A0A077Z8B8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z8B8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 125 aa.

						>A0A077Z8B8_TRITR|A0A077Z8B8
MHFDWIIDQDDIVDPNYLVKQSMKLISPVFGSEDDRYKFKIELDTTKMVFSLLVVNSDENVLYGFRIRVSGLFNQLLQRRMPDFQNIENAWLRWHPVNLESIPKADGDGSGEDCTSESSPKGASL
					

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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	71.6	Confident	89.6	Confident	170 Å²	170	105.4 Å²	105.4	84%	0.837	52%	0.523	S	S	*	.				0	132.7	0	-170.9	-168.4	-172.9	0	0	108.3	F30 G31	M1-F30 HydrophobicContact CE-CB 3.85Å; M1-F30 HydrophobicContact SD-CB 4.3Å; M1-F30 HydrophobicContact SD-CD2 4.27Å; M1-G31 VanDerWaalsContact CE-N 3.31Å; M1-G31 WeakPolarHBondContact CE-O 3.36Å; M1-G31 VanDerWaalsContact SD-C 3.51Å; M1-G31 VanDerWaalsContact SD-CA 3.58Å; M1-G31 PolarHBondContact SD-N 3.32Å
2	H	82.2	Confident	89.8	Confident	156 Å²	156	98 Å²	98	72%	0.722	49%	0.487	S	S	*	.			trans	-107	140.5	169.7	-174.5	58.6	0	0	0	107.9	D4	H2-D4 IonicContact CD2-OD1 3.67Å; H2-D4 IonicContact CD2-OD2 2.72Å; H2-D4 IonicContact CE1-OD1 3.11Å; H2-D4 IonicContact NE2-OD1 2.72Å; H2-D4 PolarHBondContact NE2-OD1 3.05Å; H2-D4 VanDerWaalsContact NE2-OD1 3.14Å; H2-D4 IonicContact NE2-OD2 3.14Å
3	F	89.3	Confident	89.9	Confident	62 Å²	62	91 Å²	91	27%	0.272	45%	0.453	S	S	.	.			trans	-139.3	125.2	-179	170.1	-107.3	0	0	0	108	W5 P28 F30	F3-W5 HydrophobicContact CD1-CB 4.49Å; F3-W5 HydrophobicContact CE1-CB 3.74Å; F3-W5 HydrophobicContact CE1-CG 4.47Å; F3-W5 HydrophobicContact CZ-CB 4.16Å; F3-P28 HydrophobicContact CE2-CB 4.19Å; F3-P28 HydrophobicContact CZ-CB 4.01Å; F3-P28 HydrophobicContact CZ-CG 4.24Å; F3-F30 HydrophobicContact CB-CB 4.05Å; F3-F30 HydrophobicContact CB-CD2 4.17Å; F3-F30 HydrophobicContact CB-CG 4.03Å; F3-F30 HydrophobicContact CD1-CB 4.23Å; F3-F30 AromaticContact CD1-CD1 3.54Å; F3-F30 HydrophobicContact CD1-CD1 3.54Å; F3-F30 HydrophobicContact CD1-CD2 4.45Å; F3-F30 AromaticContact CD1-CE1 3.97Å; F3-F30 HydrophobicContact CD1-CE1 3.97Å; F3-F30 AromaticContact CD1-CG 3.82Å; F3-F30 HydrophobicContact CD1-CG 3.82Å; F3-F30 HydrophobicContact CD2-CB 3.53Å; F3-F30 HydrophobicContact CD2-CD1 4.28Å; F3-F30 HydrophobicContact CD2-CG 4.06Å; F3-F30 AromaticContact CE1-CD1 3.59Å; F3-F30 HydrophobicContact CE1-CD1 3.59Å; F3-F30 HydrophobicContact CE1-CE1 4.04Å; F3-F30 HydrophobicContact CE1-CG 4.26Å; F3-F30 HydrophobicContact CE2-CB 3.97Å; F3-F30 HydrophobicContact CE2-CD1 4.34Å; F3-F30 HydrophobicContact CE2-CG 4.49Å; F3-F30 HydrophobicContact CG-CB 3.66Å; F3-F30 AromaticContact CG-CD1 3.89Å; F3-F30 HydrophobicContact CG-CD1 3.89Å; F3-F30 HydrophobicContact CG-CD2 4.3Å; F3-F30 AromaticContact CG-CG 3.69Å; F3-F30 HydrophobicContact CG-CG 3.69Å; F3-F30 HydrophobicContact CZ-CB 4.48Å; F3-F30 HydrophobicContact CZ-CD1 4Å
4	D	92.8	Very high	89.9	Confident	120 Å²	120	87.6 Å²	87.6	64%	0.642	44%	0.437	S	S	*	.			trans	-103.1	129.6	176.4	-69.1	-40.6	0	0	0	109.4	H2	H2-D4 IonicContact CD2-OD1 3.67Å; H2-D4 IonicContact CD2-OD2 2.72Å; H2-D4 IonicContact CE1-OD1 3.11Å; H2-D4 IonicContact NE2-OD1 2.72Å; H2-D4 PolarHBondContact NE2-OD1 3.05Å; H2-D4 VanDerWaalsContact NE2-OD1 3.14Å; H2-D4 IonicContact NE2-OD2 3.14Å
5	W	94.6	Very high	89.9	Confident	67 Å²	67	90.1 Å²	90.1	25%	0.254	46%	0.462	S	S	.	.			trans	-120.8	114.4	175	179.9	26	0	0	0	108.9	F3 I7 L25 I41 L43 F50	F3-W5 HydrophobicContact CD1-CB 4.49Å; F3-W5 HydrophobicContact CE1-CB 3.74Å; F3-W5 HydrophobicContact CE1-CG 4.47Å; F3-W5 HydrophobicContact CZ-CB 4.16Å; W5-I7 HydrophobicContact CD2-CD1 4.07Å; W5-I7 HydrophobicContact CD2-CG1 3.98Å; W5-I7 HydrophobicContact CE3-CD1 4.09Å; W5-I7 HydrophobicContact CG-CG1 4.43Å; W5-I7 HydrophobicContact CH2-CD1 3.71Å; W5-I7 HydrophobicContact CH2-CG1 4.33Å; W5-I7 HydrophobicContact CZ2-CD1 3.67Å; W5-I7 HydrophobicContact CZ2-CG1 3.77Å; W5-I7 HydrophobicContact CZ3-CD1 3.91Å; W5-L25 HydrophobicContact CH2-CB 3.86Å; W5-L25 HydrophobicContact CZ2-CB 3.8Å; W5-I41 HydrophobicContact CE3-CB 4.34Å; W5-I41 HydrophobicContact CE3-CG2 4.34Å; W5-I41 HydrophobicContact CZ3-CB 4.2Å; W5-I41 HydrophobicContact CZ3-CG2 3.91Å; W5-L43 HydrophobicContact CH2-CB 4.04Å; W5-L43 HydrophobicContact CZ3-CB 4.31Å; W5-F50 HydrophobicContact CZ3-CD1 4.37Å; W5-F50 HydrophobicContact CZ3-CE1 4.15Å
6	I	93.7	Very high	89.8	Confident	148 Å²	148	92 Å²	92	76%	0.759	47%	0.473	S	S	*	.			trans	-94.5	129.7	176.1	-57.5	173.1	0	0	0	107.6
7	I	93	Very high	89.5	Confident	46 Å²	46	95.5 Å²	95.5	24%	0.236	48%	0.48	C	S	.	.			trans	-117.3	125.5	175.1	-60.8	171.8	0	0	0	106.5	W5 D11 I12 L25 L43	W5-I7 HydrophobicContact CD2-CD1 4.07Å; W5-I7 HydrophobicContact CD2-CG1 3.98Å; W5-I7 HydrophobicContact CE3-CD1 4.09Å; W5-I7 HydrophobicContact CG-CG1 4.43Å; W5-I7 HydrophobicContact CH2-CD1 3.71Å; W5-I7 HydrophobicContact CH2-CG1 4.33Å; W5-I7 HydrophobicContact CZ2-CD1 3.67Å; W5-I7 HydrophobicContact CZ2-CG1 3.77Å; W5-I7 HydrophobicContact CZ3-CD1 3.91Å; I7-D11 HydrophobicContact CG2-CB 4.16Å; I7-I12 HydrophobicContact CG2-CB 3.99Å; I7-I12 HydrophobicContact CG2-CD1 4.45Å; I7-I12 HydrophobicContact CG2-CG2 4.13Å; I7-L25 HydrophobicContact CD1-CD1 4.22Å; I7-L25 HydrophobicContact CG2-CD1 3.57Å; I7-L43 HydrophobicContact CD1-CD2 4.3Å
8	D	92.9	Very high	89.5	Confident	108 Å²	108	95 Å²	95	58%	0.578	48%	0.479	S	S	*	.			trans	-67.5	144	176.8	-75.4	-43.1	0	0	0	110.4	D10 D11	D8-D10 PolarHBondContact O-N 2.9Å; D8-D11 WeakPolarHBondContact O-CB 3.23Å; D8-D11 PolarHBondContact O-N 2.71Å
9	Q	90.6	Very high	89.5	Confident	78 Å²	78	90.7 Å²	90.7	36%	0.364	46%	0.458	S	S	.	.	H	α-helix	trans	-54.4	-42.9	-179.5	172.5	174.8	-17.3	0	0	111.3	D11 I12 V13 L72	Q9-D11 PolarHBondContact O-N 3.43Å; Q9-I12 PolarHBondContact O-N 2.91Å; Q9-I12 VanDerWaalsContact O-N 3.15Å; Q9-V13 HydrophobicContact CG-CB 4.11Å; Q9-V13 HydrophobicContact CG-CG2 4.09Å; Q9-V13 WeakPolarHBondContact O-CB 3.4Å; Q9-V13 PolarHBondContact O-N 3.07Å; Q9-L72 HydrophobicContact CB-CD1 3.94Å; Q9-L72 HydrophobicContact CG-CD1 3.57Å
10	D	92	Very high	89.7	Confident	124 Å²	124	89.7 Å²	89.7	66%	0.663	45%	0.45	S	S	*	.	H	α-helix	trans	-67.6	-15.9	-177.9	-66.5	-21.2	0	0	0	112.7	D8 K20	D8-D10 PolarHBondContact O-N 2.9Å; D10-K20 WeakPolarHBondContact O-CE 3.29Å; D10-K20 PolarHBondContact O-NZ 2.64Å
11	D	92.8	Very high	89.8	Confident	80 Å²	80	91.1 Å²	91.1	43%	0.428	46%	0.456	S	S	.	.	H	α-helix	trans	-82.7	-27.4	175.5	-70.7	-25.9	0	0	0	112.4	I7 D8 Q9 L25	I7-D11 HydrophobicContact CG2-CB 4.16Å; D8-D11 WeakPolarHBondContact O-CB 3.23Å; D8-D11 PolarHBondContact O-N 2.71Å; Q9-D11 PolarHBondContact O-N 3.43Å; D11-L25 HydrophobicContact CB-CD1 4.36Å; D11-L25 HydrophobicContact CB-CD2 4.31Å
12	I	91.8	Very high	90.8	Very high	17 Å²	17	87.4 Å²	87.4	9%	0.087	45%	0.446	C	S	.	.	H	α-helix	trans	-114.6	-25.2	-169.8	-165.3	170.2	0	0	0	113.8	I7 Q9 V19 K20 L25 L43 W94	I7-I12 HydrophobicContact CG2-CB 3.99Å; I7-I12 HydrophobicContact CG2-CD1 4.45Å; I7-I12 HydrophobicContact CG2-CG2 4.13Å; Q9-I12 PolarHBondContact O-N 2.91Å; Q9-I12 VanDerWaalsContact O-N 3.15Å; I12-V19 HydrophobicContact CG1-CG1 4.37Å; I12-V19 CarbonylContact O-C 3.58Å; I12-V19 WeakPolarHBondContact O-CA 3.34Å; I12-K20 PolarHBondContact O-N 2.87Å; I12-L25 HydrophobicContact CB-CD1 4.29Å; I12-L43 HydrophobicContact CD1-CD2 3.6Å; I12-L43 HydrophobicContact CG1-CD2 4.39Å; I12-W94 HydrophobicContact CD1-CH2 3.46Å; I12-W94 VanDerWaalsContact CD1-CH2 3.46Å; I12-W94 HydrophobicContact CD1-CZ2 4.49Å; I12-W94 HydrophobicContact CD1-CZ3 3.78Å; I12-W94 HydrophobicContact CG1-CH2 4.19Å; I12-W94 HydrophobicContact CG1-CZ3 4.39Å
13	V	90.9	Very high	91.3	Very high	7 Å²	7	83.5 Å²	83.5	4%	0.042	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-116.8	135.2	-174.3	-165.7	0	0	0	0	110.9	Q9 L18 K20 L72 F73	Q9-V13 HydrophobicContact CG-CB 4.11Å; Q9-V13 HydrophobicContact CG-CG2 4.09Å; Q9-V13 WeakPolarHBondContact O-CB 3.4Å; Q9-V13 PolarHBondContact O-N 3.07Å; V13-L18 CarbonylContact C-O 3.59Å; V13-L18 WeakPolarHBondContact CA-O 3.19Å; V13-L18 WeakPolarHBondContact CG1-O 3.48Å; V13-K20 WeakPolarHBondContact O-CE 3.45Å; V13-L72 HydrophobicContact CG2-CD1 3.85Å; V13-F73 HydrophobicContact CG1-CZ 4.42Å; V13-F73 HydrophobicContact CG2-CE2 3.97Å; V13-F73 HydrophobicContact CG2-CZ 3.71Å
14	D	90.4	Very high	91.7	Very high	43 Å²	43	85.8 Å²	85.8	23%	0.23	44%	0.439	C	S	.	.			trans	-79.5	172.3	174	80	2.4	0	0	0	112.1	N16 Y17 L18 K20	D14-N16 PolarHBondContact O-N 2.98Å; D14-N16 VanDerWaalsContact OD1-CA 3.28Å; D14-N16 WeakPolarHBondContact OD1-CA 3.07Å; D14-N16 WeakPolarHBondContact OD1-CB 3.43Å; D14-N16 PolarHBondContact OD1-N 3.23Å; D14-Y17 PolarHBondContact O-N 3.36Å; D14-Y17 PolarHBondContact OD1-N 2.95Å; D14-L18 PolarHBondContact N-O 3.32Å; D14-L18 PolarHBondContact OD1-N 3.38Å; D14-K20 HydrophobicContact CB-CG 4Å
15	P	89.9	Confident	91.9	Very high	125 Å²	125	81.3 Å²	81.3	81%	0.812	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-14.2	177.5	-26.5	36.5	0	0	0	115.5	Y17	P15-Y17 VanDerWaalsContact C-N 3.34Å
16	N	88.3	Confident	92	Very high	121 Å²	121	81.7 Å²	81.7	65%	0.647	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	12	176.5	-56.1	-55.6	0	0	0	112.5	D14 L18	D14-N16 PolarHBondContact O-N 2.98Å; D14-N16 VanDerWaalsContact OD1-CA 3.28Å; D14-N16 WeakPolarHBondContact OD1-CA 3.07Å; D14-N16 WeakPolarHBondContact OD1-CB 3.43Å; D14-N16 PolarHBondContact OD1-N 3.23Å; N16-L18 HydrophobicContact CB-CD1 4.48Å; N16-L18 HydrophobicContact CB-CG 4.35Å; N16-L18 PolarHBondContact O-N 3.04Å
17	Y	85.1	Confident	92.1	Very high	151 Å²	151	74.9 Å²	74.9	59%	0.592	39%	0.387	S	S	*	.	S	Bend	trans	61.8	27.8	-176.9	-60.2	-86.8	0	0	0	114.1	D14 P15 N98	D14-Y17 PolarHBondContact O-N 3.36Å; D14-Y17 PolarHBondContact OD1-N 2.95Å; P15-Y17 VanDerWaalsContact C-N 3.34Å; Y17-N98 PolarHBondContact O-ND2 2.77Å
18	L	88.2	Confident	92.2	Very high	87 Å²	87	76.4 Å²	76.4	46%	0.455	40%	0.399	S	S	.	.	S	Bend	trans	-103.7	148.8	173.9	-58.7	179.1	0	0	0	110.5	V13 D14 N16 K20	V13-L18 CarbonylContact C-O 3.59Å; V13-L18 WeakPolarHBondContact CA-O 3.19Å; V13-L18 WeakPolarHBondContact CG1-O 3.48Å; D14-L18 PolarHBondContact N-O 3.32Å; D14-L18 PolarHBondContact OD1-N 3.38Å; N16-L18 HydrophobicContact CB-CD1 4.48Å; N16-L18 HydrophobicContact CB-CG 4.35Å; N16-L18 PolarHBondContact O-N 3.04Å; L18-K20 PolarHBondContact O-N 3.04Å
19	V	90.5	Very high	92.3	Very high	13 Å²	13	74.7 Å²	74.7	8%	0.079	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-62.6	122.8	173.5	177.5	0	0	0	0	109.3	I12 Q21 T45 M48 F73 W94 P96	I12-V19 HydrophobicContact CG1-CG1 4.37Å; I12-V19 CarbonylContact O-C 3.58Å; I12-V19 WeakPolarHBondContact O-CA 3.34Å; V19-Q21 PolarHBondContact O-N 2.86Å; V19-Q21 PolarHBondContact O-NE2 2.82Å; V19-T45 HydrophobicContact CG1-CG2 3.88Å; V19-M48 HydrophobicContact CB-CE 3.96Å; V19-M48 HydrophobicContact CG1-CE 3.74Å; V19-M48 HydrophobicContact CG1-SD 4.06Å; V19-F73 HydrophobicContact CG2-CE1 4.28Å; V19-F73 HydrophobicContact CG2-CE2 3.94Å; V19-F73 HydrophobicContact CG2-CZ 3.7Å; V19-W94 HydrophobicContact CG1-CZ3 4.06Å; V19-W94 HydrophobicContact CG2-CH2 3.9Å; V19-W94 HydrophobicContact CG2-CZ3 4.16Å; V19-P96 HydrophobicContact CG2-CB 4.34Å; V19-P96 HydrophobicContact CG2-CG 3.85Å
20	K	93.2	Very high	92.4	Very high	71 Å²	71	72.4 Å²	72.4	31%	0.309	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-55.2	124.2	176.6	-69.9	-177.9	178.5	-179	0	109.6	D10 I12 V13 D14 L18 M23 T45	D10-K20 WeakPolarHBondContact O-CE 3.29Å; D10-K20 PolarHBondContact O-NZ 2.64Å; I12-K20 PolarHBondContact O-N 2.87Å; V13-K20 WeakPolarHBondContact O-CE 3.45Å; D14-K20 HydrophobicContact CB-CG 4Å; L18-K20 PolarHBondContact O-N 3.04Å; K20-M23 HydrophobicContact CB-CG 3.8Å; K20-T45 WeakPolarHBondContact O-CB 3.28Å; K20-T45 PolarHBondContact O-OG1 3.24Å
21	Q	92.1	Very high	92.4	Very high	120 Å²	120	67 Å²	67	56%	0.561	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	155.5	177.1	-60.9	-58.9	-54.1	0	0	110.9	V19 M23 M48	V19-Q21 PolarHBondContact O-N 2.86Å; V19-Q21 PolarHBondContact O-NE2 2.82Å; Q21-M23 VanDerWaalsContact C-N 3.27Å; Q21-M23 PolarHBondContact O-N 3.19Å; Q21-M48 VanDerWaalsContact NE2-CE 3.33Å
22	S	92.7	Very high	92.2	Very high	92 Å²	92	64.7 Å²	64.7	64%	0.643	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	29.9	173.9	-50.4	0	0	0	0	115.2	T46	S22-T46 WeakPolarHBondContact CA-OG1 3.37Å
23	M	93.4	Very high	92.1	Very high	73 Å²	73	73.2 Å²	73.2	36%	0.36	38%	0.384	S	S	.	.			trans	-105	147.1	176.2	-71.4	-58	-47.9	0	0	111.4	K20 Q21 T45	K20-M23 HydrophobicContact CB-CG 3.8Å; Q21-M23 VanDerWaalsContact C-N 3.27Å; Q21-M23 PolarHBondContact O-N 3.19Å; M23-T45 HydrophobicContact CB-CG2 4.17Å; M23-T45 WeakPolarHBondContact CB-OG1 3.48Å; M23-T45 PolarHBondContact N-OG1 3.15Å; M23-T45 PolarHBondContact O-N 2.83Å; M23-T45 PolarHBondContact O-OG1 2.58Å
24	K	96.2	Very high	92	Very high	111 Å²	111	76.7 Å²	76.7	48%	0.483	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122.1	168.5	-74.2	179.4	169.1	-117.8	0	109.7	E42 L43 D44	K24-E42 VanDerWaalsContact NZ-CD 3.29Å; K24-E42 IonicContact NZ-OE1 3.92Å; K24-E42 PolarHBondContact NZ-OE1 2.95Å; K24-E42 IonicContact NZ-OE2 2.79Å; K24-E42 PolarHBondContact NZ-OE2 3.32Å; K24-E42 VanDerWaalsContact NZ-OE2 3.11Å; K24-L43 CarbonylContact C-O 3.57Å; K24-L43 VanDerWaalsContact CA-O 3.29Å; K24-L43 WeakPolarHBondContact CA-O 3.38Å; K24-D44 HydrophobicContact CG-CB 4.4Å; K24-D44 IonicContact NZ-OD2 2.64Å
25	L	96.5	Very high	91.9	Very high	26 Å²	26	79.3 Å²	79.3	14%	0.136	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.1	174.3	-60.7	176.1	0	0	0	108.9	W5 I7 D11 I12 E42 L43	W5-L25 HydrophobicContact CH2-CB 3.86Å; W5-L25 HydrophobicContact CZ2-CB 3.8Å; I7-L25 HydrophobicContact CD1-CD1 4.22Å; I7-L25 HydrophobicContact CG2-CD1 3.57Å; D11-L25 HydrophobicContact CB-CD1 4.36Å; D11-L25 HydrophobicContact CB-CD2 4.31Å; I12-L25 HydrophobicContact CB-CD1 4.29Å; L25-E42 CarbonylContact O-C 3.57Å; L25-E42 WeakPolarHBondContact O-CA 3.33Å; L25-L43 HydrophobicContact CB-CB 4.37Å; L25-L43 HydrophobicContact CD1-CD2 4.38Å; L25-L43 PolarHBondContact N-O 3.21Å; L25-L43 PolarHBondContact O-N 2.94Å
26	I	97	Very high	91.9	Very high	75 Å²	75	79.3 Å²	79.3	39%	0.385	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.7	-176	-56.2	-63.7	0	0	0	108.7	K40 E42 L53	I26-K40 HydrophobicContact CG2-CB 4.31Å; I26-K40 HydrophobicContact CG2-CD 3.69Å; I26-K40 HydrophobicContact CG2-CG 4.47Å; I26-E42 HydrophobicContact CD1-CB 3.57Å; I26-E42 HydrophobicContact CD1-CG 3.57Å; I26-L53 HydrophobicContact CD1-CD1 4.38Å
27	S	96.3	Very high	91.9	Very high	4 Å²	4	76.6 Å²	76.6	3%	0.028	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-68.7	158.7	175.8	80.2	0	0	0	0	112	I41	S27-I41 PolarHBondContact N-O 2.93Å; S27-I41 PolarHBondContact OG-N 3.43Å
28	P	95.8	Very high	92.3	Very high	78 Å²	78	71.3 Å²	71.3	51%	0.506	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-49.1	156.3	157	-26.7	33.1	0	0	0	112.4	F3	F3-P28 HydrophobicContact CE2-CB 4.19Å; F3-P28 HydrophobicContact CZ-CB 4.01Å; F3-P28 HydrophobicContact CZ-CG 4.24Å
29	V	94.6	Very high	92.5	Very high	72 Å²	72	68.6 Å²	68.6	44%	0.436	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-70.6	132.8	173.8	179.1	0	0	0	0	109.2	K38 F39 K40	V29-K38 HydrophobicContact CG1-CB 3.91Å; V29-K38 HydrophobicContact CG1-CD 3.67Å; V29-K38 HydrophobicContact CG1-CG 4.23Å; V29-F39 WeakPolarHBondContact CA-O 3.44Å; V29-K40 HydrophobicContact CG2-CD 4.24Å; V29-K40 HydrophobicContact CG2-CG 3.97Å
30	F	93.7	Very high	92.7	Very high	31 Å²	31	71.3 Å²	71.3	14%	0.136	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	156.5	172.4	63.4	-83.7	0	0	0	109.8	M1 F3 K38 F39 I41 L52	M1-F30 HydrophobicContact CE-CB 3.85Å; M1-F30 HydrophobicContact SD-CB 4.3Å; M1-F30 HydrophobicContact SD-CD2 4.27Å; F3-F30 HydrophobicContact CB-CB 4.05Å; F3-F30 HydrophobicContact CB-CD2 4.17Å; F3-F30 HydrophobicContact CB-CG 4.03Å; F3-F30 HydrophobicContact CD1-CB 4.23Å; F3-F30 AromaticContact CD1-CD1 3.54Å; F3-F30 HydrophobicContact CD1-CD1 3.54Å; F3-F30 HydrophobicContact CD1-CD2 4.45Å; F3-F30 AromaticContact CD1-CE1 3.97Å; F3-F30 HydrophobicContact CD1-CE1 3.97Å; F3-F30 AromaticContact CD1-CG 3.82Å; F3-F30 HydrophobicContact CD1-CG 3.82Å; F3-F30 HydrophobicContact CD2-CB 3.53Å; F3-F30 HydrophobicContact CD2-CD1 4.28Å; F3-F30 HydrophobicContact CD2-CG 4.06Å; F3-F30 AromaticContact CE1-CD1 3.59Å; F3-F30 HydrophobicContact CE1-CD1 3.59Å; F3-F30 HydrophobicContact CE1-CE1 4.04Å; F3-F30 HydrophobicContact CE1-CG 4.26Å; F3-F30 HydrophobicContact CE2-CB 3.97Å; F3-F30 HydrophobicContact CE2-CD1 4.34Å; F3-F30 HydrophobicContact CE2-CG 4.49Å; F3-F30 HydrophobicContact CG-CB 3.66Å; F3-F30 AromaticContact CG-CD1 3.89Å; F3-F30 HydrophobicContact CG-CD1 3.89Å; F3-F30 HydrophobicContact CG-CD2 4.3Å; F3-F30 AromaticContact CG-CG 3.69Å; F3-F30 HydrophobicContact CG-CG 3.69Å; F3-F30 HydrophobicContact CZ-CB 4.48Å; F3-F30 HydrophobicContact CZ-CD1 4Å; F30-K38 CarbonylContact O-C 3.6Å; F30-K38 WeakPolarHBondContact O-CA 3.44Å; F30-F39 WeakPolarHBondContact CD1-O 3.24Å; F30-F39 HydrophobicContact CD2-CB 4.32Å; F30-F39 HydrophobicContact CE1-CB 4.1Å; F30-F39 HydrophobicContact CE2-CB 3.79Å; F30-F39 HydrophobicContact CE2-CD2 4.27Å; F30-F39 HydrophobicContact CE2-CG 4.4Å; F30-F39 HydrophobicContact CZ-CB 3.66Å; F30-F39 PolarHBondContact N-O 2.91Å; F30-F39 PolarHBondContact O-N 3.11Å; F30-I41 HydrophobicContact CE1-CD1 4.34Å; F30-I41 HydrophobicContact CE1-CG1 3.85Å; F30-I41 HydrophobicContact CZ-CD1 3.96Å; F30-I41 HydrophobicContact CZ-CG1 3.91Å; F30-L52 HydrophobicContact CZ-CD1 3.99Å
31	G	90.8	Very high	92.8	Very high	9 Å²	9	68.5 Å²	68.5	9%	0.093	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.3	-168.9	-174.8	0	0	0	0	0	113.8	M1 Y37	M1-G31 VanDerWaalsContact CE-N 3.31Å; M1-G31 WeakPolarHBondContact CE-O 3.36Å; M1-G31 VanDerWaalsContact SD-C 3.51Å; M1-G31 VanDerWaalsContact SD-CA 3.58Å; M1-G31 PolarHBondContact SD-N 3.32Å; G31-Y37 CarbonylContact C-O 3.6Å; G31-Y37 WeakPolarHBondContact CA-O 3.14Å
32	S	88.8	Confident	93	Very high	32 Å²	32	64.3 Å²	64.3	22%	0.224	33%	0.326	C	S	.	.			trans	-64.3	153.4	176.8	60.6	0	0	0	0	111.7	D34 D35 R36 Y37 K38	S32-D34 VanDerWaalsContact C-N 3.27Å; S32-D34 WeakPolarHBondContact CB-OD1 3.26Å; S32-D34 PolarHBondContact O-N 3.21Å; S32-D34 PolarHBondContact OG-OD1 3.01Å; S32-D35 PolarHBondContact O-N 3.3Å; S32-R36 PolarHBondContact OG-N 2.84Å; S32-Y37 PolarHBondContact N-O 3.13Å; S32-Y37 PolarHBondContact OG-N 2.81Å; S32-K38 WeakPolarHBondContact O-CE 3.12Å; S32-K38 PolarHBondContact O-NZ 3.45Å
33	E	89	Confident	93.1	Very high	196 Å²	196	60 Å²	60	92%	0.916	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-28.7	178.4	-65.8	179.1	178	0	0	112.3	D35	E33-D35 PolarHBondContact O-N 3.04Å
34	D	90.4	Very high	93.2	Very high	81 Å²	81	56.8 Å²	56.8	43%	0.433	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	11.8	178.7	62.9	9.4	0	0	0	113.9	S32 R36	S32-D34 VanDerWaalsContact C-N 3.27Å; S32-D34 WeakPolarHBondContact CB-OD1 3.26Å; S32-D34 PolarHBondContact O-N 3.21Å; S32-D34 PolarHBondContact OG-OD1 3.01Å; D34-R36 PolarHBondContact O-N 3.08Å; D34-R36 WeakPolarHBondContact OD1-CB 3.06Å; D34-R36 PolarHBondContact OD1-N 3.46Å; D34-R36 IonicContact OD1-NE 3.9Å; D34-R36 IonicContact OD2-CZ 3.66Å; D34-R36 IonicContact OD2-NE 3.14Å; D34-R36 PolarHBondContact OD2-NE 2.96Å; D34-R36 IonicContact OD2-NH2 3.87Å; D34-R36 PolarHBondContact OD2-NH2 3.47Å
35	D	88	Confident	93.1	Very high	97 Å²	97	51.5 Å²	51.5	52%	0.519	26%	0.257	S	S	.	.	S	Bend	trans	61.1	1.8	180	-62.7	-32.9	0	0	0	117.5	S32 E33 Y37 K38 N56	S32-D35 PolarHBondContact O-N 3.3Å; E33-D35 PolarHBondContact O-N 3.04Å; D35-Y37 VanDerWaalsContact C-N 3.34Å; D35-Y37 PolarHBondContact O-N 2.71Å; D35-K38 VanDerWaalsContact CA-CE 3.44Å; D35-K38 WeakPolarHBondContact OD1-CE 3.45Å; D35-K38 IonicContact OD1-NZ 3.57Å; D35-K38 PolarHBondContact OD1-NZ 2.79Å; D35-N56 PolarHBondContact O-ND2 3.2Å
36	R	88.9	Confident	93	Very high	125 Å²	125	54.1 Å²	54.1	47%	0.472	27%	0.274	S	S	.	.	S	Bend	trans	-63.8	-35.2	-179.5	-71.8	-169	-73	173.8	-7.3	114.1	S32 D34 S57	S32-R36 PolarHBondContact OG-N 2.84Å; D34-R36 PolarHBondContact O-N 3.08Å; D34-R36 WeakPolarHBondContact OD1-CB 3.06Å; D34-R36 PolarHBondContact OD1-N 3.46Å; D34-R36 IonicContact OD1-NE 3.9Å; D34-R36 IonicContact OD2-CZ 3.66Å; D34-R36 IonicContact OD2-NE 3.14Å; D34-R36 PolarHBondContact OD2-NE 2.96Å; D34-R36 IonicContact OD2-NH2 3.87Å; D34-R36 PolarHBondContact OD2-NH2 3.47Å; R36-S57 VanDerWaalsContact O-CA 3.24Å; R36-S57 WeakPolarHBondContact O-CA 3.26Å; R36-S57 PolarHBondContact O-N 3.09Å
37	Y	89.3	Confident	92.8	Very high	64 Å²	64	57 Å²	57	25%	0.251	28%	0.284	S	S	.	.	S	Bend	trans	-123.1	118.3	178.2	-53.2	-65.8	0	0	0	109.3	G31 S32 D35 N56 D58 V61	G31-Y37 CarbonylContact C-O 3.6Å; G31-Y37 WeakPolarHBondContact CA-O 3.14Å; S32-Y37 PolarHBondContact N-O 3.13Å; S32-Y37 PolarHBondContact OG-N 2.81Å; D35-Y37 VanDerWaalsContact C-N 3.34Å; D35-Y37 PolarHBondContact O-N 2.71Å; Y37-N56 CarbonylContact C-O 3.43Å; Y37-N56 WeakPolarHBondContact CA-O 3.41Å; Y37-D58 HydrophobicContact CE1-CB 4.03Å; Y37-D58 PolarHBondContact OH-OD2 3.03Å; Y37-V61 HydrophobicContact CE1-CG1 4.44Å; Y37-V61 HydrophobicContact CE1-CG2 3.82Å
38	K	92.8	Very high	92.7	Very high	40 Å²	40	58.6 Å²	58.6	17%	0.174	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	135.4	176.8	-65.8	-70.7	165.4	175	0	110.2	V29 F30 S32 D35 V55 N56	V29-K38 HydrophobicContact CG1-CB 3.91Å; V29-K38 HydrophobicContact CG1-CD 3.67Å; V29-K38 HydrophobicContact CG1-CG 4.23Å; F30-K38 CarbonylContact O-C 3.6Å; F30-K38 WeakPolarHBondContact O-CA 3.44Å; S32-K38 WeakPolarHBondContact O-CE 3.12Å; S32-K38 PolarHBondContact O-NZ 3.45Å; D35-K38 VanDerWaalsContact CA-CE 3.44Å; D35-K38 WeakPolarHBondContact OD1-CE 3.45Å; D35-K38 IonicContact OD1-NZ 3.57Å; D35-K38 PolarHBondContact OD1-NZ 2.79Å; K38-V55 HydrophobicContact CB-CB 3.87Å; K38-V55 HydrophobicContact CB-CG1 4.28Å; K38-V55 WeakPolarHBondContact O-CA 3.37Å; K38-V55 WeakPolarHBondContact O-CB 3.42Å; K38-V55 PolarHBondContact O-N 2.86Å; K38-N56 HydrophobicContact CB-CB 3.96Å; K38-N56 HydrophobicContact CG-CB 4.22Å; K38-N56 PolarHBondContact N-O 3.23Å; K38-N56 PolarHBondContact O-N 3.37Å; K38-N56 VanDerWaalsContact O-N 3.12Å
39	F	92.8	Very high	92.6	Very high	31 Å²	31	55.7 Å²	55.7	14%	0.136	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	161.8	-174.2	-51.1	-78	0	0	0	111.5	V29 F30 L52 L53 V54 Y63	V29-F39 WeakPolarHBondContact CA-O 3.44Å; F30-F39 WeakPolarHBondContact CD1-O 3.24Å; F30-F39 HydrophobicContact CD2-CB 4.32Å; F30-F39 HydrophobicContact CE1-CB 4.1Å; F30-F39 HydrophobicContact CE2-CB 3.79Å; F30-F39 HydrophobicContact CE2-CD2 4.27Å; F30-F39 HydrophobicContact CE2-CG 4.4Å; F30-F39 HydrophobicContact CZ-CB 3.66Å; F30-F39 PolarHBondContact N-O 2.91Å; F30-F39 PolarHBondContact O-N 3.11Å; F39-L52 HydrophobicContact CB-CD1 3.77Å; F39-L52 HydrophobicContact CD1-CD1 4.1Å; F39-L52 HydrophobicContact CD1-CD2 4.22Å; F39-L52 HydrophobicContact CD1-CG 4.21Å; F39-L52 HydrophobicContact CG-CD1 4.09Å; F39-L53 CarbonylContact C-O 3.58Å; F39-L53 WeakPolarHBondContact CA-O 3.4Å; F39-V54 HydrophobicContact CD1-CG2 4.07Å; F39-V54 HydrophobicContact CE1-CG2 4Å; F39-Y63 AromaticContact CE1-CD1 3.53Å; F39-Y63 HydrophobicContact CE1-CD1 3.53Å; F39-Y63 AromaticContact CE1-CE1 3.64Å; F39-Y63 HydrophobicContact CE1-CE1 3.64Å; F39-Y63 HydrophobicContact CZ-CD1 4.02Å; F39-Y63 HydrophobicContact CZ-CE1 4.06Å
40	K	95.1	Very high	92.6	Very high	70 Å²	70	52.6 Å²	52.6	30%	0.304	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	160.2	163.1	-63.9	176	176.1	-175.3	0	109	I26 V29 L53 V55	I26-K40 HydrophobicContact CG2-CB 4.31Å; I26-K40 HydrophobicContact CG2-CD 3.69Å; I26-K40 HydrophobicContact CG2-CG 4.47Å; V29-K40 HydrophobicContact CG2-CD 4.24Å; V29-K40 HydrophobicContact CG2-CG 3.97Å; K40-L53 HydrophobicContact CB-CB 4.26Å; K40-L53 PolarHBondContact N-O 2.99Å; K40-L53 PolarHBondContact O-N 2.83Å; K40-V55 HydrophobicContact CD-CG2 4.14Å; K40-V55 HydrophobicContact CG-CG2 3.9Å
41	I	94.5	Very high	92.5	Very high	11 Å²	11	52.2 Å²	52.2	6%	0.056	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.5	163.5	-59.1	-57	0	0	0	108	W5 S27 F30 F50 S51 L52 F65 I67	W5-I41 HydrophobicContact CE3-CB 4.34Å; W5-I41 HydrophobicContact CE3-CG2 4.34Å; W5-I41 HydrophobicContact CZ3-CB 4.2Å; W5-I41 HydrophobicContact CZ3-CG2 3.91Å; S27-I41 PolarHBondContact N-O 2.93Å; S27-I41 PolarHBondContact OG-N 3.43Å; F30-I41 HydrophobicContact CE1-CD1 4.34Å; F30-I41 HydrophobicContact CE1-CG1 3.85Å; F30-I41 HydrophobicContact CZ-CD1 3.96Å; F30-I41 HydrophobicContact CZ-CG1 3.91Å; I41-F50 HydrophobicContact CG2-CB 4.17Å; I41-F50 HydrophobicContact CG2-CD1 3.75Å; I41-F50 HydrophobicContact CG2-CG 4.44Å; I41-S51 CarbonylContact C-O 3.58Å; I41-S51 WeakPolarHBondContact CA-O 3.29Å; I41-L52 HydrophobicContact CD1-CB 4.36Å; I41-L52 HydrophobicContact CD1-CD1 3.63Å; I41-F65 HydrophobicContact CD1-CD2 3.8Å; I41-F65 HydrophobicContact CD1-CE2 4.08Å; I41-F65 HydrophobicContact CD1-CG 4.49Å; I41-I67 HydrophobicContact CD1-CD1 4.34Å; I41-I67 HydrophobicContact CG1-CD1 4.44Å; I41-I67 HydrophobicContact CG2-CD1 3.96Å
42	E	95.6	Very high	92.6	Very high	33 Å²	33	52.1 Å²	52.1	15%	0.154	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.1	164.8	175.6	176.5	101.5	0	0	109	K24 L25 I26 F50 S51 L53	K24-E42 VanDerWaalsContact NZ-CD 3.29Å; K24-E42 IonicContact NZ-OE1 3.92Å; K24-E42 PolarHBondContact NZ-OE1 2.95Å; K24-E42 IonicContact NZ-OE2 2.79Å; K24-E42 PolarHBondContact NZ-OE2 3.32Å; K24-E42 VanDerWaalsContact NZ-OE2 3.11Å; L25-E42 CarbonylContact O-C 3.57Å; L25-E42 WeakPolarHBondContact O-CA 3.33Å; I26-E42 HydrophobicContact CD1-CB 3.57Å; I26-E42 HydrophobicContact CD1-CG 3.57Å; E42-F50 CarbonylContact O-C 3.51Å; E42-F50 WeakPolarHBondContact O-CA 3.49Å; E42-S51 PolarHBondContact N-O 2.94Å; E42-S51 PolarHBondContact O-N 3.25Å; E42-L53 HydrophobicContact CB-CD1 3.93Å; E42-L53 HydrophobicContact CB-CG 4.23Å
43	L	95.4	Very high	92.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.5	160.7	170.9	58.3	0	0	0	108.5	W5 I7 I12 K24 L25 T45 V49 F50 W94	W5-L43 HydrophobicContact CH2-CB 4.04Å; W5-L43 HydrophobicContact CZ3-CB 4.31Å; I7-L43 HydrophobicContact CD1-CD2 4.3Å; I12-L43 HydrophobicContact CD1-CD2 3.6Å; I12-L43 HydrophobicContact CG1-CD2 4.39Å; K24-L43 CarbonylContact C-O 3.57Å; K24-L43 VanDerWaalsContact CA-O 3.29Å; K24-L43 WeakPolarHBondContact CA-O 3.38Å; L25-L43 HydrophobicContact CB-CB 4.37Å; L25-L43 HydrophobicContact CD1-CD2 4.38Å; L25-L43 PolarHBondContact N-O 3.21Å; L25-L43 PolarHBondContact O-N 2.94Å; L43-T45 HydrophobicContact CD2-CG2 4.28Å; L43-T45 HydrophobicContact CG-CG2 4.1Å; L43-V49 WeakPolarHBondContact CA-O 3.03Å; L43-F50 HydrophobicContact CB-CD1 3.86Å; L43-F50 HydrophobicContact CB-CE1 3.72Å; L43-F50 HydrophobicContact CD1-CD1 4.06Å; L43-F50 HydrophobicContact CD1-CD2 4.36Å; L43-F50 HydrophobicContact CD1-CE1 3.81Å; L43-F50 HydrophobicContact CD1-CE2 4.11Å; L43-F50 HydrophobicContact CD1-CG 4.34Å; L43-F50 HydrophobicContact CD1-CZ 3.83Å; L43-F50 HydrophobicContact CD2-CE1 3.93Å; L43-F50 HydrophobicContact CD2-CZ 4.05Å; L43-F50 HydrophobicContact CG-CD1 4.43Å; L43-F50 HydrophobicContact CG-CE1 4.01Å; L43-F50 HydrophobicContact CG-CZ 4.35Å; L43-W94 HydrophobicContact CD1-CE3 3.8Å; L43-W94 HydrophobicContact CD1-CZ3 4.2Å; L43-W94 HydrophobicContact CD2-CE3 4.43Å; L43-W94 HydrophobicContact CD2-CZ3 4.05Å
44	D	95.7	Very high	92.8	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.032	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	106.4	170.1	-178.5	-17.9	0	0	0	108.8	K24 T46 K47 M48 V49	K24-D44 HydrophobicContact CG-CB 4.4Å; K24-D44 IonicContact NZ-OD2 2.64Å; D44-T46 VanDerWaalsContact C-N 3.26Å; D44-T46 PolarHBondContact O-N 2.82Å; D44-T46 WeakPolarHBondContact OD1-CA 3.32Å; D44-T46 WeakPolarHBondContact OD1-CB 3.3Å; D44-T46 PolarHBondContact OD1-N 2.88Å; D44-T46 PolarHBondContact OD1-OG1 2.84Å; D44-K47 PolarHBondContact O-N 2.86Å; D44-K47 PolarHBondContact OD1-N 2.77Å; D44-M48 VanDerWaalsContact O-CA 3.26Å; D44-M48 WeakPolarHBondContact O-CA 3.21Å; D44-M48 PolarHBondContact O-N 3.09Å; D44-V49 HydrophobicContact CB-CG2 4.07Å; D44-V49 PolarHBondContact N-O 2.9Å; D44-V49 PolarHBondContact O-N 3.45Å
45	T	94.5	Very high	92.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.3	-178	69.3	0	0	0	0	113	V19 K20 M23 L43 M48	V19-T45 HydrophobicContact CG1-CG2 3.88Å; K20-T45 WeakPolarHBondContact O-CB 3.28Å; K20-T45 PolarHBondContact O-OG1 3.24Å; M23-T45 HydrophobicContact CB-CG2 4.17Å; M23-T45 WeakPolarHBondContact CB-OG1 3.48Å; M23-T45 PolarHBondContact N-OG1 3.15Å; M23-T45 PolarHBondContact O-N 2.83Å; M23-T45 PolarHBondContact O-OG1 2.58Å; L43-T45 HydrophobicContact CD2-CG2 4.28Å; L43-T45 HydrophobicContact CG-CG2 4.1Å; T45-M48 VanDerWaalsContact O-CE 3.24Å; T45-M48 WeakPolarHBondContact O-CE 3.45Å
46	T	94.4	Very high	93	Very high	81 Å²	81	45.8 Å²	45.8	50%	0.497	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-44.8	172.1	-36	0	0	0	0	110.4	S22 D44	S22-T46 WeakPolarHBondContact CA-OG1 3.37Å; D44-T46 VanDerWaalsContact C-N 3.26Å; D44-T46 PolarHBondContact O-N 2.82Å; D44-T46 WeakPolarHBondContact OD1-CA 3.32Å; D44-T46 WeakPolarHBondContact OD1-CB 3.3Å; D44-T46 PolarHBondContact OD1-N 2.88Å; D44-T46 PolarHBondContact OD1-OG1 2.84Å
47	K	93.4	Very high	92.8	Very high	137 Å²	137	41.6 Å²	41.6	60%	0.596	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-11.7	-179.1	-64.3	174.5	-172.2	170.1	0	112.2	D44 V49	D44-K47 PolarHBondContact O-N 2.86Å; D44-K47 PolarHBondContact OD1-N 2.77Å; K47-V49 HydrophobicContact CB-CG1 4.14Å; K47-V49 HydrophobicContact CB-CG2 3.8Å; K47-V49 HydrophobicContact CD-CG2 4.46Å
48	M	93.1	Very high	92.4	Very high	36 Å²	36	41.7 Å²	41.7	18%	0.177	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	57.1	-168.8	-60.3	-65.9	-178	0	0	111.1	V19 Q21 D44 T45 R93 W94	V19-M48 HydrophobicContact CB-CE 3.96Å; V19-M48 HydrophobicContact CG1-CE 3.74Å; V19-M48 HydrophobicContact CG1-SD 4.06Å; Q21-M48 VanDerWaalsContact NE2-CE 3.33Å; D44-M48 VanDerWaalsContact O-CA 3.26Å; D44-M48 WeakPolarHBondContact O-CA 3.21Å; D44-M48 PolarHBondContact O-N 3.09Å; T45-M48 VanDerWaalsContact O-CE 3.24Å; T45-M48 WeakPolarHBondContact O-CE 3.45Å; M48-R93 CarbonylContact O-C 3.59Å; M48-R93 WeakPolarHBondContact O-CA 3.24Å; M48-W94 VanDerWaalsContact CB-O 3.29Å; M48-W94 WeakPolarHBondContact CB-O 3Å; M48-W94 PolarHBondContact O-N 2.98Å; M48-W94 HydrophobicContact SD-CE3 4.24Å
49	V	94	Very high	91.6	Very high	17 Å²	17	48 Å²	48	10%	0.103	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139.2	-179.9	-62.7	0	0	0	0	111.7	L43 D44 K47 W91 L92 R93	L43-V49 WeakPolarHBondContact CA-O 3.03Å; D44-V49 HydrophobicContact CB-CG2 4.07Å; D44-V49 PolarHBondContact N-O 2.9Å; D44-V49 PolarHBondContact O-N 3.45Å; K47-V49 HydrophobicContact CB-CG1 4.14Å; K47-V49 HydrophobicContact CB-CG2 3.8Å; K47-V49 HydrophobicContact CD-CG2 4.46Å; V49-W91 HydrophobicContact CG1-CE3 4.09Å; V49-L92 CarbonylContact C-O 3.54Å; V49-L92 WeakPolarHBondContact CA-O 2.93Å; V49-R93 HydrophobicContact CG1-CB 4.48Å
50	F	93.8	Very high	90.6	Very high	7 Å²	7	54.2 Å²	54.2	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	128.2	160.1	-67.9	-82.3	0	0	0	108.9	W5 I41 E42 L43 I67 V69 L77 W91 L92 W94	W5-F50 HydrophobicContact CZ3-CD1 4.37Å; W5-F50 HydrophobicContact CZ3-CE1 4.15Å; I41-F50 HydrophobicContact CG2-CB 4.17Å; I41-F50 HydrophobicContact CG2-CD1 3.75Å; I41-F50 HydrophobicContact CG2-CG 4.44Å; E42-F50 CarbonylContact O-C 3.51Å; E42-F50 WeakPolarHBondContact O-CA 3.49Å; L43-F50 HydrophobicContact CB-CD1 3.86Å; L43-F50 HydrophobicContact CB-CE1 3.72Å; L43-F50 HydrophobicContact CD1-CD1 4.06Å; L43-F50 HydrophobicContact CD1-CD2 4.36Å; L43-F50 HydrophobicContact CD1-CE1 3.81Å; L43-F50 HydrophobicContact CD1-CE2 4.11Å; L43-F50 HydrophobicContact CD1-CG 4.34Å; L43-F50 HydrophobicContact CD1-CZ 3.83Å; L43-F50 HydrophobicContact CD2-CE1 3.93Å; L43-F50 HydrophobicContact CD2-CZ 4.05Å; L43-F50 HydrophobicContact CG-CD1 4.43Å; L43-F50 HydrophobicContact CG-CE1 4.01Å; L43-F50 HydrophobicContact CG-CZ 4.35Å; F50-I67 HydrophobicContact CB-CD1 3.6Å; F50-I67 HydrophobicContact CD1-CD1 4.06Å; F50-I67 HydrophobicContact CD2-CD1 4.49Å; F50-I67 HydrophobicContact CG-CD1 3.82Å; F50-V69 HydrophobicContact CE2-CG2 3.86Å; F50-V69 HydrophobicContact CZ-CG2 3.97Å; F50-L77 HydrophobicContact CD2-CD2 4.09Å; F50-L77 HydrophobicContact CE2-CD2 4.18Å; F50-W91 CarbonylContact O-C 3.38Å; F50-W91 WeakPolarHBondContact O-CA 3.48Å; F50-W91 WeakPolarHBondContact O-CB 3.37Å; F50-L92 PolarHBondContact N-O 3.12Å; F50-L92 PolarHBondContact O-N 3.14Å; F50-W94 HydrophobicContact CD2-CB 4Å; F50-W94 HydrophobicContact CD2-CG 4.39Å; F50-W94 HydrophobicContact CE2-CB 3.77Å; F50-W94 AromaticContact CE2-CD2 3.91Å; F50-W94 HydrophobicContact CE2-CD2 3.91Å; F50-W94 HydrophobicContact CE2-CE3 4.32Å; F50-W94 AromaticContact CE2-CG 3.67Å; F50-W94 HydrophobicContact CE2-CG 3.67Å; F50-W94 HydrophobicContact CZ-CD2 4.38Å
51	S	92.7	Very high	89.7	Confident	23 Å²	23	53.1 Å²	53.1	16%	0.161	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.2	178	-51.5	0	0	0	0	110.4	I41 E42 A90	I41-S51 CarbonylContact C-O 3.58Å; I41-S51 WeakPolarHBondContact CA-O 3.29Å; E42-S51 PolarHBondContact N-O 2.94Å; E42-S51 PolarHBondContact O-N 3.25Å; S51-A90 WeakPolarHBondContact CA-O 3.48Å
52	L	92	Very high	88.9	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.042	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	125.5	170	-175.8	71.6	0	0	0	109	F30 F39 I41 F65 I87 A90	F30-L52 HydrophobicContact CZ-CD1 3.99Å; F39-L52 HydrophobicContact CB-CD1 3.77Å; F39-L52 HydrophobicContact CD1-CD1 4.1Å; F39-L52 HydrophobicContact CD1-CD2 4.22Å; F39-L52 HydrophobicContact CD1-CG 4.21Å; F39-L52 HydrophobicContact CG-CD1 4.09Å; I41-L52 HydrophobicContact CD1-CB 4.36Å; I41-L52 HydrophobicContact CD1-CD1 3.63Å; L52-F65 HydrophobicContact CB-CD1 3.69Å; L52-F65 HydrophobicContact CB-CE1 3.82Å; L52-F65 HydrophobicContact CB-CG 4.15Å; L52-F65 HydrophobicContact CB-CZ 4.33Å; L52-F65 HydrophobicContact CD1-CB 4.35Å; L52-F65 HydrophobicContact CD1-CG 4.4Å; L52-F65 HydrophobicContact CD2-CB 4.32Å; L52-F65 HydrophobicContact CD2-CD1 4.05Å; L52-F65 HydrophobicContact CD2-CG 4.4Å; L52-F65 HydrophobicContact CG-CD1 4.36Å; L52-I87 HydrophobicContact CB-CD1 4.3Å; L52-I87 HydrophobicContact CD2-CD1 4.03Å; L52-I87 HydrophobicContact CG-CD1 4.19Å; L52-I87 WeakPolarHBondContact O-CD1 3.49Å; L52-A90 HydrophobicContact CB-CB 3.94Å; L52-A90 HydrophobicContact CD2-CB 4.45Å; L52-A90 PolarHBondContact N-O 2.88Å
53	L	91.9	Very high	87.9	Confident	64 Å²	64	58 Å²	58	34%	0.335	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.7	173.8	-55.2	-177.7	0	0	0	109	I26 F39 K40 E42	I26-L53 HydrophobicContact CD1-CD1 4.38Å; F39-L53 CarbonylContact C-O 3.58Å; F39-L53 WeakPolarHBondContact CA-O 3.4Å; K40-L53 HydrophobicContact CB-CB 4.26Å; K40-L53 PolarHBondContact N-O 2.99Å; K40-L53 PolarHBondContact O-N 2.83Å; E42-L53 HydrophobicContact CB-CD1 3.93Å; E42-L53 HydrophobicContact CB-CG 4.23Å
54	V	90.4	Very high	87	Confident	49 Å²	49	60.6 Å²	60.6	30%	0.297	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	122.7	173.5	178.7	0	0	0	0	108.6	F39 S57 Y63 I87	F39-V54 HydrophobicContact CD1-CG2 4.07Å; F39-V54 HydrophobicContact CE1-CG2 4Å; V54-S57 WeakPolarHBondContact CG1-OG 3.43Å; V54-Y63 HydrophobicContact CG2-CD1 4.06Å; V54-Y63 HydrophobicContact CG2-CD2 4.24Å; V54-Y63 HydrophobicContact CG2-CE1 3.87Å; V54-Y63 HydrophobicContact CG2-CE2 4.06Å; V54-Y63 HydrophobicContact CG2-CG 4.24Å; V54-I87 HydrophobicContact CB-CG1 4.47Å; V54-I87 HydrophobicContact CG2-CB 4.44Å; V54-I87 HydrophobicContact CG2-CD1 3.41Å; V54-I87 VanDerWaalsContact CG2-CD1 3.41Å; V54-I87 HydrophobicContact CG2-CG1 3.6Å
55	V	92.2	Very high	86.4	Confident	80 Å²	80	62.3 Å²	62.3	49%	0.485	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-43.6	174.3	180	0	0	0	0	110.1	K38 K40	K38-V55 HydrophobicContact CB-CB 3.87Å; K38-V55 HydrophobicContact CB-CG1 4.28Å; K38-V55 WeakPolarHBondContact O-CA 3.37Å; K38-V55 WeakPolarHBondContact O-CB 3.42Å; K38-V55 PolarHBondContact O-N 2.86Å; K40-V55 HydrophobicContact CD-CG2 4.14Å; K40-V55 HydrophobicContact CG-CG2 3.9Å
56	N	89.5	Confident	85.9	Confident	79 Å²	79	73.7 Å²	73.7	42%	0.422	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.7	175.1	-169.6	30.3	0	0	0	110	D35 Y37 K38	D35-N56 PolarHBondContact O-ND2 3.2Å; Y37-N56 CarbonylContact C-O 3.43Å; Y37-N56 WeakPolarHBondContact CA-O 3.41Å; K38-N56 HydrophobicContact CB-CB 3.96Å; K38-N56 HydrophobicContact CG-CB 4.22Å; K38-N56 PolarHBondContact N-O 3.23Å; K38-N56 PolarHBondContact O-N 3.37Å; K38-N56 VanDerWaalsContact O-N 3.12Å
57	S	86.6	Confident	85.6	Confident	38 Å²	38	71.5 Å²	71.5	27%	0.266	37%	0.37	S	S	.	.			trans	-164.4	145	178.2	57.5	0	0	0	0	111.2	R36 V54 Y63	R36-S57 VanDerWaalsContact O-CA 3.24Å; R36-S57 WeakPolarHBondContact O-CA 3.26Å; R36-S57 PolarHBondContact O-N 3.09Å; V54-S57 WeakPolarHBondContact CG1-OG 3.43Å; S57-Y63 WeakPolarHBondContact CB-OH 3.11Å; S57-Y63 PolarHBondContact OG-OH 3.01Å
58	D	80.9	Confident	85.3	Confident	66 Å²	66	75.7 Å²	75.7	35%	0.353	38%	0.383	S	S	.	.			trans	-62	154.3	162.3	-65.1	-31.4	0	0	0	111.3	Y37 V61	Y37-D58 HydrophobicContact CE1-CB 4.03Å; Y37-D58 PolarHBondContact OH-OD2 3.03Å; D58-V61 HydrophobicContact CB-CG2 4.36Å
59	E	74.9	Confident	85.1	Confident	173 Å²	173	76.1 Å²	76.1	81%	0.808	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	146.6	176.7	-62	-179.1	174.6	0	0	111.6
60	N	71.6	Confident	84.7	Confident	161 Å²	161	80 Å²	80	86%	0.861	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	31.9	173.6	-50	-62.4	0	0	0	116.6
61	V	77.2	Confident	84.3	Confident	47 Å²	47	82.6 Å²	82.6	29%	0.285	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-95	139.2	175.1	-179.5	0	0	0	0	111.9	Y37 D58 Y63	Y37-V61 HydrophobicContact CE1-CG1 4.44Å; Y37-V61 HydrophobicContact CE1-CG2 3.82Å; D58-V61 HydrophobicContact CB-CG2 4.36Å; V61-Y63 HydrophobicContact CB-CE1 4.25Å; V61-Y63 HydrophobicContact CG1-CD1 4.5Å; V61-Y63 HydrophobicContact CG1-CE1 4.09Å; V61-Y63 VanDerWaalsContact O-CE2 3.31Å; V61-Y63 WeakPolarHBondContact O-CE2 3.43Å
62	L	77.5	Confident	83.5	Confident	115 Å²	115	85.5 Å²	85.5	60%	0.602	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-84.5	132.5	170.9	-62.2	179.9	0	0	0	110.2	Q85	L62-Q85 HydrophobicContact CD2-CB 4.01Å; L62-Q85 HydrophobicContact CD2-CG 3.67Å
63	Y	74	Confident	82.9	Confident	30 Å²	30	85.9 Å²	85.9	12%	0.118	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-103.8	127.9	-178.9	-55.1	-70.9	0	0	0	111	F39 V54 S57 V61 F84 I87	F39-Y63 AromaticContact CE1-CD1 3.53Å; F39-Y63 HydrophobicContact CE1-CD1 3.53Å; F39-Y63 AromaticContact CE1-CE1 3.64Å; F39-Y63 HydrophobicContact CE1-CE1 3.64Å; F39-Y63 HydrophobicContact CZ-CD1 4.02Å; F39-Y63 HydrophobicContact CZ-CE1 4.06Å; V54-Y63 HydrophobicContact CG2-CD1 4.06Å; V54-Y63 HydrophobicContact CG2-CD2 4.24Å; V54-Y63 HydrophobicContact CG2-CE1 3.87Å; V54-Y63 HydrophobicContact CG2-CE2 4.06Å; V54-Y63 HydrophobicContact CG2-CG 4.24Å; S57-Y63 WeakPolarHBondContact CB-OH 3.11Å; S57-Y63 PolarHBondContact OG-OH 3.01Å; V61-Y63 HydrophobicContact CB-CE1 4.25Å; V61-Y63 HydrophobicContact CG1-CD1 4.5Å; V61-Y63 HydrophobicContact CG1-CE1 4.09Å; V61-Y63 VanDerWaalsContact O-CE2 3.31Å; V61-Y63 WeakPolarHBondContact O-CE2 3.43Å; Y63-F84 PolarHBondContact N-O 2.93Å; Y63-F84 VanDerWaalsContact N-O 3.14Å; Y63-I87 HydrophobicContact CD2-CB 4.18Å; Y63-I87 HydrophobicContact CD2-CD1 4.01Å; Y63-I87 HydrophobicContact CG-CD1 4Å
64	G	77.2	Confident	82.4	Confident	56 Å²	56	86.4 Å²	86.4	58%	0.577	46%	0.462	S	S	*	.			trans	-142.8	138.8	171.6	0	0	0	0	0	109.3
65	F	81.8	Confident	82.1	Confident	41 Å²	41	86.5 Å²	86.5	18%	0.18	46%	0.459	C	S	.	.			trans	-136	152.3	174.5	71.2	-66.7	0	0	0	109.9	I41 L52 I67 A90 L92	I41-F65 HydrophobicContact CD1-CD2 3.8Å; I41-F65 HydrophobicContact CD1-CE2 4.08Å; I41-F65 HydrophobicContact CD1-CG 4.49Å; L52-F65 HydrophobicContact CB-CD1 3.69Å; L52-F65 HydrophobicContact CB-CE1 3.82Å; L52-F65 HydrophobicContact CB-CG 4.15Å; L52-F65 HydrophobicContact CB-CZ 4.33Å; L52-F65 HydrophobicContact CD1-CB 4.35Å; L52-F65 HydrophobicContact CD1-CG 4.4Å; L52-F65 HydrophobicContact CD2-CB 4.32Å; L52-F65 HydrophobicContact CD2-CD1 4.05Å; L52-F65 HydrophobicContact CD2-CG 4.4Å; L52-F65 HydrophobicContact CG-CD1 4.36Å; F65-I67 HydrophobicContact CD2-CD1 3.8Å; F65-I67 HydrophobicContact CD2-CG1 3.54Å; F65-I67 HydrophobicContact CE2-CD1 3.43Å; F65-I67 VanDerWaalsContact CE2-CD1 3.43Å; F65-I67 HydrophobicContact CE2-CG1 3.61Å; F65-A90 HydrophobicContact CD1-CB 4.37Å; F65-A90 VanDerWaalsContact CE1-C 3.44Å; F65-A90 HydrophobicContact CE1-CB 4.01Å; F65-A90 WeakPolarHBondContact CE1-O 3.17Å; F65-L92 HydrophobicContact CD2-CD1 4.47Å; F65-L92 HydrophobicContact CE2-CD1 3.82Å; F65-L92 HydrophobicContact CE2-CG 4.13Å; F65-L92 HydrophobicContact CZ-CD1 4.05Å; F65-L92 HydrophobicContact CZ-CG 3.85Å
66	R	85.5	Confident	81.7	Confident	239 Å²	239	87.8 Å²	87.8	90%	0.902	46%	0.463	S	S	*	.			trans	-121.9	125.3	172.9	-177.8	179	-180	179.6	0.1	107.1
67	I	87.7	Confident	81.6	Confident	35 Å²	35	86.5 Å²	86.5	18%	0.179	46%	0.455	C	S	.	.			trans	-105.6	139	171.4	-61.8	-171.8	0	0	0	108.3	I41 F50 F65 V69 L77 L92	I41-I67 HydrophobicContact CD1-CD1 4.34Å; I41-I67 HydrophobicContact CG1-CD1 4.44Å; I41-I67 HydrophobicContact CG2-CD1 3.96Å; F50-I67 HydrophobicContact CB-CD1 3.6Å; F50-I67 HydrophobicContact CD1-CD1 4.06Å; F50-I67 HydrophobicContact CD2-CD1 4.49Å; F50-I67 HydrophobicContact CG-CD1 3.82Å; F65-I67 HydrophobicContact CD2-CD1 3.8Å; F65-I67 HydrophobicContact CD2-CG1 3.54Å; F65-I67 HydrophobicContact CE2-CD1 3.43Å; F65-I67 VanDerWaalsContact CE2-CD1 3.43Å; F65-I67 HydrophobicContact CE2-CG1 3.61Å; I67-V69 HydrophobicContact CG2-CG2 3.41Å; I67-V69 VanDerWaalsContact CG2-CG2 3.41Å; I67-L77 HydrophobicContact CB-CD1 4.09Å; I67-L77 HydrophobicContact CG2-CD1 4.15Å; I67-L77 VanDerWaalsContact O-CD1 3.3Å; I67-L77 WeakPolarHBondContact O-CD1 3.29Å; I67-L92 HydrophobicContact CB-CD1 4.11Å; I67-L92 HydrophobicContact CG1-CD1 4.21Å
68	R	87.7	Confident	81.5	Confident	225 Å²	225	88 Å²	88	85%	0.849	46%	0.458	S	S	*	.			trans	-115.1	121.1	158.6	179.3	-177.7	-178.7	-178.1	-0.2	105.9
69	V	87.7	Confident	81.5	Confident	45 Å²	45	91 Å²	91	27%	0.273	47%	0.465	S	S	.	.			trans	-106.1	137.7	172.4	-160.3	0	0	0	0	108.6	F50 I67 Q75 L77	F50-V69 HydrophobicContact CE2-CG2 3.86Å; F50-V69 HydrophobicContact CZ-CG2 3.97Å; I67-V69 HydrophobicContact CG2-CG2 3.41Å; I67-V69 VanDerWaalsContact CG2-CG2 3.41Å; V69-Q75 VanDerWaalsContact CG1-CD 3.45Å; V69-L77 HydrophobicContact CG2-CD1 4.19Å; V69-L77 HydrophobicContact CG2-CD2 4.19Å
70	S	86.3	Confident	81	Confident	98 Å²	98	90.8 Å²	90.8	69%	0.685	46%	0.456	S	S	*	.			trans	-138.9	148.8	178.3	47.1	0	0	0	0	108.9
71	G	84.6	Confident	80.8	Confident	63 Å²	63	91.2 Å²	91.2	65%	0.649	46%	0.455	S	S	*	.	S	Bend	trans	144	-139.2	178.5	0	0	0	0	0	112.4	F73	G71-F73 VanDerWaalsContact C-N 3.31Å; G71-F73 PolarHBondContact O-N 3.08Å
72	L	76.2	Confident	79.9	Confident	83 Å²	83	91.5 Å²	91.5	44%	0.435	46%	0.458	S	S	.	.	S	Bend	trans	-62.9	-28	-166.3	-62.7	171.6	0	0	0	115.6	Q9 V13 L99	Q9-L72 HydrophobicContact CB-CD1 3.94Å; Q9-L72 HydrophobicContact CG-CD1 3.57Å; V13-L72 HydrophobicContact CG2-CD1 3.85Å; L72-L99 WeakPolarHBondContact O-CD1 3.13Å
73	F	80.4	Confident	79.3	Confident	16 Å²	16	89.4 Å²	89.4	7%	0.07	45%	0.448	C	S	.	.	S	Bend	trans	-107.9	153.2	-175.2	-52.7	-76.9	0	0	0	111	V13 V19 G71 Q75 W94 P96 N98	V13-F73 HydrophobicContact CG1-CZ 4.42Å; V13-F73 HydrophobicContact CG2-CE2 3.97Å; V13-F73 HydrophobicContact CG2-CZ 3.71Å; V19-F73 HydrophobicContact CG2-CE1 4.28Å; V19-F73 HydrophobicContact CG2-CE2 3.94Å; V19-F73 HydrophobicContact CG2-CZ 3.7Å; G71-F73 VanDerWaalsContact C-N 3.31Å; G71-F73 PolarHBondContact O-N 3.08Å; F73-Q75 HydrophobicContact CB-CG 4.04Å; F73-Q75 WeakPolarHBondContact O-CG 3.3Å; F73-Q75 PolarHBondContact O-N 3.1Å; F73-W94 HydrophobicContact CD2-CH2 4.27Å; F73-W94 AromaticContact CD2-CZ2 3.91Å; F73-W94 HydrophobicContact CD2-CZ2 3.91Å; F73-W94 HydrophobicContact CE2-CH2 4.28Å; F73-W94 HydrophobicContact CE2-CZ2 4.37Å; F73-P96 HydrophobicContact CB-CB 3.78Å; F73-P96 HydrophobicContact CD1-CB 4.01Å; F73-P96 HydrophobicContact CD2-CB 4.08Å; F73-P96 HydrophobicContact CG-CB 3.68Å; F73-N98 WeakPolarHBondContact CD1-OD1 3.46Å; F73-N98 WeakPolarHBondContact CE1-OD1 3.12Å
74	N	79.7	Confident	78.8	Confident	76 Å²	76	92.1 Å²	92.1	41%	0.406	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	122.2	155.4	-78.9	-28.4	0	0	0	107.4	V97 L99	N74-V97 HydrophobicContact CB-CB 4.18Å; N74-V97 PolarHBondContact N-O 3.14Å; N74-V97 PolarHBondContact O-N 2.88Å; N74-L99 WeakPolarHBondContact ND2-CD2 3.37Å
75	Q	84.7	Confident	78.3	Confident	50 Å²	50	96.5 Å²	96.5	23%	0.234	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	122.2	-165.6	-42.8	-154.2	21.1	0	0	110.8	V69 F73	V69-Q75 VanDerWaalsContact CG1-CD 3.45Å; F73-Q75 HydrophobicContact CB-CG 4.04Å; F73-Q75 WeakPolarHBondContact O-CG 3.3Å; F73-Q75 PolarHBondContact O-N 3.1Å
76	L	84.3	Confident	77.9	Confident	107 Å²	107	97.2 Å²	97.2	56%	0.56	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	127	166.9	-178.6	74.7	0	0	0	109	H95	L76-H95 HydrophobicContact CB-CB 4.21Å; L76-H95 PolarHBondContact N-O 3.47Å; L76-H95 VanDerWaalsContact N-O 3.09Å; L76-H95 PolarHBondContact O-N 2.87Å
77	L	87.9	Confident	77.7	Confident	52 Å²	52	88.3 Å²	88.3	27%	0.272	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.2	169.2	-64.6	175.8	0	0	0	108.8	F50 I67 V69 R93 W94	F50-L77 HydrophobicContact CD2-CD2 4.09Å; F50-L77 HydrophobicContact CE2-CD2 4.18Å; I67-L77 HydrophobicContact CB-CD1 4.09Å; I67-L77 HydrophobicContact CG2-CD1 4.15Å; I67-L77 VanDerWaalsContact O-CD1 3.3Å; I67-L77 WeakPolarHBondContact O-CD1 3.29Å; V69-L77 HydrophobicContact CG2-CD1 4.19Å; V69-L77 HydrophobicContact CG2-CD2 4.19Å; L77-R93 CarbonylContact C-O 3.42Å; L77-R93 WeakPolarHBondContact CA-O 3.41Å; L77-W94 HydrophobicContact CD2-CB 4.27Å; L77-W94 HydrophobicContact CD2-CG 4.42Å
78	Q	84.6	Confident	77.4	Confident	69 Å²	69	93.8 Å²	93.8	32%	0.322	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.5	176.4	-176.2	-178.9	14.7	0	0	109.9	R93 H95	Q78-R93 HydrophobicContact CB-CB 4.36Å; Q78-R93 PolarHBondContact N-O 3.37Å; Q78-R93 PolarHBondContact O-N 2.79Å; Q78-H95 PolarHBondContact OE1-NE2 2.83Å; Q78-H95 VanDerWaalsContact OE1-NE2 3.08Å
79	R	79.7	Confident	77	Confident	129 Å²	129	86 Å²	86	49%	0.487	44%	0.441	S	S	.	.			trans	-93.2	126.9	165.7	-162.7	163.7	82.9	-174.9	3.8	109.1	F84 L92	R79-F84 VanDerWaalsContact NH2-CZ 3.29Å; R79-L92 HydrophobicContact CB-CD2 3.62Å; R79-L92 HydrophobicContact CG-CD2 3.76Å
80	R	65.7	Low	77	Confident	169 Å²	169	84.3 Å²	84.3	64%	0.638	43%	0.432	S	S	*	.			trans	-101.2	124.9	162.9	-84.3	-167.6	168.8	-173.9	-3.6	107.9	W91	R80-W91 HydrophobicContact CB-CH2 3.96Å
81	M	65.8	Low	77.1	Confident	170 Å²	170	83.2 Å²	83.2	84%	0.837	41%	0.413	S	S	*	.			trans	22.3	108.9	179.6	-70	-140.4	-70.5	0	0	117	D83	M81-D83 PolarHBondContact O-N 3.15Å
82	P	58.9	Low	77.4	Confident	54 Å²	54	81 Å²	81	35%	0.351	39%	0.386	S	S	.	.			trans	-79.2	93.3	-179.8	36.3	-35.4	0	0	0	110.1	F84	P82-F84 HydrophobicContact CB-CD1 3.78Å; P82-F84 HydrophobicContact CB-CD2 3.69Å; P82-F84 HydrophobicContact CB-CE1 3.45Å; P82-F84 VanDerWaalsContact CB-CE1 3.45Å; P82-F84 HydrophobicContact CB-CE2 3.36Å; P82-F84 HydrophobicContact CB-CG 3.92Å; P82-F84 HydrophobicContact CB-CZ 3.27Å; P82-F84 HydrophobicContact CG-CD2 4.05Å; P82-F84 HydrophobicContact CG-CE1 4.32Å; P82-F84 HydrophobicContact CG-CE2 3.43Å; P82-F84 VanDerWaalsContact CG-CE2 3.43Å; P82-F84 HydrophobicContact CG-CZ 3.62Å; P82-F84 PolarHBondContact O-N 2.93Å; P82-F84 VanDerWaalsContact O-N 3.08Å
83	D	65	Low	78.1	Confident	71 Å²	71	82.2 Å²	82.2	38%	0.38	39%	0.385	S	S	.	.			trans	-76.7	87.9	151.6	-177	5.7	0	0	0	107.5	M81 Q85 N86 N89	M81-D83 PolarHBondContact O-N 3.15Å; D83-Q85 PolarHBondContact O-N 3.18Å; D83-Q85 VanDerWaalsContact O-N 3.12Å; D83-Q85 VanDerWaalsContact OD1-CB 3.26Å; D83-Q85 WeakPolarHBondContact OD1-CB 3.2Å; D83-Q85 WeakPolarHBondContact OD1-CG 3.47Å; D83-Q85 PolarHBondContact OD1-N 3.12Å; D83-Q85 VanDerWaalsContact OD1-N 3.09Å; D83-N86 PolarHBondContact O-N 2.96Å; D83-N89 HydrophobicContact CB-CB 4.24Å
84	F	64.2	Low	78.7	Confident	86 Å²	86	81.6 Å²	81.6	38%	0.377	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-5.3	179.1	-61.1	-71.2	0	0	0	113.4	Y63 R79 P82	Y63-F84 PolarHBondContact N-O 2.93Å; Y63-F84 VanDerWaalsContact N-O 3.14Å; R79-F84 VanDerWaalsContact NH2-CZ 3.29Å; P82-F84 HydrophobicContact CB-CD1 3.78Å; P82-F84 HydrophobicContact CB-CD2 3.69Å; P82-F84 HydrophobicContact CB-CE1 3.45Å; P82-F84 VanDerWaalsContact CB-CE1 3.45Å; P82-F84 HydrophobicContact CB-CE2 3.36Å; P82-F84 HydrophobicContact CB-CG 3.92Å; P82-F84 HydrophobicContact CB-CZ 3.27Å; P82-F84 HydrophobicContact CG-CD2 4.05Å; P82-F84 HydrophobicContact CG-CE1 4.32Å; P82-F84 HydrophobicContact CG-CE2 3.43Å; P82-F84 VanDerWaalsContact CG-CE2 3.43Å; P82-F84 HydrophobicContact CG-CZ 3.62Å; P82-F84 PolarHBondContact O-N 2.93Å; P82-F84 VanDerWaalsContact O-N 3.08Å
85	Q	65.1	Low	79.2	Confident	149 Å²	149	80.7 Å²	80.7	70%	0.696	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-33.9	179.3	-49	-167.9	-7	0	0	111.2	L62 D83	L62-Q85 HydrophobicContact CD2-CB 4.01Å; L62-Q85 HydrophobicContact CD2-CG 3.67Å; D83-Q85 PolarHBondContact O-N 3.18Å; D83-Q85 VanDerWaalsContact O-N 3.12Å; D83-Q85 VanDerWaalsContact OD1-CB 3.26Å; D83-Q85 WeakPolarHBondContact OD1-CB 3.2Å; D83-Q85 WeakPolarHBondContact OD1-CG 3.47Å; D83-Q85 PolarHBondContact OD1-N 3.12Å; D83-Q85 VanDerWaalsContact OD1-N 3.09Å
86	N	75.1	Confident	79.4	Confident	55 Å²	55	80 Å²	80	29%	0.294	38%	0.375	S	S	.	.			trans	-101.5	119	-179.5	-170.9	-10.7	0	0	0	111	D83 E88 N89	D83-N86 PolarHBondContact O-N 2.96Å; N86-E88 PolarHBondContact ND2-OE2 2.92Å; N86-E88 VanDerWaalsContact ND2-OE2 3.1Å; N86-E88 PolarHBondContact O-N 2.78Å; N86-E88 VanDerWaalsContact OD1-CB 3.3Å; N86-E88 WeakPolarHBondContact OD1-CB 3.31Å; N86-E88 WeakPolarHBondContact OD1-CG 3.44Å; N86-E88 PolarHBondContact OD1-N 2.86Å; N86-N89 WeakPolarHBondContact O-CB 3.45Å; N86-N89 PolarHBondContact O-N 2.77Å
87	I	79.7	Confident	79.3	Confident	52 Å²	52	78.1 Å²	78.1	27%	0.267	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-57.8	-29.3	176.1	-171.6	61.4	0	0	0	112.7	L52 V54 Y63 N89 A90	L52-I87 HydrophobicContact CB-CD1 4.3Å; L52-I87 HydrophobicContact CD2-CD1 4.03Å; L52-I87 HydrophobicContact CG-CD1 4.19Å; L52-I87 WeakPolarHBondContact O-CD1 3.49Å; V54-I87 HydrophobicContact CB-CG1 4.47Å; V54-I87 HydrophobicContact CG2-CB 4.44Å; V54-I87 HydrophobicContact CG2-CD1 3.41Å; V54-I87 VanDerWaalsContact CG2-CD1 3.41Å; V54-I87 HydrophobicContact CG2-CG1 3.6Å; Y63-I87 HydrophobicContact CD2-CB 4.18Å; Y63-I87 HydrophobicContact CD2-CD1 4.01Å; Y63-I87 HydrophobicContact CG-CD1 4Å; I87-N89 PolarHBondContact O-N 2.82Å; I87-N89 VanDerWaalsContact O-N 3.15Å; I87-A90 HydrophobicContact CD1-CB 3.81Å; I87-A90 VanDerWaalsContact O-CB 3.29Å; I87-A90 WeakPolarHBondContact O-CB 3.36Å; I87-A90 PolarHBondContact O-N 2.88Å
88	E	81.5	Confident	78.5	Confident	150 Å²	150	78.3 Å²	78.3	70%	0.701	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-62.4	-21.1	175.5	-60.7	175.9	157.4	0	0	112.6	N86 W91	N86-E88 PolarHBondContact ND2-OE2 2.92Å; N86-E88 VanDerWaalsContact ND2-OE2 3.1Å; N86-E88 PolarHBondContact O-N 2.78Å; N86-E88 VanDerWaalsContact OD1-CB 3.3Å; N86-E88 WeakPolarHBondContact OD1-CB 3.31Å; N86-E88 WeakPolarHBondContact OD1-CG 3.44Å; N86-E88 PolarHBondContact OD1-N 2.86Å; E88-W91 VanDerWaalsContact O-CD1 3.3Å
89	N	80.9	Confident	77.4	Confident	61 Å²	61	79.7 Å²	79.7	33%	0.326	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-96.1	-0.9	176.3	-66.2	-38.3	0	0	0	113	D83 N86 I87 W91	D83-N89 HydrophobicContact CB-CB 4.24Å; N86-N89 WeakPolarHBondContact O-CB 3.45Å; N86-N89 PolarHBondContact O-N 2.77Å; I87-N89 PolarHBondContact O-N 2.82Å; I87-N89 VanDerWaalsContact O-N 3.15Å; N89-W91 PolarHBondContact O-N 2.88Å
90	A	86.3	Confident	76.4	Confident	11 Å²	11	82.8 Å²	82.8	9%	0.091	40%	0.398	C	S	.	.			trans	-81.4	67	177.7	0	0	0	0	0	111	S51 L52 F65 I87	S51-A90 WeakPolarHBondContact CA-O 3.48Å; L52-A90 HydrophobicContact CB-CB 3.94Å; L52-A90 HydrophobicContact CD2-CB 4.45Å; L52-A90 PolarHBondContact N-O 2.88Å; F65-A90 HydrophobicContact CD1-CB 4.37Å; F65-A90 VanDerWaalsContact CE1-C 3.44Å; F65-A90 HydrophobicContact CE1-CB 4.01Å; F65-A90 WeakPolarHBondContact CE1-O 3.17Å; I87-A90 HydrophobicContact CD1-CB 3.81Å; I87-A90 VanDerWaalsContact O-CB 3.29Å; I87-A90 WeakPolarHBondContact O-CB 3.36Å; I87-A90 PolarHBondContact O-N 2.88Å
91	W	89.3	Confident	75.8	Confident	75 Å²	75	78.2 Å²	78.2	28%	0.284	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	156.5	174.6	59.1	-95.4	0	0	0	113.1	V49 F50 R80 E88 N89 R93	V49-W91 HydrophobicContact CG1-CE3 4.09Å; F50-W91 CarbonylContact O-C 3.38Å; F50-W91 WeakPolarHBondContact O-CA 3.48Å; F50-W91 WeakPolarHBondContact O-CB 3.37Å; R80-W91 HydrophobicContact CB-CH2 3.96Å; E88-W91 VanDerWaalsContact O-CD1 3.3Å; N89-W91 PolarHBondContact O-N 2.88Å; W91-R93 HydrophobicContact CZ3-CB 4.09Å
92	L	90.9	Very high	75.2	Confident	15 Å²	15	75.3 Å²	75.3	8%	0.079	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	125.3	176.1	-66.8	174.2	0	0	0	108.7	V49 F50 F65 I67 R79	V49-L92 CarbonylContact C-O 3.54Å; V49-L92 WeakPolarHBondContact CA-O 2.93Å; F50-L92 PolarHBondContact N-O 3.12Å; F50-L92 PolarHBondContact O-N 3.14Å; F65-L92 HydrophobicContact CD2-CD1 4.47Å; F65-L92 HydrophobicContact CE2-CD1 3.82Å; F65-L92 HydrophobicContact CE2-CG 4.13Å; F65-L92 HydrophobicContact CZ-CD1 4.05Å; F65-L92 HydrophobicContact CZ-CG 3.85Å; I67-L92 HydrophobicContact CB-CD1 4.11Å; I67-L92 HydrophobicContact CG1-CD1 4.21Å; R79-L92 HydrophobicContact CB-CD2 3.62Å; R79-L92 HydrophobicContact CG-CD2 3.76Å
93	R	91.5	Very high	74.6	Confident	109 Å²	109	78.1 Å²	78.1	41%	0.411	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	132.5	174	-168.6	171.6	-170.4	175.7	4.7	109.8	M48 V49 L77 Q78 W91 H95	M48-R93 CarbonylContact O-C 3.59Å; M48-R93 WeakPolarHBondContact O-CA 3.24Å; V49-R93 HydrophobicContact CG1-CB 4.48Å; L77-R93 CarbonylContact C-O 3.42Å; L77-R93 WeakPolarHBondContact CA-O 3.41Å; Q78-R93 HydrophobicContact CB-CB 4.36Å; Q78-R93 PolarHBondContact N-O 3.37Å; Q78-R93 PolarHBondContact O-N 2.79Å; W91-R93 HydrophobicContact CZ3-CB 4.09Å; R93-H95 PolarHBondContact NE-CE1 2.91Å
94	W	92.9	Very high	74	Confident	4 Å²	4	83.5 Å²	83.5	2%	0.015	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.7	178.6	-177.5	39.4	0	0	0	110	I12 V19 L43 M48 F50 F73 L77 P96	I12-W94 HydrophobicContact CD1-CH2 3.46Å; I12-W94 VanDerWaalsContact CD1-CH2 3.46Å; I12-W94 HydrophobicContact CD1-CZ2 4.49Å; I12-W94 HydrophobicContact CD1-CZ3 3.78Å; I12-W94 HydrophobicContact CG1-CH2 4.19Å; I12-W94 HydrophobicContact CG1-CZ3 4.39Å; V19-W94 HydrophobicContact CG1-CZ3 4.06Å; V19-W94 HydrophobicContact CG2-CH2 3.9Å; V19-W94 HydrophobicContact CG2-CZ3 4.16Å; L43-W94 HydrophobicContact CD1-CE3 3.8Å; L43-W94 HydrophobicContact CD1-CZ3 4.2Å; L43-W94 HydrophobicContact CD2-CE3 4.43Å; L43-W94 HydrophobicContact CD2-CZ3 4.05Å; M48-W94 VanDerWaalsContact CB-O 3.29Å; M48-W94 WeakPolarHBondContact CB-O 3Å; M48-W94 PolarHBondContact O-N 2.98Å; M48-W94 HydrophobicContact SD-CE3 4.24Å; F50-W94 HydrophobicContact CD2-CB 4Å; F50-W94 HydrophobicContact CD2-CG 4.39Å; F50-W94 HydrophobicContact CE2-CB 3.77Å; F50-W94 AromaticContact CE2-CD2 3.91Å; F50-W94 HydrophobicContact CE2-CD2 3.91Å; F50-W94 HydrophobicContact CE2-CE3 4.32Å; F50-W94 AromaticContact CE2-CG 3.67Å; F50-W94 HydrophobicContact CE2-CG 3.67Å; F50-W94 HydrophobicContact CZ-CD2 4.38Å; F73-W94 HydrophobicContact CD2-CH2 4.27Å; F73-W94 AromaticContact CD2-CZ2 3.91Å; F73-W94 HydrophobicContact CD2-CZ2 3.91Å; F73-W94 HydrophobicContact CE2-CH2 4.28Å; F73-W94 HydrophobicContact CE2-CZ2 4.37Å; L77-W94 HydrophobicContact CD2-CB 4.27Å; L77-W94 HydrophobicContact CD2-CG 4.42Å; W94-P96 HydrophobicContact CD2-CG 4.2Å; W94-P96 HydrophobicContact CE3-CG 4.4Å; W94-P96 HydrophobicContact CH2-CB 4.31Å; W94-P96 HydrophobicContact CH2-CG 4.27Å; W94-P96 HydrophobicContact CZ2-CB 3.75Å; W94-P96 HydrophobicContact CZ2-CG 4.09Å; W94-P96 HydrophobicContact CZ3-CG 4.43Å
95	H	90.2	Very high	73.4	Confident	57 Å²	57	84 Å²	84	26%	0.264	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	90.1	174.2	-58.2	-81.9	0	0	0	108	L76 Q78 R93	L76-H95 HydrophobicContact CB-CB 4.21Å; L76-H95 PolarHBondContact N-O 3.47Å; L76-H95 VanDerWaalsContact N-O 3.09Å; L76-H95 PolarHBondContact O-N 2.87Å; Q78-H95 PolarHBondContact OE1-NE2 2.83Å; Q78-H95 VanDerWaalsContact OE1-NE2 3.08Å; R93-H95 PolarHBondContact NE-CE1 2.91Å
96	P	88.2	Confident	72.6	Confident	35 Å²	35	84.6 Å²	84.6	23%	0.227	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	133.2	172.7	27.8	-29.5	0	0	0	109.8	V19 F73 W94	V19-P96 HydrophobicContact CG2-CB 4.34Å; V19-P96 HydrophobicContact CG2-CG 3.85Å; F73-P96 HydrophobicContact CB-CB 3.78Å; F73-P96 HydrophobicContact CD1-CB 4.01Å; F73-P96 HydrophobicContact CD2-CB 4.08Å; F73-P96 HydrophobicContact CG-CB 3.68Å; W94-P96 HydrophobicContact CD2-CG 4.2Å; W94-P96 HydrophobicContact CE3-CG 4.4Å; W94-P96 HydrophobicContact CH2-CB 4.31Å; W94-P96 HydrophobicContact CH2-CG 4.27Å; W94-P96 HydrophobicContact CZ2-CB 3.75Å; W94-P96 HydrophobicContact CZ2-CG 4.09Å; W94-P96 HydrophobicContact CZ3-CG 4.43Å
97	V	81.5	Confident	71.2	Confident	68 Å²	68	85.5 Å²	85.5	41%	0.412	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.7	173.5	-178.2	0	0	0	0	107.8	N74 L99 S101	N74-V97 HydrophobicContact CB-CB 4.18Å; N74-V97 PolarHBondContact N-O 3.14Å; N74-V97 PolarHBondContact O-N 2.88Å; V97-L99 PolarHBondContact O-N 2.78Å; V97-S101 WeakPolarHBondContact CG1-OG 3.49Å
98	N	70.7	Confident	69.7	Low	55 Å²	55	90.4 Å²	90.4	29%	0.294	49%	0.494	S	S	.	.			trans	-63.4	132.9	176	-79.2	1	0	0	0	109.9	Y17 F73 E100 S101	Y17-N98 PolarHBondContact O-ND2 2.77Å; F73-N98 WeakPolarHBondContact CD1-OD1 3.46Å; F73-N98 WeakPolarHBondContact CE1-OD1 3.12Å; N98-E100 PolarHBondContact O-N 2.89Å; N98-E100 VanDerWaalsContact O-N 3.13Å; N98-S101 PolarHBondContact O-N 3.01Å; N98-S101 PolarHBondContact O-OG 2.57Å
99	L	62.7	Low	67.9	Low	98 Å²	98	86.3 Å²	86.3	51%	0.513	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-57.1	-28.9	179.6	-76.7	161.5	0	0	0	112.5	L72 N74 V97 S101	L72-L99 WeakPolarHBondContact O-CD1 3.13Å; N74-L99 WeakPolarHBondContact ND2-CD2 3.37Å; V97-L99 PolarHBondContact O-N 2.78Å; L99-S101 VanDerWaalsContact C-N 3.28Å; L99-S101 PolarHBondContact O-N 3.38Å
100	E	58.9	Low	66.4	Low	194 Å²	194	87.9 Å²	87.9	91%	0.907	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-77.9	-6.7	-179.7	-59.4	-170.9	167.3	0	0	114.5	N98	N98-E100 PolarHBondContact O-N 2.89Å; N98-E100 VanDerWaalsContact O-N 3.13Å
101	S	53.1	Low	64.4	Low	73 Å²	73	91.2 Å²	91.2	51%	0.51	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-91.1	4	179.9	66	0	0	0	0	114.5	V97 N98 L99 P103	V97-S101 WeakPolarHBondContact CG1-OG 3.49Å; N98-S101 PolarHBondContact O-N 3.01Å; N98-S101 PolarHBondContact O-OG 2.57Å; L99-S101 VanDerWaalsContact C-N 3.28Å; L99-S101 PolarHBondContact O-N 3.38Å; S101-P103 VanDerWaalsContact O-CD 3.23Å; S101-P103 WeakPolarHBondContact O-CD 2.83Å
102	I	52.2	Low	62.7	Low	110 Å²	110	95.6 Å²	95.6	56%	0.564	57%	0.567	S	S	*	*	S	Bend	trans	-70.1	114.8	167.2	-56.8	173.6	0	0	0	106.1	K104	I102-K104 PolarHBondContact O-N 3.27Å
103	P	47.5	Very low	60.6	Low	113 Å²	113	101.7 Å²	101.7	73%	0.734	60%	0.6	S	S	*	*			trans	-56	117.4	173.2	22.1	-29.7	0	0	0	106.9	S101 A105	S101-P103 VanDerWaalsContact O-CD 3.23Å; S101-P103 WeakPolarHBondContact O-CD 2.83Å; P103-A105 PolarHBondContact O-N 3.26Å; P103-A105 VanDerWaalsContact O-N 3.07Å
104	K	52	Low	58.7	Low	184 Å²	184	101.9 Å²	101.9	80%	0.8	62%	0.617	S	S	*	*			trans	-51.9	122.5	161.5	-78.8	179.8	178.7	172.8	0	104.3	I102 D106	I102-K104 PolarHBondContact O-N 3.27Å; K104-D106 PolarHBondContact O-N 2.98Å
105	A	52.3	Low	56.6	Low	97 Å²	97	107.6 Å²	107.6	80%	0.802	65%	0.652	S	S	*	*			trans	-52.1	115.1	166.5	0	0	0	0	0	105.5	P103 G107	P103-A105 PolarHBondContact O-N 3.26Å; P103-A105 VanDerWaalsContact O-N 3.07Å; A105-G107 PolarHBondContact O-N 3.36Å
106	D	48.3	Very low	55.1	Low	161 Å²	161	110.2 Å²	110.2	86%	0.861	68%	0.677	S	S	*	*			trans	-64.6	78.8	170.3	-68.1	-41.8	0	0	0	106.8	K104 D108	K104-D106 PolarHBondContact O-N 2.98Å; D106-D108 PolarHBondContact O-N 3.18Å
107	G	45.1	Very low	53.3	Low	74 Å²	74	117.5 Å²	117.5	76%	0.763	71%	0.708	S	S	*	*			trans	-90.1	58	159.2	0	0	0	0	0	107.6	A105 G109	A105-G107 PolarHBondContact O-N 3.36Å; G107-G109 PolarHBondContact O-N 3.4Å
108	D	47	Very low	52.1	Low	154 Å²	154	120 Å²	120	82%	0.824	73%	0.729	S	S	*	*			trans	-75.2	99.1	162	-163.5	12.9	0	0	0	106.5	D106	D106-D108 PolarHBondContact O-N 3.18Å
109	G	44.4	Very low	51.3	Low	65 Å²	65	122.7 Å²	122.7	67%	0.67	75%	0.752	S	S	*	*			trans	-154.3	61.2	178.9	0	0	0	0	0	106.6	G107 G111	G107-G109 PolarHBondContact O-N 3.4Å; G109-G111 PolarHBondContact O-N 2.84Å
110	S	50.5	Low	50.5	Low	93 Å²	93	123.7 Å²	123.7	65%	0.65	76%	0.764	S	S	*	*			trans	-42	111.1	164	49.9	0	0	0	0	108.7	E112	S110-E112 VanDerWaalsContact C-N 3.26Å; S110-E112 PolarHBondContact O-N 2.64Å
111	G	42.9	Very low	50.3	Low	81 Å²	81	124.8 Å²	124.8	84%	0.835	77%	0.766	S	S	*	*			trans	-64.6	92.2	165.9	0	0	0	0	0	108.1	G109 D113	G109-G111 PolarHBondContact O-N 2.84Å; G111-D113 PolarHBondContact O-N 3.49Å
112	E	54.8	Low	50	Low	167 Å²	167	124.8 Å²	124.8	78%	0.78	78%	0.778	S	S	*	*			trans	-77.8	106.5	159.3	-79.6	-170.3	118.6	0	0	108	S110 C114	S110-E112 VanDerWaalsContact C-N 3.26Å; S110-E112 PolarHBondContact O-N 2.64Å; E112-C114 PolarHBondContact O-N 2.72Å
113	D	45.2	Very low	49.7	Very low	143 Å²	143	124.8 Å²	124.8	77%	0.765	79%	0.794	S	S	*	*			trans	-56	96.2	163.1	-163.6	9.2	0	0	0	109	G111	G111-D113 PolarHBondContact O-N 3.49Å
114	C	52.2	Low	50	Low	113 Å²	113	124.7 Å²	124.7	76%	0.764	80%	0.796	S	S	*	*			trans	-109.7	85.6	168	-86.4	0	0	0	0	108.9	E112 S116	E112-C114 PolarHBondContact O-N 2.72Å; C114-S116 PolarHBondContact O-N 2.72Å
115	T	48.5	Very low	50	Low	124 Å²	124	127.3 Å²	127.3	76%	0.761	82%	0.818	S	S	*	*			trans	-59	116.2	158.1	34.8	0	0	0	0	109.3
116	S	58.9	Low	49.9	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	82%	0.818	S	S	*	*			trans	-154.5	118.4	147.6	44.5	0	0	0	0	110.5	C114	C114-S116 PolarHBondContact O-N 2.72Å
117	E	50.9	Low	50	Low	188 Å²	188	127.1 Å²	127.1	88%	0.879	82%	0.816	S	S	*	*			trans	-48.7	133.7	169.8	-78.5	162.5	68.7	0	0	112.5
118	S	55.8	Low	50.3	Low	121 Å²	121	130.1 Å²	130.1	85%	0.846	82%	0.819	S	S	*	*			trans	-146.6	123.3	134	51.5	0	0	0	0	109.6
119	S	54.7	Low	50.5	Low	112 Å²	112	128.6 Å²	128.6	78%	0.783	82%	0.819	S	S	*	*			trans	-71.8	163.1	-171.7	-86.3	0	0	0	0	114.1
120	P	46.1	Very low	50.8	Low	119 Å²	119	132.6 Å²	132.6	77%	0.773	83%	0.828	S	S	*	*			trans	-95	148.1	-166.4	36.7	-32.5	0	0	0	114.1
121	K	54.5	Low	50.9	Low	216 Å²	216	135.3 Å²	135.3	94%	0.939	84%	0.84	S	S	*	*			trans	-151.9	128.5	154.3	-72.5	-175.2	-179.4	176.2	0	104.8
122	G	46.7	Very low	51.4	Low	74 Å²	74	139.1 Å²	139.1	76%	0.763	84%	0.84	S	S	*	*			cis	144.3	153.3	21.9	0	0	0	0	0	106.5
123	A	45.6	Very low	51.2	Low	110 Å²	110	137 Å²	137	91%	0.909	85%	0.845	S	S	*	*			trans	82.3	125.9	162.2	0	0	0	0	0	120
124	S	53.5	Low	51.7	Low	110 Å²	110	136.5 Å²	136.5	77%	0.769	85%	0.852	S	S	*	*			trans	-73.1	153.5	174.2	-166.3	0	0	0	0	112.7
125	L	52.6	Low	51.6	Low	239 Å²	239	138.6 Å²	138.6	100%	1.251	86%	0.86	S	S	*	*			trans	-127.3	0	130.7	-93.9	167.4	0	0	0	107.4

Retrieved 125 of 125 residues in 75.9 ms (Link to these results)

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