y137-L208 PolarHBondContact OH-N 3.06Å; Y137-L208 VanDerWaalsContact OH-N 3.09Å; Y137-L208 PolarHBondContact OH-O 3.26Å
138	S	93.3	Very high	83.8	Confident	9 Å²	9	68.3 Å²	68.3	6%	0.063	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	133.5	179.1	56.3	0	0	0	0	111.3	G150 S152 A155	S138-G150 PolarHBondContact N-O 2.71Å; S138-G150 VanDerWaalsContact N-O 3.14Å; S138-S152 PolarHBondContact OG-N 3.4Å; S138-S152 PolarHBondContact OG-O 3.2Å; S138-A155 WeakPolarHBondContact OG-CB 2.97Å
139	L	94.4	Very high	82.2	Confident	0 Å²	0	74 Å²	74	0%	0	38%	0.375	C	S	.	.			trans	-79.5	133.3	175.4	-59	179.6	0	0	0	110.9	V124 Y126 Y137 I156 A157 L174 W192 L208	V124-L139 HydrophobicContact CB-CB 4.18Å; V124-L139 HydrophobicContact CB-CD1 3.81Å; V124-L139 HydrophobicContact CB-CG 4.18Å; V124-L139 HydrophobicContact CG1-CD1 3.46Å; V124-L139 VanDerWaalsContact CG1-CD1 3.46Å; V124-L139 HydrophobicContact CG1-CG 4.07Å; V124-L139 PolarHBondContact O-N 3.4Å; Y126-L139 HydrophobicContact CE2-CD1 4.09Å; Y126-L139 HydrophobicContact CE2-CD2 3.91Å; Y126-L139 HydrophobicContact CE2-CG 3.9Å; Y137-L139 HydrophobicContact CD1-CD2 4.28Å; Y137-L139 HydrophobicContact CE1-CD2 3.52Å; L139-I156 CarbonylContact O-C 3.6Å; L139-A157 HydrophobicContact CB-CB 4.22Å; L139-A157 PolarHBondContact O-N 2.91Å; L139-L174 HydrophobicContact CD1-CD2 3.64Å; L139-W192 HydrophobicContact CB-CD2 4.21Å; L139-W192 HydrophobicContact CB-CE3 3.96Å; L139-W192 HydrophobicContact CB-CH2 3.85Å; L139-W192 HydrophobicContact CB-CZ2 4.12Å; L139-W192 HydrophobicContact CB-CZ3 3.76Å; L139-W192 HydrophobicContact CD1-CB 4.34Å; L139-W192 HydrophobicContact CD1-CD2 3.6Å; L139-W192 HydrophobicContact CD1-CE3 4.09Å; L139-W192 HydrophobicContact CD1-CG 3.69Å; L139-W192 HydrophobicContact CD1-CZ2 4.42Å; L139-W192 HydrophobicContact CD2-CD2 4.2Å; L139-W192 HydrophobicContact CD2-CE3 3.91Å; L139-W192 HydrophobicContact CD2-CZ3 4.45Å; L139-W192 HydrophobicContact CG-CD2 4.22Å; L139-W192 HydrophobicContact CG-CE3 4.2Å; L139-L208 HydrophobicContact CD2-CB 3.99Å; L139-L208 HydrophobicContact CD2-CD1 4.27Å
140	N	93.4	Very high	81.3	Confident	40 Å²	40	74.8 Å²	74.8	21%	0.214	39%	0.388	C	S	.	.			trans	-124.5	123.8	178	-168.1	-7	0	0	0	111.1	E142 N143 A155 I156 W192	N140-E142 VanDerWaalsContact C-N 3.35Å; N140-E142 PolarHBondContact O-N 3.49Å; N140-E142 PolarHBondContact OD1-N 3.33Å; N140-N143 PolarHBondContact O-N 2.77Å; N140-A155 HydrophobicContact CB-CB 3.82Å; N140-I156 CarbonylContact C-O 3.58Å; N140-I156 WeakPolarHBondContact CA-O 3.48Å; N140-W192 WeakPolarHBondContact O-CZ3 3.25Å
141	K	92.9	Very high	81	Confident	38 Å²	38	68.9 Å²	68.9	17%	0.165	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.6	-179.1	63.8	179.1	-176.7	105.2	0	114.8	N143 I156 T159 W192	K141-N143 PolarHBondContact O-N 2.7Å; K141-I156 HydrophobicContact CD-CD1 4.38Å; K141-I156 HydrophobicContact CD-CG1 4.38Å; K141-I156 VanDerWaalsContact CE-CD1 3.42Å; K141-I156 HydrophobicContact CG-CG1 4.3Å; K141-I156 WeakPolarHBondContact CG-O 3.46Å; K141-I156 PolarHBondContact N-O 2.84Å; K141-T159 WeakPolarHBondContact CE-OG1 2.97Å; K141-T159 PolarHBondContact NZ-OG1 2.89Å; K141-W192 HydrophobicContact CB-CH2 4.42Å
142	E	88.6	Confident	80.8	Confident	133 Å²	133	64.9 Å²	64.9	62%	0.621	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-6.7	-177.6	-57.7	-53.9	147.6	0	0	111.8	N140	N140-E142 VanDerWaalsContact C-N 3.35Å; N140-E142 PolarHBondContact O-N 3.49Å; N140-E142 PolarHBondContact OD1-N 3.33Å
143	N	73.4	Confident	80.6	Confident	64 Å²	64	68.8 Å²	68.8	34%	0.342	37%	0.372	S	S	.	.			trans	44.7	74.3	176.3	-177.3	61.6	0	0	0	112.3	N140 K141 P145	N140-N143 PolarHBondContact O-N 2.77Å; K141-N143 PolarHBondContact O-N 2.7Å; N143-P145 WeakPolarHBondContact O-CD 3.16Å
144	D	63.3	Low	80.5	Confident	72 Å²	72	71.8 Å²	71.8	39%	0.385	38%	0.379	S	S	.	.			trans	-73.8	111	174.2	-177.5	7.8	0	0	0	109.7	Q146 S147	D144-Q146 PolarHBondContact O-N 2.84Å; D144-Q146 WeakPolarHBondContact OD1-CB 3.38Å; D144-Q146 PolarHBondContact OD1-N 2.84Å; D144-S147 PolarHBondContact O-N 3Å; D144-S147 PolarHBondContact O-OG 3.4Å; D144-S147 VanDerWaalsContact O-OG 3.05Å; D144-S147 PolarHBondContact OD2-N 2.93Å
145	P	55	Low	80.6	Confident	107 Å²	107	66.3 Å²	66.3	70%	0.695	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-21	176.7	-13.3	29.7	0	0	0	112.2	N143	N143-P145 WeakPolarHBondContact O-CD 3.16Å
146	Q	52.8	Low	80.6	Confident	170 Å²	170	68.8 Å²	68.8	79%	0.794	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-11.3	-179	-58.7	-173.7	-19.8	0	0	112.8	D144 D148	D144-Q146 PolarHBondContact O-N 2.84Å; D144-Q146 WeakPolarHBondContact OD1-CB 3.38Å; D144-Q146 PolarHBondContact OD1-N 2.84Å; Q146-D148 VanDerWaalsContact C-N 3.26Å; Q146-D148 PolarHBondContact O-N 3.39Å
147	S	59.1	Low	80.8	Confident	52 Å²	52	66.7 Å²	66.7	36%	0.364	36%	0.356	S	S	.	.			trans	-78.9	79	174.8	74.3	0	0	0	0	109.9	D144 L149	D144-S147 PolarHBondContact O-N 3Å; D144-S147 PolarHBondContact O-OG 3.4Å; D144-S147 VanDerWaalsContact O-OG 3.05Å; D144-S147 PolarHBondContact OD2-N 2.93Å; S147-L149 PolarHBondContact O-N 2.86Å; S147-L149 VanDerWaalsContact O-N 3.14Å
148	D	57.8	Low	81	Confident	116 Å²	116	65.4 Å²	65.4	62%	0.62	35%	0.352	S	S	*	.			trans	-65.3	-5.3	167.4	-89.4	-32.9	0	0	0	112.8	Q146 R207	Q146-D148 VanDerWaalsContact C-N 3.26Å; Q146-D148 PolarHBondContact O-N 3.39Å; D148-R207 IonicContact OD1-CZ 3.07Å; D148-R207 IonicContact OD1-NH1 3.33Å; D148-R207 PolarHBondContact OD1-NH1 3.4Å; D148-R207 IonicContact OD1-NH2 3.75Å; D148-R207 PolarHBondContact OD1-NH2 3Å
149	L	62.3	Low	81.1	Confident	133 Å²	133	68 Å²	68	70%	0.696	37%	0.367	S	S	*	.			trans	-83.2	119.2	179.5	-59.1	175.9	0	0	0	110.1	S147 Y151	S147-L149 PolarHBondContact O-N 2.86Å; S147-L149 VanDerWaalsContact O-N 3.14Å; L149-Y151 PolarHBondContact O-N 3.24Å
150	G	77.9	Confident	81.1	Confident	34 Å²	34	69 Å²	69	35%	0.351	38%	0.378	S	S	.	.	S	Bend	trans	-53.7	-40.6	176.1	0	0	0	0	0	113.1	Y137 S138	Y137-G150 VanDerWaalsContact CA-O 3.25Å; Y137-G150 WeakPolarHBondContact CA-O 3.35Å; Y137-G150 WeakPolarHBondContact CD2-O 3.22Å; S138-G150 PolarHBondContact N-O 2.71Å; S138-G150 VanDerWaalsContact N-O 3.14Å
151	Y	87.7	Confident	81.1	Confident	24 Å²	24	68.5 Å²	68.5	9%	0.094	38%	0.377	C	S	.	.			trans	-117.7	129.9	179.6	173	-96.5	0	0	0	112.1	S96 R123 L125 P135 L149 N153	S96-Y151 VanDerWaalsContact CB-OH 3.26Å; S96-Y151 WeakPolarHBondContact CB-OH 3.37Å; S96-Y151 PolarHBondContact OG-OH 3.43Å; S96-Y151 VanDerWaalsContact OG-OH 3.08Å; R123-Y151 PolarHBondContact NH1-OH 3.31Å; R123-Y151 VanDerWaalsContact NH2-CE2 3.27Å; R123-Y151 PolarHBondContact NH2-OH 3.2Å; L125-Y151 HydrophobicContact CD2-CD2 4.48Å; L125-Y151 HydrophobicContact CD2-CE2 3.96Å; P135-Y151 HydrophobicContact CB-CD2 3.68Å; P135-Y151 HydrophobicContact CB-CE2 3.76Å; P135-Y151 HydrophobicContact CG-CD2 4Å; P135-Y151 HydrophobicContact CG-CE2 3.54Å; L149-Y151 PolarHBondContact O-N 3.24Å; Y151-N153 VanDerWaalsContact CE1-OD1 3.31Å; Y151-N153 WeakPolarHBondContact CE1-OD1 3.27Å; Y151-N153 VanDerWaalsContact CZ-OD1 3.3Å; Y151-N153 PolarHBondContact OH-OD1 3.19Å
152	S	89.6	Confident	81.3	Confident	38 Å²	38	66.7 Å²	66.7	27%	0.266	37%	0.369	S	S	.	.			trans	-125.9	136.9	169.8	172.9	0	0	0	0	111.2	R123 S138 E154 A155	R123-S152 PolarHBondContact NH2-O 2.88Å; S138-S152 PolarHBondContact OG-N 3.4Å; S138-S152 PolarHBondContact OG-O 3.2Å; S152-E154 VanDerWaalsContact C-N 3.26Å; S152-E154 PolarHBondContact O-N 3.16Å; S152-E154 PolarHBondContact OG-N 3.35Å; S152-A155 PolarHBondContact O-N 2.72Å
153	N	89.1	Confident	81.7	Confident	115 Å²	115	60.8 Å²	60.8	62%	0.615	34%	0.341	S	S	*	.	S	Bend	trans	-66.5	-27.5	174.3	-79.1	-40.2	0	0	0	112.9	Y151	Y151-N153 VanDerWaalsContact CE1-OD1 3.31Å; Y151-N153 WeakPolarHBondContact CE1-OD1 3.27Å; Y151-N153 VanDerWaalsContact CZ-OD1 3.3Å; Y151-N153 PolarHBondContact OH-OD1 3.19Å
154	E	90.4	Very high	82.8	Confident	172 Å²	172	57.8 Å²	57.8	80%	0.804	33%	0.325	S	S	*	.	S	Bend	trans	-88.8	-12.2	-176.5	-60.5	179.3	170.7	0	0	112.5	S152 I156	S152-E154 VanDerWaalsContact C-N 3.26Å; S152-E154 PolarHBondContact O-N 3.16Å; S152-E154 PolarHBondContact OG-N 3.35Å; E154-I156 PolarHBondContact O-N 3.49Å
155	A	92.6	Very high	84.5	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.008	31%	0.31	C	S	.	.			trans	-64.1	124.4	179.8	0	0	0	0	0	111.7	R123 S138 N140 S152	R123-A155 WeakPolarHBondContact CG-O 3.18Å; R123-A155 PolarHBondContact NE-O 2.76Å; S138-A155 WeakPolarHBondContact OG-CB 2.97Å; N140-A155 HydrophobicContact CB-CB 3.82Å; S152-A155 PolarHBondContact O-N 2.72Å
156	I	95.3	Very high	86.5	Confident	55 Å²	55	53.2 Å²	53.2	28%	0.282	29%	0.291	S	S	.	.			trans	-122.7	137.2	172.6	57.1	168.4	0	0	0	110.3	R123 L139 N140 K141 E154	R123-I156 HydrophobicContact CG-CG2 4.23Å; L139-I156 CarbonylContact O-C 3.6Å; N140-I156 CarbonylContact C-O 3.58Å; N140-I156 WeakPolarHBondContact CA-O 3.48Å; K141-I156 HydrophobicContact CD-CD1 4.38Å; K141-I156 HydrophobicContact CD-CG1 4.38Å; K141-I156 VanDerWaalsContact CE-CD1 3.42Å; K141-I156 HydrophobicContact CG-CG1 4.3Å; K141-I156 WeakPolarHBondContact CG-O 3.46Å; K141-I156 PolarHBondContact N-O 2.84Å; E154-I156 PolarHBondContact O-N 3.49Å
157	A	96.4	Very high	88.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-86.5	-31.7	174.7	0	0	0	0	0	111.5	G122 V124 L139 R190 W192	G122-A157 WeakPolarHBondContact O-CA 3.48Å; G122-A157 WeakPolarHBondContact O-CB 3.45Å; G122-A157 PolarHBondContact O-N 2.79Å; V124-A157 HydrophobicContact CB-CB 3.9Å; V124-A157 HydrophobicContact CG2-CB 3.54Å; L139-A157 HydrophobicContact CB-CB 4.22Å; L139-A157 PolarHBondContact O-N 2.91Å; A157-R190 WeakPolarHBondContact O-CD 3.45Å; A157-R190 PolarHBondContact O-NE 3.12Å; A157-W192 HydrophobicContact CB-CH2 4.08Å; A157-W192 HydrophobicContact CB-CZ2 3.6Å
158	H	96.6	Very high	90.3	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	24%	0.239	C	C	.	.	S	Bend	trans	-139.5	148.4	-177.3	-73.3	-81.6	0	0	0	110.8	G122 G160 S176 G178 G179 S188	G122-H158 WeakPolarHBondContact CA-O 3.4Å; G122-H158 PolarHBondContact O-N 2.79Å; H158-G160 WeakPolarHBondContact CB-O 3.5Å; H158-G160 PolarHBondContact O-N 3.03Å; H158-G160 VanDerWaalsContact O-N 3.11Å; H158-S176 WeakPolarHBondContact NE2-CB 3.37Å; H158-S176 PolarHBondContact NE2-OG 3.26Å; H158-G178 PolarHBondContact CE1-N 2.94Å; H158-G179 WeakPolarHBondContact CB-O 3.11Å; H158-S188 PolarHBondContact CE1-O 3.09Å; H158-S188 VanDerWaalsContact CE1-O 3.29Å; H158-S188 PolarHBondContact ND1-OG 2.91Å
159	T	95	Very high	92	Very high	62 Å²	62	41 Å²	41	38%	0.38	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-88	67.3	172.9	-56.4	0	0	0	0	108.8	K141 G179 G181	K141-T159 WeakPolarHBondContact CE-OG1 2.97Å; K141-T159 PolarHBondContact NZ-OG1 2.89Å; T159-G179 PolarHBondContact N-O 3.42Å; T159-G179 CarbonylContact O-C 3.57Å; T159-G181 PolarHBondContact O-N 3.03Å
160	G	93.3	Very high	93.3	Very high	22 Å²	22	36.6 Å²	36.6	23%	0.227	21%	0.209	C	C	.	.	S	Bend	trans	138.7	-179.8	-173.9	0	0	0	0	0	111.7	G122 H158 V162	G122-G160 WeakPolarHBondContact CA-O 3.13Å; G122-G160 PolarHBondContact N-O 2.81Å; H158-G160 WeakPolarHBondContact CB-O 3.5Å; H158-G160 PolarHBondContact O-N 3.03Å; H158-G160 VanDerWaalsContact O-N 3.11Å; G160-V162 PolarHBondContact O-N 2.95Å
161	P	94.4	Very high	93.9	Very high	30 Å²	30	35.3 Å²	35.3	20%	0.195	20%	0.197	C	C	.	.			trans	-55.2	139.1	-173	-27.8	35	0	0	0	113.8	R120 L163 G178 G179	R120-P161 HydrophobicContact CB-CG 4.48Å; R120-P161 WeakPolarHBondContact O-CA 3.43Å; P161-L163 HydrophobicContact CB-CD2 4.1Å; P161-L163 HydrophobicContact CB-CG 4.5Å; P161-L163 PolarHBondContact O-N 2.92Å; P161-G178 CarbonylContact O-C 3.56Å; P161-G178 WeakPolarHBondContact O-CA 3.43Å; P161-G179 PolarHBondContact O-N 2.87Å
162	V	97.2	Very high	94	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	120.1	163.5	-174	0	0	0	0	107.3	T103 G119 R123 V124 G160 L165	T103-V162 WeakPolarHBondContact CB-O 3.34Å; T103-V162 PolarHBondContact OG1-O 2.8Å; G119-V162 PolarHBondContact O-N 2.75Å; R123-V162 WeakPolarHBondContact O-CG2 3.32Å; V124-V162 HydrophobicContact CG2-CG1 4.17Å; V124-V162 HydrophobicContact CG2-CG2 3.73Å; G160-V162 PolarHBondContact O-N 2.95Å; V162-L165 HydrophobicContact CG1-CD1 4.46Å
163	L	95.6	Very high	94.2	Very high	9 Å²	9	35 Å²	35	5%	0.047	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-23.8	-173.8	-64.5	172.3	0	0	0	112.8	Q104 P161 W177 V250 P252 I253	Q104-L163 PolarHBondContact NE2-O 3.32Å; P161-L163 HydrophobicContact CB-CD2 4.1Å; P161-L163 HydrophobicContact CB-CG 4.5Å; P161-L163 PolarHBondContact O-N 2.92Å; L163-W177 WeakPolarHBondContact CA-O 3.35Å; L163-W177 PolarHBondContact N-O 3.36Å; L163-V250 HydrophobicContact CD1-CB 4.19Å; L163-V250 HydrophobicContact CD1-CG1 3.42Å; L163-V250 VanDerWaalsContact CD1-CG1 3.42Å; L163-V250 HydrophobicContact CD2-CB 4.17Å; L163-V250 HydrophobicContact CD2-CG1 3.94Å; L163-V250 VanDerWaalsContact CD2-O 3.27Å; L163-V250 WeakPolarHBondContact CD2-O 3.34Å; L163-V250 HydrophobicContact CG-CG1 4.31Å; L163-P252 CarbonylContact O-C 3.57Å; L163-P252 WeakPolarHBondContact O-CA 3.3Å; L163-P252 WeakPolarHBondContact O-CB 3.35Å; L163-I253 PolarHBondContact O-N 3.26Å
164	G	97.6	Very high	94.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	145.4	175.5	0	0	0	0	0	110.7	S176 W177	G164-S176 WeakPolarHBondContact O-CA 3.4Å; G164-W177 PolarHBondContact N-O 3.49Å; G164-W177 PolarHBondContact O-N 2.79Å
165	L	98.3	Very high	94.9	Very high	11 Å²	11	21.3 Å²	21.3	6%	0.058	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	123.6	-178	-162.2	66.7	0	0	0	109.3	Q104 T106 V116 V124 V162 L174 I175	Q104-L165 HydrophobicContact CB-CB 3.79Å; Q104-L165 HydrophobicContact CB-CD2 4.24Å; Q104-L165 HydrophobicContact CG-CB 3.99Å; T106-L165 HydrophobicContact CG2-CD2 4.04Å; T106-L165 HydrophobicContact CG2-CG 4.21Å; V116-L165 HydrophobicContact CB-CD2 4.32Å; V116-L165 HydrophobicContact CG1-CD2 3.92Å; V124-L165 HydrophobicContact CG1-CD1 4.17Å; V124-L165 HydrophobicContact CG1-CD2 4.45Å; V124-L165 HydrophobicContact CG2-CD1 4.26Å; V162-L165 HydrophobicContact CG1-CD1 4.46Å; L165-L174 HydrophobicContact CD1-CD1 4.14Å; L165-L174 HydrophobicContact CD1-CD2 3.71Å; L165-L174 HydrophobicContact CD1-CG 3.97Å; L165-L174 HydrophobicContact CG-CD1 4.16Å; L165-L174 HydrophobicContact CG-CD2 4.43Å; L165-I175 WeakPolarHBondContact CA-O 3.37Å
166	K	98	Very high	95.2	Very high	72 Å²	72	21.2 Å²	21.2	31%	0.313	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	134.5	-177.5	-178.2	66.4	-164.8	-119.6	0	110.1	I175 L255 D256	K166-I175 PolarHBondContact N-O 2.95Å; K166-I175 WeakPolarHBondContact O-CB 3.5Å; K166-I175 WeakPolarHBondContact O-CD1 3.45Å; K166-I175 PolarHBondContact O-N 2.94Å; K166-L255 HydrophobicContact CB-CD1 3.46Å; K166-L255 VanDerWaalsContact CB-CD1 3.46Å; K166-L255 HydrophobicContact CB-CG 4.33Å; K166-L255 HydrophobicContact CG-CD1 4.23Å; K166-D256 WeakPolarHBondContact CE-OD1 3.12Å; K166-D256 IonicContact NZ-OD1 3.71Å; K166-D256 PolarHBondContact NZ-OD1 2.81Å
167	F	96.9	Very high	95.3	Very high	13 Å²	13	18.9 Å²	18.9	6%	0.057	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	148.1	167.4	-78.7	-82.9	0	0	0	110.8	T106 W107 P109 V116 Y126 H173 L174	T106-F167 HydrophobicContact CG2-CD2 3.91Å; T106-F167 HydrophobicContact CG2-CE2 3.85Å; W107-F167 WeakPolarHBondContact O-CD2 3.48Å; W107-F167 WeakPolarHBondContact O-CE2 3.43Å; P109-F167 VanDerWaalsContact CD-CG 3.5Å; P109-F167 HydrophobicContact CG-CB 3.87Å; P109-F167 HydrophobicContact CG-CD2 4.5Å; P109-F167 HydrophobicContact CG-CG 4.07Å; V116-F167 HydrophobicContact CB-CE2 4.43Å; V116-F167 HydrophobicContact CG2-CE2 3.71Å; V116-F167 HydrophobicContact CG2-CZ 3.55Å; Y126-F167 HydrophobicContact CE1-CZ 4.18Å; F167-H173 CarbonylContact C-O 3.37Å; F167-H173 WeakPolarHBondContact CA-O 3.48Å; F167-H173 WeakPolarHBondContact CD1-O 3.29Å; F167-L174 HydrophobicContact CD1-CB 4.34Å; F167-L174 HydrophobicContact CD1-CD1 3.88Å; F167-L174 HydrophobicContact CD2-CD1 3.78Å; F167-L174 HydrophobicContact CE1-CB 4.27Å; F167-L174 HydrophobicContact CE1-CD1 3.9Å; F167-L174 HydrophobicContact CE2-CD1 3.81Å; F167-L174 HydrophobicContact CG-CD1 3.82Å; F167-L174 HydrophobicContact CZ-CD1 3.88Å
168	S	94.7	Very high	95.3	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.007	11%	0.113	C	C	.	.			trans	-57	156.5	160.7	54.2	0	0	0	0	110.3	D170 G171 L172 H173	S168-D170 WeakPolarHBondContact CB-OD1 3.35Å; S168-D170 PolarHBondContact O-N 2.69Å; S168-D170 PolarHBondContact OG-OD1 3.06Å; S168-G171 WeakPolarHBondContact O-CA 3.33Å; S168-G171 PolarHBondContact O-N 3.03Å; S168-L172 PolarHBondContact OG-N 3.16Å; S168-H173 PolarHBondContact N-O 3.42Å; S168-H173 PolarHBondContact OG-N 3.39Å; S168-H173 PolarHBondContact OG-O 3.01Å
169	S	92.1	Very high	95.2	Very high	68 Å²	68	19.4 Å²	19.4	48%	0.476	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.2	-176.2	-56.5	0	0	0	0	113.4	G171	S169-G171 VanDerWaalsContact C-N 3.32Å
170	D	89.6	Confident	95.1	Very high	40 Å²	40	17.3 Å²	17.3	21%	0.214	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-9.6	173.9	58.3	19.4	0	0	0	114.3	R110 S168 L172 A268	R110-D170 VanDerWaalsContact CD-O 3.32Å; R110-D170 WeakPolarHBondContact CD-O 3.42Å; R110-D170 PolarHBondContact NH1-O 3.46Å; S168-D170 WeakPolarHBondContact CB-OD1 3.35Å; S168-D170 PolarHBondContact O-N 2.69Å; S168-D170 PolarHBondContact OG-OD1 3.06Å; D170-L172 VanDerWaalsContact C-N 3.26Å; D170-L172 HydrophobicContact CB-CD1 4.46Å; D170-L172 HydrophobicContact CB-CG 4.39Å; D170-L172 PolarHBondContact O-N 2.53Å; D170-L172 PolarHBondContact OD1-N 3.18Å; D170-A268 WeakPolarHBondContact OD2-CB 3.24Å
171	G	91.9	Very high	94.8	Very high	8 Å²	8	18.5 Å²	18.5	8%	0.082	12%	0.118	C	C	.	.	S	Bend	trans	71.9	7.8	-178.2	0	0	0	0	0	116.7	P109 R110 S168 S169	P109-G171 VanDerWaalsContact CG-CA 3.42Å; R110-G171 WeakPolarHBondContact CD-O 3.46Å; S168-G171 WeakPolarHBondContact O-CA 3.33Å; S168-G171 PolarHBondContact O-N 3.03Å; S169-G171 VanDerWaalsContact C-N 3.32Å
172	L	89.8	Confident	94.5	Very high	54 Å²	54	20 Å²	20	28%	0.283	12%	0.124	S	C	.	.	S	Bend	trans	-80	-25.1	-177.4	-67.2	175.4	0	0	0	112.5	S168 D170 A268	S168-L172 PolarHBondContact OG-N 3.16Å; D170-L172 VanDerWaalsContact C-N 3.26Å; D170-L172 HydrophobicContact CB-CD1 4.46Å; D170-L172 HydrophobicContact CB-CG 4.39Å; D170-L172 PolarHBondContact O-N 2.53Å; D170-L172 PolarHBondContact OD1-N 3.18Å; L172-A268 HydrophobicContact CD1-CB 3.78Å
173	H	92.9	Very high	94	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.143	C	C	.	.			trans	-122.2	148.3	-179.3	-48.8	-73.5	0	0	0	111.4	F167 S168 L191 W192 T193 L265 A268 L271	F167-H173 CarbonylContact C-O 3.37Å; F167-H173 WeakPolarHBondContact CA-O 3.48Å; F167-H173 WeakPolarHBondContact CD1-O 3.29Å; S168-H173 PolarHBondContact N-O 3.42Å; S168-H173 PolarHBondContact OG-N 3.39Å; S168-H173 PolarHBondContact OG-O 3.01Å; H173-L191 HydrophobicContact CB-CD1 3.55Å; H173-L191 HydrophobicContact CB-CG 4.5Å; H173-W192 WeakPolarHBondContact CA-O 3.39Å; H173-T193 PolarHBondContact CE1-OG1 2.85Å; H173-T193 WeakPolarHBondContact ND1-CB 3.26Å; H173-T193 PolarHBondContact ND1-OG1 2.94Å; H173-T193 VanDerWaalsContact ND1-OG1 3.11Å; H173-L265 PolarHBondContact CE1-O 2.78Å; H173-L265 VanDerWaalsContact CE1-O 3.26Å; H173-L265 PolarHBondContact NE2-O 3.44Å; H173-A268 WeakPolarHBondContact NE2-CB 3.41Å; H173-L271 HydrophobicContact CB-CD1 4.32Å
174	L	96.4	Very high	93.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.8	168.6	-173.1	75.6	0	0	0	109.4	V116 V124 Y126 L139 L165 F167 L191 W192	V116-L174 HydrophobicContact CG1-CD2 4.06Å; V124-L174 HydrophobicContact CG1-CD2 3.95Å; Y126-L174 HydrophobicContact CE2-CD2 4.5Å; L139-L174 HydrophobicContact CD1-CD2 3.64Å; L165-L174 HydrophobicContact CD1-CD1 4.14Å; L165-L174 HydrophobicContact CD1-CD2 3.71Å; L165-L174 HydrophobicContact CD1-CG 3.97Å; L165-L174 HydrophobicContact CG-CD1 4.16Å; L165-L174 HydrophobicContact CG-CD2 4.43Å; F167-L174 HydrophobicContact CD1-CB 4.34Å; F167-L174 HydrophobicContact CD1-CD1 3.88Å; F167-L174 HydrophobicContact CD2-CD1 3.78Å; F167-L174 HydrophobicContact CE1-CB 4.27Å; F167-L174 HydrophobicContact CE1-CD1 3.9Å; F167-L174 HydrophobicContact CE2-CD1 3.81Å; F167-L174 HydrophobicContact CG-CD1 3.82Å; F167-L174 HydrophobicContact CZ-CD1 3.88Å; L174-L191 CarbonylContact O-C 3.58Å; L174-W192 HydrophobicContact CB-CB 4.15Å; L174-W192 PolarHBondContact N-O 2.9Å; L174-W192 WeakPolarHBondContact O-CB 3.23Å; L174-W192 VanDerWaalsContact O-CD1 3.27Å; L174-W192 PolarHBondContact O-N 3.46Å
175	I	97.9	Very high	92.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.5	176.2	-60.6	83.1	0	0	0	107.5	L165 K166 L189 R190 L191 L255 T257 L271 I273	L165-I175 WeakPolarHBondContact CA-O 3.37Å; K166-I175 PolarHBondContact N-O 2.95Å; K166-I175 WeakPolarHBondContact O-CB 3.5Å; K166-I175 WeakPolarHBondContact O-CD1 3.45Å; K166-I175 PolarHBondContact O-N 2.94Å; I175-L189 HydrophobicContact CG2-CD1 3.58Å; I175-R190 WeakPolarHBondContact CA-O 3.36Å; I175-L191 HydrophobicContact CD1-CD1 4.28Å; I175-L191 HydrophobicContact CG1-CD1 4.03Å; I175-L255 HydrophobicContact CB-CD1 4.24Å; I175-L255 HydrophobicContact CG2-CD1 3.83Å; I175-L255 HydrophobicContact CG2-CD2 4.4Å; I175-T257 HydrophobicContact CB-CG2 4.46Å; I175-T257 HydrophobicContact CD1-CG2 3.71Å; I175-T257 HydrophobicContact CG1-CG2 3.82Å; I175-L271 HydrophobicContact CD1-CD1 4.28Å; I175-I273 HydrophobicContact CG1-CD1 4.05Å; I175-I273 HydrophobicContact CG1-CG1 4.42Å; I175-I273 HydrophobicContact CG2-CD1 4.33Å; I175-I273 HydrophobicContact CG2-CG2 3.85Å
176	S	98.4	Very high	92.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	143.5	174.9	71.7	0	0	0	0	112.1	H158 G164 R190 W192	H158-S176 WeakPolarHBondContact NE2-CB 3.37Å; H158-S176 PolarHBondContact NE2-OG 3.26Å; G164-S176 WeakPolarHBondContact O-CA 3.4Å; S176-R190 PolarHBondContact N-O 2.8Å; S176-R190 PolarHBondContact O-N 3.14Å; S176-W192 PolarHBondContact OG-NE1 2.96Å
177	W	97.8	Very high	92.2	Very high	6 Å²	6	27.1 Å²	27.1	2%	0.023	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.3	175.3	172	-113.4	0	0	0	108.3	L163 G164 A187 S188 L189 I216 L218 I253 L255 V275 V277 L282	L163-W177 WeakPolarHBondContact CA-O 3.35Å; L163-W177 PolarHBondContact N-O 3.36Å; G164-W177 PolarHBondContact N-O 3.49Å; G164-W177 PolarHBondContact O-N 2.79Å; W177-A187 HydrophobicContact CD2-CB 4.19Å; W177-A187 HydrophobicContact CE3-CB 4.36Å; W177-A187 HydrophobicContact CH2-CB 3.47Å; W177-A187 VanDerWaalsContact CH2-CB 3.47Å; W177-A187 HydrophobicContact CZ2-CB 3.26Å; W177-A187 HydrophobicContact CZ3-CB 4.03Å; W177-S188 VanDerWaalsContact CE3-O 3.26Å; W177-L189 HydrophobicContact CE3-CB 3.88Å; W177-L189 HydrophobicContact CZ3-CB 4.08Å; W177-I216 HydrophobicContact CH2-CB 4.02Å; W177-I216 HydrophobicContact CH2-CD1 3.83Å; W177-I216 HydrophobicContact CH2-CG1 4.04Å; W177-I216 HydrophobicContact CZ3-CD1 4Å; W177-I216 HydrophobicContact CZ3-CG1 4.26Å; W177-L218 HydrophobicContact CZ2-CD2 4.08Å; W177-I253 HydrophobicContact CG-CD1 4.36Å; W177-L255 HydrophobicContact CB-CD2 3.64Å; W177-V275 HydrophobicContact CB-CG1 4.18Å; W177-V275 HydrophobicContact CD2-CG1 3.64Å; W177-V275 HydrophobicContact CE3-CG1 4.01Å; W177-V275 HydrophobicContact CG-CG1 3.71Å; W177-V275 HydrophobicContact CZ2-CG1 4.5Å; W177-V277 HydrophobicContact CH2-CG2 3.98Å; W177-V277 HydrophobicContact CZ2-CG1 4.45Å; W177-V277 HydrophobicContact CZ2-CG2 3.82Å; W177-L282 HydrophobicContact CZ3-CD2 4.34Å
178	G	96.7	Very high	92.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	-179.6	-176.3	0	0	0	0	0	114.3	H158 P161 S180 A187 S188	H158-G178 PolarHBondContact CE1-N 2.94Å; P161-G178 CarbonylContact O-C 3.56Å; P161-G178 WeakPolarHBondContact O-CA 3.43Å; G178-S180 PolarHBondContact O-N 3.02Å; G178-A187 CarbonylContact O-C 3.5Å; G178-A187 WeakPolarHBondContact O-CA 3.36Å; G178-A187 WeakPolarHBondContact O-CB 3.19Å; G178-S188 PolarHBondContact N-O 3.01Å; G178-S188 VanDerWaalsContact N-O 3.16Å; G178-S188 PolarHBondContact O-N 3.27Å; G178-S188 PolarHBondContact O-OG 2.71Å
179	G	94.7	Very high	92.2	Very high	12 Å²	12	26.6 Å²	26.6	12%	0.124	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	134.3	-178.3	0	0	0	0	0	113.2	H158 T159 P161	H158-G179 WeakPolarHBondContact CB-O 3.11Å; T159-G179 PolarHBondContact N-O 3.42Å; T159-G179 CarbonylContact O-C 3.57Å; P161-G179 PolarHBondContact O-N 2.87Å
180	S	92.7	Very high	92.4	Very high	17 Å²	17	24.3 Å²	24.3	12%	0.119	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-92.6	-20.3	178.7	59.8	0	0	0	0	113.7	G178 L182 S186 N215	G178-S180 PolarHBondContact O-N 3.02Å; S180-L182 PolarHBondContact O-N 3.37Å; S180-L182 PolarHBondContact OG-N 3.14Å; S180-S186 PolarHBondContact N-O 3.15Å; S180-S186 WeakPolarHBondContact OG-CB 3.44Å; S180-S186 PolarHBondContact OG-O 3.19Å; S180-N215 WeakPolarHBondContact CB-OD1 3.3Å
181	G	88.1	Confident	92.7	Very high	47 Å²	47	22.5 Å²	22.5	49%	0.485	14%	0.142	S	C	.	.	S	Bend	trans	78.3	-8.3	-171.1	0	0	0	0	0	114.9	T159	T159-G181 PolarHBondContact O-N 3.03Å
182	L	87.6	Confident	92.8	Very high	61 Å²	61	22.1 Å²	22.1	32%	0.319	14%	0.138	S	C	.	.	S	Bend	trans	-67	-48.6	-180	179.8	64.1	0	0	0	112	S180 N215 V217 F233	S180-L182 PolarHBondContact O-N 3.37Å; S180-L182 PolarHBondContact OG-N 3.14Å; L182-N215 HydrophobicContact CD2-CB 3.92Å; L182-V217 HydrophobicContact CD2-CG2 4.4Å; L182-F233 HydrophobicContact CD1-CE2 4.47Å
183	T	86.3	Confident	92.8	Very high	66 Å²	66	19.7 Å²	19.7	41%	0.405	13%	0.126	S	C	.	.	S	Bend	trans	-140.2	166.5	169	81.7	0	0	0	0	108.9	N185 S186	T183-N185 PolarHBondContact O-N 2.93Å; T183-N185 VanDerWaalsContact O-N 3.08Å; T183-N185 VanDerWaalsContact OG1-C 3.3Å; T183-N185 PolarHBondContact OG1-N 3.07Å; T183-N185 VanDerWaalsContact OG1-N 3.1Å; T183-S186 WeakPolarHBondContact CB-OG 3.08Å; T183-S186 PolarHBondContact N-OG 2.72Å; T183-S186 PolarHBondContact O-N 3.41Å; T183-S186 VanDerWaalsContact O-N 3.09Å; T183-S186 PolarHBondContact OG1-N 3.19Å; T183-S186 PolarHBondContact OG1-OG 3.22Å
184	V	81.5	Confident	92.3	Very high	124 Å²	124	20.4 Å²	20.4	75%	0.752	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.1	173.3	-60.1	0	0	0	0	113
185	N	85.2	Confident	91.3	Very high	44 Å²	44	20.6 Å²	20.6	24%	0.235	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	38.2	179.4	-68.4	-28.8	0	0	0	110.9	T183 L218 N219	T183-N185 PolarHBondContact O-N 2.93Å; T183-N185 VanDerWaalsContact O-N 3.08Å; T183-N185 VanDerWaalsContact OG1-C 3.3Å; T183-N185 PolarHBondContact OG1-N 3.07Å; T183-N185 VanDerWaalsContact OG1-N 3.1Å; N185-L218 HydrophobicContact CB-CB 4.4Å; N185-L218 WeakPolarHBondContact O-CA 3.29Å; N185-L218 WeakPolarHBondContact O-CB 3.38Å; N185-L218 WeakPolarHBondContact O-CG 3.38Å; N185-L218 PolarHBondContact O-N 2.63Å; N185-N219 HydrophobicContact CB-CB 4.48Å; N185-N219 PolarHBondContact ND2-ND2 2.88Å; N185-N219 PolarHBondContact ND2-OD1 2.73Å
186	S	90.8	Very high	89.9	Confident	6 Å²	6	25.3 Å²	25.3	4%	0.042	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134.1	174.1	-61.2	0	0	0	0	111.6	S180 T183 I216	S180-S186 PolarHBondContact N-O 3.15Å; S180-S186 WeakPolarHBondContact OG-CB 3.44Å; S180-S186 PolarHBondContact OG-O 3.19Å; T183-S186 WeakPolarHBondContact CB-OG 3.08Å; T183-S186 PolarHBondContact N-OG 2.72Å; T183-S186 PolarHBondContact O-N 3.41Å; T183-S186 VanDerWaalsContact O-N 3.09Å; T183-S186 PolarHBondContact OG1-N 3.19Å; T183-S186 PolarHBondContact OG1-OG 3.22Å; S186-I216 CarbonylContact C-O 3.54Å; S186-I216 VanDerWaalsContact CA-O 3.25Å; S186-I216 WeakPolarHBondContact CA-O 3.43Å
187	A	93.4	Very high	88.4	Confident	2 Å²	2	27.8 Å²	27.8	2%	0.017	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	160.6	178.3	0	0	0	0	0	111.4	W177 G178 I216 L218	W177-A187 HydrophobicContact CD2-CB 4.19Å; W177-A187 HydrophobicContact CE3-CB 4.36Å; W177-A187 HydrophobicContact CH2-CB 3.47Å; W177-A187 VanDerWaalsContact CH2-CB 3.47Å; W177-A187 HydrophobicContact CZ2-CB 3.26Å; W177-A187 HydrophobicContact CZ3-CB 4.03Å; G178-A187 CarbonylContact O-C 3.5Å; G178-A187 WeakPolarHBondContact O-CA 3.36Å; G178-A187 WeakPolarHBondContact O-CB 3.19Å; A187-I216 PolarHBondContact N-O 3.25Å; A187-I216 PolarHBondContact O-N 3.09Å; A187-L218 HydrophobicContact CB-CD2 4.37Å
188	S	95.1	Very high	86.9	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	140.1	-179.9	53.3	0	0	0	0	109.5	H158 W177 G178	H158-S188 PolarHBondContact CE1-O 3.09Å; H158-S188 VanDerWaalsContact CE1-O 3.29Å; H158-S188 PolarHBondContact ND1-OG 2.91Å; W177-S188 VanDerWaalsContact CE3-O 3.26Å; G178-S188 PolarHBondContact N-O 3.01Å; G178-S188 VanDerWaalsContact N-O 3.16Å; G178-S188 PolarHBondContact O-N 3.27Å; G178-S188 PolarHBondContact O-OG 2.71Å
189	L	97.3	Very high	84.9	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.5	168.8	172.8	64.1	0	0	0	108.3	I175 W177 N212 F213 I273 V275 L282 S284	I175-L189 HydrophobicContact CG2-CD1 3.58Å; W177-L189 HydrophobicContact CE3-CB 3.88Å; W177-L189 HydrophobicContact CZ3-CB 4.08Å; L189-N212 PolarHBondContact O-OD1 3.1Å; L189-F213 HydrophobicContact CB-CB 4.09Å; L189-F213 HydrophobicContact CB-CD2 4.35Å; L189-F213 HydrophobicContact CB-CG 4.44Å; L189-F213 HydrophobicContact CD2-CB 4.17Å; L189-F213 HydrophobicContact CD2-CD1 4.31Å; L189-F213 HydrophobicContact CD2-CD2 4.03Å; L189-F213 HydrophobicContact CD2-CG 3.9Å; L189-F213 HydrophobicContact CG-CB 4.27Å; L189-F213 HydrophobicContact CG-CD2 3.8Å; L189-F213 HydrophobicContact CG-CE2 4.42Å; L189-F213 HydrophobicContact CG-CG 4.09Å; L189-F213 WeakPolarHBondContact O-CD2 3.26Å; L189-F213 PolarHBondContact O-N 3.08Å; L189-F213 VanDerWaalsContact O-N 3.11Å; L189-I273 HydrophobicContact CD1-CG2 4.16Å; L189-I273 HydrophobicContact CD2-CD1 4.41Å; L189-I273 HydrophobicContact CD2-CG2 4.11Å; L189-V275 HydrophobicContact CD1-CG2 3.99Å; L189-V275 HydrophobicContact CD2-CG2 4.27Å; L189-L282 HydrophobicContact CB-CD2 4.42Å; L189-L282 HydrophobicContact CD2-CD2 4.09Å; L189-S284 VanDerWaalsContact CD2-OG 3.23Å; L189-S284 WeakPolarHBondContact CD2-OG 3.43Å
190	R	96.4	Very high	82.8	Confident	21 Å²	21	39.6 Å²	39.6	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.3	175.5	-67.4	173.2	178.2	-103.2	-0.5	110.4	A157 I175 S176 W192 V211	A157-R190 WeakPolarHBondContact O-CD 3.45Å; A157-R190 PolarHBondContact O-NE 3.12Å; I175-R190 WeakPolarHBondContact CA-O 3.36Å; S176-R190 PolarHBondContact N-O 2.8Å; S176-R190 PolarHBondContact O-N 3.14Å; R190-W192 HydrophobicContact CB-CZ2 4.42Å; R190-V211 WeakPolarHBondContact CA-O 3.37Å
191	L	95.4	Very high	80.8	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	129.9	165.1	171.3	81.5	0	0	0	107.4	H173 L174 I175 P210 V211 F213 L265 L271 A286	H173-L191 HydrophobicContact CB-CD1 3.55Å; H173-L191 HydrophobicContact CB-CG 4.5Å; L174-L191 CarbonylContact O-C 3.58Å; I175-L191 HydrophobicContact CD1-CD1 4.28Å; I175-L191 HydrophobicContact CG1-CD1 4.03Å; L191-P210 CarbonylContact O-C 3.49Å; L191-P210 WeakPolarHBondContact O-CA 3.23Å; L191-V211 HydrophobicContact CB-CB 4.23Å; L191-V211 HydrophobicContact CD2-CB 4.38Å; L191-V211 HydrophobicContact CD2-CG2 4.32Å; L191-V211 PolarHBondContact N-O 3.28Å; L191-V211 PolarHBondContact O-N 2.93Å; L191-F213 HydrophobicContact CB-CE2 3.63Å; L191-F213 HydrophobicContact CB-CZ 4.11Å; L191-L265 HydrophobicContact CD1-CD2 4.22Å; L191-L265 HydrophobicContact CD2-CD1 3.69Å; L191-L265 HydrophobicContact CD2-CD2 3.57Å; L191-L265 HydrophobicContact CD2-CG 4.05Å; L191-L265 HydrophobicContact CG-CD2 4.49Å; L191-L271 HydrophobicContact CD1-CD1 3.91Å; L191-A286 HydrophobicContact CD2-CB 4.39Å
192	W	94.6	Very high	78.7	Confident	0 Å²	0	47 Å²	47	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	115.9	176.5	-57.8	91.1	0	0	0	108.1	L139 N140 K141 A157 H173 L174 S176 R190 L208 R209 P210	L139-W192 HydrophobicContact CB-CD2 4.21Å; L139-W192 HydrophobicContact CB-CE3 3.96Å; L139-W192 HydrophobicContact CB-CH2 3.85Å; L139-W192 HydrophobicContact CB-CZ2 4.12Å; L139-W192 HydrophobicContact CB-CZ3 3.76Å; L139-W192 HydrophobicContact CD1-CB 4.34Å; L139-W192 HydrophobicContact CD1-CD2 3.6Å; L139-W192 HydrophobicContact CD1-CE3 4.09Å; L139-W192 HydrophobicContact CD1-CG 3.69Å; L139-W192 HydrophobicContact CD1-CZ2 4.42Å; L139-W192 HydrophobicContact CD2-CD2 4.2Å; L139-W192 HydrophobicContact CD2-CE3 3.91Å; L139-W192 HydrophobicContact CD2-CZ3 4.45Å; L139-W192 HydrophobicContact CG-CD2 4.22Å; L139-W192 HydrophobicContact CG-CE3 4.2Å; N140-W192 WeakPolarHBondContact O-CZ3 3.25Å; K141-W192 HydrophobicContact CB-CH2 4.42Å; A157-W192 HydrophobicContact CB-CH2 4.08Å; A157-W192 HydrophobicContact CB-CZ2 3.6Å; H173-W192 WeakPolarHBondContact CA-O 3.39Å; L174-W192 HydrophobicContact CB-CB 4.15Å; L174-W192 PolarHBondContact N-O 2.9Å; L174-W192 WeakPolarHBondContact O-CB 3.23Å; L174-W192 VanDerWaalsContact O-CD1 3.27Å; L174-W192 PolarHBondContact O-N 3.46Å; S176-W192 PolarHBondContact OG-NE1 2.96Å; R190-W192 HydrophobicContact CB-CZ2 4.42Å; W192-L208 HydrophobicContact CB-CB 4.01Å; W192-L208 HydrophobicContact CB-CD1 4.09Å; W192-R209 WeakPolarHBondContact CA-O 3.19Å; W192-P210 HydrophobicContact CD2-CB 4.35Å; W192-P210 HydrophobicContact CE3-CB 3.87Å; W192-P210 HydrophobicContact CE3-CG 4.38Å; W192-P210 HydrophobicContact CH2-CB 3.88Å; W192-P210 HydrophobicContact CH2-CG 4.27Å; W192-P210 HydrophobicContact CZ2-CB 4.34Å; W192-P210 HydrophobicContact CZ3-CB 3.62Å; W192-P210 HydrophobicContact CZ3-CG 3.84Å
193	T	89.8	Confident	77	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.025	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145.3	-169.1	-177.6	0	0	0	0	110.9	H173 L208 R209 V211 W266	H173-T193 PolarHBondContact CE1-OG1 2.85Å; H173-T193 WeakPolarHBondContact ND1-CB 3.26Å; H173-T193 PolarHBondContact ND1-OG1 2.94Å; H173-T193 VanDerWaalsContact ND1-OG1 3.11Å; T193-L208 CarbonylContact O-C 3.56Å; T193-L208 WeakPolarHBondContact O-CA 3.36Å; T193-R209 PolarHBondContact N-O 3.15Å; T193-R209 PolarHBondContact O-N 2.54Å; T193-V211 HydrophobicContact CG2-CG2 3.89Å; T193-W266 HydrophobicContact CG2-CE3 3.62Å; T193-W266 HydrophobicContact CG2-CZ3 3.62Å
194	P	83.5	Confident	75.6	Confident	14 Å²	14	52.9 Å²	52.9	9%	0.091	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	150.2	167.4	25.5	-33.7	0	0	0	110.5	D198	P194-D198 HydrophobicContact CB-CB 4.02Å
195	G	75.3	Confident	74.7	Confident	4 Å²	4	49.2 Å²	49.2	4%	0.041	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-75.5	165.1	171.8	0	0	0	0	0	112	G197 D198	G195-G197 PolarHBondContact O-N 3.17Å; G195-G197 VanDerWaalsContact O-N 3.14Å; G195-D198 WeakPolarHBondContact CA-OD2 3.17Å; G195-D198 PolarHBondContact N-OD2 2.91Å; G195-D198 PolarHBondContact O-N 3.36Å; G195-D198 VanDerWaalsContact O-N 3.13Å
196	P	68.4	Low	73.7	Confident	99 Å²	99	49.9 Å²	49.9	64%	0.643	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	120.5	168.9	-18.4	29.2	0	0	0	110
197	G	65.3	Low	73.1	Confident	52 Å²	52	54.8 Å²	54.8	54%	0.536	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	94	-6	179.3	0	0	0	0	0	116.1	G195 C199	G195-G197 PolarHBondContact O-N 3.17Å; G195-G197 VanDerWaalsContact O-N 3.14Å; G197-C199 VanDerWaalsContact C-N 3.26Å; G197-C199 PolarHBondContact O-N 3.22Å
198	D	66.2	Low	72.9	Confident	28 Å²	28	55.1 Å²	55.1	15%	0.15	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-76.9	-14.7	175.7	-70.9	-33.7	0	0	0	112.5	P194 G195 D200 Q201 R209	P194-D198 HydrophobicContact CB-CB 4.02Å; G195-D198 WeakPolarHBondContact CA-OD2 3.17Å; G195-D198 PolarHBondContact N-OD2 2.91Å; G195-D198 PolarHBondContact O-N 3.36Å; G195-D198 VanDerWaalsContact O-N 3.13Å; D198-D200 PolarHBondContact O-N 2.87Å; D198-Q201 PolarHBondContact O-N 3.31Å; D198-R209 IonicContact OD2-NH2 3.44Å
199	C	55.5	Low	72.6	Confident	86 Å²	86	60.2 Å²	60.2	58%	0.581	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-61.7	-22.6	179.7	-57.5	0	0	0	0	113.7	G197	G197-C199 VanDerWaalsContact C-N 3.26Å; G197-C199 PolarHBondContact O-N 3.22Å
200	D	51.3	Low	72.3	Confident	152 Å²	152	61.6 Å²	61.6	81%	0.813	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-93.6	-4.7	-175.3	-68.3	-24.1	0	0	0	113.8	D198	D198-D200 PolarHBondContact O-N 2.87Å
201	Q	50.1	Low	72.1	Confident	97 Å²	97	62 Å²	62	45%	0.453	35%	0.35	S	S	.	.			trans	-81.2	129.6	-177.2	-64.9	-167.8	22	0	0	111.9	D198 S203	D198-Q201 PolarHBondContact O-N 3.31Å; Q201-S203 PolarHBondContact O-N 2.81Å
202	S	44.8	Very low	72	Confident	122 Å²	122	65.3 Å²	65.3	85%	0.853	37%	0.368	S	S	*	.			trans	-67.7	4.1	173.4	57.6	0	0	0	0	114.4	H204	S202-H204 PolarHBondContact O-N 2.99Å
203	S	51.6	Low	71.9	Confident	58 Å²	58	66.2 Å²	66.2	41%	0.406	37%	0.372	S	S	.	.			trans	-71.1	124.6	176.8	60.1	0	0	0	0	109.3	Q201 I205	Q201-S203 PolarHBondContact O-N 2.81Å; S203-I205 PolarHBondContact O-N 3.24Å; S203-I205 PolarHBondContact OG-O 3Å
204	H	55.6	Low	71.8	Confident	193 Å²	193	66.9 Å²	66.9	89%	0.894	38%	0.379	S	S	*	.	S	Bend	trans	-63.1	-4.2	178.4	-76.1	-73.9	0	0	0	114.1	S202	S202-H204 PolarHBondContact O-N 2.99Å
205	I	63	Low	72	Confident	48 Å²	48	67.1 Å²	67.1	25%	0.246	38%	0.38	C	S	.	.	S	Bend	trans	-126.1	114.6	-175.2	-58.1	176	0	0	0	108.2	I136 Y137 S203	I136-I205 HydrophobicContact CB-CD1 3.78Å; I136-I205 HydrophobicContact CD1-CD1 3.66Å; I136-I205 HydrophobicContact CD1-CG1 4Å; I136-I205 HydrophobicContact CG1-CD1 3.81Å; Y137-I205 VanDerWaalsContact CB-CG2 3.46Å; Y137-I205 HydrophobicContact CD1-CG2 3.9Å; Y137-I205 HydrophobicContact CD2-CG2 3.74Å; Y137-I205 HydrophobicContact CG-CG2 3.45Å; Y137-I205 VanDerWaalsContact CG-CG2 3.45Å; S203-I205 PolarHBondContact O-N 3.24Å; S203-I205 PolarHBondContact OG-O 3Å
206	P	64.3	Low	72.5	Confident	58 Å²	58	67.3 Å²	67.3	38%	0.377	38%	0.38	S	S	.	.			trans	-70	135.5	-178.5	27.8	-32.9	0	0	0	111.2	L208	P206-L208 HydrophobicContact CB-CD2 3.77Å; P206-L208 HydrophobicContact CB-CG 4.06Å; P206-L208 HydrophobicContact CG-CD1 4.28Å; P206-L208 HydrophobicContact CG-CD2 4.01Å; P206-L208 HydrophobicContact CG-CG 3.97Å; P206-L208 PolarHBondContact O-N 2.94Å
207	R	78.7	Confident	73.2	Confident	109 Å²	109	63.7 Å²	63.7	41%	0.411	36%	0.356	S	S	.	.			trans	-73.4	89.8	167.5	-72.1	-172.4	174.6	-157.3	-5.7	108.9	D148	D148-R207 IonicContact OD1-CZ 3.07Å; D148-R207 IonicContact OD1-NH1 3.33Å; D148-R207 PolarHBondContact OD1-NH1 3.4Å; D148-R207 IonicContact OD1-NH2 3.75Å; D148-R207 PolarHBondContact OD1-NH2 3Å
208	L	88.5	Confident	73.5	Confident	9 Å²	9	62 Å²	62	5%	0.047	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	133.6	-177.4	-59.4	-179.9	0	0	0	111.8	Y126 Y137 L139 W192 T193 P206	Y126-L208 WeakPolarHBondContact OH-CD1 3.5Å; Y137-L208 PolarHBondContact OH-N 3.06Å; Y137-L208 VanDerWaalsContact OH-N 3.09Å; Y137-L208 PolarHBondContact OH-O 3.26Å; L139-L208 HydrophobicContact CD2-CB 3.99Å; L139-L208 HydrophobicContact CD2-CD1 4.27Å; W192-L208 HydrophobicContact CB-CB 4.01Å; W192-L208 HydrophobicContact CB-CD1 4.09Å; T193-L208 CarbonylContact O-C 3.56Å; T193-L208 WeakPolarHBondContact O-CA 3.36Å; P206-L208 HydrophobicContact CB-CD2 3.77Å; P206-L208 HydrophobicContact CB-CG 4.06Å; P206-L208 HydrophobicContact CG-CD1 4.28Å; P206-L208 HydrophobicContact CG-CD2 4.01Å; P206-L208 HydrophobicContact CG-CG 3.97Å; P206-L208 PolarHBondContact O-N 2.94Å
209	R	88.2	Confident	73.6	Confident	108 Å²	108	65.2 Å²	65.2	41%	0.408	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	145.7	177.5	-54.7	-176.1	-163.9	-170.1	3.3	110.5	W192 T193 D198	W192-R209 WeakPolarHBondContact CA-O 3.19Å; T193-R209 PolarHBondContact N-O 3.15Å; T193-R209 PolarHBondContact O-N 2.54Å; D198-R209 IonicContact OD2-NH2 3.44Å
210	P	92.4	Very high	73.7	Confident	31 Å²	31	62.2 Å²	62.2	20%	0.201	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	131.2	179.2	30.7	-32.4	0	0	0	112	L191 W192	L191-P210 CarbonylContact O-C 3.49Å; L191-P210 WeakPolarHBondContact O-CA 3.23Å; W192-P210 HydrophobicContact CD2-CB 4.35Å; W192-P210 HydrophobicContact CE3-CB 3.87Å; W192-P210 HydrophobicContact CE3-CG 4.38Å; W192-P210 HydrophobicContact CH2-CB 3.88Å; W192-P210 HydrophobicContact CH2-CG 4.27Å; W192-P210 HydrophobicContact CZ2-CB 4.34Å; W192-P210 HydrophobicContact CZ3-CB 3.62Å; W192-P210 HydrophobicContact CZ3-CG 3.84Å
211	V	92	Very high	73.6	Confident	29 Å²	29	64.2 Å²	64.2	18%	0.176	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	122.7	154.8	-179.4	0	0	0	0	107.3	R190 L191 T193 F213 W266 T291	R190-V211 WeakPolarHBondContact CA-O 3.37Å; L191-V211 HydrophobicContact CB-CB 4.23Å; L191-V211 HydrophobicContact CD2-CB 4.38Å; L191-V211 HydrophobicContact CD2-CG2 4.32Å; L191-V211 PolarHBondContact N-O 3.28Å; L191-V211 PolarHBondContact O-N 2.93Å; T193-V211 HydrophobicContact CG2-CG2 3.89Å; V211-F213 HydrophobicContact CG1-CE2 4.22Å; V211-F213 HydrophobicContact CG1-CZ 4.41Å; V211-W266 HydrophobicContact CG2-CH2 4.09Å; V211-W266 HydrophobicContact CG2-CZ3 3.69Å; V211-T291 HydrophobicContact CG1-CG2 3.95Å
212	N	92	Very high	73.6	Confident	71 Å²	71	62.2 Å²	62.2	38%	0.38	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.7	-177.5	-169.5	-11.1	0	0	0	110.4	L189 G214	L189-N212 PolarHBondContact O-OD1 3.1Å; N212-G214 VanDerWaalsContact C-N 3.33Å; N212-G214 PolarHBondContact OD1-N 2.9Å
213	F	92.6	Very high	73.7	Confident	19 Å²	19	61.4 Å²	61.4	8%	0.083	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	14.2	180	-64.5	-102.1	0	0	0	112.7	L189 L191 V211 I273 S285 A286 T291 T293	L189-F213 HydrophobicContact CB-CB 4.09Å; L189-F213 HydrophobicContact CB-CD2 4.35Å; L189-F213 HydrophobicContact CB-CG 4.44Å; L189-F213 HydrophobicContact CD2-CB 4.17Å; L189-F213 HydrophobicContact CD2-CD1 4.31Å; L189-F213 HydrophobicContact CD2-CD2 4.03Å; L189-F213 HydrophobicContact CD2-CG 3.9Å; L189-F213 HydrophobicContact CG-CB 4.27Å; L189-F213 HydrophobicContact CG-CD2 3.8Å; L189-F213 HydrophobicContact CG-CE2 4.42Å; L189-F213 HydrophobicContact CG-CG 4.09Å; L189-F213 WeakPolarHBondContact O-CD2 3.26Å; L189-F213 PolarHBondContact O-N 3.08Å; L189-F213 VanDerWaalsContact O-N 3.11Å; L191-F213 HydrophobicContact CB-CE2 3.63Å; L191-F213 HydrophobicContact CB-CZ 4.11Å; V211-F213 HydrophobicContact CG1-CE2 4.22Å; V211-F213 HydrophobicContact CG1-CZ 4.41Å; F213-I273 HydrophobicContact CZ-CD1 4.18Å; F213-S285 WeakPolarHBondContact CE1-O 3.42Å; F213-A286 HydrophobicContact CE1-CB 3.97Å; F213-A286 HydrophobicContact CZ-CB 3.66Å; F213-T291 HydrophobicContact CE1-CG2 4.22Å; F213-T293 HydrophobicContact CB-CG2 4.2Å; F213-T293 HydrophobicContact CD1-CG2 4.07Å
214	G	87.7	Confident	73.4	Confident	17 Å²	17	65.5 Å²	65.5	18%	0.175	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	90.2	179.1	-179	0	0	0	0	0	113.5	N212	N212-G214 VanDerWaalsContact C-N 3.33Å; N212-G214 PolarHBondContact OD1-N 2.9Å
215	N	89.4	Confident	73	Confident	20 Å²	20	59.3 Å²	59.3	11%	0.107	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.3	-177.8	-64.1	-37.3	0	0	0	110.2	S180 L182 A228	S180-N215 WeakPolarHBondContact CB-OD1 3.3Å; L182-N215 HydrophobicContact CD2-CB 3.92Å; N215-A228 WeakPolarHBondContact ND2-CB 3.47Å
216	I	85.3	Confident	72.4	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.036	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116	177.8	-47.7	-163.8	0	0	0	108.5	W177 S186 A187 L218 L225 V277 L282 I295	W177-I216 HydrophobicContact CH2-CB 4.02Å; W177-I216 HydrophobicContact CH2-CD1 3.83Å; W177-I216 HydrophobicContact CH2-CG1 4.04Å; W177-I216 HydrophobicContact CZ3-CD1 4Å; W177-I216 HydrophobicContact CZ3-CG1 4.26Å; S186-I216 CarbonylContact C-O 3.54Å; S186-I216 VanDerWaalsContact CA-O 3.25Å; S186-I216 WeakPolarHBondContact CA-O 3.43Å; A187-I216 PolarHBondContact N-O 3.25Å; A187-I216 PolarHBondContact O-N 3.09Å; I216-L218 PolarHBondContact O-N 2.71Å; I216-L225 HydrophobicContact CB-CD2 4.39Å; I216-L225 HydrophobicContact CD1-CD2 3.81Å; I216-L225 HydrophobicContact CG1-CD2 3.58Å; I216-L225 HydrophobicContact CG2-CD2 4.46Å; I216-V277 HydrophobicContact CG2-CG1 4.19Å; I216-L282 HydrophobicContact CD1-CD1 3.71Å; I216-L282 HydrophobicContact CD1-CD2 3.43Å; I216-L282 VanDerWaalsContact CD1-CD2 3.43Å; I216-L282 HydrophobicContact CD1-CG 4.08Å; I216-I295 HydrophobicContact CG2-CD1 4.31Å
217	V	81.9	Confident	71.2	Confident	24 Å²	24	64.2 Å²	64.2	15%	0.145	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	113.6	170.7	-178	0	0	0	0	107.9	L182 N219 S220 F226	L182-V217 HydrophobicContact CD2-CG2 4.4Å; V217-N219 HydrophobicContact CG1-CB 4.5Å; V217-N219 PolarHBondContact O-N 2.81Å; V217-S220 PolarHBondContact O-OG 3.06Å; V217-F226 HydrophobicContact CB-CE2 4.4Å; V217-F226 HydrophobicContact CG2-CD2 3.69Å; V217-F226 HydrophobicContact CG2-CE2 3.63Å
218	L	73.4	Confident	69.3	Low	17 Å²	17	60.9 Å²	60.9	9%	0.089	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-26.5	-176.3	-53.6	175.1	0	0	0	111.6	W177 N185 A187 I216 V277 K278	W177-L218 HydrophobicContact CZ2-CD2 4.08Å; N185-L218 HydrophobicContact CB-CB 4.4Å; N185-L218 WeakPolarHBondContact O-CA 3.29Å; N185-L218 WeakPolarHBondContact O-CB 3.38Å; N185-L218 WeakPolarHBondContact O-CG 3.38Å; N185-L218 PolarHBondContact O-N 2.63Å; A187-L218 HydrophobicContact CB-CD2 4.37Å; I216-L218 PolarHBondContact O-N 2.71Å; L218-V277 HydrophobicContact CD2-CG1 3.44Å; L218-V277 VanDerWaalsContact CD2-CG1 3.44Å; L218-K278 HydrophobicContact CB-CD 4.46Å; L218-K278 WeakPolarHBondContact O-CD 3.48Å; L218-K278 WeakPolarHBondContact O-CE 3.32Å; L218-K278 PolarHBondContact O-NZ 2.86Å
219	N	67.9	Low	67	Low	94 Å²	94	70 Å²	70	50%	0.503	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-6	-176.2	-83	7.8	0	0	0	115.6	N185 V217 K278	N185-N219 HydrophobicContact CB-CB 4.48Å; N185-N219 PolarHBondContact ND2-ND2 2.88Å; N185-N219 PolarHBondContact ND2-OD1 2.73Å; V217-N219 HydrophobicContact CG1-CB 4.5Å; V217-N219 PolarHBondContact O-N 2.81Å; N219-K278 PolarHBondContact OD1-NZ 3.05Å
220	S	56.8	Low	64.4	Low	23 Å²	23	72 Å²	72	16%	0.161	37%	0.373	C	S	.	.			trans	-81	124.5	178	64.9	0	0	0	0	110.4	V217 S222 R280	V217-S220 PolarHBondContact O-OG 3.06Å; S220-S222 VanDerWaalsContact CB-OG 3.29Å; S220-S222 WeakPolarHBondContact CB-OG 3.33Å; S220-S222 PolarHBondContact O-N 2.8Å; S220-S222 PolarHBondContact OG-O 2.94Å; S220-R280 PolarHBondContact O-NH2 2.79Å
221	E	50	Low	61.5	Low	195 Å²	195	76.3 Å²	76.3	91%	0.911	39%	0.39	S	S	*	.	S	Bend	trans	-64	-19.7	160.9	-66.1	-169.6	164.1	0	0	110.9
222	S	48.6	Very low	58.2	Low	55 Å²	55	81.9 Å²	81.9	39%	0.385	42%	0.424	S	S	.	.	S	Bend	trans	-71	138	171.3	63.4	0	0	0	0	111.6	S220 Q224	S220-S222 VanDerWaalsContact CB-OG 3.29Å; S220-S222 WeakPolarHBondContact CB-OG 3.33Å; S220-S222 PolarHBondContact O-N 2.8Å; S220-S222 PolarHBondContact OG-O 2.94Å; S222-Q224 PolarHBondContact O-N 2.92Å
223	D	46.9	Very low	55.6	Low	104 Å²	104	85.8 Å²	85.8	56%	0.556	44%	0.438	S	S	*	.			trans	-76.4	5.2	171.6	-67.3	-35.5	0	0	0	112.9	L225 R280	D223-L225 PolarHBondContact O-N 3.47Å; D223-R280 IonicContact OD1-NH1 3.04Å; D223-R280 PolarHBondContact OD1-NH1 3.12Å
224	Q	45.5	Very low	52.4	Low	145 Å²	145	91 Å²	91	68%	0.678	47%	0.472	S	S	*	.			trans	-75	115.4	-176.7	-66.5	-166.2	18.1	0	0	111	S222	S222-Q224 PolarHBondContact O-N 2.92Å
225	L	48.9	Very low	49.7	Very low	62 Å²	62	95.2 Å²	95.2	33%	0.325	50%	0.499	S	S	.	.			trans	-75	135.8	165.1	-66.4	159.3	0	0	0	108.9	I216 D223 T293 I295	I216-L225 HydrophobicContact CB-CD2 4.39Å; I216-L225 HydrophobicContact CD1-CD2 3.81Å; I216-L225 HydrophobicContact CG1-CD2 3.58Å; I216-L225 HydrophobicContact CG2-CD2 4.46Å; D223-L225 PolarHBondContact O-N 3.47Å; L225-T293 WeakPolarHBondContact CD1-OG1 3.32Å; L225-I295 HydrophobicContact CD2-CD1 4.42Å
226	F	49.1	Very low	46.7	Very low	95 Å²	95	99.3 Å²	99.3	42%	0.417	53%	0.529	S	S	.	.	B	Isolated β-bridge	trans	-88	114.6	172.3	-68.1	-86.8	0	0	0	108.8	V217 A228	V217-F226 HydrophobicContact CB-CE2 4.4Å; V217-F226 HydrophobicContact CG2-CD2 3.69Å; V217-F226 HydrophobicContact CG2-CE2 3.63Å; F226-A228 PolarHBondContact O-N 2.88Å; F226-A228 VanDerWaalsContact O-N 3.12Å
227	D	38.6	Very low	43.8	Very low	114 Å²	114	106.3 Å²	106.3	61%	0.61	57%	0.566	S	S	*	*			trans	-73.8	98.4	170	-163.4	-5	0	0	0	108.9	R229	D227-R229 VanDerWaalsContact C-N 3.26Å; D227-R229 PolarHBondContact O-N 2.95Å; D227-R229 WeakPolarHBondContact OD1-CG 3.4Å; D227-R229 IonicContact OD1-NE 2.76Å
228	A	40.6	Very low	41.2	Very low	40 Å²	40	110.5 Å²	110.5	33%	0.331	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-82.9	8.8	-171.5	0	0	0	0	0	114	N215 F226 N230	N215-A228 WeakPolarHBondContact ND2-CB 3.47Å; F226-A228 PolarHBondContact O-N 2.88Å; F226-A228 VanDerWaalsContact O-N 3.12Å; A228-N230 PolarHBondContact O-N 2.87Å
229	R	40.3	Very low	39	Very low	200 Å²	200	115.8 Å²	115.8	76%	0.755	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-58.2	-21.5	176.4	-66.3	-178.7	-152.6	-167.4	1.6	113.2	D227	D227-R229 VanDerWaalsContact C-N 3.26Å; D227-R229 PolarHBondContact O-N 2.95Å; D227-R229 WeakPolarHBondContact OD1-CG 3.4Å; D227-R229 IonicContact OD1-NE 2.76Å
230	N	32.2	Very low	37.1	Very low	150 Å²	150	114.5 Å²	114.5	80%	0.802	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-117	17.2	-172.6	-72.3	-12.6	0	0	0	115.7	A228	A228-N230 PolarHBondContact O-N 2.87Å
231	Q	31.4	Very low	35.6	Very low	122 Å²	122	119.3 Å²	119.3	57%	0.57	68%	0.678	S	S	*	*			trans	-126.9	97.1	176.8	-66.2	-171.7	15.2	0	0	112.5	F233	Q231-F233 HydrophobicContact CB-CD2 4.26Å; Q231-F233 HydrophobicContact CB-CE2 3.94Å
232	T	23.9	Very low	34.4	Very low	145 Å²	145	113.2 Å²	113.2	89%	0.89	67%	0.667	S	S	*	*			trans	-77.7	111.6	161.5	38.7	0	0	0	0	108.9
233	F	36.7	Very low	33.3	Very low	153 Å²	153	118.3 Å²	118.3	67%	0.671	69%	0.69	S	S	*	*			trans	-96.8	120.2	169.9	-82.9	-78.8	0	0	0	110.4	L182 Q231	L182-F233 HydrophobicContact CD1-CE2 4.47Å; Q231-F233 HydrophobicContact CB-CD2 4.26Å; Q231-F233 HydrophobicContact CB-CE2 3.94Å
234	T	25.2	Very low	32.5	Very low	130 Å²	130	122.5 Å²	122.5	80%	0.798	71%	0.707	S	S	*	*			trans	-66.3	127	169.9	43.9	0	0	0	0	109.5	S236	T234-S236 PolarHBondContact O-N 2.81Å
235	S	30.6	Very low	31.6	Very low	105 Å²	105	120.1 Å²	120.1	73%	0.734	71%	0.706	S	S	*	*			trans	-64.3	95.8	171.8	52.8	0	0	0	0	109.7	N237	S235-N237 PolarHBondContact O-N 2.97Å; S235-N237 VanDerWaalsContact O-N 3.1Å
236	S	26.9	Very low	30.7	Very low	106 Å²	106	123 Å²	123	74%	0.741	73%	0.728	S	S	*	*			trans	-73.3	98.8	163.5	56.3	0	0	0	0	108.2	T234 S238	T234-S236 PolarHBondContact O-N 2.81Å; S236-S238 PolarHBondContact O-N 2.71Å
237	N	25	Very low	30.4	Very low	154 Å²	154	125.2 Å²	125.2	82%	0.824	74%	0.74	S	S	*	*			trans	-51.6	105.2	167	-79.3	-20.8	0	0	0	109.6	S235	S235-N237 PolarHBondContact O-N 2.97Å; S235-N237 VanDerWaalsContact O-N 3.1Å
238	S	27.7	Very low	30.8	Very low	111 Å²	111	121.9 Å²	121.9	78%	0.776	73%	0.725	S	S	*	*			trans	-102.8	97.2	160.5	45.7	0	0	0	0	107.8	S236 G240	S236-S238 PolarHBondContact O-N 2.71Å; S238-G240 VanDerWaalsContact C-N 3.27Å; S238-G240 PolarHBondContact O-N 2.86Å
239	S	25.8	Very low	31.7	Very low	128 Å²	128	125 Å²	125	90%	0.895	75%	0.745	S	S	*	*			trans	-66.1	87.7	162.4	49	0	0	0	0	108.6
240	G	28	Very low	33.4	Very low	68 Å²	68	117.1 Å²	117.1	70%	0.701	72%	0.719	S	S	*	*			trans	-121.3	109.3	172.9	0	0	0	0	0	110	S238	S238-G240 VanDerWaalsContact C-N 3.27Å; S238-G240 PolarHBondContact O-N 2.86Å
241	S	25.3	Very low	35.8	Very low	124 Å²	124	113.4 Å²	113.4	87%	0.867	70%	0.698	S	S	*	*			trans	-62.9	140.8	168	63.1	0	0	0	0	110.6
242	G	25.9	Very low	38.7	Very low	67 Å²	67	108.4 Å²	108.4	69%	0.691	68%	0.677	S	S	*	*			trans	85.1	82.2	157	0	0	0	0	0	115.4
243	N	25.9	Very low	42	Very low	162 Å²	162	101.8 Å²	101.8	87%	0.866	64%	0.636	S	S	*	*				172.5	121.9	125.5	-88.5	-25.8	0	0	0	105.8	S245	N243-S245 VanDerWaalsContact C-N 3.27Å; N243-S245 PolarHBondContact O-N 2.85Å
244	Q	28.5	Very low	44.9	Very low	192 Å²	192	97.8 Å²	97.8	90%	0.897	62%	0.616	S	S	*	*			trans	-56.9	102.4	164.4	-67.3	-179.4	8.9	0	0	105.8
245	S	26.6	Very low	48.4	Very low	94 Å²	94	91.9 Å²	91.9	66%	0.657	58%	0.58	S	S	*	*			trans	-53.3	135.7	170.5	49.2	0	0	0	0	106.6	N243 Q247	N243-S245 VanDerWaalsContact C-N 3.27Å; N243-S245 PolarHBondContact O-N 2.85Å; S245-Q247 PolarHBondContact O-N 2.83Å
246	P	30.9	Very low	51.6	Low	123 Å²	123	87.4 Å²	87.4	80%	0.799	55%	0.548	S	S	*	.			trans	-57	113.8	-175.7	21.7	-30.8	0	0	0	107.1	S248	P246-S248 PolarHBondContact O-N 2.91Å
247	Q	43.3	Very low	54.9	Low	142 Å²	142	82.5 Å²	82.5	66%	0.664	51%	0.513	S	S	*	.			trans	-45.8	116.1	176.6	-74	-178	-8.8	0	0	106.7	S245 S249	S245-Q247 PolarHBondContact O-N 2.83Å; Q247-S249 PolarHBondContact O-N 3.11Å
248	S	46.7	Very low	58.2	Low	43 Å²	43	75.7 Å²	75.7	30%	0.301	48%	0.477	S	S	.	.			trans	-49.9	121.6	-176.5	70.2	0	0	0	0	108.2	P246 V250	P246-S248 PolarHBondContact O-N 2.91Å; S248-V250 PolarHBondContact O-N 3.48Å
249	S	59.9	Low	61.2	Low	107 Å²	107	74.7 Å²	74.7	75%	0.748	46%	0.46	S	S	*	.			trans	-75.5	29.8	-173.9	58.7	0	0	0	0	112.1	Q247 L251	Q247-S249 PolarHBondContact O-N 3.11Å; S249-L251 PolarHBondContact O-N 3.29Å
250	V	74.2	Confident	64.1	Low	33 Å²	33	69.5 Å²	69.5	20%	0.2	43%	0.427	C	S	.	.			trans	-69.5	104.7	-178.5	-168.4	0	0	0	0	108	L163 S248	L163-V250 HydrophobicContact CD1-CB 4.19Å; L163-V250 HydrophobicContact CD1-CG1 3.42Å; L163-V250 VanDerWaalsContact CD1-CG1 3.42Å; L163-V250 HydrophobicContact CD2-CB 4.17Å; L163-V250 HydrophobicContact CD2-CG1 3.94Å; L163-V250 VanDerWaalsContact CD2-O 3.27Å; L163-V250 WeakPolarHBondContact CD2-O 3.34Å; L163-V250 HydrophobicContact CG-CG1 4.31Å; S248-V250 PolarHBondContact O-N 3.48Å
251	L	83.5	Confident	66.3	Low	72 Å²	72	68.7 Å²	68.7	38%	0.377	41%	0.41	S	S	.	.			trans	-70.7	146	177.8	-60.7	175.9	0	0	0	111	S249	S249-L251 PolarHBondContact O-N 3.29Å
252	P	91.7	Very high	68.8	Low	18 Å²	18	68.3 Å²	68.3	12%	0.117	40%	0.398	C	S	.	.			trans	-54.5	152.2	169.3	-22.2	32.9	0	0	0	111.9	W51 T103 L163	W51-P252 HydrophobicContact CE3-CB 4.15Å; W51-P252 HydrophobicContact CZ3-CB 3.91Å; T103-P252 HydrophobicContact CG2-CG 4.11Å; L163-P252 CarbonylContact O-C 3.57Å; L163-P252 WeakPolarHBondContact O-CA 3.3Å; L163-P252 WeakPolarHBondContact O-CB 3.35Å
253	I	94.8	Very high	71.6	Confident	6 Å²	6	67.4 Å²	67.4	3%	0.031	39%	0.388	C	S	.	.			trans	-127.9	154	-179.2	53.5	129.8	0	0	0	109.6	Q104 L163 W177 L255 V275 P276	Q104-I253 PolarHBondContact NE2-O 3.42Å; L163-I253 PolarHBondContact O-N 3.26Å; W177-I253 HydrophobicContact CG-CD1 4.36Å; I253-L255 HydrophobicContact CD1-CB 4.15Å; I253-V275 HydrophobicContact CD1-CG1 3.7Å; I253-P276 HydrophobicContact CB-CB 4.23Å; I253-P276 HydrophobicContact CB-CG 4.49Å; I253-P276 HydrophobicContact CD1-CB 4.04Å; I253-P276 HydrophobicContact CD1-CG 4.17Å; I253-P276 HydrophobicContact CG2-CB 4.19Å
254	R	97.3	Very high	74.4	Confident	69 Å²	69	63.3 Å²	63.3	26%	0.26	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-92.7	112.5	165.9	-177.6	174.8	-75.5	-155.1	0.7	108.4	C9 V10 W51 P276 R304 A305 C306	C9-R254 PolarHBondContact SG-NH2 3.37Å; V10-R254 PolarHBondContact O-NH2 3Å; W51-R254 HydrophobicContact CH2-CB 3.92Å; W51-R254 HydrophobicContact CZ2-CB 3.95Å; W51-R254 HydrophobicContact CZ2-CG 4.45Å; R254-P276 WeakPolarHBondContact O-CG 3.49Å; R254-R304 PolarHBondContact N-O 3.1Å; R254-A305 HydrophobicContact CB-CB 3.7Å; R254-A305 HydrophobicContact CG-CB 4.49Å; R254-A305 WeakPolarHBondContact O-CA 3.49Å; R254-C306 PolarHBondContact O-N 2.98Å
255	L	98.1	Very high	77	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.026	32%	0.324	C	S	.	.			trans	-96.2	162.4	166.9	68.9	85.8	0	0	0	109.3	K166 I175 W177 I253 F274 V275	K166-L255 HydrophobicContact CB-CD1 3.46Å; K166-L255 VanDerWaalsContact CB-CD1 3.46Å; K166-L255 HydrophobicContact CB-CG 4.33Å; K166-L255 HydrophobicContact CG-CD1 4.23Å; I175-L255 HydrophobicContact CB-CD1 4.24Å; I175-L255 HydrophobicContact CG2-CD1 3.83Å; I175-L255 HydrophobicContact CG2-CD2 4.4Å; W177-L255 HydrophobicContact CB-CD2 3.64Å; I253-L255 HydrophobicContact CD1-CB 4.15Å; L255-F274 WeakPolarHBondContact CA-O 3.27Å; L255-F274 VanDerWaalsContact CB-O 3.27Å; L255-F274 WeakPolarHBondContact CB-O 3.37Å; L255-V275 HydrophobicContact CB-CG1 4.45Å; L255-V275 HydrophobicContact CB-CG2 4.31Å; L255-V275 HydrophobicContact CD2-CG2 4.49Å
256	D	97.8	Very high	79.5	Confident	12 Å²	12	53.4 Å²	53.4	6%	0.064	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	169.3	176.4	-146.1	3.7	0	0	0	112.5	K166 F274 V307 W308	K166-D256 WeakPolarHBondContact CE-OD1 3.12Å; K166-D256 IonicContact NZ-OD1 3.71Å; K166-D256 PolarHBondContact NZ-OD1 2.81Å; D256-F274 PolarHBondContact N-O 2.85Å; D256-F274 VanDerWaalsContact N-O 3.1Å; D256-F274 PolarHBondContact O-N 3.24Å; D256-V307 WeakPolarHBondContact OD2-CA 3.41Å; D256-W308 PolarHBondContact OD2-N 3.24Å
257	T	96	Very high	81.7	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	156.3	-178.5	64.7	0	0	0	0	111.7	I175 C272 I273	I175-T257 HydrophobicContact CB-CG2 4.46Å; I175-T257 HydrophobicContact CD1-CG2 3.71Å; I175-T257 HydrophobicContact CG1-CG2 3.82Å; T257-C272 CarbonylContact C-O 3.58Å; T257-C272 VanDerWaalsContact CA-O 3.24Å; T257-C272 WeakPolarHBondContact CA-O 3.01Å; T257-I273 HydrophobicContact CG2-CB 4.27Å; T257-I273 HydrophobicContact CG2-CG1 3.93Å; T257-I273 HydrophobicContact CG2-CG2 4.09Å
258	T	94.8	Very high	83.6	Confident	12 Å²	12	44.4 Å²	44.4	7%	0.074	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	177.1	164.6	-170.4	0	0	0	0	110.4	G260 L271 C272 F274 W308 D310	T258-G260 PolarHBondContact O-N 2.96Å; T258-L271 CarbonylContact O-C 3.54Å; T258-L271 VanDerWaalsContact O-CA 3.32Å; T258-L271 WeakPolarHBondContact O-CA 3.35Å; T258-C272 HydrophobicContact CG2-CB 4.04Å; T258-C272 PolarHBondContact N-O 3.15Å; T258-C272 PolarHBondContact O-N 2.67Å; T258-F274 HydrophobicContact CG2-CE2 3.85Å; T258-F274 HydrophobicContact CG2-CZ 4.07Å; T258-W308 VanDerWaalsContact CB-CD1 3.4Å; T258-W308 VanDerWaalsContact CB-NE1 3.29Å; T258-W308 HydrophobicContact CG2-CD2 3.98Å; T258-W308 HydrophobicContact CG2-CG 4.32Å; T258-W308 HydrophobicContact CG2-CZ2 4Å; T258-W308 PolarHBondContact OG1-NE1 3.07Å; T258-D310 PolarHBondContact OG1-OD1 2.55Å
259	H	91.3	Very high	85.4	Confident	89 Å²	89	45.4 Å²	45.4	41%	0.412	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	133	171.2	-67.4	-68.8	0	0	0	110.6
260	G	85.4	Confident	87	Confident	19 Å²	19	40.4 Å²	40.4	20%	0.196	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	158.1	168.2	0	0	0	0	0	110.5	T258 S270	T258-G260 PolarHBondContact O-N 2.96Å; G260-S270 WeakPolarHBondContact CA-OG 3.26Å; G260-S270 PolarHBondContact N-O 2.79Å; G260-S270 PolarHBondContact O-OG 2.86Å
261	S	75.5	Confident	87.9	Confident	51 Å²	51	38.9 Å²	38.9	36%	0.357	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	-19	-177.6	-46.7	0	0	0	0	113.2	L332	S261-L332 WeakPolarHBondContact CB-O 3.14Å; S261-L332 PolarHBondContact OG-N 3.33Å; S261-L332 PolarHBondContact OG-O 3.05Å
262	I	77.5	Confident	88.4	Confident	117 Å²	117	36.6 Å²	36.6	60%	0.6	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139.6	129.3	-170.4	-58.8	175.2	0	0	0	110.5	S270	I262-S270 VanDerWaalsContact O-CB 3.3Å; I262-S270 WeakPolarHBondContact O-CB 3.07Å; I262-S270 PolarHBondContact O-OG 3.34Å
263	G	83.2	Confident	88.7	Confident	47 Å²	47	35.7 Å²	35.7	49%	0.485	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	85.7	177.1	171.4	0	0	0	0	0	115.1	S270	G263-S270 VanDerWaalsContact O-CB 3.23Å; G263-S270 WeakPolarHBondContact O-CB 3.27Å; G263-S270 PolarHBondContact O-N 3.11Å; G263-S270 VanDerWaalsContact O-N 3.15Å; G263-S270 PolarHBondContact O-OG 3.49Å; G263-S270 VanDerWaalsContact O-OG 3.05Å
264	D	85.3	Confident	88.8	Confident	76 Å²	76	35.5 Å²	35.5	41%	0.406	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	163.8	-178.3	67.8	-25.9	0	0	0	111.6	S287 K288	D264-S287 CarbonylContact O-C 3.39Å; D264-S287 WeakPolarHBondContact O-CA 2.95Å; D264-K288 WeakPolarHBondContact O-CB 3.2Å; D264-K288 PolarHBondContact O-N 2.83Å
265	L	83.7	Confident	88.8	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	21%	0.206	C	C	.	.			trans	-136.8	76.1	-179.7	-172	69.7	0	0	0	109.3	H173 L191 G267 A268 L271	H173-L265 PolarHBondContact CE1-O 2.78Å; H173-L265 VanDerWaalsContact CE1-O 3.26Å; H173-L265 PolarHBondContact NE2-O 3.44Å; L191-L265 HydrophobicContact CD1-CD2 4.22Å; L191-L265 HydrophobicContact CD2-CD1 3.69Å; L191-L265 HydrophobicContact CD2-CD2 3.57Å; L191-L265 HydrophobicContact CD2-CG 4.05Å; L191-L265 HydrophobicContact CG-CD2 4.49Å; L265-G267 PolarHBondContact O-N 2.96Å; L265-A268 PolarHBondContact N-O 3.47Å; L265-A268 PolarHBondContact O-N 3.04Å; L265-L271 HydrophobicContact CD2-CD1 3.74Å; L265-L271 HydrophobicContact CD2-CG 3.92Å
266	W	79.4	Confident	88.6	Confident	76 Å²	76	32 Å²	32	29%	0.288	21%	0.205	S	C	.	.	S	Bend	trans	38.1	74.6	177.2	-61.6	-63.6	0	0	0	114.9	T193 V211	T193-W266 HydrophobicContact CG2-CE3 3.62Å; T193-W266 HydrophobicContact CG2-CZ3 3.62Å; V211-W266 HydrophobicContact CG2-CH2 4.09Å; V211-W266 HydrophobicContact CG2-CZ3 3.69Å
267	G	75.5	Confident	88.4	Confident	62 Å²	62	31.6 Å²	31.6	64%	0.639	20%	0.203	S	C	*	.	S	Bend	trans	90.7	1.1	178.4	0	0	0	0	0	114.5	L265	L265-G267 PolarHBondContact O-N 2.96Å
268	A	83.8	Confident	88.1	Confident	15 Å²	15	35.4 Å²	35.4	12%	0.124	22%	0.219	C	C	.	.	S	Bend	trans	-137.4	172.2	176.2	0	0	0	0	0	112.6	D170 L172 H173 L265	D170-A268 WeakPolarHBondContact OD2-CB 3.24Å; L172-A268 HydrophobicContact CD1-CB 3.78Å; H173-A268 WeakPolarHBondContact NE2-CB 3.41Å; L265-A268 PolarHBondContact N-O 3.47Å; L265-A268 PolarHBondContact O-N 3.04Å
269	S	85.8	Confident	88	Confident	63 Å²	63	37.3 Å²	37.3	44%	0.441	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	152.2	167.7	-60.1	0	0	0	0	110.6
270	S	91.8	Very high	88.1	Confident	3 Å²	3	34 Å²	34	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	161.4	167.7	55.9	0	0	0	0	111.9	G260 I262 G263 A286	G260-S270 WeakPolarHBondContact CA-OG 3.26Å; G260-S270 PolarHBondContact N-O 2.79Å; G260-S270 PolarHBondContact O-OG 2.86Å; I262-S270 VanDerWaalsContact O-CB 3.3Å; I262-S270 WeakPolarHBondContact O-CB 3.07Å; I262-S270 PolarHBondContact O-OG 3.34Å; G263-S270 VanDerWaalsContact O-CB 3.23Å; G263-S270 WeakPolarHBondContact O-CB 3.27Å; G263-S270 PolarHBondContact O-N 3.11Å; G263-S270 VanDerWaalsContact O-N 3.15Å; G263-S270 PolarHBondContact O-OG 3.49Å; G263-S270 VanDerWaalsContact O-OG 3.05Å; S270-A286 CarbonylContact C-O 3.54Å; S270-A286 WeakPolarHBondContact CA-O 3.35Å; S270-A286 WeakPolarHBondContact CB-O 3.45Å
271	L	94.1	Very high	88.5	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148	179.2	-56	172.1	0	0	0	111.2	H173 I175 L191 T258 L265 I273 A286	H173-L271 HydrophobicContact CB-CD1 4.32Å; I175-L271 HydrophobicContact CD1-CD1 4.28Å; L191-L271 HydrophobicContact CD1-CD1 3.91Å; T258-L271 CarbonylContact O-C 3.54Å; T258-L271 VanDerWaalsContact O-CA 3.32Å; T258-L271 WeakPolarHBondContact O-CA 3.35Å; L265-L271 HydrophobicContact CD2-CD1 3.74Å; L265-L271 HydrophobicContact CD2-CG 3.92Å; L271-I273 HydrophobicContact CB-CG1 4.34Å; L271-A286 HydrophobicContact CB-CB 4.21Å; L271-A286 PolarHBondContact N-O 3.18Å; L271-A286 PolarHBondContact O-N 2.82Å
272	C	94.7	Very high	89.4	Confident	23 Å²	23	30.7 Å²	30.7	16%	0.155	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.1	159	-170.4	0	0	0	0	108.4	T257 T258 F274 S284	T257-C272 CarbonylContact C-O 3.58Å; T257-C272 VanDerWaalsContact CA-O 3.24Å; T257-C272 WeakPolarHBondContact CA-O 3.01Å; T258-C272 HydrophobicContact CG2-CB 4.04Å; T258-C272 PolarHBondContact N-O 3.15Å; T258-C272 PolarHBondContact O-N 2.67Å; C272-F274 HydrophobicContact CB-CZ 4.16Å; C272-F274 WeakPolarHBondContact SG-CE1 3.46Å; C272-F274 VanDerWaalsContact SG-CZ 3.55Å; C272-S284 CarbonylContact C-O 3.52Å; C272-S284 WeakPolarHBondContact CA-O 3.48Å
273	I	96.3	Very high	90.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.3	-172.6	-54.5	171.2	0	0	0	109.4	I175 L189 F213 T257 L271 V275 I283 S284 A286	I175-I273 HydrophobicContact CG1-CD1 4.05Å; I175-I273 HydrophobicContact CG1-CG1 4.42Å; I175-I273 HydrophobicContact CG2-CD1 4.33Å; I175-I273 HydrophobicContact CG2-CG2 3.85Å; L189-I273 HydrophobicContact CD1-CG2 4.16Å; L189-I273 HydrophobicContact CD2-CD1 4.41Å; L189-I273 HydrophobicContact CD2-CG2 4.11Å; F213-I273 HydrophobicContact CZ-CD1 4.18Å; T257-I273 HydrophobicContact CG2-CB 4.27Å; T257-I273 HydrophobicContact CG2-CG1 3.93Å; T257-I273 HydrophobicContact CG2-CG2 4.09Å; L271-I273 HydrophobicContact CB-CG1 4.34Å; I273-V275 HydrophobicContact CG2-CG2 3.85Å; I273-I283 CarbonylContact O-C 3.5Å; I273-I283 WeakPolarHBondContact O-CA 3.46Å; I273-S284 PolarHBondContact N-O 3.11Å; I273-S284 PolarHBondContact O-N 3.47Å; I273-A286 HydrophobicContact CD1-CB 3.98Å
274	F	97.3	Very high	90.7	Very high	1 Å²	1	24.6 Å²	24.6	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.5	-179.2	-50.2	-67.1	0	0	0	110.3	L255 D256 T258 C272 L281 L282 I283 C306 W308 L315 I329	L255-F274 WeakPolarHBondContact CA-O 3.27Å; L255-F274 VanDerWaalsContact CB-O 3.27Å; L255-F274 WeakPolarHBondContact CB-O 3.37Å; D256-F274 PolarHBondContact N-O 2.85Å; D256-F274 VanDerWaalsContact N-O 3.1Å; D256-F274 PolarHBondContact O-N 3.24Å; T258-F274 HydrophobicContact CG2-CE2 3.85Å; T258-F274 HydrophobicContact CG2-CZ 4.07Å; C272-F274 HydrophobicContact CB-CZ 4.16Å; C272-F274 WeakPolarHBondContact SG-CE1 3.46Å; C272-F274 VanDerWaalsContact SG-CZ 3.55Å; F274-L281 HydrophobicContact CB-CD1 4.32Å; F274-L282 WeakPolarHBondContact CA-O 3.41Å; F274-I283 HydrophobicContact CD1-CG1 4.13Å; F274-I283 HydrophobicContact CD1-CG2 4.14Å; F274-I283 HydrophobicContact CE1-CG2 3.94Å; F274-C306 PolarHBondContact O-SG 2.67Å; F274-W308 HydrophobicContact CE2-CB 4.39Å; F274-W308 HydrophobicContact CE2-CD2 4.19Å; F274-W308 AromaticContact CE2-CE3 3.82Å; F274-W308 HydrophobicContact CE2-CE3 3.82Å; F274-W308 HydrophobicContact CE2-CG 4.45Å; F274-W308 HydrophobicContact CE2-CZ3 4.49Å; F274-W308 HydrophobicContact CZ-CE3 4.09Å; F274-W308 HydrophobicContact CZ-CZ3 4.32Å; F274-L315 HydrophobicContact CB-CD1 4.05Å; F274-L315 HydrophobicContact CB-CD2 4.12Å; F274-L315 HydrophobicContact CD1-CD1 4.44Å; F274-L315 HydrophobicContact CD1-CD2 3.93Å; F274-L315 HydrophobicContact CD2-CD1 3.59Å; F274-L315 HydrophobicContact CE2-CD1 4.12Å; F274-L315 HydrophobicContact CG-CD1 3.76Å; F274-L315 HydrophobicContact CG-CD2 3.93Å; F274-L315 HydrophobicContact CG-CG 4.49Å; F274-I329 HydrophobicContact CD1-CD1 3.99Å; F274-I329 HydrophobicContact CE1-CD1 3.23Å; F274-I329 HydrophobicContact CE2-CD1 4.48Å; F274-I329 HydrophobicContact CZ-CD1 3.52Å
275	V	97.1	Very high	91	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	118.7	-176.1	-170	0	0	0	0	110.9	W177 L189 I253 L255 I273 V277 L282	W177-V275 HydrophobicContact CB-CG1 4.18Å; W177-V275 HydrophobicContact CD2-CG1 3.64Å; W177-V275 HydrophobicContact CE3-CG1 4.01Å; W177-V275 HydrophobicContact CG-CG1 3.71Å; W177-V275 HydrophobicContact CZ2-CG1 4.5Å; L189-V275 HydrophobicContact CD1-CG2 3.99Å; L189-V275 HydrophobicContact CD2-CG2 4.27Å; I253-V275 HydrophobicContact CD1-CG1 3.7Å; L255-V275 HydrophobicContact CB-CG1 4.45Å; L255-V275 HydrophobicContact CB-CG2 4.31Å; L255-V275 HydrophobicContact CD2-CG2 4.49Å; I273-V275 HydrophobicContact CG2-CG2 3.85Å; V275-V277 HydrophobicContact CG1-CG2 4.41Å; V275-V277 PolarHBondContact O-N 3.03Å; V275-L282 HydrophobicContact CB-CB 4.15Å; V275-L282 HydrophobicContact CB-CD2 4.09Å; V275-L282 HydrophobicContact CG2-CD2 4.18Å; V275-L282 PolarHBondContact N-O 3.26Å; V275-L282 PolarHBondContact O-N 3.34Å
276	P	95.5	Very high	91.4	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.013	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	120.3	166.9	-30.9	38	0	0	0	113	I253 R254 I303 C306	I253-P276 HydrophobicContact CB-CB 4.23Å; I253-P276 HydrophobicContact CB-CG 4.49Å; I253-P276 HydrophobicContact CD1-CB 4.04Å; I253-P276 HydrophobicContact CD1-CG 4.17Å; I253-P276 HydrophobicContact CG2-CB 4.19Å; R254-P276 WeakPolarHBondContact O-CG 3.49Å; P276-I303 HydrophobicContact CB-CB 3.88Å; P276-I303 HydrophobicContact CB-CG2 3.73Å; P276-I303 HydrophobicContact CG-CB 4.49Å; P276-I303 HydrophobicContact CG-CG2 3.79Å; P276-C306 HydrophobicContact CG-CB 4.21Å
277	V	92.7	Very high	92	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.012	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	95.7	177.5	-174.7	0	0	0	0	109.4	W177 I216 L218 V275 N279 R280 L282	W177-V277 HydrophobicContact CH2-CG2 3.98Å; W177-V277 HydrophobicContact CZ2-CG1 4.45Å; W177-V277 HydrophobicContact CZ2-CG2 3.82Å; I216-V277 HydrophobicContact CG2-CG1 4.19Å; L218-V277 HydrophobicContact CD2-CG1 3.44Å; L218-V277 VanDerWaalsContact CD2-CG1 3.44Å; V275-V277 HydrophobicContact CG1-CG2 4.41Å; V275-V277 PolarHBondContact O-N 3.03Å; V277-N279 PolarHBondContact O-N 2.85Å; V277-R280 CarbonylContact C-O 3.48Å; V277-R280 PolarHBondContact N-O 3.37Å; V277-R280 WeakPolarHBondContact O-CA 3.39Å; V277-R280 WeakPolarHBondContact O-CB 3.26Å; V277-R280 PolarHBondContact O-N 3.27Å; V277-L282 HydrophobicContact CG2-CB 3.78Å
278	K	90.3	Very high	92.5	Very high	83 Å²	83	20.4 Å²	20.4	36%	0.361	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	-123.8	-168.3	-65.9	-173.2	170.9	175.7	0	110.1	L218 N219 R280 K302 I303	L218-K278 HydrophobicContact CB-CD 4.46Å; L218-K278 WeakPolarHBondContact O-CD 3.48Å; L218-K278 WeakPolarHBondContact O-CE 3.32Å; L218-K278 PolarHBondContact O-NZ 2.86Å; N219-K278 PolarHBondContact OD1-NZ 3.05Å; K278-R280 VanDerWaalsContact C-N 3.31Å; K278-K302 CarbonylContact O-C 3.59Å; K278-K302 WeakPolarHBondContact O-CA 3.28Å; K278-I303 PolarHBondContact O-N 2.76Å
279	N	92	Very high	92.6	Very high	52 Å²	52	28.6 Å²	28.6	28%	0.278	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	4.6	177.5	69.9	-40.5	0	0	0	113.5	V277 H299 S301	V277-N279 PolarHBondContact O-N 2.85Å; N279-H299 WeakPolarHBondContact CB-O 3.41Å; N279-H299 PolarHBondContact ND2-O 2.82Å; N279-S301 VanDerWaalsContact CA-O 3.28Å; N279-S301 WeakPolarHBondContact CA-O 3.17Å; N279-S301 WeakPolarHBondContact CB-O 3.41Å
280	R	92.4	Very high	92.7	Very high	18 Å²	18	28.2 Å²	28.2	7%	0.068	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	159.6	-178.5	-49	-169.9	-76.2	-168.5	-15.5	110.6	S220 D223 V277 K278 I295 I296 T297 I303	S220-R280 PolarHBondContact O-NH2 2.79Å; D223-R280 IonicContact OD1-NH1 3.04Å; D223-R280 PolarHBondContact OD1-NH1 3.12Å; V277-R280 CarbonylContact C-O 3.48Å; V277-R280 PolarHBondContact N-O 3.37Å; V277-R280 WeakPolarHBondContact O-CA 3.39Å; V277-R280 WeakPolarHBondContact O-CB 3.26Å; V277-R280 PolarHBondContact O-N 3.27Å; K278-R280 VanDerWaalsContact C-N 3.31Å; R280-I295 HydrophobicContact CB-CG2 3.64Å; R280-I295 HydrophobicContact CG-CG2 4.22Å; R280-I296 CarbonylContact C-O 3.47Å; R280-I296 WeakPolarHBondContact CA-O 3.23Å; R280-I296 WeakPolarHBondContact CB-O 3.18Å; R280-T297 WeakPolarHBondContact CD-OG1 3.44Å; R280-T297 HydrophobicContact CG-CG2 4.21Å; R280-T297 VanDerWaalsContact CG-OG1 3.29Å; R280-T297 WeakPolarHBondContact CG-OG1 3.29Å; R280-I303 WeakPolarHBondContact O-CD1 3.37Å
281	L	94.2	Very high	92.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.1	174	-176.7	73.4	0	0	0	108.8	F274 I283 I295 I296 I303 C306 L315 T317	F274-L281 HydrophobicContact CB-CD1 4.32Å; L281-I283 HydrophobicContact CD2-CD1 4.19Å; L281-I283 HydrophobicContact CD2-CG1 4.07Å; L281-I283 HydrophobicContact CG-CG1 4.22Å; L281-I295 WeakPolarHBondContact O-CA 3.27Å; L281-I296 HydrophobicContact CB-CG1 3.94Å; L281-I296 HydrophobicContact CD2-CD1 4.18Å; L281-I296 HydrophobicContact CD2-CG1 4.36Å; L281-I296 PolarHBondContact N-O 3.49Å; L281-I296 PolarHBondContact O-N 3Å; L281-I303 HydrophobicContact CB-CD1 4.26Å; L281-C306 HydrophobicContact CD1-CB 4.31Å; L281-L315 HydrophobicContact CD1-CD2 4.3Å; L281-L315 HydrophobicContact CD2-CD2 3.36Å; L281-L315 HydrophobicContact CG-CD2 4.45Å; L281-T317 HydrophobicContact CD1-CG2 4.29Å; L281-T317 HydrophobicContact CD2-CG2 4.42Å
282	L	94.5	Very high	92.4	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	130	166.9	172.8	74.7	0	0	0	108.7	W177 L189 I216 F274 V275 V277 T293 K294 I295	W177-L282 HydrophobicContact CZ3-CD2 4.34Å; L189-L282 HydrophobicContact CB-CD2 4.42Å; L189-L282 HydrophobicContact CD2-CD2 4.09Å; I216-L282 HydrophobicContact CD1-CD1 3.71Å; I216-L282 HydrophobicContact CD1-CD2 3.43Å; I216-L282 VanDerWaalsContact CD1-CD2 3.43Å; I216-L282 HydrophobicContact CD1-CG 4.08Å; F274-L282 WeakPolarHBondContact CA-O 3.41Å; V275-L282 HydrophobicContact CB-CB 4.15Å; V275-L282 HydrophobicContact CB-CD2 4.09Å; V275-L282 HydrophobicContact CG2-CD2 4.18Å; V275-L282 PolarHBondContact N-O 3.26Å; V275-L282 PolarHBondContact O-N 3.34Å; V277-L282 HydrophobicContact CG2-CB 3.78Å; L282-T293 HydrophobicContact CD1-CG2 4.46Å; L282-K294 WeakPolarHBondContact CA-O 3.42Å; L282-I295 HydrophobicContact CD1-CD1 4.5Å; L282-I295 HydrophobicContact CD1-CG1 3.84Å
283	I	94.4	Very high	92.2	Very high	36 Å²	36	34.3 Å²	34.3	19%	0.185	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.4	173.9	-53.5	-176.4	0	0	0	107	I273 F274 L281 T293 K294 I296	I273-I283 CarbonylContact O-C 3.5Å; I273-I283 WeakPolarHBondContact O-CA 3.46Å; F274-I283 HydrophobicContact CD1-CG1 4.13Å; F274-I283 HydrophobicContact CD1-CG2 4.14Å; F274-I283 HydrophobicContact CE1-CG2 3.94Å; L281-I283 HydrophobicContact CD2-CD1 4.19Å; L281-I283 HydrophobicContact CD2-CG1 4.07Å; L281-I283 HydrophobicContact CG-CG1 4.22Å; I283-T293 CarbonylContact O-C 3.54Å; I283-T293 VanDerWaalsContact O-CA 3.29Å; I283-T293 WeakPolarHBondContact O-CA 3.47Å; I283-K294 PolarHBondContact N-O 3.2Å; I283-K294 PolarHBondContact O-N 3.2Å; I283-I296 HydrophobicContact CD1-CD1 3.73Å; I283-I296 HydrophobicContact CD1-CG1 4.29Å
284	S	93.9	Very high	91.9	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.6	-178.6	-51.6	0	0	0	0	110.6	L189 C272 I273 S292 T293	L189-S284 VanDerWaalsContact CD2-OG 3.23Å; L189-S284 WeakPolarHBondContact CD2-OG 3.43Å; C272-S284 CarbonylContact C-O 3.52Å; C272-S284 WeakPolarHBondContact CA-O 3.48Å; I273-S284 PolarHBondContact N-O 3.11Å; I273-S284 PolarHBondContact O-N 3.47Å; S284-S292 CarbonylContact C-O 3.59Å; S284-S292 WeakPolarHBondContact CA-O 2.9Å; S284-T293 VanDerWaalsContact OG-CG2 3.26Å; S284-T293 WeakPolarHBondContact OG-CG2 3.48Å
285	S	92.2	Very high	91.6	Very high	30 Å²	30	42.2 Å²	42.2	21%	0.21	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	137.1	165.8	-177.3	0	0	0	0	108.6	F213 D290 T291 S292	F213-S285 WeakPolarHBondContact CE1-O 3.42Å; S285-D290 CarbonylContact C-O 3.56Å; S285-D290 WeakPolarHBondContact CB-OD2 3.38Å; S285-D290 PolarHBondContact OG-OD2 3.47Å; S285-T291 CarbonylContact O-C 3.6Å; S285-T291 VanDerWaalsContact O-CA 3.27Å; S285-T291 WeakPolarHBondContact O-CA 3.13Å; S285-S292 PolarHBondContact N-O 2.67Å
286	A	92.5	Very high	91.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	96.7	176.6	0	0	0	0	0	109.8	L191 F213 S270 L271 I273 D290	L191-A286 HydrophobicContact CD2-CB 4.39Å; F213-A286 HydrophobicContact CE1-CB 3.97Å; F213-A286 HydrophobicContact CZ-CB 3.66Å; S270-A286 CarbonylContact C-O 3.54Å; S270-A286 WeakPolarHBondContact CA-O 3.35Å; S270-A286 WeakPolarHBondContact CB-O 3.45Å; L271-A286 HydrophobicContact CB-CB 4.21Å; L271-A286 PolarHBondContact N-O 3.18Å; L271-A286 PolarHBondContact O-N 2.82Å; I273-A286 HydrophobicContact CD1-CB 3.98Å; A286-D290 CarbonylContact C-O 3.54Å; A286-D290 WeakPolarHBondContact CA-O 3Å
287	S	90.6	Very high	91.2	Very high	11 Å²	11	48 Å²	48	8%	0.077	24%	0.242	C	C	.	.	S	Bend	trans	-128.2	174	166.3	76.5	0	0	0	0	109.3	D264 Y289 D290	D264-S287 CarbonylContact O-C 3.39Å; D264-S287 WeakPolarHBondContact O-CA 2.95Å; S287-Y289 PolarHBondContact O-N 2.95Å; S287-Y289 VanDerWaalsContact O-N 3.12Å; S287-Y289 PolarHBondContact OG-N 3.08Å; S287-D290 PolarHBondContact N-O 2.99Å; S287-D290 PolarHBondContact O-N 2.74Å; S287-D290 VanDerWaalsContact OG-CB 3.29Å; S287-D290 WeakPolarHBondContact OG-CB 3.49Å; S287-D290 PolarHBondContact OG-N 3.42Å
288	K	86.5	Confident	91.1	Very high	85 Å²	85	53.3 Å²	53.3	37%	0.37	26%	0.262	S	S	.	.	S	Bend	trans	-53.4	-30.4	175.3	-174.9	178.7	176.8	-166.6	0	113.5	D264	D264-K288 WeakPolarHBondContact O-CB 3.2Å; D264-K288 PolarHBondContact O-N 2.83Å
289	Y	85.8	Confident	91.3	Very high	187 Å²	187	49.5 Å²	49.5	73%	0.733	25%	0.245	S	C	*	.	S	Bend	trans	-118.3	-5.8	-174.7	-56.5	-69.1	0	0	0	113.9	S287	S287-Y289 PolarHBondContact O-N 2.95Å; S287-Y289 VanDerWaalsContact O-N 3.12Å; S287-Y289 PolarHBondContact OG-N 3.08Å
290	D	87.9	Confident	91.4	Very high	56 Å²	56	55.3 Å²	55.3	30%	0.299	27%	0.268	S	S	.	.			trans	-133.5	114.8	-176.7	-177.2	18.7	0	0	0	110.6	S285 A286 S287 S292	S285-D290 CarbonylContact C-O 3.56Å; S285-D290 WeakPolarHBondContact CB-OD2 3.38Å; S285-D290 PolarHBondContact OG-OD2 3.47Å; A286-D290 CarbonylContact C-O 3.54Å; A286-D290 WeakPolarHBondContact CA-O 3Å; S287-D290 PolarHBondContact N-O 2.99Å; S287-D290 PolarHBondContact O-N 2.74Å; S287-D290 VanDerWaalsContact OG-CB 3.29Å; S287-D290 WeakPolarHBondContact OG-CB 3.49Å; S287-D290 PolarHBondContact OG-N 3.42Å; D290-S292 WeakPolarHBondContact OD1-CA 3.46Å; D290-S292 WeakPolarHBondContact OD1-CB 3.31Å; D290-S292 PolarHBondContact OD1-N 2.83Å; D290-S292 PolarHBondContact OD1-OG 2.83Å; D290-S292 PolarHBondContact OD2-OG 2.97Å
291	T	89.8	Confident	91.4	Very high	52 Å²	52	56.8 Å²	56.8	32%	0.319	28%	0.281	S	S	.	.			trans	-120.4	29.6	170.3	65.1	0	0	0	0	110.4	V211 F213 S285	V211-T291 HydrophobicContact CG1-CG2 3.95Å; F213-T291 HydrophobicContact CE1-CG2 4.22Å; S285-T291 CarbonylContact O-C 3.6Å; S285-T291 VanDerWaalsContact O-CA 3.27Å; S285-T291 WeakPolarHBondContact O-CA 3.13Å
292	S	89.9	Confident	91.3	Very high	65 Å²	65	59.4 Å²	59.4	46%	0.455	29%	0.293	S	S	.	.			trans	-63.9	151.3	-178.8	62.4	0	0	0	0	111.1	S284 S285 D290	S284-S292 CarbonylContact C-O 3.59Å; S284-S292 WeakPolarHBondContact CA-O 2.9Å; S285-S292 PolarHBondContact N-O 2.67Å; D290-S292 WeakPolarHBondContact OD1-CA 3.46Å; D290-S292 WeakPolarHBondContact OD1-CB 3.31Å; D290-S292 PolarHBondContact OD1-N 2.83Å; D290-S292 PolarHBondContact OD1-OG 2.83Å; D290-S292 PolarHBondContact OD2-OG 2.97Å
293	T	90.7	Very high	91.3	Very high	38 Å²	38	59.4 Å²	59.4	23%	0.233	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	150.5	-178.4	60.9	0	0	0	0	110.2	F213 L225 L282 I283 S284	F213-T293 HydrophobicContact CB-CG2 4.2Å; F213-T293 HydrophobicContact CD1-CG2 4.07Å; L225-T293 WeakPolarHBondContact CD1-OG1 3.32Å; L282-T293 HydrophobicContact CD1-CG2 4.46Å; I283-T293 CarbonylContact O-C 3.54Å; I283-T293 VanDerWaalsContact O-CA 3.29Å; I283-T293 WeakPolarHBondContact O-CA 3.47Å; S284-T293 VanDerWaalsContact OG-CG2 3.26Å; S284-T293 WeakPolarHBondContact OG-CG2 3.48Å
294	K	90.4	Very high	91.1	Very high	141 Å²	141	62.5 Å²	62.5	61%	0.613	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.4	178.2	-177.2	176.6	-179.4	177.3	0	109.2	L282 I283 I296	L282-K294 WeakPolarHBondContact CA-O 3.42Å; I283-K294 PolarHBondContact N-O 3.2Å; I283-K294 PolarHBondContact O-N 3.2Å; K294-I296 HydrophobicContact CD-CG2 4.32Å; K294-I296 HydrophobicContact CG-CG2 4.24Å
295	I	91.1	Very high	91.2	Very high	25 Å²	25	63.5 Å²	63.5	13%	0.128	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134	173.8	-62.9	177.8	0	0	0	108.6	I216 L225 R280 L281 L282	I216-I295 HydrophobicContact CG2-CD1 4.31Å; L225-I295 HydrophobicContact CD2-CD1 4.42Å; R280-I295 HydrophobicContact CB-CG2 3.64Å; R280-I295 HydrophobicContact CG-CG2 4.22Å; L281-I295 WeakPolarHBondContact O-CA 3.27Å; L282-I295 HydrophobicContact CD1-CD1 4.5Å; L282-I295 HydrophobicContact CD1-CG1 3.84Å
296	I	92	Very high	91.4	Very high	42 Å²	42	62.1 Å²	62.1	22%	0.215	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	152.6	174.5	66.5	175.9	0	0	0	110.8	R280 L281 I283 K294 W327	R280-I296 CarbonylContact C-O 3.47Å; R280-I296 WeakPolarHBondContact CA-O 3.23Å; R280-I296 WeakPolarHBondContact CB-O 3.18Å; L281-I296 HydrophobicContact CB-CG1 3.94Å; L281-I296 HydrophobicContact CD2-CD1 4.18Å; L281-I296 HydrophobicContact CD2-CG1 4.36Å; L281-I296 PolarHBondContact N-O 3.49Å; L281-I296 PolarHBondContact O-N 3Å; I283-I296 HydrophobicContact CD1-CD1 3.73Å; I283-I296 HydrophobicContact CD1-CG1 4.29Å; K294-I296 HydrophobicContact CD-CG2 4.32Å; K294-I296 HydrophobicContact CG-CG2 4.24Å; I296-W327 HydrophobicContact CD1-CE3 3.68Å; I296-W327 HydrophobicContact CD1-CH2 3.94Å; I296-W327 HydrophobicContact CD1-CZ3 3.36Å; I296-W327 HydrophobicContact CG1-CH2 4.2Å; I296-W327 HydrophobicContact CG1-CZ3 4.05Å
297	T	91.1	Very high	91.6	Very high	82 Å²	82	64.8 Å²	64.8	50%	0.503	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.8	-175.7	-52.5	0	0	0	0	110.2	R280	R280-T297 WeakPolarHBondContact CD-OG1 3.44Å; R280-T297 HydrophobicContact CG-CG2 4.21Å; R280-T297 VanDerWaalsContact CG-OG1 3.29Å; R280-T297 WeakPolarHBondContact CG-OG1 3.29Å
298	R	91.6	Very high	91.9	Very high	114 Å²	114	65.3 Å²	65.3	43%	0.43	32%	0.317	S	S	.	.			trans	-151.3	-32.5	173.2	-168.8	-178.9	-179.4	-173	0.8	112.8	F325 T326 W327	R298-F325 HydrophobicContact CB-CD2 4.34Å; R298-F325 HydrophobicContact CB-CE2 4.36Å; R298-F325 HydrophobicContact CG-CD2 3.92Å; R298-F325 HydrophobicContact CG-CE2 3.82Å; R298-F325 HydrophobicContact CG-CG 4.38Å; R298-F325 HydrophobicContact CG-CZ 4.16Å; R298-T326 PolarHBondContact NH1-O 3.46Å; R298-W327 HydrophobicContact CB-CH2 3.16Å; R298-W327 HydrophobicContact CB-CZ2 3.75Å; R298-W327 HydrophobicContact CB-CZ3 3.9Å; R298-W327 HydrophobicContact CG-CH2 4.08Å; R298-W327 HydrophobicContact CG-CZ2 4.49Å
299	H	94.2	Very high	92.2	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.009	31%	0.311	C	S	.	.			trans	-72	144	173.6	-76.8	-85.7	0	0	0	111.6	N279 S301 I303 T317 G319 D321 N323 F325	N279-H299 WeakPolarHBondContact CB-O 3.41Å; N279-H299 PolarHBondContact ND2-O 2.82Å; H299-S301 WeakPolarHBondContact CB-O 3.45Å; H299-I303 HydrophobicContact CB-CD1 4.45Å; H299-I303 HydrophobicContact CB-CG1 3.93Å; H299-I303 VanDerWaalsContact CD2-CG1 3.45Å; H299-I303 WeakPolarHBondContact CD2-CG1 3.35Å; H299-T317 WeakPolarHBondContact NE2-CB 3.39Å; H299-T317 PolarHBondContact NE2-O 3.42Å; H299-T317 PolarHBondContact NE2-OG1 3.24Å; H299-G319 PolarHBondContact CE1-N 3.31Å; H299-G319 VanDerWaalsContact CE1-N 3.34Å; H299-D321 WeakPolarHBondContact CA-OD2 3.46Å; H299-D321 IonicContact CE1-OD1 3.16Å; H299-D321 IonicContact CG-OD2 2.67Å; H299-D321 IonicContact ND1-OD1 3.18Å; H299-D321 PolarHBondContact ND1-OD1 3.41Å; H299-D321 IonicContact ND1-OD2 3.87Å; H299-D321 PolarHBondContact ND1-OD2 3.48Å; H299-D321 VanDerWaalsContact ND1-OD2 3.16Å; H299-N323 PolarHBondContact CE1-O 3.06Å; H299-F325 AromaticContact CD2-CD2 3.61Å; H299-F325 AromaticContact CE1-CD2 3.39Å; H299-F325 WeakPolarHBondContact CE1-CD2 3.25Å; H299-F325 AromaticContact CE1-CE2 3.79Å; H299-F325 AromaticContact CG-CD2 3.84Å; H299-F325 AromaticContact CG-CE2 3.83Å; H299-F325 AromaticContact ND1-CD2 3.71Å; H299-F325 AromaticContact ND1-CE2 3.64Å; H299-F325 AromaticContact NE2-CD2 3.36Å; H299-F325 WeakPolarHBondContact NE2-CD2 3.37Å
300	F	93.5	Very high	92.4	Very high	175 Å²	175	58.5 Å²	58.5	77%	0.768	30%	0.297	S	S	*	.	S	Bend	trans	-86.1	-13.1	176.3	-62.7	-76.4	0	0	0	112.5	D321	F300-D321 HydrophobicContact CB-CB 4.24Å; F300-D321 PolarHBondContact N-OD2 3.23Å
301	S	92.8	Very high	92.6	Very high	48 Å²	48	66.3 Å²	66.3	34%	0.336	32%	0.323	S	S	.	.	S	Bend	trans	-141.9	178.8	177.9	-169.6	0	0	0	0	110.8	N279 H299 I303	N279-S301 VanDerWaalsContact CA-O 3.28Å; N279-S301 WeakPolarHBondContact CA-O 3.17Å; N279-S301 WeakPolarHBondContact CB-O 3.41Å; H299-S301 WeakPolarHBondContact CB-O 3.45Å; S301-I303 PolarHBondContact O-N 3.2Å
302	K	91.8	Very high	92.6	Very high	57 Å²	57	69.2 Å²	69.2	25%	0.248	33%	0.332	C	S	.	.			trans	-56.7	122.7	-173.1	-179.6	173.6	178.8	-179.3	0	112	K278 G319 A320	K278-K302 CarbonylContact O-C 3.59Å; K278-K302 WeakPolarHBondContact O-CA 3.28Å; K302-G319 CarbonylContact O-C 3.53Å; K302-G319 WeakPolarHBondContact O-CA 3.44Å; K302-A320 PolarHBondContact O-N 3.2Å
303	I	94.4	Very high	92.7	Very high	1 Å²	1	70.1 Å²	70.1	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	129.3	166.9	-51.5	-174	0	0	0	108.4	P276 K278 R280 L281 H299 S301 C318	P276-I303 HydrophobicContact CB-CB 3.88Å; P276-I303 HydrophobicContact CB-CG2 3.73Å; P276-I303 HydrophobicContact CG-CB 4.49Å; P276-I303 HydrophobicContact CG-CG2 3.79Å; K278-I303 PolarHBondContact O-N 2.76Å; R280-I303 WeakPolarHBondContact O-CD1 3.37Å; L281-I303 HydrophobicContact CB-CD1 4.26Å; H299-I303 HydrophobicContact CB-CD1 4.45Å; H299-I303 HydrophobicContact CB-CG1 3.93Å; H299-I303 VanDerWaalsContact CD2-CG1 3.45Å; H299-I303 WeakPolarHBondContact CD2-CG1 3.35Å; S301-I303 PolarHBondContact O-N 3.2Å; I303-C318 WeakPolarHBondContact CA-O 3.49Å
304	R	90.6	Very high	92.9	Very high	100 Å²	100	71 Å²	71	38%	0.377	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-33.3	-177.5	-64.4	-55.2	-55.5	-107.1	-4.9	112.6	R254 C318	R254-R304 PolarHBondContact N-O 3.1Å; R304-C318 PolarHBondContact N-O 3.49Å
305	A	95.7	Very high	93.2	Very high	22 Å²	22	64.3 Å²	64.3	18%	0.182	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	148.5	178.8	0	0	0	0	0	110.6	R254 T317 C318	R254-A305 HydrophobicContact CB-CB 3.7Å; R254-A305 HydrophobicContact CG-CB 4.49Å; R254-A305 WeakPolarHBondContact O-CA 3.49Å; A305-T317 WeakPolarHBondContact O-CA 3.42Å; A305-C318 PolarHBondContact O-N 3.14Å
306	C	97	Very high	93.5	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.007	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	149	157.7	69.2	0	0	0	0	109.9	R254 F274 P276 L281 L315 Y316 T317	R254-C306 PolarHBondContact O-N 2.98Å; F274-C306 PolarHBondContact O-SG 2.67Å; P276-C306 HydrophobicContact CG-CB 4.21Å; L281-C306 HydrophobicContact CD1-CB 4.31Å; C306-L315 HydrophobicContact CB-CD1 4.12Å; C306-L315 HydrophobicContact CB-CD2 4.45Å; C306-L315 HydrophobicContact CB-CG 4.44Å; C306-Y316 CarbonylContact C-O 3.58Å; C306-Y316 WeakPolarHBondContact CA-O 3.48Å; C306-T317 HydrophobicContact CB-CG2 3.78Å
307	V	96.7	Very high	93.7	Very high	56 Å²	56	64.4 Å²	64.4	34%	0.339	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	131.1	176.6	178.5	0	0	0	0	108.8	D256 Y316	D256-V307 WeakPolarHBondContact OD2-CA 3.41Å; V307-Y316 PolarHBondContact N-O 3.09Å; V307-Y316 PolarHBondContact O-N 3.04Å
308	W	96.3	Very high	93.9	Very high	22 Å²	22	62.9 Å²	62.9	8%	0.083	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	143.9	175.4	178	-103.4	0	0	0	111.1	D256 T258 F274 D310 L313 E314 L315 I329	D256-W308 PolarHBondContact OD2-N 3.24Å; T258-W308 VanDerWaalsContact CB-CD1 3.4Å; T258-W308 VanDerWaalsContact CB-NE1 3.29Å; T258-W308 HydrophobicContact CG2-CD2 3.98Å; T258-W308 HydrophobicContact CG2-CG 4.32Å; T258-W308 HydrophobicContact CG2-CZ2 4Å; T258-W308 PolarHBondContact OG1-NE1 3.07Å; F274-W308 HydrophobicContact CE2-CB 4.39Å; F274-W308 HydrophobicContact CE2-CD2 4.19Å; F274-W308 AromaticContact CE2-CE3 3.82Å; F274-W308 HydrophobicContact CE2-CE3 3.82Å; F274-W308 HydrophobicContact CE2-CG 4.45Å; F274-W308 HydrophobicContact CE2-CZ3 4.49Å; F274-W308 HydrophobicContact CZ-CE3 4.09Å; F274-W308 HydrophobicContact CZ-CZ3 4.32Å; W308-D310 PolarHBondContact NE1-OD1 3.12Å; W308-L313 HydrophobicContact CH2-CB 4.25Å; W308-L313 WeakPolarHBondContact CH2-O 3.29Å; W308-L313 HydrophobicContact CZ2-CB 4.17Å; W308-L313 HydrophobicContact CZ2-CD2 4.01Å; W308-E314 VanDerWaalsContact CE3-C 3.47Å; W308-E314 VanDerWaalsContact CZ3-C 3.45Å; W308-L315 HydrophobicContact CB-CD1 4.28Å; W308-L315 HydrophobicContact CE3-CB 3.94Å; W308-L315 HydrophobicContact CE3-CD1 4.32Å; W308-L315 HydrophobicContact CZ3-CB 4.24Å; W308-I329 HydrophobicContact CE3-CD1 4.48Å; W308-I329 HydrophobicContact CH2-CB 4.08Å; W308-I329 HydrophobicContact CZ3-CB 3.78Å; W308-I329 HydrophobicContact CZ3-CD1 3.96Å; W308-I329 HydrophobicContact CZ3-CG1 4.04Å
309	N	94	Very high	93.9	Very high	45 Å²	45	58 Å²	58	24%	0.241	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	96.9	175.3	-177	-12.1	0	0	0	109.9	R311 H312 L313 E314 Y316	N309-R311 PolarHBondContact O-N 3.31Å; N309-R311 WeakPolarHBondContact OD1-CB 3.29Å; N309-R311 PolarHBondContact OD1-N 3.37Å; N309-H312 PolarHBondContact ND2-CD2 2.94Å; N309-H312 PolarHBondContact O-N 3.01Å; N309-H312 PolarHBondContact OD1-N 2.99Å; N309-L313 WeakPolarHBondContact O-CA 3.08Å; N309-L313 PolarHBondContact O-N 3.47Å; N309-E314 PolarHBondContact N-O 2.95Å; N309-E314 PolarHBondContact O-N 3.08Å; N309-Y316 HydrophobicContact CB-CD2 4.36Å; N309-Y316 HydrophobicContact CB-CE2 3.69Å
310	D	90.2	Very high	93.8	Very high	84 Å²	84	61 Å²	61	45%	0.449	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.5	-178.7	-68.8	-65.1	0	0	0	113.4	T258 W308 L313	T258-D310 PolarHBondContact OG1-OD1 2.55Å; W308-D310 PolarHBondContact NE1-OD1 3.12Å; D310-L313 WeakPolarHBondContact O-CD2 3.32Å
311	R	90.4	Very high	93.8	Very high	221 Å²	221	54.6 Å²	54.6	83%	0.834	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-39.1	179	177.8	178.6	-70.5	-163.8	-1.7	112.1	N309	N309-R311 PolarHBondContact O-N 3.31Å; N309-R311 WeakPolarHBondContact OD1-CB 3.29Å; N309-R311 PolarHBondContact OD1-N 3.37Å
312	H	90.9	Very high	93.8	Very high	112 Å²	112	55.7 Å²	55.7	52%	0.519	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-8.6	-175.5	-70.1	-85.2	0	0	0	113.2	N309 E314	N309-H312 PolarHBondContact ND2-CD2 2.94Å; N309-H312 PolarHBondContact O-N 3.01Å; N309-H312 PolarHBondContact OD1-N 2.99Å; H312-E314 VanDerWaalsContact C-N 3.29Å; H312-E314 HydrophobicContact CB-CB 4.49Å; H312-E314 HydrophobicContact CB-CG 4.34Å; H312-E314 PolarHBondContact O-N 3.44Å
313	L	91.5	Very high	94	Very high	85 Å²	85	55.8 Å²	55.8	45%	0.445	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	44.2	-174.8	-53.8	177.1	0	0	0	112.2	W308 N309 D310	W308-L313 HydrophobicContact CH2-CB 4.25Å; W308-L313 WeakPolarHBondContact CH2-O 3.29Å; W308-L313 HydrophobicContact CZ2-CB 4.17Å; W308-L313 HydrophobicContact CZ2-CD2 4.01Å; N309-L313 WeakPolarHBondContact O-CA 3.08Å; N309-L313 PolarHBondContact O-N 3.47Å; D310-L313 WeakPolarHBondContact O-CD2 3.32Å
314	E	94.3	Very high	94.1	Very high	57 Å²	57	61.5 Å²	61.5	27%	0.266	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144	-177.2	-70.5	177.7	161.2	0	0	110.9	W308 N309 H312 Y316 T326	W308-E314 VanDerWaalsContact CE3-C 3.47Å; W308-E314 VanDerWaalsContact CZ3-C 3.45Å; N309-E314 PolarHBondContact N-O 2.95Å; N309-E314 PolarHBondContact O-N 3.08Å; H312-E314 VanDerWaalsContact C-N 3.29Å; H312-E314 HydrophobicContact CB-CB 4.49Å; H312-E314 HydrophobicContact CB-CG 4.34Å; H312-E314 PolarHBondContact O-N 3.44Å; E314-Y316 PolarHBondContact OE2-OH 2.79Å; E314-T326 HydrophobicContact CB-CG2 3.93Å; E314-T326 HydrophobicContact CG-CG2 4.03Å; E314-T326 WeakPolarHBondContact OE2-CG2 3.4Å
315	L	96.4	Very high	94.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	136.4	168.4	-174.4	75.7	0	0	0	109.3	F274 L281 C306 W308 T317 T326 W327 I329	F274-L315 HydrophobicContact CB-CD1 4.05Å; F274-L315 HydrophobicContact CB-CD2 4.12Å; F274-L315 HydrophobicContact CD1-CD1 4.44Å; F274-L315 HydrophobicContact CD1-CD2 3.93Å; F274-L315 HydrophobicContact CD2-CD1 3.59Å; F274-L315 HydrophobicContact CE2-CD1 4.12Å; F274-L315 HydrophobicContact CG-CD1 3.76Å; F274-L315 HydrophobicContact CG-CD2 3.93Å; F274-L315 HydrophobicContact CG-CG 4.49Å; L281-L315 HydrophobicContact CD1-CD2 4.3Å; L281-L315 HydrophobicContact CD2-CD2 3.36Å; L281-L315 HydrophobicContact CG-CD2 4.45Å; C306-L315 HydrophobicContact CB-CD1 4.12Å; C306-L315 HydrophobicContact CB-CD2 4.45Å; C306-L315 HydrophobicContact CB-CG 4.44Å; W308-L315 HydrophobicContact CB-CD1 4.28Å; W308-L315 HydrophobicContact CE3-CB 3.94Å; W308-L315 HydrophobicContact CE3-CD1 4.32Å; W308-L315 HydrophobicContact CZ3-CB 4.24Å; L315-T317 HydrophobicContact CD2-CG2 4.03Å; L315-T317 HydrophobicContact CG-CG2 4.33Å; L315-T326 CarbonylContact O-C 3.6Å; L315-T326 WeakPolarHBondContact O-CA 3.31Å; L315-W327 HydrophobicContact CB-CB 4.18Å; L315-W327 PolarHBondContact N-O 3.05Å; L315-W327 VanDerWaalsContact O-CD1 3.3Å; L315-W327 PolarHBondContact O-N 3.33Å; L315-I329 HydrophobicContact CB-CD1 3.64Å; L315-I329 HydrophobicContact CB-CG1 4.19Å; L315-I329 HydrophobicContact CD2-CD1 3.99Å; L315-I329 HydrophobicContact CG-CD1 4.39Å
316	Y	97.3	Very high	94.4	Very high	68 Å²	68	59.7 Å²	59.7	27%	0.267	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	137.5	167.1	-57.2	-73.3	0	0	0	110.5	C306 V307 N309 E314 F325 T326	C306-Y316 CarbonylContact C-O 3.58Å; C306-Y316 WeakPolarHBondContact CA-O 3.48Å; V307-Y316 PolarHBondContact N-O 3.09Å; V307-Y316 PolarHBondContact O-N 3.04Å; N309-Y316 HydrophobicContact CB-CD2 4.36Å; N309-Y316 HydrophobicContact CB-CE2 3.69Å; E314-Y316 PolarHBondContact OE2-OH 2.79Å; Y316-F325 CarbonylContact C-O 3.58Å; Y316-F325 VanDerWaalsContact CA-O 3.28Å; Y316-F325 WeakPolarHBondContact CA-O 2.88Å; Y316-T326 HydrophobicContact CD1-CG2 3.96Å; Y316-T326 HydrophobicContact CE1-CG2 3.51Å; Y316-T326 WeakPolarHBondContact CE1-OG1 3.35Å
317	T	97.6	Very high	94.1	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	138.5	172.5	61.6	0	0	0	0	110.7	L281 H299 A305 C306 L315 L324 F325 W327	L281-T317 HydrophobicContact CD1-CG2 4.29Å; L281-T317 HydrophobicContact CD2-CG2 4.42Å; H299-T317 WeakPolarHBondContact NE2-CB 3.39Å; H299-T317 PolarHBondContact NE2-O 3.42Å; H299-T317 PolarHBondContact NE2-OG1 3.24Å; A305-T317 WeakPolarHBondContact O-CA 3.42Å; C306-T317 HydrophobicContact CB-CG2 3.78Å; L315-T317 HydrophobicContact CD2-CG2 4.03Å; L315-T317 HydrophobicContact CG-CG2 4.33Å; T317-L324 CarbonylContact O-C 3.58Å; T317-L324 WeakPolarHBondContact O-CA 3.45Å; T317-F325 PolarHBondContact N-O 3.18Å; T317-F325 PolarHBondContact O-N 3.01Å; T317-W327 PolarHBondContact OG1-NE1 3.37Å
318	C	95.4	Very high	93.4	Very high	50 Å²	50	63.2 Å²	63.2	34%	0.338	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	139.8	173.1	68.4	0	0	0	0	111.3	I303 R304 A305 N323 L324	I303-C318 WeakPolarHBondContact CA-O 3.49Å; R304-C318 PolarHBondContact N-O 3.49Å; A305-C318 PolarHBondContact O-N 3.14Å; C318-N323 WeakPolarHBondContact CA-O 3.03Å; C318-L324 HydrophobicContact CB-CD1 4.11Å
319	G	92	Very high	92.2	Very high	13 Å²	13	64 Å²	64	13%	0.134	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	164.1	-176.2	0	0	0	0	0	113.5	H299 K302 D321 G322 N323	H299-G319 PolarHBondContact CE1-N 3.31Å; H299-G319 VanDerWaalsContact CE1-N 3.34Å; K302-G319 CarbonylContact O-C 3.53Å; K302-G319 WeakPolarHBondContact O-CA 3.44Å; G319-D321 VanDerWaalsContact C-OD1 3.31Å; G319-D321 VanDerWaalsContact CA-OD1 3.27Å; G319-D321 WeakPolarHBondContact CA-OD1 3.26Å; G319-D321 PolarHBondContact O-N 3.49Å; G319-G322 PolarHBondContact O-N 3.39Å; G319-G322 VanDerWaalsContact O-N 3.16Å; G319-N323 PolarHBondContact N-O 2.94Å; G319-N323 VanDerWaalsContact N-O 3.14Å
320	A	91.2	Very high	90.5	Very high	64 Å²	64	68.7 Å²	68.7	53%	0.529	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-1.8	171.3	0	0	0	0	0	113.1	K302	K302-A320 PolarHBondContact O-N 3.2Å
321	D	94.4	Very high	88.7	Confident	40 Å²	40	68 Å²	68	21%	0.214	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-1.1	169.3	56.5	-6	0	0	0	112.5	H299 F300 G319 N323	H299-D321 WeakPolarHBondContact CA-OD2 3.46Å; H299-D321 IonicContact CE1-OD1 3.16Å; H299-D321 IonicContact CG-OD2 2.67Å; H299-D321 IonicContact ND1-OD1 3.18Å; H299-D321 PolarHBondContact ND1-OD1 3.41Å; H299-D321 IonicContact ND1-OD2 3.87Å; H299-D321 PolarHBondContact ND1-OD2 3.48Å; H299-D321 VanDerWaalsContact ND1-OD2 3.16Å; F300-D321 HydrophobicContact CB-CB 4.24Å; F300-D321 PolarHBondContact N-OD2 3.23Å; G319-D321 VanDerWaalsContact C-OD1 3.31Å; G319-D321 VanDerWaalsContact CA-OD1 3.27Å; G319-D321 WeakPolarHBondContact CA-OD1 3.26Å; G319-D321 PolarHBondContact O-N 3.49Å; D321-N323 VanDerWaalsContact CG-ND2 3.28Å; D321-N323 PolarHBondContact O-N 3.45Å; D321-N323 PolarHBondContact OD1-N 2.96Å; D321-N323 PolarHBondContact OD2-ND2 3.1Å
322	G	92.7	Very high	86.6	Confident	72 Å²	72	64.1 Å²	64.1	74%	0.742	37%	0.369	S	S	*	.	S	Bend	trans	80.4	1.8	-179	0	0	0	0	0	113.8	G319	G319-G322 PolarHBondContact O-N 3.39Å; G319-G322 VanDerWaalsContact O-N 3.16Å
323	N	95.8	Very high	84.1	Confident	58 Å²	58	62.4 Å²	62.4	31%	0.31	37%	0.37	S	S	.	.			trans	-88.5	143.1	-179.4	-65	-48.7	0	0	0	111.6	H299 C318 G319 D321 F325	H299-N323 PolarHBondContact CE1-O 3.06Å; C318-N323 WeakPolarHBondContact CA-O 3.03Å; G319-N323 PolarHBondContact N-O 2.94Å; G319-N323 VanDerWaalsContact N-O 3.14Å; D321-N323 VanDerWaalsContact CG-ND2 3.28Å; D321-N323 PolarHBondContact O-N 3.45Å; D321-N323 PolarHBondContact OD1-N 2.96Å; D321-N323 PolarHBondContact OD2-ND2 3.1Å; N323-F325 HydrophobicContact CB-CD2 4.46Å; N323-F325 HydrophobicContact CB-CE1 4.23Å; N323-F325 HydrophobicContact CB-CE2 3.9Å; N323-F325 HydrophobicContact CB-CZ 3.77Å
324	L	96	Very high	81.4	Confident	121 Å²	121	62.2 Å²	62.2	63%	0.634	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	117.3	162.2	179.2	71.3	0	0	0	107.3	T317 C318	T317-L324 CarbonylContact O-C 3.58Å; T317-L324 WeakPolarHBondContact O-CA 3.45Å; C318-L324 HydrophobicContact CB-CD1 4.11Å
325	F	96.2	Very high	78.5	Confident	32 Å²	32	65.7 Å²	65.7	14%	0.14	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.4	175.6	-68.3	-49.2	0	0	0	111.5	R298 H299 Y316 T317 N323	R298-F325 HydrophobicContact CB-CD2 4.34Å; R298-F325 HydrophobicContact CB-CE2 4.36Å; R298-F325 HydrophobicContact CG-CD2 3.92Å; R298-F325 HydrophobicContact CG-CE2 3.82Å; R298-F325 HydrophobicContact CG-CG 4.38Å; R298-F325 HydrophobicContact CG-CZ 4.16Å; H299-F325 AromaticContact CD2-CD2 3.61Å; H299-F325 AromaticContact CE1-CD2 3.39Å; H299-F325 WeakPolarHBondContact CE1-CD2 3.25Å; H299-F325 AromaticContact CE1-CE2 3.79Å; H299-F325 AromaticContact CG-CD2 3.84Å; H299-F325 AromaticContact CG-CE2 3.83Å; H299-F325 AromaticContact ND1-CD2 3.71Å; H299-F325 AromaticContact ND1-CE2 3.64Å; H299-F325 AromaticContact NE2-CD2 3.36Å; H299-F325 WeakPolarHBondContact NE2-CD2 3.37Å; Y316-F325 CarbonylContact C-O 3.58Å; Y316-F325 VanDerWaalsContact CA-O 3.28Å; Y316-F325 WeakPolarHBondContact CA-O 2.88Å; T317-F325 PolarHBondContact N-O 3.18Å; T317-F325 PolarHBondContact O-N 3.01Å; N323-F325 HydrophobicContact CB-CD2 4.46Å; N323-F325 HydrophobicContact CB-CE1 4.23Å; N323-F325 HydrophobicContact CB-CE2 3.9Å; N323-F325 HydrophobicContact CB-CZ 3.77Å
326	T	95.2	Very high	75.3	Confident	53 Å²	53	72.6 Å²	72.6	33%	0.325	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.4	167.8	-46.6	0	0	0	0	108	R298 E314 L315 Y316	R298-T326 PolarHBondContact NH1-O 3.46Å; E314-T326 HydrophobicContact CB-CG2 3.93Å; E314-T326 HydrophobicContact CG-CG2 4.03Å; E314-T326 WeakPolarHBondContact OE2-CG2 3.4Å; L315-T326 CarbonylContact O-C 3.6Å; L315-T326 WeakPolarHBondContact O-CA 3.31Å; Y316-T326 HydrophobicContact CD1-CG2 3.96Å; Y316-T326 HydrophobicContact CE1-CG2 3.51Å; Y316-T326 WeakPolarHBondContact CE1-OG1 3.35Å
327	W	91.6	Very high	72.3	Confident	31 Å²	31	74.8 Å²	74.8	12%	0.117	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	111	176.5	-47.5	76.9	0	0	0	107.1	I296 R298 L315 T317 I329	I296-W327 HydrophobicContact CD1-CE3 3.68Å; I296-W327 HydrophobicContact CD1-CH2 3.94Å; I296-W327 HydrophobicContact CD1-CZ3 3.36Å; I296-W327 HydrophobicContact CG1-CH2 4.2Å; I296-W327 HydrophobicContact CG1-CZ3 4.05Å; R298-W327 HydrophobicContact CB-CH2 3.16Å; R298-W327 HydrophobicContact CB-CZ2 3.75Å; R298-W327 HydrophobicContact CB-CZ3 3.9Å; R298-W327 HydrophobicContact CG-CH2 4.08Å; R298-W327 HydrophobicContact CG-CZ2 4.49Å; L315-W327 HydrophobicContact CB-CB 4.18Å; L315-W327 PolarHBondContact N-O 3.05Å; L315-W327 VanDerWaalsContact O-CD1 3.3Å; L315-W327 PolarHBondContact O-N 3.33Å; T317-W327 PolarHBondContact OG1-NE1 3.37Å; W327-I329 VanDerWaalsContact C-N 3.3Å; W327-I329 HydrophobicContact CB-CG1 4.11Å; W327-I329 PolarHBondContact O-N 3.14Å
328	P	82.5	Confident	69.2	Low	100 Å²	100	80.2 Å²	80.2	65%	0.649	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	99.2	166.2	28.4	-30.2	0	0	0	106.1	L330	P328-L330 PolarHBondContact O-N 3.13Å
329	I	71.5	Confident	66.3	Low	39 Å²	39	84 Å²	84	20%	0.2	50%	0.498	C	S	.	.			trans	-90.7	95	170.9	-52.4	-173.1	0	0	0	103.6	F274 W308 L315 W327	F274-I329 HydrophobicContact CD1-CD1 3.99Å; F274-I329 HydrophobicContact CE1-CD1 3.23Å; F274-I329 HydrophobicContact CE2-CD1 4.48Å; F274-I329 HydrophobicContact CZ-CD1 3.52Å; W308-I329 HydrophobicContact CE3-CD1 4.48Å; W308-I329 HydrophobicContact CH2-CB 4.08Å; W308-I329 HydrophobicContact CZ3-CB 3.78Å; W308-I329 HydrophobicContact CZ3-CD1 3.96Å; W308-I329 HydrophobicContact CZ3-CG1 4.04Å; L315-I329 HydrophobicContact CB-CD1 3.64Å; L315-I329 HydrophobicContact CB-CG1 4.19Å; L315-I329 HydrophobicContact CD2-CD1 3.99Å; L315-I329 HydrophobicContact CG-CD1 4.39Å; W327-I329 VanDerWaalsContact C-N 3.3Å; W327-I329 HydrophobicContact CB-CG1 4.11Å; W327-I329 PolarHBondContact O-N 3.14Å
330	L	57.6	Low	63.6	Low	143 Å²	143	90 Å²	90	75%	0.749	53%	0.527	S	S	*	.			trans	-50.9	129.2	167.7	-66.5	171.8	0	0	0	106.1	P328 L332	P328-L330 PolarHBondContact O-N 3.13Å; L330-L332 PolarHBondContact O-N 3.25Å; L330-L332 VanDerWaalsContact O-N 3.11Å
331	P	52	Low	60.8	Low	69 Å²	69	93.4 Å²	93.4	45%	0.448	54%	0.536	S	S	.	.			trans	-48.7	131	161.7	20.3	-28.4	0	0	0	105.2	S333	P331-S333 PolarHBondContact O-N 3.24Å
332	L	46.7	Very low	58.1	Low	139 Å²	139	99.9 Å²	99.9	73%	0.728	57%	0.565	S	S	*	*			trans	-65.2	77	169.7	-74	161.6	0	0	0	104.8	S261 L330 S334	S261-L332 WeakPolarHBondContact CB-O 3.14Å; S261-L332 PolarHBondContact OG-N 3.33Å; S261-L332 PolarHBondContact OG-O 3.05Å; L330-L332 PolarHBondContact O-N 3.25Å; L330-L332 VanDerWaalsContact O-N 3.11Å; L332-S334 PolarHBondContact O-N 3.14Å
333	S	38.2	Very low	55.6	Low	76 Å²	76	109.9 Å²	109.9	53%	0.531	59%	0.589	S	S	.	*			trans	-56.8	129.6	-170.6	50.3	0	0	0	0	106.8	P331 N335	P331-S333 PolarHBondContact O-N 3.24Å; S333-N335 PolarHBondContact O-N 2.76Å
334	S	35.6	Very low	53.6	Low	82 Å²	82	112.5 Å²	112.5	57%	0.573	60%	0.603	S	S	*	*			trans	-60.5	67.6	167.9	52.7	0	0	0	0	110.4	L332	L332-S334 PolarHBondContact O-N 3.14Å
335	N	32	Very low	51.3	Low	130 Å²	130	112 Å²	112	70%	0.695	60%	0.601	S	S	*	*			trans	-111.5	77.1	167.4	-80.2	-2.7	0	0	0	106.4	S333	S333-N335 PolarHBondContact O-N 2.76Å
336	N	30.9	Very low	48.8	Very low	145 Å²	145	116.4 Å²	116.4	78%	0.775	63%	0.627	S	S	*	*			trans	-165.9	55.9	142.9	-85.9	-18.4	0	0	0	107	I338	N336-I338 PolarHBondContact O-N 3.44Å
337	V	33.1	Very low	46.1	Very low	113 Å²	113	120.2 Å²	120.2	69%	0.685	64%	0.644	S	S	*	*			trans	-78.1	88	140.9	-177.1	0	0	0	0	103.1	D339	V337-D339 PolarHBondContact O-N 2.87Å; V337-D339 VanDerWaalsContact O-N 3.12Å
338	I	33.6	Very low	43.3	Very low	114 Å²	114	125.8 Å²	125.8	59%	0.585	68%	0.677	S	S	*	*			trans	-69.7	98.9	154.7	-60.6	174.3	0	0	0	102.1	N336 D340	N336-I338 PolarHBondContact O-N 3.44Å; I338-D340 HydrophobicContact CG2-CB 4.45Å; I338-D340 WeakPolarHBondContact CG2-OD1 3.32Å; I338-D340 PolarHBondContact O-N 2.91Å
339	D	33.1	Very low	40.7	Very low	129 Å²	129	127.5 Å²	127.5	69%	0.69	68%	0.679	S	S	*	*			trans	-61.2	84.9	157.5	-88.1	-22.6	0	0	0	105.9	V337 D341	V337-D339 PolarHBondContact O-N 2.87Å; V337-D339 VanDerWaalsContact O-N 3.12Å; D339-D341 PolarHBondContact O-N 3.5Å
340	D	35	Very low	38.5	Very low	141 Å²	141	133.8 Å²	133.8	75%	0.754	71%	0.714	S	S	*	*			trans	-76.6	66.2	155.7	-83	-23.2	0	0	0	107	I338	I338-D340 HydrophobicContact CG2-CB 4.45Å; I338-D340 WeakPolarHBondContact CG2-OD1 3.32Å; I338-D340 PolarHBondContact O-N 2.91Å
341	D	33.9	Very low	37	Very low	134 Å²	134	133.1 Å²	133.1	72%	0.717	71%	0.711	S	S	*	*			trans	-129.9	82.2	162.7	-97.4	-19.1	0	0	0	106.8	D339	D339-D341 PolarHBondContact O-N 3.5Å
342	Q	36.5	Very low	35.7	Very low	177 Å²	177	138.4 Å²	138.4	83%	0.827	73%	0.733	S	S	*	*			trans	-165.6	99.7	149.4	-107.6	163.1	79.5	0	0	111.6
343	F	40.3	Very low	34.7	Very low	281 Å²	281	138.4 Å²	138.4	100%	1.232	73%	0.733	S	S	*	*			trans	49.1	0	152.6	-60.3	-78.3	0	0	0	119.6

Retrieved 343 of 343 residues in 499 ms (Link to these results)

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