G4LW01_SCHMA Loading...

DNA-directed RNA polymerase I subunit RPA12

Core component of RNA polymerase I (Pol I), a DNA-dependent RNA polymerase which synthesizes ribosomal RNA precursors using the four ribonucleoside triphosphates as substrates. Can mediate Pol I proofreading of the nascent RNA transcript. Anchors into the Pol I active site to monitor transcription fidelity and cleave mis-incorporated 5'-ribonucleotides.

AlphaFold DB , UniProt , Accession G4LW01, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 164 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.6	Very low	46.4	Very low	243 Å²	243	141.5 Å²	141.5	100%	1.197	79%	0.793	S	S	*	*				0	94.6	0	-71	-178.1	167.1	0	0	108.3
2	L	45.8	Very low	46.4	Very low	178 Å²	178	138.1 Å²	138.1	93%	0.932	77%	0.771	S	S	*	*			trans	-103	100	174.3	-86.9	155.3	0	0	0	107.1	K4	L2-K4 PolarHBondContact O-N 3Å
3	Q	41.8	Very low	46.7	Very low	161 Å²	161	141.5 Å²	141.5	75%	0.752	78%	0.777	S	S	*	*			trans	-67.7	114.2	173.9	-77.7	176.2	-8.9	0	0	108.8	H5	Q3-H5 PolarHBondContact O-N 3.46Å; Q3-H5 VanDerWaalsContact O-N 3.1Å
4	K	43.2	Very low	47.2	Very low	211 Å²	211	139 Å²	139	92%	0.917	75%	0.75	S	S	*	*			trans	-74.1	88.7	167.1	-74.5	179.6	175.4	179.4	0	108.6	L2	L2-K4 PolarHBondContact O-N 3Å
5	H	44.9	Very low	48.1	Very low	153 Å²	153	137.3 Å²	137.3	71%	0.708	74%	0.739	S	S	*	*			trans	-80.6	141.2	153.8	-74.4	-90.9	0	0	0	107.5	Q3	Q3-H5 PolarHBondContact O-N 3.46Å; Q3-H5 VanDerWaalsContact O-N 3.1Å
6	S	44.5	Very low	49	Very low	102 Å²	102	131.3 Å²	131.3	71%	0.713	71%	0.705	S	S	*	*			cis	-170.5	159.5	-15.3	35.3	0	0	0	0	102.6
7	G	56.2	Low	50.6	Low	59 Å²	59	134.8 Å²	134.8	61%	0.608	71%	0.705	S	S	*	*	S	Bend	trans	-46.6	160	-175.9	0	0	0	0	0	114.6
8	P	48.9	Very low	52.4	Low	108 Å²	108	128.4 Å²	128.4	70%	0.701	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-50.6	134.7	-178.6	22.8	-32.8	0	0	0	109.6	L10	P8-L10 PolarHBondContact O-N 3.29Å
9	P	46.2	Very low	54.3	Low	100 Å²	100	128.1 Å²	128.1	65%	0.649	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-56	135.9	-177.8	21.5	-31.6	0	0	0	110.1	G11	P9-G11 PolarHBondContact O-N 3.4Å
10	L	48.5	Very low	56.1	Low	187 Å²	187	121.9 Å²	121.9	98%	0.979	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.1	123.3	174.8	-75.9	145.7	0	0	0	109.4	P8	P8-L10 PolarHBondContact O-N 3.29Å
11	G	49.4	Very low	57.7	Low	55 Å²	55	123 Å²	123	57%	0.567	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.7	2.8	-179.1	0	0	0	0	0	116	P9 E13	P9-G11 PolarHBondContact O-N 3.4Å; G11-E13 VanDerWaalsContact C-N 3.26Å; G11-E13 PolarHBondContact O-N 2.71Å
12	L	46.7	Very low	60.1	Low	100 Å²	100	115.5 Å²	115.5	52%	0.524	60%	0.596	S	S	.	*			trans	-82	9.4	175.9	-124.1	92.7	0	0	0	115.1	R14	L12-R14 PolarHBondContact O-N 2.97Å
13	E	50.1	Low	62.4	Low	182 Å²	182	108.8 Å²	108.8	85%	0.85	56%	0.564	S	S	*	*			trans	-86.3	29.3	167.4	-73	-167.8	163.1	0	0	112.5	G11 I15	G11-E13 VanDerWaalsContact C-N 3.26Å; G11-E13 PolarHBondContact O-N 2.71Å; E13-I15 VanDerWaalsContact C-N 3.32Å; E13-I15 PolarHBondContact O-N 3.21Å
14	R	54.4	Low	64.8	Low	107 Å²	107	103.5 Å²	103.5	40%	0.404	55%	0.553	S	S	.	*			trans	-64.3	96.8	172.4	-67.3	-170.2	-167.1	-163.5	5.9	108.7	L12 H16 H29	L12-R14 PolarHBondContact O-N 2.97Å; R14-H16 HydrophobicContact CB-CB 4.49Å; R14-H16 PolarHBondContact O-N 3.2Å; R14-H16 VanDerWaalsContact O-N 3.12Å; R14-H29 PolarHBondContact O-CD2 2.97Å; R14-H29 PolarHBondContact O-NE2 3.21Å
15	I	59.6	Low	67.1	Low	113 Å²	113	95.4 Å²	95.4	58%	0.579	52%	0.521	S	S	*	.			trans	-62.2	-9.3	169.2	-63.6	161.1	0	0	0	110.6	E13 R17 F58	E13-I15 VanDerWaalsContact C-N 3.32Å; E13-I15 PolarHBondContact O-N 3.21Å; I15-R17 PolarHBondContact O-N 2.75Å; I15-R17 VanDerWaalsContact O-N 3.08Å; I15-F58 HydrophobicContact CD1-CD2 4.25Å; I15-F58 HydrophobicContact CD1-CE2 3.9Å
16	H	63.5	Low	69.3	Low	41 Å²	41	92.3 Å²	92.3	19%	0.19	51%	0.509	C	S	.	.			trans	-57.5	114.2	175.8	-64.5	-82.5	0	0	0	111.4	R14 Y18 M54 A56	R14-H16 HydrophobicContact CB-CB 4.49Å; R14-H16 PolarHBondContact O-N 3.2Å; R14-H16 VanDerWaalsContact O-N 3.12Å; H16-Y18 HydrophobicContact CB-CE1 3.74Å; H16-Y18 HydrophobicContact CB-CE2 4.17Å; H16-Y18 WeakPolarHBondContact CB-OH 3.49Å; H16-M54 PolarHBondContact CE1-O 2.81Å; H16-M54 PolarHBondContact NE2-O 3.41Å; H16-M54 VanDerWaalsContact NE2-O 3.08Å; H16-A56 PolarHBondContact NE2-N 3.26Å
17	R	76.2	Confident	71.3	Confident	191 Å²	191	87.8 Å²	87.8	72%	0.721	48%	0.477	S	S	*	.			trans	-94.3	108.3	171.9	-71.4	-177.9	-174.3	-170.9	1.9	107.6	I15 F19 L26	I15-R17 PolarHBondContact O-N 2.75Å; I15-R17 VanDerWaalsContact O-N 3.08Å; R17-F19 HydrophobicContact CB-CE2 4.29Å; R17-F19 HydrophobicContact CB-CZ 4.49Å; R17-L26 HydrophobicContact CB-CD1 3.65Å; R17-L26 HydrophobicContact CG-CD1 4.13Å
18	Y	83.2	Confident	72.3	Confident	21 Å²	21	86.5 Å²	86.5	8%	0.082	46%	0.458	C	S	.	.			trans	-89.1	141.6	176.5	-52.8	-62.2	0	0	0	110.5	H16 L26 L27 L37 M48 F51	H16-Y18 HydrophobicContact CB-CE1 3.74Å; H16-Y18 HydrophobicContact CB-CE2 4.17Å; H16-Y18 WeakPolarHBondContact CB-OH 3.49Å; Y18-L26 WeakPolarHBondContact O-CD1 3.31Å; Y18-L27 WeakPolarHBondContact O-CB 3.46Å; Y18-L27 PolarHBondContact O-N 3.46Å; Y18-L37 HydrophobicContact CD2-CD1 3.88Å; Y18-L37 HydrophobicContact CG-CD1 4.26Å; Y18-M48 HydrophobicContact CD2-CE 4.24Å; Y18-M48 HydrophobicContact CE2-CE 3.89Å; Y18-F51 HydrophobicContact CD1-CB 4.01Å; Y18-F51 AromaticContact CD1-CD1 3.2Å; Y18-F51 HydrophobicContact CD1-CD1 3.2Å; Y18-F51 AromaticContact CD1-CD2 3.95Å; Y18-F51 HydrophobicContact CD1-CD2 3.95Å; Y18-F51 AromaticContact CD1-CE1 3.51Å; Y18-F51 HydrophobicContact CD1-CE1 3.51Å; Y18-F51 HydrophobicContact CD1-CE2 4.21Å; Y18-F51 AromaticContact CD1-CG 3.44Å; Y18-F51 HydrophobicContact CD1-CG 3.44Å; Y18-F51 VanDerWaalsContact CD1-CG 3.44Å; Y18-F51 HydrophobicContact CD1-CZ 4Å; Y18-F51 HydrophobicContact CE1-CB 3.35Å; Y18-F51 AromaticContact CE1-CD1 3.39Å; Y18-F51 HydrophobicContact CE1-CD1 3.39Å; Y18-F51 HydrophobicContact CE1-CD2 4.14Å; Y18-F51 HydrophobicContact CE1-CE1 4.18Å; Y18-F51 AromaticContact CE1-CG 3.35Å; Y18-F51 HydrophobicContact CE1-CG 3.35Å; Y18-F51 HydrophobicContact CE2-CB 4.46Å; Y18-F51 HydrophobicContact CG-CD1 4.13Å; Y18-F51 HydrophobicContact CG-CD2 4.15Å; Y18-F51 HydrophobicContact CG-CE1 4.18Å; Y18-F51 HydrophobicContact CG-CE2 4.21Å; Y18-F51 HydrophobicContact CG-CG 4.1Å; Y18-F51 HydrophobicContact CG-CZ 4.21Å; Y18-F51 AromaticContact CZ-CG 3.92Å
19	F	88.3	Confident	73.1	Confident	122 Å²	122	86.1 Å²	86.1	54%	0.535	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-114.7	145	178.2	-63.1	-89.3	0	0	0	110	R17 Y21 G24 L26	R17-F19 HydrophobicContact CB-CE2 4.29Å; R17-F19 HydrophobicContact CB-CZ 4.49Å; F19-Y21 PolarHBondContact O-N 2.99Å; F19-G24 WeakPolarHBondContact CD1-O 3.4Å; F19-L26 HydrophobicContact CD1-CB 4.49Å; F19-L26 HydrophobicContact CD1-CD1 4.27Å; F19-L26 HydrophobicContact CE1-CB 4.45Å; F19-L26 HydrophobicContact CE1-CD1 3.93Å; F19-L26 HydrophobicContact CZ-CD1 4.11Å
20	C	89.7	Confident	74	Confident	3 Å²	3	90.1 Å²	90.1	2%	0.02	45%	0.454	C	S	.	.			trans	-67.2	125.2	175	177.4	0	0	0	0	110.1	V22 G24 T25 L27 C39 C42	C20-V22 PolarHBondContact O-N 3.43Å; C20-V22 PolarHBondContact SG-N 3.49Å; C20-G24 VanDerWaalsContact O-CA 3.28Å; C20-G24 WeakPolarHBondContact O-CA 3.4Å; C20-G24 PolarHBondContact O-N 3.01Å; C20-T25 WeakPolarHBondContact CB-O 3.26Å; C20-T25 PolarHBondContact N-O 3.12Å; C20-L27 HydrophobicContact CB-CD2 3.92Å; C20-L27 HydrophobicContact CB-CG 4.33Å; C20-C39 HydrophobicContact CB-CB 3.85Å; C20-C39 VanDerWaalsContact CB-SG 3.6Å; C20-C39 VanDerWaalsContact SG-CB 3.57Å; C20-C39 VanDerWaalsContact SG-SG 3.68Å; C20-C42 PolarHBondContact SG-SG 3.47Å
21	Y	89.5	Confident	74.5	Confident	145 Å²	145	85.8 Å²	85.8	57%	0.569	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.3	-178.6	71.6	-88	0	0	0	114.4	F19 T44 T46 W50	F19-Y21 PolarHBondContact O-N 2.99Å; Y21-T44 HydrophobicContact CD1-CG2 4.39Å; Y21-T44 HydrophobicContact CE1-CG2 3.49Å; Y21-T44 VanDerWaalsContact CE1-CG2 3.49Å; Y21-T44 WeakPolarHBondContact OH-CG2 3.21Å; Y21-T46 HydrophobicContact CD1-CG2 4.29Å; Y21-W50 HydrophobicContact CD1-CZ3 4.15Å; Y21-W50 HydrophobicContact CE1-CZ3 4.14Å
22	V	92.1	Very high	75	Confident	86 Å²	86	90.6 Å²	90.6	52%	0.521	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-43.5	178.8	177.4	0	0	0	0	112.1	C20 T44	C20-V22 PolarHBondContact O-N 3.43Å; C20-V22 PolarHBondContact SG-N 3.49Å; V22-T44 HydrophobicContact CG2-CG2 3.71Å
23	C	94.2	Very high	75.7	Confident	38 Å²	38	92.9 Å²	92.9	26%	0.257	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	2.8	-171.8	76.9	0	0	0	0	115.1	T25 C39 K41 C42	C23-T25 PolarHBondContact O-N 2.94Å; C23-T25 VanDerWaalsContact O-N 3.1Å; C23-T25 VanDerWaalsContact SG-CB 3.59Å; C23-T25 PolarHBondContact SG-OG1 3.29Å; C23-C39 PolarHBondContact SG-SG 3.13Å; C23-K41 HydrophobicContact CB-CD 4.37Å; C23-C42 HydrophobicContact CB-CB 4.14Å; C23-C42 PolarHBondContact SG-SG 3.43Å
24	G	91.3	Very high	76.3	Confident	50 Å²	50	89.4 Å²	89.4	52%	0.515	44%	0.444	S	S	.	.			trans	67.7	5.6	178.9	0	0	0	0	0	115.4	F19 C20	F19-G24 WeakPolarHBondContact CD1-O 3.4Å; C20-G24 VanDerWaalsContact O-CA 3.28Å; C20-G24 WeakPolarHBondContact O-CA 3.4Å; C20-G24 PolarHBondContact O-N 3.01Å
25	T	92.4	Very high	77.2	Confident	41 Å²	41	89.9 Å²	89.9	25%	0.252	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-73	138.6	178.8	-58	0	0	0	0	110.6	C20 C23 L27 K41	C20-T25 WeakPolarHBondContact CB-O 3.26Å; C20-T25 PolarHBondContact N-O 3.12Å; C23-T25 PolarHBondContact O-N 2.94Å; C23-T25 VanDerWaalsContact O-N 3.1Å; C23-T25 VanDerWaalsContact SG-CB 3.59Å; C23-T25 PolarHBondContact SG-OG1 3.29Å; T25-L27 PolarHBondContact O-N 2.89Å; T25-K41 HydrophobicContact CG2-CB 4.23Å; T25-K41 VanDerWaalsContact OG1-CD 3.28Å; T25-K41 WeakPolarHBondContact OG1-CD 3.34Å
26	L	90.3	Very high	78.1	Confident	88 Å²	88	89 Å²	89	46%	0.461	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-56.9	122.5	174.9	-172.6	72.1	0	0	0	110.3	R17 Y18 F19	R17-L26 HydrophobicContact CB-CD1 3.65Å; R17-L26 HydrophobicContact CG-CD1 4.13Å; Y18-L26 WeakPolarHBondContact O-CD1 3.31Å; F19-L26 HydrophobicContact CD1-CB 4.49Å; F19-L26 HydrophobicContact CD1-CD1 4.27Å; F19-L26 HydrophobicContact CE1-CB 4.45Å; F19-L26 HydrophobicContact CE1-CD1 3.93Å; F19-L26 HydrophobicContact CZ-CD1 4.11Å
27	L	85.9	Confident	79.1	Confident	7 Å²	7	87.2 Å²	87.2	4%	0.037	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-73.4	143.6	176.2	-67.1	172.8	0	0	0	109.6	Y18 C20 T25 H29 L37 C39 T46	Y18-L27 WeakPolarHBondContact O-CB 3.46Å; Y18-L27 PolarHBondContact O-N 3.46Å; C20-L27 HydrophobicContact CB-CD2 3.92Å; C20-L27 HydrophobicContact CB-CG 4.33Å; T25-L27 PolarHBondContact O-N 2.89Å; L27-H29 PolarHBondContact O-N 3.05Å; L27-L37 HydrophobicContact CB-CB 4.34Å; L27-L37 HydrophobicContact CB-CD1 4.06Å; L27-L37 HydrophobicContact CD1-CB 3.97Å; L27-L37 HydrophobicContact CD1-CD1 3.78Å; L27-L37 HydrophobicContact CD2-CB 4.38Å; L27-L37 HydrophobicContact CG-CB 4.45Å; L27-C39 HydrophobicContact CD2-CB 3.85Å; L27-T46 HydrophobicContact CD1-CG2 4.37Å
28	P	77.5	Confident	79.6	Confident	31 Å²	31	81.2 Å²	81.2	20%	0.201	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-60.6	138.5	-179.4	23.2	-30.9	0	0	0	111.5	K30 L37	P28-K30 VanDerWaalsContact C-N 3.31Å; P28-L37 WeakPolarHBondContact O-CD2 3.34Å
29	H	66.9	Low	79.9	Confident	101 Å²	101	80.2 Å²	80.2	47%	0.468	42%	0.423	S	S	.	.	S	Bend	trans	-74	-22.7	176.4	-173.7	-95.7	0	0	0	112.9	R14 L27 L31	R14-H29 PolarHBondContact O-CD2 2.97Å; R14-H29 PolarHBondContact O-NE2 3.21Å; L27-H29 PolarHBondContact O-N 3.05Å; H29-L31 PolarHBondContact O-N 3.23Å
30	K	64.1	Low	79.9	Confident	184 Å²	184	83.2 Å²	83.2	80%	0.8	43%	0.431	S	S	*	.			trans	-74.8	110.3	178	-67.5	-171.7	178.5	-174.8	0	109.9	P28	P28-K30 VanDerWaalsContact C-N 3.31Å
31	L	59.9	Low	80	Confident	95 Å²	95	90.5 Å²	90.5	50%	0.497	46%	0.462	S	S	.	.			trans	-75.6	121	173.3	-53.9	-179.7	0	0	0	108.7	H29 L37 M48	H29-L31 PolarHBondContact O-N 3.23Å; L31-L37 HydrophobicContact CD2-CD2 3.96Å; L31-M48 HydrophobicContact CD1-SD 4.03Å; L31-M48 HydrophobicContact CD2-CE 3.46Å; L31-M48 VanDerWaalsContact CD2-CE 3.46Å; L31-M48 HydrophobicContact CD2-CG 4.15Å; L31-M48 HydrophobicContact CD2-SD 3.29Å; L31-M48 WeakPolarHBondContact CD2-SD 3.48Å; L31-M48 HydrophobicContact CG-SD 4.28Å
32	E	58.8	Low	80.2	Confident	156 Å²	156	85.7 Å²	85.7	73%	0.729	45%	0.449	S	S	*	.			trans	-81.6	162	161.8	-67.9	-173.2	176.3	0	0	108.7	N34	E32-N34 CarbonylContact O-C 3.59Å; E32-N34 PolarHBondContact O-N 2.96Å; E32-N34 VanDerWaalsContact O-O 3.07Å
33	V	61.8	Low	80.2	Confident	149 Å²	149	88.4 Å²	88.4	90%	0.903	45%	0.454	S	S	*	.	S	Bend	trans	-59.7	-17.5	-175.2	-178.4	0	0	0	0	112.7
34	N	63.5	Low	80	Confident	108 Å²	108	87.9 Å²	87.9	58%	0.578	45%	0.449	S	S	*	.	S	Bend	trans	-87.8	125.6	174	-56.5	-27.5	0	0	0	107.8	E32 L36	E32-N34 CarbonylContact O-C 3.59Å; E32-N34 PolarHBondContact O-N 2.96Å; E32-N34 VanDerWaalsContact O-O 3.07Å; N34-L36 HydrophobicContact CB-CD1 4.21Å; N34-L36 PolarHBondContact O-N 3.2Å
35	D	72.9	Confident	79.9	Confident	118 Å²	118	88.4 Å²	88.4	63%	0.631	45%	0.445	S	S	*	.	S	Bend	trans	-61.3	40.5	-178.6	-77	-38.7	0	0	0	115.2	C47 M48	D35-C47 WeakPolarHBondContact O-CA 3.31Å; D35-M48 HydrophobicContact CB-CB 4.26Å; D35-M48 PolarHBondContact O-N 2.94Å
36	L	79.3	Confident	79.4	Confident	93 Å²	93	86.5 Å²	86.5	49%	0.487	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	119.9	-170.2	-72	136.5	0	0	0	109.5	N34 T46	N34-L36 HydrophobicContact CB-CD1 4.21Å; N34-L36 PolarHBondContact O-N 3.2Å; L36-T46 CarbonylContact C-O 3.23Å; L36-T46 WeakPolarHBondContact CA-O 3.44Å
37	L	83.1	Confident	79	Confident	4 Å²	4	84.6 Å²	84.6	2%	0.021	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.8	166.3	-68.8	177.4	0	0	0	109.6	Y18 L27 P28 L31 S45 T46 M48 F51	Y18-L37 HydrophobicContact CD2-CD1 3.88Å; Y18-L37 HydrophobicContact CG-CD1 4.26Å; L27-L37 HydrophobicContact CB-CB 4.34Å; L27-L37 HydrophobicContact CB-CD1 4.06Å; L27-L37 HydrophobicContact CD1-CB 3.97Å; L27-L37 HydrophobicContact CD1-CD1 3.78Å; L27-L37 HydrophobicContact CD2-CB 4.38Å; L27-L37 HydrophobicContact CG-CB 4.45Å; P28-L37 WeakPolarHBondContact O-CD2 3.34Å; L31-L37 HydrophobicContact CD2-CD2 3.96Å; L37-S45 CarbonylContact O-C 3.5Å; L37-T46 PolarHBondContact N-O 3.48Å; L37-T46 PolarHBondContact O-N 3.07Å; L37-M48 HydrophobicContact CD1-CE 3.5Å; L37-M48 VanDerWaalsContact CD1-CE 3.5Å; L37-M48 HydrophobicContact CD2-CE 4Å; L37-M48 HydrophobicContact CG-CE 3.75Å; L37-M48 HydrophobicContact CG-CG 4.35Å; L37-F51 HydrophobicContact CD1-CD2 4.3Å; L37-F51 HydrophobicContact CD1-CE2 4Å
38	V	86.4	Confident	78.5	Confident	65 Å²	65	85.4 Å²	85.4	39%	0.394	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.3	177.2	-176	0	0	0	0	110.3	R40	V38-R40 PolarHBondContact O-N 2.76Å
39	C	90.1	Very high	78.5	Confident	0 Å²	0	90.6 Å²	90.6	0%	0	45%	0.452	C	S	.	.			trans	-65.9	127.2	175.5	-180	0	0	0	0	111.3	C20 C23 L27 K41 K43 T44	C20-C39 HydrophobicContact CB-CB 3.85Å; C20-C39 VanDerWaalsContact CB-SG 3.6Å; C20-C39 VanDerWaalsContact SG-CB 3.57Å; C20-C39 VanDerWaalsContact SG-SG 3.68Å; C23-C39 PolarHBondContact SG-SG 3.13Å; L27-C39 HydrophobicContact CD2-CB 3.85Å; C39-K41 VanDerWaalsContact C-N 3.26Å; C39-K41 PolarHBondContact O-N 2.87Å; C39-K41 PolarHBondContact SG-N 2.71Å; C39-K41 VanDerWaalsContact SG-N 3.44Å; C39-K43 WeakPolarHBondContact O-CA 3.22Å; C39-K43 PolarHBondContact O-N 3.29Å; C39-T44 WeakPolarHBondContact CB-O 3.26Å; C39-T44 PolarHBondContact N-O 2.77Å
40	R	89.5	Confident	78.8	Confident	186 Å²	186	93.7 Å²	93.7	70%	0.702	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-32.1	179.2	-68.6	-176.1	176.7	-171.2	-1.2	113.2	V38 K43	V38-R40 PolarHBondContact O-N 2.76Å; R40-K43 PolarHBondContact O-NZ 3.17Å
41	K	91.7	Very high	79.2	Confident	155 Å²	155	86.4 Å²	86.4	67%	0.674	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-63.7	-174.8	-172.7	177.8	-177.8	-177	0	112.7	C23 T25 C39	C23-K41 HydrophobicContact CB-CD 4.37Å; T25-K41 HydrophobicContact CG2-CB 4.23Å; T25-K41 VanDerWaalsContact OG1-CD 3.28Å; T25-K41 WeakPolarHBondContact OG1-CD 3.34Å; C39-K41 VanDerWaalsContact C-N 3.26Å; C39-K41 PolarHBondContact O-N 2.87Å; C39-K41 PolarHBondContact SG-N 2.71Å; C39-K41 VanDerWaalsContact SG-N 3.44Å
42	C	93.9	Very high	79.6	Confident	45 Å²	45	84.2 Å²	84.2	30%	0.304	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	0.3	-175.9	61.6	0	0	0	0	114.4	C20 C23 T44	C20-C42 PolarHBondContact SG-SG 3.47Å; C23-C42 HydrophobicContact CB-CB 4.14Å; C23-C42 PolarHBondContact SG-SG 3.43Å; C42-T44 PolarHBondContact O-N 3.05Å; C42-T44 PolarHBondContact SG-OG1 3.48Å
43	K	90.7	Very high	80.1	Confident	143 Å²	143	84.4 Å²	84.4	62%	0.622	43%	0.427	S	S	*	.			trans	60.5	10.1	-177.4	-51	-54	-172.3	-166.5	0	115.2	C39 R40 S45	C39-K43 WeakPolarHBondContact O-CA 3.22Å; C39-K43 PolarHBondContact O-N 3.29Å; R40-K43 PolarHBondContact O-NZ 3.17Å; K43-S45 PolarHBondContact O-N 2.97Å
44	T	90.5	Very high	80.4	Confident	26 Å²	26	81.9 Å²	81.9	16%	0.16	41%	0.407	C	S	.	.			trans	-61.7	128.8	173.2	-55	0	0	0	0	110.4	Y21 V22 C39 C42	Y21-T44 HydrophobicContact CD1-CG2 4.39Å; Y21-T44 HydrophobicContact CE1-CG2 3.49Å; Y21-T44 VanDerWaalsContact CE1-CG2 3.49Å; Y21-T44 WeakPolarHBondContact OH-CG2 3.21Å; V22-T44 HydrophobicContact CG2-CG2 3.71Å; C39-T44 WeakPolarHBondContact CB-O 3.26Å; C39-T44 PolarHBondContact N-O 2.77Å; C42-T44 PolarHBondContact O-N 3.05Å; C42-T44 PolarHBondContact SG-OG1 3.48Å
45	S	88	Confident	80.6	Confident	61 Å²	61	83.7 Å²	83.7	43%	0.427	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	130	173.9	-60.5	0	0	0	0	109.6	L37 K43	L37-S45 CarbonylContact O-C 3.5Å; K43-S45 PolarHBondContact O-N 2.97Å
46	T	82.5	Confident	80.2	Confident	2 Å²	2	80.4 Å²	80.4	1%	0.012	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.6	178.2	-49.3	0	0	0	0	108.4	Y21 L27 L36 L37 W50 F51	Y21-T46 HydrophobicContact CD1-CG2 4.29Å; L27-T46 HydrophobicContact CD1-CG2 4.37Å; L36-T46 CarbonylContact C-O 3.23Å; L36-T46 WeakPolarHBondContact CA-O 3.44Å; L37-T46 PolarHBondContact N-O 3.48Å; L37-T46 PolarHBondContact O-N 3.07Å; T46-W50 HydrophobicContact CG2-CE3 3.72Å; T46-W50 HydrophobicContact CG2-CZ3 3.99Å; T46-F51 HydrophobicContact CG2-CE2 3.73Å; T46-F51 HydrophobicContact CG2-CZ 3.9Å
47	C	81.6	Confident	79.7	Confident	47 Å²	47	81.8 Å²	81.8	32%	0.318	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	133.3	-179.3	-174.2	0	0	0	0	111	D35 H49 W50	D35-C47 WeakPolarHBondContact O-CA 3.31Å; C47-H49 PolarHBondContact O-N 3.29Å; C47-W50 PolarHBondContact O-N 2.94Å
48	M	76.7	Confident	78.9	Confident	24 Å²	24	88.5 Å²	88.5	12%	0.118	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-57.7	-35.3	175.4	-96.8	-93.7	108.2	0	0	112.7	Y18 L31 D35 L37 W50 F51	Y18-M48 HydrophobicContact CD2-CE 4.24Å; Y18-M48 HydrophobicContact CE2-CE 3.89Å; L31-M48 HydrophobicContact CD1-SD 4.03Å; L31-M48 HydrophobicContact CD2-CE 3.46Å; L31-M48 VanDerWaalsContact CD2-CE 3.46Å; L31-M48 HydrophobicContact CD2-CG 4.15Å; L31-M48 HydrophobicContact CD2-SD 3.29Å; L31-M48 WeakPolarHBondContact CD2-SD 3.48Å; L31-M48 HydrophobicContact CG-SD 4.28Å; D35-M48 HydrophobicContact CB-CB 4.26Å; D35-M48 PolarHBondContact O-N 2.94Å; L37-M48 HydrophobicContact CD1-CE 3.5Å; L37-M48 VanDerWaalsContact CD1-CE 3.5Å; L37-M48 HydrophobicContact CD2-CE 4Å; L37-M48 HydrophobicContact CG-CE 3.75Å; L37-M48 HydrophobicContact CG-CG 4.35Å; M48-W50 PolarHBondContact O-N 3.08Å; M48-W50 VanDerWaalsContact O-N 3.08Å; M48-F51 HydrophobicContact CE-CD2 4.44Å; M48-F51 PolarHBondContact O-N 2.85Å
49	H	76.6	Confident	78	Confident	141 Å²	141	91.8 Å²	91.8	65%	0.653	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-60.3	-23	-176.1	-167.4	79.4	0	0	0	113.4	C47 F51 S52	C47-H49 PolarHBondContact O-N 3.29Å; H49-F51 PolarHBondContact O-N 3.37Å; H49-S52 PolarHBondContact O-N 3.01Å
50	W	73.1	Confident	76.8	Confident	165 Å²	165	97.7 Å²	97.7	63%	0.625	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-65.1	-18	174.6	-68.7	-1.3	0	0	0	113.8	Y21 T46 C47 M48	Y21-W50 HydrophobicContact CD1-CZ3 4.15Å; Y21-W50 HydrophobicContact CE1-CZ3 4.14Å; T46-W50 HydrophobicContact CG2-CE3 3.72Å; T46-W50 HydrophobicContact CG2-CZ3 3.99Å; C47-W50 PolarHBondContact O-N 2.94Å; M48-W50 PolarHBondContact O-N 3.08Å; M48-W50 VanDerWaalsContact O-N 3.08Å
51	F	72.1	Confident	75.1	Confident	31 Å²	31	97 Å²	97	14%	0.136	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-111.6	2.2	-177.7	-53.5	-67.8	0	0	0	113.3	Y18 L37 T46 M48 H49 M54	Y18-F51 HydrophobicContact CD1-CB 4.01Å; Y18-F51 AromaticContact CD1-CD1 3.2Å; Y18-F51 HydrophobicContact CD1-CD1 3.2Å; Y18-F51 AromaticContact CD1-CD2 3.95Å; Y18-F51 HydrophobicContact CD1-CD2 3.95Å; Y18-F51 AromaticContact CD1-CE1 3.51Å; Y18-F51 HydrophobicContact CD1-CE1 3.51Å; Y18-F51 HydrophobicContact CD1-CE2 4.21Å; Y18-F51 AromaticContact CD1-CG 3.44Å; Y18-F51 HydrophobicContact CD1-CG 3.44Å; Y18-F51 VanDerWaalsContact CD1-CG 3.44Å; Y18-F51 HydrophobicContact CD1-CZ 4Å; Y18-F51 HydrophobicContact CE1-CB 3.35Å; Y18-F51 AromaticContact CE1-CD1 3.39Å; Y18-F51 HydrophobicContact CE1-CD1 3.39Å; Y18-F51 HydrophobicContact CE1-CD2 4.14Å; Y18-F51 HydrophobicContact CE1-CE1 4.18Å; Y18-F51 AromaticContact CE1-CG 3.35Å; Y18-F51 HydrophobicContact CE1-CG 3.35Å; Y18-F51 HydrophobicContact CE2-CB 4.46Å; Y18-F51 HydrophobicContact CG-CD1 4.13Å; Y18-F51 HydrophobicContact CG-CD2 4.15Å; Y18-F51 HydrophobicContact CG-CE1 4.18Å; Y18-F51 HydrophobicContact CG-CE2 4.21Å; Y18-F51 HydrophobicContact CG-CG 4.1Å; Y18-F51 HydrophobicContact CG-CZ 4.21Å; Y18-F51 AromaticContact CZ-CG 3.92Å; L37-F51 HydrophobicContact CD1-CD2 4.3Å; L37-F51 HydrophobicContact CD1-CE2 4Å; T46-F51 HydrophobicContact CG2-CE2 3.73Å; T46-F51 HydrophobicContact CG2-CZ 3.9Å; M48-F51 HydrophobicContact CE-CD2 4.44Å; M48-F51 PolarHBondContact O-N 2.85Å; H49-F51 PolarHBondContact O-N 3.37Å; F51-M54 HydrophobicContact CD1-SD 4.37Å; F51-M54 PolarHBondContact O-N 3.21Å
52	S	68.6	Low	73.4	Confident	50 Å²	50	92.4 Å²	92.4	35%	0.35	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	142.7	174.8	-64.2	0	0	0	0	110.2	H49 M54	H49-S52 PolarHBondContact O-N 3.01Å; S52-M54 VanDerWaalsContact C-N 3.27Å; S52-M54 PolarHBondContact O-N 3.04Å
53	N	70.2	Confident	71.5	Confident	159 Å²	159	98.9 Å²	98.9	85%	0.85	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	15.2	-179.3	-45	-28.1	0	0	0	115.5
54	M	67.9	Low	69.6	Low	97 Å²	97	97.3 Å²	97.3	48%	0.478	53%	0.525	S	S	.	.			trans	-84.6	109.5	161.7	-72.7	-173.2	168.5	0	0	109	H16 F51 S52	H16-M54 PolarHBondContact CE1-O 2.81Å; H16-M54 PolarHBondContact NE2-O 3.41Å; H16-M54 VanDerWaalsContact NE2-O 3.08Å; F51-M54 HydrophobicContact CD1-SD 4.37Å; F51-M54 PolarHBondContact O-N 3.21Å; S52-M54 VanDerWaalsContact C-N 3.27Å; S52-M54 PolarHBondContact O-N 3.04Å
55	D	68	Low	67.7	Low	145 Å²	145	100.3 Å²	100.3	78%	0.775	55%	0.547	S	S	*	.			trans	-114.2	137.2	171.9	-66.8	-38.8	0	0	0	109.6
56	A	64.4	Low	65.9	Low	50 Å²	50	107.4 Å²	107.4	41%	0.413	57%	0.57	S	S	.	*			trans	-114.3	113.1	172.3	0	0	0	0	0	108.9	H16 F58	H16-A56 PolarHBondContact NE2-N 3.26Å; A56-F58 HydrophobicContact CB-CE2 3.99Å; A56-F58 HydrophobicContact CB-CZ 4.47Å
57	T	68.2	Low	64.3	Low	122 Å²	122	115 Å²	115	75%	0.748	61%	0.608	S	S	*	*			trans	-100.9	126.4	175.1	55.5	0	0	0	0	110
58	F	65.8	Low	62.5	Low	145 Å²	145	115.9 Å²	115.9	64%	0.636	63%	0.626	S	S	*	*			trans	-112.1	116.7	170.7	-60.1	-89.5	0	0	0	108.3	I15 A56 T60	I15-F58 HydrophobicContact CD1-CD2 4.25Å; I15-F58 HydrophobicContact CD1-CE2 3.9Å; A56-F58 HydrophobicContact CB-CE2 3.99Å; A56-F58 HydrophobicContact CB-CZ 4.47Å; F58-T60 PolarHBondContact O-N 3.3Å
59	N	67.1	Low	60.9	Low	133 Å²	133	123.8 Å²	123.8	71%	0.711	66%	0.663	S	S	*	*			trans	-89.9	97	174.6	-66.4	-9.8	0	0	0	108.3	E61	N59-E61 VanDerWaalsContact C-N 3.34Å
60	T	65.7	Low	59.5	Low	124 Å²	124	126.9 Å²	126.9	76%	0.761	68%	0.675	S	S	*	*			trans	-90	-2.8	168.8	46.1	0	0	0	0	112.5	F58 A62	F58-T60 PolarHBondContact O-N 3.3Å; T60-A62 PolarHBondContact O-N 2.99Å; T60-A62 VanDerWaalsContact O-N 3.08Å
61	E	54.9	Low	57.9	Low	171 Å²	171	125.3 Å²	125.3	80%	0.799	68%	0.678	S	S	*	*			trans	-75.7	103.6	-177.5	-64.7	-173.8	176.4	0	0	111.5	N59 K63	N59-E61 VanDerWaalsContact C-N 3.34Å; E61-K63 PolarHBondContact O-N 2.93Å
62	A	54.9	Low	56.4	Low	59 Å²	59	130.4 Å²	130.4	49%	0.488	71%	0.707	S	S	.	*			trans	-46.8	101.3	154.9	0	0	0	0	0	109.5	T60 S64 L80	T60-A62 PolarHBondContact O-N 2.99Å; T60-A62 VanDerWaalsContact O-N 3.08Å; A62-S64 PolarHBondContact O-N 3.17Å; A62-L80 HydrophobicContact CB-CD1 3.58Å
63	K	54.9	Low	55.2	Low	182 Å²	182	135.3 Å²	135.3	79%	0.791	73%	0.729	S	S	*	*			trans	-64.9	88.3	168.6	-76.5	-174.9	178.5	179.7	0	108.6	E61 S65	E61-K63 PolarHBondContact O-N 2.93Å; K63-S65 PolarHBondContact O-N 2.95Å
64	S	50.1	Low	54.2	Low	110 Å²	110	136.4 Å²	136.4	77%	0.769	73%	0.73	S	S	*	*			trans	-66.5	78.9	163.7	-173.8	0	0	0	0	107.9	A62 K66	A62-S64 PolarHBondContact O-N 3.17Å; S64-K66 PolarHBondContact O-N 3.35Å
65	S	49.6	Very low	53.3	Low	89 Å²	89	141.4 Å²	141.4	62%	0.622	74%	0.744	S	S	*	*			trans	-76.3	108.3	168.7	-55.5	0	0	0	0	105.8	K63 I67	K63-S65 PolarHBondContact O-N 2.95Å; S65-I67 PolarHBondContact O-N 3.49Å
66	K	50.1	Low	52.5	Low	209 Å²	209	139.2 Å²	139.2	91%	0.909	73%	0.729	S	S	*	*			trans	-40.4	102.2	175.5	-64.6	177.1	179.6	178.4	0	111	S64	S64-K66 PolarHBondContact O-N 3.35Å
67	I	48.7	Very low	52	Low	161 Å²	161	141.4 Å²	141.4	83%	0.826	74%	0.742	S	S	*	*			trans	-121.5	122.3	160.6	-67	170.4	0	0	0	105	S65	S65-I67 PolarHBondContact O-N 3.49Å
68	G	44.7	Very low	51.5	Low	67 Å²	67	141 Å²	141	69%	0.691	74%	0.74	S	S	*	*			trans	-57.2	147.3	-165.7	0	0	0	0	0	114.8
69	Q	43.3	Very low	51.1	Low	189 Å²	189	136 Å²	136	88%	0.883	72%	0.723	S	S	*	*			trans	17.7	101.3	152.5	-69.5	172.6	3.3	0	0	115.7
70	F	47	Very low	50.8	Low	206 Å²	206	134.9 Å²	134.9	90%	0.904	72%	0.716	S	S	*	*			trans	-140	136.4	143.4	-120	-90.5	0	0	0	109.5
71	N	39.8	Very low	50.8	Low	132 Å²	132	135.1 Å²	135.1	71%	0.706	71%	0.707	S	S	*	*			trans	-67.5	144.2	-160.9	-59.9	-51.1	0	0	0	114
72	N	40.4	Very low	51.8	Low	139 Å²	139	132.7 Å²	132.7	74%	0.743	69%	0.694	S	S	*	*			trans	46.6	133.1	144	-61.4	-22	0	0	0	120.8
73	D	43.7	Very low	53	Low	152 Å²	152	133.4 Å²	133.4	81%	0.813	69%	0.693	S	S	*	*			trans	94	123.8	159.8	-50.4	-29.7	0	0	0	117.1
74	E	49	Very low	54.3	Low	183 Å²	183	128.5 Å²	128.5	86%	0.855	68%	0.682	S	S	*	*			trans	89.9	103.6	172	-60.8	-172.7	138.4	0	0	118.6	E76	E74-E76 PolarHBondContact O-N 3.14Å
75	Y	49.1	Very low	56	Low	201 Å²	201	128.6 Å²	128.6	79%	0.788	67%	0.672	S	S	*	*			trans	-33.8	98.8	157.8	143.5	-92.1	0	0	0	112.2
76	E	52.1	Low	57.8	Low	99 Å²	99	126.2 Å²	126.2	46%	0.463	65%	0.651	S	S	.	*			trans	-127.7	69.5	175.2	-157.7	168.6	-163.6	0	0	108.3	E74 I86 K90	E74-E76 PolarHBondContact O-N 3.14Å; E76-I86 WeakPolarHBondContact OE1-CG2 3.48Å; E76-K90 VanDerWaalsContact CD-NZ 3.33Å; E76-K90 VanDerWaalsContact OE1-CE 3.29Å; E76-K90 WeakPolarHBondContact OE1-CE 3.34Å; E76-K90 IonicContact OE1-NZ 3.14Å; E76-K90 PolarHBondContact OE1-NZ 3Å; E76-K90 VanDerWaalsContact OE1-NZ 3.14Å; E76-K90 IonicContact OE2-NZ 2.7Å; E76-K90 PolarHBondContact OE2-NZ 2.88Å
77	S	53.8	Low	59.5	Low	96 Å²	96	124 Å²	124	67%	0.671	64%	0.637	S	S	*	*			trans	-101.9	3.8	-172.6	-63.4	0	0	0	0	115.3
78	T	56.6	Low	61.4	Low	115 Å²	115	117.7 Å²	117.7	71%	0.706	61%	0.613	S	S	*	*	S	Bend	trans	-120.5	-6.5	-171	15.9	0	0	0	0	116.5
79	S	56.9	Low	63.6	Low	40 Å²	40	117.2 Å²	117.2	28%	0.28	60%	0.602	S	S	.	*			trans	-123	15.8	-160.6	72.1	0	0	0	0	116.7	F81 F82 I86	S79-F81 PolarHBondContact O-N 3.45Å; S79-F82 PolarHBondContact O-N 2.86Å; S79-I86 WeakPolarHBondContact O-CD1 3.29Å; S79-I86 WeakPolarHBondContact OG-CD1 3.46Å
80	L	60.9	Low	65.9	Low	108 Å²	108	112.5 Å²	112.5	57%	0.565	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-7.3	-178.1	-68.2	175.9	0	0	0	115.8	A62 F82	A62-L80 HydrophobicContact CB-CD1 3.58Å; L80-F82 VanDerWaalsContact C-N 3.31Å; L80-F82 PolarHBondContact O-N 3.4Å
81	F	65.4	Low	68.1	Low	130 Å²	130	110 Å²	110	57%	0.57	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-25.8	178.5	-66.8	-78.9	0	0	0	113.8	S79	S79-F81 PolarHBondContact O-N 3.45Å
82	F	77.7	Confident	70.7	Confident	120 Å²	120	109 Å²	109	53%	0.526	56%	0.561	S	S	.	*			trans	-140.3	68.8	-172	-55.7	-72.7	0	0	0	113.9	S79 L80 S84 M85 I86	S79-F82 PolarHBondContact O-N 2.86Å; L80-F82 VanDerWaalsContact C-N 3.31Å; L80-F82 PolarHBondContact O-N 3.4Å; F82-S84 VanDerWaalsContact C-N 3.26Å; F82-S84 PolarHBondContact O-N 3.12Å; F82-M85 HydrophobicContact CB-CB 3.95Å; F82-M85 HydrophobicContact CB-CE 3.3Å; F82-M85 HydrophobicContact CB-CG 4.11Å; F82-M85 HydrophobicContact CD1-CE 3.4Å; F82-M85 VanDerWaalsContact CD1-CE 3.4Å; F82-M85 HydrophobicContact CD2-CE 3.41Å; F82-M85 VanDerWaalsContact CD2-CE 3.41Å; F82-M85 HydrophobicContact CE1-CE 3.99Å; F82-M85 HydrophobicContact CE2-CE 4Å; F82-M85 HydrophobicContact CG-CE 3.06Å; F82-M85 HydrophobicContact CZ-CE 4.26Å; F82-M85 PolarHBondContact O-N 2.9Å; F82-M85 VanDerWaalsContact O-N 3.12Å; F82-I86 WeakPolarHBondContact O-CG1 3.5Å; F82-I86 PolarHBondContact O-N 3.19Å; F82-I86 VanDerWaalsContact O-N 3.07Å
83	P	80	Confident	73.3	Confident	74 Å²	74	106.9 Å²	106.9	48%	0.481	55%	0.549	S	S	.	.	H	α-helix	trans	-63.3	-26.8	-177.1	25.1	-34.8	0	0	0	113.9	R87	P83-R87 WeakPolarHBondContact O-CB 3.34Å; P83-R87 VanDerWaalsContact O-CG 3.31Å; P83-R87 WeakPolarHBondContact O-CG 2.92Å; P83-R87 PolarHBondContact O-N 3.36Å; P83-R87 PolarHBondContact O-NE 3.25Å; P83-R87 VanDerWaalsContact O-NE 3.07Å
84	S	82	Confident	75.7	Confident	79 Å²	79	108.1 Å²	108.1	55%	0.552	54%	0.542	S	S	*	.	H	α-helix	trans	-69.3	-44.7	173.2	53.2	0	0	0	0	111.9	F82 R87 G88	F82-S84 VanDerWaalsContact C-N 3.26Å; F82-S84 PolarHBondContact O-N 3.12Å; S84-R87 PolarHBondContact O-N 3.41Å; S84-G88 PolarHBondContact O-N 2.68Å
85	M	86.2	Confident	77.9	Confident	112 Å²	112	102.4 Å²	102.4	55%	0.552	52%	0.523	S	S	*	.	H	α-helix	trans	-64.4	-42.9	178.5	-67.9	-156.8	-78.1	0	0	111.4	F82 R87 G88 A89	F82-M85 HydrophobicContact CB-CB 3.95Å; F82-M85 HydrophobicContact CB-CE 3.3Å; F82-M85 HydrophobicContact CB-CG 4.11Å; F82-M85 HydrophobicContact CD1-CE 3.4Å; F82-M85 VanDerWaalsContact CD1-CE 3.4Å; F82-M85 HydrophobicContact CD2-CE 3.41Å; F82-M85 VanDerWaalsContact CD2-CE 3.41Å; F82-M85 HydrophobicContact CE1-CE 3.99Å; F82-M85 HydrophobicContact CE2-CE 4Å; F82-M85 HydrophobicContact CG-CE 3.06Å; F82-M85 HydrophobicContact CZ-CE 4.26Å; F82-M85 PolarHBondContact O-N 2.9Å; F82-M85 VanDerWaalsContact O-N 3.12Å; M85-R87 PolarHBondContact O-N 3.38Å; M85-G88 PolarHBondContact O-N 3.13Å; M85-G88 VanDerWaalsContact O-N 3.16Å; M85-A89 WeakPolarHBondContact O-CB 3.48Å; M85-A89 PolarHBondContact O-N 3.22Å
86	I	86.3	Confident	80	Confident	38 Å²	38	99 Å²	99	20%	0.195	51%	0.514	C	S	.	.	H	α-helix	trans	-62.6	-43.4	176.7	-64.3	159.9	0	0	0	111.2	E76 S79 F82 G88 A89 K90	E76-I86 WeakPolarHBondContact OE1-CG2 3.48Å; S79-I86 WeakPolarHBondContact O-CD1 3.29Å; S79-I86 WeakPolarHBondContact OG-CD1 3.46Å; F82-I86 WeakPolarHBondContact O-CG1 3.5Å; F82-I86 PolarHBondContact O-N 3.19Å; F82-I86 VanDerWaalsContact O-N 3.07Å; I86-G88 VanDerWaalsContact C-N 3.29Å; I86-G88 PolarHBondContact O-N 3.42Å; I86-A89 PolarHBondContact O-N 3.3Å; I86-K90 HydrophobicContact CG2-CD 4.07Å; I86-K90 HydrophobicContact CG2-CG 4.26Å; I86-K90 WeakPolarHBondContact O-CB 3.34Å; I86-K90 WeakPolarHBondContact O-CG 3.33Å; I86-K90 PolarHBondContact O-N 3.01Å
87	R	85.9	Confident	82	Confident	162 Å²	162	98.2 Å²	98.2	61%	0.611	51%	0.512	S	S	*	.	H	α-helix	trans	-60.9	-39.3	175.1	-78.4	-178.9	-69.4	-164.5	2.6	112	P83 S84 M85 K91	P83-R87 WeakPolarHBondContact O-CB 3.34Å; P83-R87 VanDerWaalsContact O-CG 3.31Å; P83-R87 WeakPolarHBondContact O-CG 2.92Å; P83-R87 PolarHBondContact O-N 3.36Å; P83-R87 PolarHBondContact O-NE 3.25Å; P83-R87 VanDerWaalsContact O-NE 3.07Å; S84-R87 PolarHBondContact O-N 3.41Å; M85-R87 PolarHBondContact O-N 3.38Å; R87-K91 WeakPolarHBondContact O-CG 3.4Å; R87-K91 PolarHBondContact O-N 2.92Å
88	G	89.1	Confident	84	Confident	30 Å²	30	96.1 Å²	96.1	31%	0.309	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-51.3	172.7	0	0	0	0	0	112.1	S84 M85 I86 K90 K91 I92	S84-G88 PolarHBondContact O-N 2.68Å; M85-G88 PolarHBondContact O-N 3.13Å; M85-G88 VanDerWaalsContact O-N 3.16Å; I86-G88 VanDerWaalsContact C-N 3.29Å; I86-G88 PolarHBondContact O-N 3.42Å; G88-K90 PolarHBondContact O-N 3.37Å; G88-K91 WeakPolarHBondContact O-CB 3.44Å; G88-K91 PolarHBondContact O-N 2.74Å; G88-K91 VanDerWaalsContact O-N 3.12Å; G88-I92 WeakPolarHBondContact O-CG1 3.37Å; G88-I92 PolarHBondContact O-N 2.91Å
89	A	90.6	Very high	85.7	Confident	57 Å²	57	96.7 Å²	96.7	47%	0.471	50%	0.498	S	S	.	.	H	α-helix	trans	-59.3	-44.4	179.1	0	0	0	0	0	112.3	M85 I86 K91 I92 L93	M85-A89 WeakPolarHBondContact O-CB 3.48Å; M85-A89 PolarHBondContact O-N 3.22Å; I86-A89 PolarHBondContact O-N 3.3Å; A89-K91 VanDerWaalsContact C-N 3.31Å; A89-K91 PolarHBondContact O-N 3Å; A89-I92 PolarHBondContact O-N 3.43Å; A89-L93 WeakPolarHBondContact O-CB 3.44Å; A89-L93 PolarHBondContact O-N 3.02Å
90	K	91.3	Very high	87.3	Confident	90 Å²	90	101 Å²	101	39%	0.391	51%	0.512	S	S	.	.	H	α-helix	trans	-61.9	-36.4	175.9	-73.3	-175.2	-179.2	-175.8	0	112.2	E76 I86 G88 R94	E76-K90 VanDerWaalsContact CD-NZ 3.33Å; E76-K90 VanDerWaalsContact OE1-CE 3.29Å; E76-K90 WeakPolarHBondContact OE1-CE 3.34Å; E76-K90 IonicContact OE1-NZ 3.14Å; E76-K90 PolarHBondContact OE1-NZ 3Å; E76-K90 VanDerWaalsContact OE1-NZ 3.14Å; E76-K90 IonicContact OE2-NZ 2.7Å; E76-K90 PolarHBondContact OE2-NZ 2.88Å; I86-K90 HydrophobicContact CG2-CD 4.07Å; I86-K90 HydrophobicContact CG2-CG 4.26Å; I86-K90 WeakPolarHBondContact O-CB 3.34Å; I86-K90 WeakPolarHBondContact O-CG 3.33Å; I86-K90 PolarHBondContact O-N 3.01Å; G88-K90 PolarHBondContact O-N 3.37Å; K90-R94 VanDerWaalsContact O-CG 3.26Å; K90-R94 WeakPolarHBondContact O-CG 3.48Å; K90-R94 PolarHBondContact O-N 2.83Å; K90-R94 VanDerWaalsContact O-N 3.12Å
91	K	93.9	Very high	88.8	Confident	153 Å²	153	101.5 Å²	101.5	67%	0.665	51%	0.512	S	S	*	.	H	α-helix	trans	-66.7	-45	174.1	-75.3	178.9	179	-172.6	0	111.8	R87 G88 A89 R94 S95	R87-K91 WeakPolarHBondContact O-CG 3.4Å; R87-K91 PolarHBondContact O-N 2.92Å; G88-K91 WeakPolarHBondContact O-CB 3.44Å; G88-K91 PolarHBondContact O-N 2.74Å; G88-K91 VanDerWaalsContact O-N 3.12Å; A89-K91 VanDerWaalsContact C-N 3.31Å; A89-K91 PolarHBondContact O-N 3Å; K91-R94 PolarHBondContact O-N 3.34Å; K91-S95 PolarHBondContact O-N 2.92Å; K91-S95 PolarHBondContact O-OG 3.02Å
92	I	94.3	Very high	90.1	Very high	110 Å²	110	97.4 Å²	97.4	56%	0.564	50%	0.502	S	S	*	.	H	α-helix	trans	-60.5	-47.7	178.1	-66.3	165.9	0	0	0	110.3	G88 A89 R94 S95 E96	G88-I92 WeakPolarHBondContact O-CG1 3.37Å; G88-I92 PolarHBondContact O-N 2.91Å; A89-I92 PolarHBondContact O-N 3.43Å; I92-R94 PolarHBondContact O-N 3.06Å; I92-S95 WeakPolarHBondContact CA-OG 3.46Å; I92-S95 PolarHBondContact O-N 3.15Å; I92-S95 VanDerWaalsContact O-N 3.13Å; I92-S95 PolarHBondContact O-OG 3.16Å; I92-E96 PolarHBondContact O-N 3.34Å
93	L	94.4	Very high	90.5	Very high	96 Å²	96	96.1 Å²	96.1	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-59	-45.4	178.2	-178.7	63.4	0	0	0	112	A89 S95 E96 I97	A89-L93 WeakPolarHBondContact O-CB 3.44Å; A89-L93 PolarHBondContact O-N 3.02Å; L93-S95 VanDerWaalsContact C-N 3.32Å; L93-S95 PolarHBondContact O-N 3.07Å; L93-E96 PolarHBondContact O-N 3.42Å; L93-I97 HydrophobicContact CD1-CD1 4.22Å; L93-I97 HydrophobicContact CD1-CG1 4.49Å; L93-I97 HydrophobicContact CG-CD1 4.01Å; L93-I97 VanDerWaalsContact O-CG1 3.32Å; L93-I97 WeakPolarHBondContact O-CG1 3.4Å; L93-I97 PolarHBondContact O-N 3Å
94	R	93.8	Very high	90.8	Very high	178 Å²	178	97.1 Å²	97.1	67%	0.672	50%	0.498	S	S	*	.	H	α-helix	trans	-61.2	-39.8	176	-73	173.7	-173.8	-179.5	0.3	112.3	K90 K91 I92 A98	K90-R94 VanDerWaalsContact O-CG 3.26Å; K90-R94 WeakPolarHBondContact O-CG 3.48Å; K90-R94 PolarHBondContact O-N 2.83Å; K90-R94 VanDerWaalsContact O-N 3.12Å; K91-R94 PolarHBondContact O-N 3.34Å; I92-R94 PolarHBondContact O-N 3.06Å; R94-A98 WeakPolarHBondContact O-CB 3.49Å; R94-A98 PolarHBondContact O-N 2.87Å; R94-A98 VanDerWaalsContact O-N 3.07Å
95	S	94.7	Very high	90.8	Very high	63 Å²	63	96.2 Å²	96.2	44%	0.441	49%	0.492	S	S	.	.	H	α-helix	trans	-68.2	-36.2	176.4	56	0	0	0	0	113	K91 I92 L93 A98 L99	K91-S95 PolarHBondContact O-N 2.92Å; K91-S95 PolarHBondContact O-OG 3.02Å; I92-S95 WeakPolarHBondContact CA-OG 3.46Å; I92-S95 PolarHBondContact O-N 3.15Å; I92-S95 VanDerWaalsContact O-N 3.13Å; I92-S95 PolarHBondContact O-OG 3.16Å; L93-S95 VanDerWaalsContact C-N 3.32Å; L93-S95 PolarHBondContact O-N 3.07Å; S95-A98 PolarHBondContact O-N 2.98Å; S95-L99 WeakPolarHBondContact O-CB 3.24Å; S95-L99 VanDerWaalsContact O-CG 3.31Å; S95-L99 WeakPolarHBondContact O-CG 3.32Å; S95-L99 PolarHBondContact O-N 3.4Å
96	E	94.6	Very high	90.4	Very high	128 Å²	128	96.9 Å²	96.9	60%	0.598	49%	0.494	S	S	*	.	H	α-helix	trans	-66.4	-44.2	176.6	-174.8	179	175.1	0	0	111.6	I92 L93 L99 K100	I92-E96 PolarHBondContact O-N 3.34Å; L93-E96 PolarHBondContact O-N 3.42Å; E96-L99 PolarHBondContact O-N 2.8Å; E96-K100 WeakPolarHBondContact O-CB 3.41Å; E96-K100 PolarHBondContact O-N 3.18Å
97	I	94.7	Very high	89.5	Confident	83 Å²	83	101.4 Å²	101.4	43%	0.426	51%	0.512	S	S	.	.	H	α-helix	trans	-59.5	-48.6	174.8	-66.1	165.9	0	0	0	110.3	L93 L99 K100 E101	L93-I97 HydrophobicContact CD1-CD1 4.22Å; L93-I97 HydrophobicContact CD1-CG1 4.49Å; L93-I97 HydrophobicContact CG-CD1 4.01Å; L93-I97 VanDerWaalsContact O-CG1 3.32Å; L93-I97 WeakPolarHBondContact O-CG1 3.4Å; L93-I97 PolarHBondContact O-N 3Å; I97-L99 VanDerWaalsContact C-N 3.33Å; I97-L99 PolarHBondContact O-N 2.91Å; I97-K100 PolarHBondContact O-N 3.46Å; I97-E101 HydrophobicContact CG2-CG 4.41Å; I97-E101 WeakPolarHBondContact O-CG 3.49Å; I97-E101 PolarHBondContact O-N 2.84Å
98	A	94.2	Very high	88.3	Confident	52 Å²	52	100.9 Å²	100.9	43%	0.43	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-37.1	178.3	0	0	0	0	0	113.1	R94 S95 A102	R94-A98 WeakPolarHBondContact O-CB 3.49Å; R94-A98 PolarHBondContact O-N 2.87Å; R94-A98 VanDerWaalsContact O-N 3.07Å; S95-A98 PolarHBondContact O-N 2.98Å; A98-A102 VanDerWaalsContact O-CB 3.31Å; A98-A102 WeakPolarHBondContact O-CB 3.4Å; A98-A102 PolarHBondContact O-N 3.12Å
99	L	92.6	Very high	86.8	Confident	127 Å²	127	106.7 Å²	106.7	67%	0.665	54%	0.54	S	S	*	.	H	α-helix	trans	-66.8	-40.6	174.8	-77.1	171.3	0	0	0	111.9	S95 E96 I97 A102 L103	S95-L99 WeakPolarHBondContact O-CB 3.24Å; S95-L99 VanDerWaalsContact O-CG 3.31Å; S95-L99 WeakPolarHBondContact O-CG 3.32Å; S95-L99 PolarHBondContact O-N 3.4Å; E96-L99 PolarHBondContact O-N 2.8Å; I97-L99 VanDerWaalsContact C-N 3.33Å; I97-L99 PolarHBondContact O-N 2.91Å; L99-A102 PolarHBondContact O-N 3.47Å; L99-L103 WeakPolarHBondContact O-CB 3.45Å; L99-L103 PolarHBondContact O-N 2.76Å
100	K	91.8	Very high	85	Confident	131 Å²	131	106.9 Å²	106.9	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-64.7	-46.9	177.2	-177.1	178.2	169.2	-175.4	0	111.4	E96 I97 A102 L103 E104	E96-K100 WeakPolarHBondContact O-CB 3.41Å; E96-K100 PolarHBondContact O-N 3.18Å; I97-K100 PolarHBondContact O-N 3.46Å; K100-A102 VanDerWaalsContact C-N 3.35Å; K100-A102 PolarHBondContact O-N 2.87Å; K100-L103 PolarHBondContact O-N 2.98Å; K100-E104 WeakPolarHBondContact CE-OE1 3.46Å; K100-E104 IonicContact NZ-OE1 3.97Å; K100-E104 WeakPolarHBondContact O-CB 3.18Å; K100-E104 WeakPolarHBondContact O-CG 3.31Å; K100-E104 PolarHBondContact O-N 3.28Å
101	E	92.1	Very high	82.9	Confident	119 Å²	119	108.3 Å²	108.3	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-60.5	-43.1	175.9	-70.9	172.7	173.2	0	0	111.7	I97 L103 E104 S105	I97-E101 HydrophobicContact CG2-CG 4.41Å; I97-E101 WeakPolarHBondContact O-CG 3.49Å; I97-E101 PolarHBondContact O-N 2.84Å; E101-L103 PolarHBondContact O-N 3.28Å; E101-E104 PolarHBondContact O-N 2.81Å; E101-S105 PolarHBondContact O-N 2.79Å
102	A	91	Very high	80.7	Confident	44 Å²	44	106.4 Å²	106.4	36%	0.364	56%	0.561	S	S	.	*	H	α-helix	trans	-63.2	-41.5	175.9	0	0	0	0	0	112.1	A98 L99 K100 S105 Q106	A98-A102 VanDerWaalsContact O-CB 3.31Å; A98-A102 WeakPolarHBondContact O-CB 3.4Å; A98-A102 PolarHBondContact O-N 3.12Å; L99-A102 PolarHBondContact O-N 3.47Å; K100-A102 VanDerWaalsContact C-N 3.35Å; K100-A102 PolarHBondContact O-N 2.87Å; A102-S105 PolarHBondContact O-N 3.27Å; A102-S105 PolarHBondContact O-OG 2.7Å; A102-Q106 WeakPolarHBondContact O-CG 3.48Å; A102-Q106 PolarHBondContact O-N 3.14Å
103	L	87.8	Confident	78.5	Confident	92 Å²	92	108.1 Å²	108.1	48%	0.482	57%	0.567	S	S	.	*	H	α-helix	trans	-65.4	-45.3	177.3	-172.8	66	0	0	0	111.4	L99 K100 E101 S105 Q106 F107	L99-L103 WeakPolarHBondContact O-CB 3.45Å; L99-L103 PolarHBondContact O-N 2.76Å; K100-L103 PolarHBondContact O-N 2.98Å; E101-L103 PolarHBondContact O-N 3.28Å; L103-S105 VanDerWaalsContact C-N 3.33Å; L103-S105 PolarHBondContact O-N 3.12Å; L103-Q106 WeakPolarHBondContact O-CB 3.17Å; L103-Q106 PolarHBondContact O-N 2.82Å; L103-Q106 VanDerWaalsContact O-N 3.13Å; L103-F107 HydrophobicContact CD1-CD2 4.1Å; L103-F107 HydrophobicContact CD1-CE2 3.56Å; L103-F107 HydrophobicContact CD2-CE2 4.11Å; L103-F107 HydrophobicContact CG-CD2 3.86Å; L103-F107 HydrophobicContact CG-CE2 3.58Å; L103-F107 WeakPolarHBondContact O-CD2 3.44Å; L103-F107 PolarHBondContact O-N 3.28Å
104	E	86.4	Confident	76.4	Confident	95 Å²	95	107.3 Å²	107.3	44%	0.444	57%	0.569	S	S	.	*	H	α-helix	trans	-58.3	-44.6	176.2	-73.9	171.3	179.2	0	0	111.1	K100 E101 Q106 F107 E108	K100-E104 WeakPolarHBondContact CE-OE1 3.46Å; K100-E104 IonicContact NZ-OE1 3.97Å; K100-E104 WeakPolarHBondContact O-CB 3.18Å; K100-E104 WeakPolarHBondContact O-CG 3.31Å; K100-E104 PolarHBondContact O-N 3.28Å; E101-E104 PolarHBondContact O-N 2.81Å; E104-Q106 VanDerWaalsContact C-N 3.28Å; E104-Q106 PolarHBondContact O-N 3.16Å; E104-F107 PolarHBondContact O-N 3.32Å; E104-F107 VanDerWaalsContact O-N 3.12Å; E104-E108 PolarHBondContact O-N 3.21Å
105	S	81.3	Confident	74.6	Confident	60 Å²	60	102.9 Å²	102.9	42%	0.42	56%	0.562	S	S	.	*	H	α-helix	trans	-63.1	-29.9	176.6	75.4	0	0	0	0	114.1	E101 A102 L103	E101-S105 PolarHBondContact O-N 2.79Å; A102-S105 PolarHBondContact O-N 3.27Å; A102-S105 PolarHBondContact O-OG 2.7Å; L103-S105 VanDerWaalsContact C-N 3.33Å; L103-S105 PolarHBondContact O-N 3.12Å
106	Q	77	Confident	72.9	Confident	126 Å²	126	104.4 Å²	104.4	59%	0.589	56%	0.561	S	S	*	*	H	α-helix	trans	-73.8	-37.4	174	-71.3	179.5	23.2	0	0	111.8	A102 L103 E104 S110	A102-Q106 WeakPolarHBondContact O-CG 3.48Å; A102-Q106 PolarHBondContact O-N 3.14Å; L103-Q106 WeakPolarHBondContact O-CB 3.17Å; L103-Q106 PolarHBondContact O-N 2.82Å; L103-Q106 VanDerWaalsContact O-N 3.13Å; E104-Q106 VanDerWaalsContact C-N 3.28Å; E104-Q106 PolarHBondContact O-N 3.16Å; Q106-S110 WeakPolarHBondContact O-CB 3.29Å; Q106-S110 PolarHBondContact O-N 2.8Å; Q106-S110 PolarHBondContact O-OG 3.22Å
107	F	67.3	Low	71.6	Confident	134 Å²	134	106 Å²	106	59%	0.588	57%	0.573	S	S	*	*	H	α-helix	trans	-69.6	-39.9	176.5	-81.2	-71.4	0	0	0	112	L103 E104 N109 S110 T111	L103-F107 HydrophobicContact CD1-CD2 4.1Å; L103-F107 HydrophobicContact CD1-CE2 3.56Å; L103-F107 HydrophobicContact CD2-CE2 4.11Å; L103-F107 HydrophobicContact CG-CD2 3.86Å; L103-F107 HydrophobicContact CG-CE2 3.58Å; L103-F107 WeakPolarHBondContact O-CD2 3.44Å; L103-F107 PolarHBondContact O-N 3.28Å; E104-F107 PolarHBondContact O-N 3.32Å; E104-F107 VanDerWaalsContact O-N 3.12Å; F107-N109 PolarHBondContact O-N 3.37Å; F107-S110 CarbonylContact O-C 3.55Å; F107-S110 PolarHBondContact O-N 2.76Å; F107-T111 PolarHBondContact O-N 2.88Å; F107-T111 PolarHBondContact O-OG1 3.4Å
108	E	61.4	Low	70.9	Confident	151 Å²	151	103.4 Å²	103.4	71%	0.706	57%	0.566	S	S	*	*	H	α-helix	trans	-60.8	-42.7	-179.6	-74.9	-176	170.8	0	0	112.5	E104 S110 T111	E104-E108 PolarHBondContact O-N 3.21Å; E108-S110 PolarHBondContact O-N 3.07Å; E108-T111 PolarHBondContact O-OG1 3.07Å
109	N	56.7	Low	70.7	Confident	151 Å²	151	104.2 Å²	104.2	81%	0.807	57%	0.568	S	S	*	*	H	α-helix	trans	-71.7	-14.3	175.8	-76.6	-29.6	0	0	0	113.9	F107	F107-N109 PolarHBondContact O-N 3.37Å
110	S	54.3	Low	70.6	Confident	61 Å²	61	100.8 Å²	100.8	43%	0.427	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.7	6.7	-175.3	-49.1	0	0	0	0	113.7	Q106 F107 E108 S112 Q113	Q106-S110 WeakPolarHBondContact O-CB 3.29Å; Q106-S110 PolarHBondContact O-N 2.8Å; Q106-S110 PolarHBondContact O-OG 3.22Å; F107-S110 CarbonylContact O-C 3.55Å; F107-S110 PolarHBondContact O-N 2.76Å; E108-S110 PolarHBondContact O-N 3.07Å; S110-S112 PolarHBondContact O-N 3.04Å; S110-Q113 PolarHBondContact O-N 2.91Å
111	T	47.1	Very low	70.7	Confident	121 Å²	121	97.8 Å²	97.8	74%	0.742	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	25.3	-173.5	-44.5	0	0	0	0	115	F107 E108	F107-T111 PolarHBondContact O-N 2.88Å; F107-T111 PolarHBondContact O-OG1 3.4Å; E108-T111 PolarHBondContact O-OG1 3.07Å
112	S	46.7	Very low	70.7	Confident	113 Å²	113	103.5 Å²	103.5	79%	0.79	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.2	-2.9	170.2	55.5	0	0	0	0	115.8	S110	S110-S112 PolarHBondContact O-N 3.04Å
113	Q	48	Very low	70.8	Confident	146 Å²	146	103.9 Å²	103.9	68%	0.682	55%	0.553	S	S	*	*			trans	-141.3	120.6	173.7	-71.9	-175.9	-6.6	0	0	111.8	S110 T115	S110-Q113 PolarHBondContact O-N 2.91Å; Q113-T115 HydrophobicContact CB-CG2 4.14Å; Q113-T115 PolarHBondContact O-N 2.97Å
114	S	51.3	Low	71	Confident	79 Å²	79	105.8 Å²	105.8	55%	0.552	56%	0.56	S	S	*	*			trans	-61.4	68	166.2	45.9	0	0	0	0	111.1	F116 T154	S114-F116 PolarHBondContact O-N 2.77Å; S114-T154 PolarHBondContact OG-O 2.88Å
115	T	55.5	Low	71.4	Confident	85 Å²	85	101.3 Å²	101.3	52%	0.521	54%	0.539	S	S	.	.			trans	-79.5	77.2	172.8	53	0	0	0	0	108.5	Q113 D117	Q113-T115 HydrophobicContact CB-CG2 4.14Å; Q113-T115 PolarHBondContact O-N 2.97Å; T115-D117 VanDerWaalsContact C-N 3.26Å; T115-D117 PolarHBondContact O-N 3.08Å
116	F	59.8	Low	72	Confident	95 Å²	95	102.7 Å²	102.7	42%	0.417	55%	0.554	S	S	.	*			trans	-61.3	100.8	148.8	-91.5	-87.2	0	0	0	106.1	S114 G118 T134 T152	S114-F116 PolarHBondContact O-N 2.77Å; F116-G118 PolarHBondContact O-N 3.36Å; F116-T134 HydrophobicContact CB-CG2 3.96Å; F116-T152 HydrophobicContact CD1-CG2 4.31Å; F116-T152 HydrophobicContact CD2-CG2 4.19Å; F116-T152 HydrophobicContact CE1-CG2 4.03Å; F116-T152 HydrophobicContact CE2-CG2 3.89Å; F116-T152 HydrophobicContact CG-CG2 4.39Å; F116-T152 HydrophobicContact CZ-CG2 3.81Å
117	D	67.5	Low	72.7	Confident	162 Å²	162	104 Å²	104	87%	0.866	56%	0.555	S	S	*	*			trans	-66.5	14	-176.1	-108.4	-9.7	0	0	0	114.5	T115	T115-D117 VanDerWaalsContact C-N 3.26Å; T115-D117 PolarHBondContact O-N 3.08Å
118	G	79.7	Confident	74	Confident	27 Å²	27	100.7 Å²	100.7	28%	0.278	55%	0.548	S	S	.	.	S	Bend	trans	-79.6	159.3	178.1	0	0	0	0	0	112.5	F116 S120	F116-G118 PolarHBondContact O-N 3.36Å; G118-S120 PolarHBondContact O-N 3.08Å
119	P	89.6	Confident	75.4	Confident	70 Å²	70	95.3 Å²	95.3	46%	0.455	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-57.2	130.6	171.7	26.9	-34.7	0	0	0	110.1	T134 Y135	P119-T134 WeakPolarHBondContact O-CA 3.36Å; P119-Y135 HydrophobicContact CB-CD1 4.28Å; P119-Y135 HydrophobicContact CB-CE1 3.58Å; P119-Y135 HydrophobicContact CG-CD1 4.01Å; P119-Y135 HydrophobicContact CG-CD2 4.4Å; P119-Y135 HydrophobicContact CG-CE1 3.54Å; P119-Y135 HydrophobicContact CG-CE2 3.97Å; P119-Y135 HydrophobicContact CG-CG 4.41Å; P119-Y135 WeakPolarHBondContact O-CD1 3.07Å; P119-Y135 PolarHBondContact O-N 3.21Å
120	S	90.6	Very high	77.1	Confident	54 Å²	54	89.9 Å²	89.9	38%	0.378	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	137.3	-179.7	73.4	0	0	0	0	111.8	G118 R132 M133	G118-S120 PolarHBondContact O-N 3.08Å; S120-R132 PolarHBondContact OG-NE 3.46Å; S120-R132 PolarHBondContact OG-NH2 3.12Å; S120-M133 CarbonylContact C-O 3.43Å; S120-M133 VanDerWaalsContact CA-O 3.26Å; S120-M133 WeakPolarHBondContact CA-O 3.04Å
121	I	92.9	Very high	79	Confident	69 Å²	69	92.2 Å²	92.2	35%	0.354	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	154.5	177.2	-170	164.4	0	0	0	110.6	K123 M133 Y135 Y151	I121-K123 HydrophobicContact CG2-CB 4.25Å; I121-K123 PolarHBondContact O-N 3.37Å; I121-M133 HydrophobicContact CG2-CB 4.45Å; I121-M133 PolarHBondContact N-O 3.39Å; I121-M133 PolarHBondContact O-N 2.94Å; I121-Y135 HydrophobicContact CB-CD1 4.22Å; I121-Y135 HydrophobicContact CG2-CD1 4.14Å; I121-Y151 HydrophobicContact CG2-CD1 4.04Å; I121-Y151 HydrophobicContact CG2-CE1 3.94Å
122	R	93.6	Very high	81.1	Confident	239 Å²	239	93.2 Å²	93.2	90%	0.902	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	95.2	171	-70.3	-175.9	176.4	-179.6	-1.8	109.7	D131	R122-D131 CarbonylContact C-O 3.53Å; R122-D131 WeakPolarHBondContact CA-O 3.1Å
123	K	91.4	Very high	83.4	Confident	51 Å²	51	87.9 Å²	87.9	22%	0.222	46%	0.464	C	S	.	.			trans	-141.2	127.6	177.6	-178.9	172.3	177.7	172.8	0	108	I121 D131 M133 Y151 E162	I121-K123 HydrophobicContact CG2-CB 4.25Å; I121-K123 PolarHBondContact O-N 3.37Å; K123-D131 PolarHBondContact N-O 3.08Å; K123-D131 CarbonylContact O-C 3.5Å; K123-D131 VanDerWaalsContact O-C 3.23Å; K123-M133 HydrophobicContact CB-CB 4.49Å; K123-M133 HydrophobicContact CB-CG 4.36Å; K123-M133 HydrophobicContact CB-SD 4.36Å; K123-M133 HydrophobicContact CD-SD 4.13Å; K123-M133 HydrophobicContact CG-SD 4.14Å; K123-Y151 HydrophobicContact CD-CD1 3.85Å; K123-Y151 HydrophobicContact CD-CD2 4.18Å; K123-Y151 HydrophobicContact CD-CE1 3.89Å; K123-Y151 HydrophobicContact CD-CE2 4.2Å; K123-Y151 HydrophobicContact CD-CG 3.98Å; K123-E162 IonicContact NZ-OE2 2.76Å; K123-E162 PolarHBondContact NZ-OE2 3.03Å
124	E	94	Very high	85.5	Confident	132 Å²	132	81.2 Å²	81.2	62%	0.617	43%	0.433	S	S	*	.			trans	-71.4	135.4	178.7	-171.7	-178.8	174.5	0	0	110.8	N130	E124-N130 CarbonylContact C-O 3.47Å; E124-N130 WeakPolarHBondContact CA-O 2.82Å
125	C	94.1	Very high	87.5	Confident	1 Å²	1	81.4 Å²	81.4	1%	0.007	42%	0.423	C	S	.	.			trans	-82.5	123.7	176.8	-175.7	0	0	0	0	113.1	Y127 C128 G129 N130 M133 C153	C125-Y127 PolarHBondContact O-N 2.76Å; C125-Y127 PolarHBondContact SG-N 3.36Å; C125-Y127 VanDerWaalsContact SG-N 3.43Å; C125-C128 PolarHBondContact O-N 2.89Å; C125-G129 WeakPolarHBondContact O-CA 3.5Å; C125-G129 PolarHBondContact O-N 3.45Å; C125-N130 HydrophobicContact CB-CB 4.43Å; C125-N130 PolarHBondContact N-O 3.43Å; C125-M133 HydrophobicContact CB-CE 3.27Å; C125-C153 HydrophobicContact CB-CB 4.26Å
126	A	92.8	Very high	89.3	Confident	90 Å²	90	81 Å²	81	74%	0.744	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-19.4	177.9	0	0	0	0	0	113.4	E160	A126-E160 WeakPolarHBondContact CB-OE1 3.47Å; A126-E160 PolarHBondContact N-OE1 3.25Å
127	Y	92.7	Very high	90.8	Very high	154 Å²	154	79.3 Å²	79.3	60%	0.604	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-32.8	-178.3	-58.7	-79.1	0	0	0	114.5	C125 K158 E160	C125-Y127 PolarHBondContact O-N 2.76Å; C125-Y127 PolarHBondContact SG-N 3.36Å; C125-Y127 VanDerWaalsContact SG-N 3.43Å; Y127-K158 HydrophobicContact CD2-CB 3.5Å; Y127-K158 HydrophobicContact CD2-CG 3.95Å; Y127-K158 HydrophobicContact CE2-CB 3.85Å; Y127-K158 HydrophobicContact CE2-CG 4.44Å; Y127-K158 HydrophobicContact CG-CB 4.07Å; Y127-K158 HydrophobicContact CG-CG 3.98Å; Y127-E160 HydrophobicContact CE2-CG 3.96Å
128	C	93.9	Very high	91.8	Very high	64 Å²	64	75.2 Å²	75.2	43%	0.432	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	-3.7	-172.6	69.5	0	0	0	0	115.3	C125 N130 C156	C125-C128 PolarHBondContact O-N 2.89Å; C128-N130 VanDerWaalsContact C-N 3.28Å; C128-N130 PolarHBondContact O-N 3.39Å; C128-N130 VanDerWaalsContact SG-CB 3.59Å; C128-C156 HydrophobicContact CB-CB 4.14Å
129	G	92.2	Very high	92.3	Very high	38 Å²	38	80 Å²	80	39%	0.392	41%	0.41	S	S	.	.			trans	71.8	15.4	-179.3	0	0	0	0	0	114.9	C125	C125-G129 WeakPolarHBondContact O-CA 3.5Å; C125-G129 PolarHBondContact O-N 3.45Å
130	N	92.1	Very high	92.1	Very high	36 Å²	36	80.6 Å²	80.6	19%	0.193	41%	0.413	C	S	.	.			trans	-77.1	130.5	177.6	177.8	48.9	0	0	0	111.2	E124 C125 C128 R132 T154 Q155	E124-N130 CarbonylContact C-O 3.47Å; E124-N130 WeakPolarHBondContact CA-O 2.82Å; C125-N130 HydrophobicContact CB-CB 4.43Å; C125-N130 PolarHBondContact N-O 3.43Å; C128-N130 VanDerWaalsContact C-N 3.28Å; C128-N130 PolarHBondContact O-N 3.39Å; C128-N130 VanDerWaalsContact SG-CB 3.59Å; N130-R132 VanDerWaalsContact C-N 3.25Å; N130-R132 PolarHBondContact ND2-O 3.25Å; N130-R132 PolarHBondContact O-N 3.1Å; N130-T154 PolarHBondContact ND2-OG1 3.39Å; N130-Q155 HydrophobicContact CB-CB 4.24Å; N130-Q155 HydrophobicContact CB-CG 3.99Å; N130-Q155 VanDerWaalsContact CG-CG 3.44Å; N130-Q155 WeakPolarHBondContact ND2-CG 3.48Å
131	D	93.6	Very high	91.9	Very high	110 Å²	110	83.5 Å²	83.5	59%	0.588	42%	0.415	S	S	*	.	S	Bend	trans	-76.9	-0.9	-176.4	-74.7	-25.5	0	0	0	115.1	R122 K123	R122-D131 CarbonylContact C-O 3.53Å; R122-D131 WeakPolarHBondContact CA-O 3.1Å; K123-D131 PolarHBondContact N-O 3.08Å; K123-D131 CarbonylContact O-C 3.5Å; K123-D131 VanDerWaalsContact O-C 3.23Å
132	R	91.7	Very high	91.7	Very high	143 Å²	143	84 Å²	84	54%	0.54	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.2	-175.1	-159.8	173.7	-175.9	-175	-2.6	112	S120 N130 T154	S120-R132 PolarHBondContact OG-NE 3.46Å; S120-R132 PolarHBondContact OG-NH2 3.12Å; N130-R132 VanDerWaalsContact C-N 3.25Å; N130-R132 PolarHBondContact ND2-O 3.25Å; N130-R132 PolarHBondContact O-N 3.1Å; R132-T154 HydrophobicContact CG-CG2 4.27Å; R132-T154 PolarHBondContact O-N 3.35Å; R132-T154 PolarHBondContact O-OG1 3.22Å
133	M	93.7	Very high	91.2	Very high	0 Å²	0	77.3 Å²	77.3	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153.5	173.3	-65.7	-164.9	169.9	0	0	110.9	S120 I121 K123 C125 Y151 T152 C153 E160	S120-M133 CarbonylContact C-O 3.43Å; S120-M133 VanDerWaalsContact CA-O 3.26Å; S120-M133 WeakPolarHBondContact CA-O 3.04Å; I121-M133 HydrophobicContact CG2-CB 4.45Å; I121-M133 PolarHBondContact N-O 3.39Å; I121-M133 PolarHBondContact O-N 2.94Å; K123-M133 HydrophobicContact CB-CB 4.49Å; K123-M133 HydrophobicContact CB-CG 4.36Å; K123-M133 HydrophobicContact CB-SD 4.36Å; K123-M133 HydrophobicContact CD-SD 4.13Å; K123-M133 HydrophobicContact CG-SD 4.14Å; C125-M133 HydrophobicContact CB-CE 3.27Å; M133-Y151 VanDerWaalsContact SD-CB 3.55Å; M133-Y151 HydrophobicContact SD-CG 4.3Å; M133-T152 WeakPolarHBondContact CA-O 3.41Å; M133-C153 HydrophobicContact CE-CB 4.2Å; M133-E160 WeakPolarHBondContact CE-OE1 3.49Å
134	T	93.3	Very high	91	Very high	6 Å²	6	82.7 Å²	82.7	4%	0.037	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	147.2	165.1	54.2	0	0	0	0	108.9	F116 P119 Y151 T152 T154	F116-T134 HydrophobicContact CB-CG2 3.96Å; P119-T134 WeakPolarHBondContact O-CA 3.36Å; T134-Y151 CarbonylContact O-C 3.6Å; T134-Y151 VanDerWaalsContact O-CA 3.24Å; T134-Y151 WeakPolarHBondContact O-CA 3.28Å; T134-T152 PolarHBondContact N-O 3.36Å; T134-T152 PolarHBondContact O-N 3.19Å; T134-T152 PolarHBondContact OG1-O 3.08Å; T134-T152 VanDerWaalsContact OG1-O 3.08Å; T134-T154 HydrophobicContact CG2-CG2 4.14Å
135	Y	92.9	Very high	90.3	Very high	84 Å²	84	80.9 Å²	80.9	33%	0.329	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.5	176	74.2	-87	0	0	0	111.3	P119 I121 T137 V149 I150	P119-Y135 HydrophobicContact CB-CD1 4.28Å; P119-Y135 HydrophobicContact CB-CE1 3.58Å; P119-Y135 HydrophobicContact CG-CD1 4.01Å; P119-Y135 HydrophobicContact CG-CD2 4.4Å; P119-Y135 HydrophobicContact CG-CE1 3.54Å; P119-Y135 HydrophobicContact CG-CE2 3.97Å; P119-Y135 HydrophobicContact CG-CG 4.41Å; P119-Y135 WeakPolarHBondContact O-CD1 3.07Å; P119-Y135 PolarHBondContact O-N 3.21Å; I121-Y135 HydrophobicContact CB-CD1 4.22Å; I121-Y135 HydrophobicContact CG2-CD1 4.14Å; Y135-T137 HydrophobicContact CD2-CG2 4.02Å; Y135-T137 HydrophobicContact CE2-CG2 4.14Å; Y135-V149 HydrophobicContact CD2-CG1 4.2Å; Y135-V149 HydrophobicContact CG-CG1 4.45Å; Y135-I150 CarbonylContact C-O 3.6Å; Y135-I150 WeakPolarHBondContact CA-O 3.47Å
136	V	92.6	Very high	89.8	Confident	75 Å²	75	82.7 Å²	82.7	46%	0.455	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.5	170	-171.7	0	0	0	0	107.3	L138 I150	V136-L138 HydrophobicContact CB-CD1 3.91Å; V136-L138 HydrophobicContact CG1-CD1 3.5Å; V136-L138 HydrophobicContact CG1-CG 4.44Å; V136-I150 PolarHBondContact N-O 3.33Å; V136-I150 PolarHBondContact O-N 2.8Å
137	T	91.5	Very high	89.6	Confident	61 Å²	61	82.2 Å²	82.2	37%	0.374	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.4	179	62.8	0	0	0	0	110.1	Y135 Q147 T148 V149	Y135-T137 HydrophobicContact CD2-CG2 4.02Å; Y135-T137 HydrophobicContact CE2-CG2 4.14Å; T137-Q147 VanDerWaalsContact CB-CD 3.47Å; T137-Q147 PolarHBondContact OG1-NE2 3.5Å; T137-Q147 VanDerWaalsContact OG1-NE2 3.15Å; T137-T148 WeakPolarHBondContact CA-O 3.45Å; T137-V149 HydrophobicContact CG2-CG1 4.39Å; T137-V149 HydrophobicContact CG2-CG2 4.19Å
138	L	90	Very high	89.6	Confident	75 Å²	75	75 Å²	75	39%	0.393	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	142.1	-179.6	-69.4	88.8	0	0	0	110.3	V136 T140 T148 I150	V136-L138 HydrophobicContact CB-CD1 3.91Å; V136-L138 HydrophobicContact CG1-CD1 3.5Å; V136-L138 HydrophobicContact CG1-CG 4.44Å; L138-T140 HydrophobicContact CB-CG2 4.26Å; L138-T148 PolarHBondContact N-O 2.82Å; L138-T148 WeakPolarHBondContact O-CB 3.29Å; L138-T148 PolarHBondContact O-N 3.25Å; L138-T148 VanDerWaalsContact O-O 3.12Å; L138-I150 HydrophobicContact CD1-CB 4.5Å; L138-I150 HydrophobicContact CD1-CD1 3.73Å; L138-I150 HydrophobicContact CD1-CG1 4.02Å
139	Q	88.7	Confident	89.6	Confident	128 Å²	128	72.7 Å²	72.7	60%	0.598	40%	0.401	S	S	*	.			trans	-84	112.3	168.8	-68.9	-65.3	-2.8	0	0	108.6
140	T	86.2	Confident	89.6	Confident	83 Å²	83	72.6 Å²	72.6	51%	0.509	39%	0.391	S	S	.	.			trans	-113.4	-5.4	-179.1	67.8	0	0	0	0	113.6	L138 T148	L138-T140 HydrophobicContact CB-CG2 4.26Å; T140-T148 HydrophobicContact CG2-CG2 4.42Å; T140-T148 PolarHBondContact OG1-OG1 3.37Å
141	R	86.2	Confident	89.7	Confident	114 Å²	114	72.1 Å²	72.1	43%	0.43	39%	0.387	S	S	.	.	S	Bend	trans	-136.3	-178.5	-172.3	-54.1	-172	-170.8	163.7	2.7	111.6	E145 N163	R141-E145 HydrophobicContact CB-CB 4.21Å; R141-E145 WeakPolarHBondContact CD-OE2 3.33Å; R141-E145 IonicContact CZ-OE2 3.57Å; R141-E145 IonicContact NE-OE2 3.6Å; R141-E145 IonicContact NH1-OE2 2.77Å; R141-E145 PolarHBondContact NH1-OE2 3.23Å; R141-N163 PolarHBondContact NH2-ND2 2.78Å; R141-N163 PolarHBondContact NH2-OD1 3.01Å
142	S	89.4	Confident	89.7	Confident	79 Å²	79	67 Å²	67	55%	0.552	36%	0.36	S	S	*	.			trans	-59.5	155	173.9	-61.8	0	0	0	0	111.6	D144 E145	S142-D144 PolarHBondContact O-N 3.1Å; S142-E145 PolarHBondContact O-N 3.5Å; S142-E145 VanDerWaalsContact O-N 3.07Å
143	A	82.8	Confident	89.7	Confident	100 Å²	100	60.2 Å²	60.2	83%	0.826	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.2	-178.4	0	0	0	0	0	114.5	E145	A143-E145 VanDerWaalsContact C-N 3.31Å
144	D	86.5	Confident	89.6	Confident	164 Å²	164	61.5 Å²	61.5	88%	0.877	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-15.1	179.2	-60.1	-33.3	0	0	0	113.1	S142	S142-D144 PolarHBondContact O-N 3.1Å
145	E	79.2	Confident	89.4	Confident	93 Å²	93	67.9 Å²	67.9	44%	0.435	37%	0.371	S	S	.	.	S	Bend	trans	-100	149.1	175.7	-64.8	-174.1	-138.7	0	0	110.6	R141 S142 A143	R141-E145 HydrophobicContact CB-CB 4.21Å; R141-E145 WeakPolarHBondContact CD-OE2 3.33Å; R141-E145 IonicContact CZ-OE2 3.57Å; R141-E145 IonicContact NE-OE2 3.6Å; R141-E145 IonicContact NH1-OE2 2.77Å; R141-E145 PolarHBondContact NH1-OE2 3.23Å; S142-E145 PolarHBondContact O-N 3.5Å; S142-E145 VanDerWaalsContact O-N 3.07Å; A143-E145 VanDerWaalsContact C-N 3.31Å
146	G	83.4	Confident	89.3	Confident	40 Å²	40	66.2 Å²	66.2	41%	0.412	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-70.6	174	-179.9	0	0	0	0	0	113.5	T164	G146-T164 WeakPolarHBondContact CA-OXT 3.16Å
147	Q	88.9	Confident	89.2	Confident	80 Å²	80	65.7 Å²	65.7	37%	0.374	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-74.4	138.2	-167.9	-171.7	172.3	35.7	0	0	111.7	T137 T164	T137-Q147 VanDerWaalsContact CB-CD 3.47Å; T137-Q147 PolarHBondContact OG1-NE2 3.5Å; T137-Q147 VanDerWaalsContact OG1-NE2 3.15Å; Q147-T164 PolarHBondContact N-OXT 3.18Å; Q147-T164 PolarHBondContact O-N 3.02Å
148	T	92.9	Very high	89.2	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.018	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	123.5	171.3	-54.8	0	0	0	0	110.3	T137 L138 T140 I150 I161 N163	T137-T148 WeakPolarHBondContact CA-O 3.45Å; L138-T148 PolarHBondContact N-O 2.82Å; L138-T148 WeakPolarHBondContact O-CB 3.29Å; L138-T148 PolarHBondContact O-N 3.25Å; L138-T148 VanDerWaalsContact O-O 3.12Å; T140-T148 HydrophobicContact CG2-CG2 4.42Å; T140-T148 PolarHBondContact OG1-OG1 3.37Å; T148-I150 HydrophobicContact CG2-CG1 4.47Å; T148-I161 HydrophobicContact CG2-CG2 3.35Å; T148-N163 PolarHBondContact OG1-OD1 2.85Å
149	V	93.1	Very high	89.4	Confident	15 Å²	15	70.3 Å²	70.3	9%	0.091	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.4	174.5	-170.5	0	0	0	0	109.1	Y135 T137 Y151 E162	Y135-V149 HydrophobicContact CD2-CG1 4.2Å; Y135-V149 HydrophobicContact CG-CG1 4.45Å; T137-V149 HydrophobicContact CG2-CG1 4.39Å; T137-V149 HydrophobicContact CG2-CG2 4.19Å; V149-Y151 HydrophobicContact CB-CE2 4.02Å; V149-Y151 HydrophobicContact CG1-CD1 4.5Å; V149-Y151 HydrophobicContact CG1-CD2 4.24Å; V149-Y151 HydrophobicContact CG1-CE1 3.95Å; V149-Y151 HydrophobicContact CG1-CE2 3.67Å; V149-E162 PolarHBondContact N-O 2.87Å; V149-E162 PolarHBondContact O-N 2.77Å
150	I	93.4	Very high	89.5	Confident	35 Å²	35	65.7 Å²	65.7	18%	0.179	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	113	175.4	-52.9	-172.8	0	0	0	108.5	Y135 V136 L138 T148 K159 I161	Y135-I150 CarbonylContact C-O 3.6Å; Y135-I150 WeakPolarHBondContact CA-O 3.47Å; V136-I150 PolarHBondContact N-O 3.33Å; V136-I150 PolarHBondContact O-N 2.8Å; L138-I150 HydrophobicContact CD1-CB 4.5Å; L138-I150 HydrophobicContact CD1-CD1 3.73Å; L138-I150 HydrophobicContact CD1-CG1 4.02Å; T148-I150 HydrophobicContact CG2-CG1 4.47Å; I150-K159 HydrophobicContact CG2-CB 4.42Å; I150-I161 HydrophobicContact CG1-CG1 4.43Å
151	Y	93.5	Very high	89.9	Confident	26 Å²	26	67.4 Å²	67.4	10%	0.102	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	139.3	172.2	-57.7	-86.7	0	0	0	110.4	I121 K123 M133 T134 V149 K159 E160 E162	I121-Y151 HydrophobicContact CG2-CD1 4.04Å; I121-Y151 HydrophobicContact CG2-CE1 3.94Å; K123-Y151 HydrophobicContact CD-CD1 3.85Å; K123-Y151 HydrophobicContact CD-CD2 4.18Å; K123-Y151 HydrophobicContact CD-CE1 3.89Å; K123-Y151 HydrophobicContact CD-CE2 4.2Å; K123-Y151 HydrophobicContact CD-CG 3.98Å; M133-Y151 VanDerWaalsContact SD-CB 3.55Å; M133-Y151 HydrophobicContact SD-CG 4.3Å; T134-Y151 CarbonylContact O-C 3.6Å; T134-Y151 VanDerWaalsContact O-CA 3.24Å; T134-Y151 WeakPolarHBondContact O-CA 3.28Å; V149-Y151 HydrophobicContact CB-CE2 4.02Å; V149-Y151 HydrophobicContact CG1-CD1 4.5Å; V149-Y151 HydrophobicContact CG1-CD2 4.24Å; V149-Y151 HydrophobicContact CG1-CE1 3.95Å; V149-Y151 HydrophobicContact CG1-CE2 3.67Å; Y151-K159 CarbonylContact O-C 3.44Å; Y151-K159 WeakPolarHBondContact O-CA 3.49Å; Y151-E160 PolarHBondContact N-O 2.88Å; Y151-E160 PolarHBondContact O-N 3.4Å; Y151-E162 HydrophobicContact CD2-CB 4.41Å; Y151-E162 HydrophobicContact CE2-CB 3.76Å; Y151-E162 WeakPolarHBondContact CE2-OE2 3.49Å; Y151-E162 PolarHBondContact OH-OE2 3.47Å
152	T	93.6	Very high	90	Very high	4 Å²	4	65.8 Å²	65.8	3%	0.025	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	120.7	174	-54.9	0	0	0	0	109	F116 M133 T134 K158 K159	F116-T152 HydrophobicContact CD1-CG2 4.31Å; F116-T152 HydrophobicContact CD2-CG2 4.19Å; F116-T152 HydrophobicContact CE1-CG2 4.03Å; F116-T152 HydrophobicContact CE2-CG2 3.89Å; F116-T152 HydrophobicContact CG-CG2 4.39Å; F116-T152 HydrophobicContact CZ-CG2 3.81Å; M133-T152 WeakPolarHBondContact CA-O 3.41Å; T134-T152 PolarHBondContact N-O 3.36Å; T134-T152 PolarHBondContact O-N 3.19Å; T134-T152 PolarHBondContact OG1-O 3.08Å; T134-T152 VanDerWaalsContact OG1-O 3.08Å; T152-K158 WeakPolarHBondContact CA-O 3.28Å; T152-K159 HydrophobicContact CG2-CG 4.29Å; T152-K159 PolarHBondContact OG1-NZ 3.35Å
153	C	93.1	Very high	89.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	132.9	-179.7	178.1	0	0	0	0	111.9	C125 M133 Q155 C156 S157 K158	C125-C153 HydrophobicContact CB-CB 4.26Å; M133-C153 HydrophobicContact CE-CB 4.2Å; C153-Q155 VanDerWaalsContact C-N 3.28Å; C153-Q155 PolarHBondContact O-N 3.44Å; C153-Q155 PolarHBondContact SG-N 3.29Å; C153-C156 VanDerWaalsContact CB-SG 3.55Å; C153-S157 VanDerWaalsContact O-CA 3.29Å; C153-S157 WeakPolarHBondContact O-CA 3.39Å; C153-S157 PolarHBondContact O-N 2.65Å; C153-S157 VanDerWaalsContact O-N 3.14Å; C153-K158 PolarHBondContact N-O 3.08Å
154	T	90.2	Very high	89.8	Confident	26 Å²	26	66.9 Å²	66.9	16%	0.16	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-21.5	-177.9	61.7	0	0	0	0	113.9	S114 N130 R132 T134	S114-T154 PolarHBondContact OG-O 2.88Å; N130-T154 PolarHBondContact ND2-OG1 3.39Å; R132-T154 HydrophobicContact CG-CG2 4.27Å; R132-T154 PolarHBondContact O-N 3.35Å; R132-T154 PolarHBondContact O-OG1 3.22Å; T134-T154 HydrophobicContact CG2-CG2 4.14Å
155	Q	89.5	Confident	89.9	Confident	141 Å²	141	62.1 Å²	62.1	66%	0.659	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-67.4	179.1	-67.5	-70.1	-15.2	0	0	112.3	N130 C153 S157	N130-Q155 HydrophobicContact CB-CB 4.24Å; N130-Q155 HydrophobicContact CB-CG 3.99Å; N130-Q155 VanDerWaalsContact CG-CG 3.44Å; N130-Q155 WeakPolarHBondContact ND2-CG 3.48Å; C153-Q155 VanDerWaalsContact C-N 3.28Å; C153-Q155 PolarHBondContact O-N 3.44Å; C153-Q155 PolarHBondContact SG-N 3.29Å; Q155-S157 PolarHBondContact O-N 2.98Å
156	C	91.5	Very high	90.5	Very high	49 Å²	49	60.4 Å²	60.4	33%	0.331	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-3.5	-174.3	70.7	0	0	0	0	115.2	C128 C153 K158	C128-C156 HydrophobicContact CB-CB 4.14Å; C153-C156 VanDerWaalsContact CB-SG 3.55Å; C156-K158 HydrophobicContact CB-CG 4.35Å; C156-K158 PolarHBondContact O-N 3.35Å
157	S	89.5	Confident	90.9	Very high	63 Å²	63	61.6 Å²	61.6	44%	0.441	32%	0.317	S	S	.	.			trans	55.9	16.5	-177.1	-57.7	0	0	0	0	115.5	C153 Q155	C153-S157 VanDerWaalsContact O-CA 3.29Å; C153-S157 WeakPolarHBondContact O-CA 3.39Å; C153-S157 PolarHBondContact O-N 2.65Å; C153-S157 VanDerWaalsContact O-N 3.14Å; Q155-S157 PolarHBondContact O-N 2.98Å
158	K	92.5	Very high	91	Very high	115 Å²	115	60.5 Å²	60.5	50%	0.5	31%	0.314	S	S	.	.			trans	-75	148.4	172.7	-65.2	-66.5	-176.1	-176.5	0	110.8	Y127 T152 C153 C156	Y127-K158 HydrophobicContact CD2-CB 3.5Å; Y127-K158 HydrophobicContact CD2-CG 3.95Å; Y127-K158 HydrophobicContact CE2-CB 3.85Å; Y127-K158 HydrophobicContact CE2-CG 4.44Å; Y127-K158 HydrophobicContact CG-CB 4.07Å; Y127-K158 HydrophobicContact CG-CG 3.98Å; T152-K158 WeakPolarHBondContact CA-O 3.28Å; C153-K158 PolarHBondContact N-O 3.08Å; C156-K158 HydrophobicContact CB-CG 4.35Å; C156-K158 PolarHBondContact O-N 3.35Å
159	K	92.3	Very high	90.9	Very high	119 Å²	119	64.1 Å²	64.1	52%	0.517	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.2	-178.1	-63.2	175.3	-178.3	-74.5	0	110.6	I150 Y151 T152	I150-K159 HydrophobicContact CG2-CB 4.42Å; Y151-K159 CarbonylContact O-C 3.44Å; Y151-K159 WeakPolarHBondContact O-CA 3.49Å; T152-K159 HydrophobicContact CG2-CG 4.29Å; T152-K159 PolarHBondContact OG1-NZ 3.35Å
160	E	92.7	Very high	90.7	Very high	31 Å²	31	67.3 Å²	67.3	15%	0.145	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.6	174.4	-66.6	175.3	-164.7	0	0	108.7	A126 Y127 M133 Y151	A126-E160 WeakPolarHBondContact CB-OE1 3.47Å; A126-E160 PolarHBondContact N-OE1 3.25Å; Y127-E160 HydrophobicContact CE2-CG 3.96Å; M133-E160 WeakPolarHBondContact CE-OE1 3.49Å; Y151-E160 PolarHBondContact N-O 2.88Å; Y151-E160 PolarHBondContact O-N 3.4Å
161	I	92.7	Very high	90.6	Very high	118 Å²	118	69.6 Å²	69.6	61%	0.605	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.8	-176.2	-57.1	175.3	0	0	0	108.4	T148 I150	T148-I161 HydrophobicContact CG2-CG2 3.35Å; I150-I161 HydrophobicContact CG1-CG1 4.43Å
162	E	90.4	Very high	90.3	Very high	81 Å²	81	73 Å²	73	38%	0.379	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.8	176.6	-164.9	173.3	160.8	0	0	108.8	K123 V149 Y151	K123-E162 IonicContact NZ-OE2 2.76Å; K123-E162 PolarHBondContact NZ-OE2 3.03Å; V149-E162 PolarHBondContact N-O 2.87Å; V149-E162 PolarHBondContact O-N 2.77Å; Y151-E162 HydrophobicContact CD2-CB 4.41Å; Y151-E162 HydrophobicContact CE2-CB 3.76Å; Y151-E162 WeakPolarHBondContact CE2-OE2 3.49Å; Y151-E162 PolarHBondContact OH-OE2 3.47Å
163	N	86.9	Confident	90.1	Very high	74 Å²	74	78.8 Å²	78.8	40%	0.396	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.8	172.7	-50.7	-64	0	0	0	106.8	R141 T148	R141-N163 PolarHBondContact NH2-ND2 2.78Å; R141-N163 PolarHBondContact NH2-OD1 3.01Å; T148-N163 PolarHBondContact OG1-OD1 2.85Å
164	T	79.4	Confident	89.8	Confident	128 Å²	128	85.9 Å²	85.9	79%	0.785	45%	0.447	S	S	*	.			trans	-93.8	0	170.1	-53.2	0	0	0	0	108.3	G146 Q147	G146-T164 WeakPolarHBondContact CA-OXT 3.16Å; Q147-T164 PolarHBondContact N-OXT 3.18Å; Q147-T164 PolarHBondContact O-N 3.02Å

Retrieved 164 of 164 residues in 42.3 ms (Link to these results)

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