A0A096LWT6_POEFO Loading...

Cyclin-dependent kinases regulatory subunit

Binds to the catalytic subunit of the cyclin dependent kinases and is essential for their biological function.

AlphaFold DB , UniProt , Accession A0A096LWT6, Species POEFO (Poecilia formosa, Amazon molly), Gene CKS2, Length 96 aa.

						>A0A096LWT6_POEFO|A0A096LWT6|CKS2
MQLNCNYSLIKLFLFIFTGNMSRSQIYYSNVYMDDQYEYRHVVLPQVMAKYVPKSHLISEDEWRQLGVQQSRGWIQYMIHEPEPHILLFRRPLSRH
					

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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	33.2	Very low	44.7	Very low	238 Å²	238	117.4 Å²	117.4	100%	1.172	60%	0.6	S	S	*	*				0	74.1	0	-66	170.4	-168.6	0	0	107.2	L3	M1-L3 PolarHBondContact O-N 3.19Å
2	Q	31.8	Very low	45.3	Very low	174 Å²	174	117 Å²	117	81%	0.813	60%	0.599	S	S	*	*			trans	-58.4	125.4	170.6	-101.8	97.8	-24.3	0	0	107.2	N4	Q2-N4 PolarHBondContact O-N 2.81Å
3	L	36.1	Very low	46	Very low	124 Å²	124	118.1 Å²	118.1	65%	0.649	60%	0.597	S	S	*	*			trans	-56.2	92.6	168.6	-77.8	151	0	0	0	108.3	M1 C5	M1-L3 PolarHBondContact O-N 3.19Å; L3-C5 PolarHBondContact O-N 2.78Å
4	N	35.5	Very low	46.5	Very low	140 Å²	140	110.6 Å²	110.6	75%	0.749	56%	0.559	S	S	*	*			trans	-65.6	58.9	156.8	-82.8	-35.7	0	0	0	108.1	Q2 N6	Q2-N4 PolarHBondContact O-N 2.81Å; N4-N6 PolarHBondContact O-N 3.45Å
5	C	42.5	Very low	47	Very low	64 Å²	64	115.1 Å²	115.1	43%	0.432	57%	0.574	S	S	.	*			trans	-78.5	71.7	171	-150	0	0	0	0	107.3	L3 Y7	L3-C5 PolarHBondContact O-N 2.78Å; C5-Y7 PolarHBondContact O-N 3.18Å
6	N	49.9	Very low	47.3	Very low	84 Å²	84	115.6 Å²	115.6	45%	0.449	58%	0.578	S	S	.	*			trans	42.1	64.4	155.8	-69.6	-63.3	0	0	0	117.5	N4 S8 L9 I10	N4-N6 PolarHBondContact O-N 3.45Å; N6-S8 PolarHBondContact O-N 2.91Å; N6-L9 HydrophobicContact CB-CB 3.82Å; N6-L9 HydrophobicContact CB-CD1 3.75Å; N6-L9 HydrophobicContact CB-CG 3.83Å; N6-L9 PolarHBondContact O-N 3.22Å; N6-L9 VanDerWaalsContact O-N 3.13Å; N6-I10 PolarHBondContact O-N 2.91Å
7	Y	52	Low	47.5	Very low	122 Å²	122	114.8 Å²	114.8	48%	0.478	57%	0.57	S	S	.	*	H	α-helix	trans	-49.2	-28.4	159.7	-73.4	-81.6	0	0	0	112.6	C5 K11 M78	C5-Y7 PolarHBondContact O-N 3.18Å; Y7-K11 WeakPolarHBondContact O-CB 3.47Å; Y7-K11 PolarHBondContact O-N 3.38Å; Y7-M78 PolarHBondContact OH-SD 3.48Å
8	S	49.5	Very low	47.8	Very low	93 Å²	93	113.6 Å²	113.6	65%	0.65	57%	0.57	S	S	*	*	H	α-helix	trans	-75.3	-37.7	179.6	-146.1	0	0	0	0	113.8	N6 L12	N6-S8 PolarHBondContact O-N 2.91Å; S8-L12 WeakPolarHBondContact O-CB 3.47Å; S8-L12 PolarHBondContact O-N 3.41Å
9	L	54.1	Low	48	Very low	93 Å²	93	111.2 Å²	111.2	49%	0.487	58%	0.577	S	S	.	*	H	α-helix	trans	-75.6	-35.7	177.9	-67.3	175	0	0	0	111.8	N6 L12 F13	N6-L9 HydrophobicContact CB-CB 3.82Å; N6-L9 HydrophobicContact CB-CD1 3.75Å; N6-L9 HydrophobicContact CB-CG 3.83Å; N6-L9 PolarHBondContact O-N 3.22Å; N6-L9 VanDerWaalsContact O-N 3.13Å; L9-L12 PolarHBondContact O-N 3.38Å; L9-F13 WeakPolarHBondContact O-CB 3.33Å; L9-F13 PolarHBondContact O-N 3.13Å
10	I	55	Low	48.2	Very low	30 Å²	30	113.7 Å²	113.7	15%	0.154	59%	0.591	C	S	.	*	H	α-helix	trans	-60.3	-49.8	172.9	-66.9	170.6	0	0	0	109.1	N6 L12 F13 L14	N6-I10 PolarHBondContact O-N 2.91Å; I10-L12 PolarHBondContact O-N 3.04Å; I10-F13 PolarHBondContact O-N 3.18Å; I10-L14 HydrophobicContact CG2-CD1 3.37Å; I10-L14 HydrophobicContact CG2-CG 4.34Å; I10-L14 WeakPolarHBondContact O-CB 3.44Å; I10-L14 WeakPolarHBondContact O-CD1 3.46Å; I10-L14 WeakPolarHBondContact O-CG 3.23Å; I10-L14 PolarHBondContact O-N 3.23Å
11	K	52.3	Low	48.7	Very low	129 Å²	129	111.5 Å²	111.5	56%	0.561	58%	0.579	S	S	*	*	H	α-helix	trans	-56.5	-45.6	174.2	-92.1	-175	171.2	-179.1	0	113.6	Y7 L14 F15	Y7-K11 WeakPolarHBondContact O-CB 3.47Å; Y7-K11 PolarHBondContact O-N 3.38Å; K11-L14 PolarHBondContact O-N 3.41Å; K11-F15 WeakPolarHBondContact O-CB 3.47Å; K11-F15 PolarHBondContact O-N 3.11Å; K11-F15 VanDerWaalsContact O-N 3.08Å
12	L	52.2	Low	49.7	Very low	113 Å²	113	102.8 Å²	102.8	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-68.4	-38.3	-177.7	-170	67	0	0	0	112.1	S8 L9 I10	S8-L12 WeakPolarHBondContact O-CB 3.47Å; S8-L12 PolarHBondContact O-N 3.41Å; L9-L12 PolarHBondContact O-N 3.38Å; I10-L12 PolarHBondContact O-N 3.04Å
13	F	53.5	Low	51	Low	131 Å²	131	105.3 Å²	105.3	58%	0.575	54%	0.544	S	S	*	.	H	α-helix	trans	-68.7	-43	174.7	-105.5	-95.4	0	0	0	112	L9 I10 F15 I16 F17	L9-F13 WeakPolarHBondContact O-CB 3.33Å; L9-F13 PolarHBondContact O-N 3.13Å; I10-F13 PolarHBondContact O-N 3.18Å; F13-F15 PolarHBondContact O-N 3.1Å; F13-I16 PolarHBondContact O-N 3.34Å; F13-F17 HydrophobicContact CD1-CD2 4.1Å; F13-F17 AromaticContact CD1-CE2 3.8Å; F13-F17 HydrophobicContact CD1-CE2 3.8Å; F13-F17 AromaticContact CE1-CE2 3.98Å; F13-F17 HydrophobicContact CE1-CE2 3.98Å; F13-F17 WeakPolarHBondContact O-CD2 3.49Å; F13-F17 PolarHBondContact O-N 3.31Å
14	L	53.8	Low	52.6	Low	13 Å²	13	104.2 Å²	104.2	7%	0.068	55%	0.546	C	S	.	.	H	α-helix	trans	-65.8	-40.5	-178.6	-70.8	157	0	0	0	112.7	I10 K11 I16 F17 T18 V43 E83 I86	I10-L14 HydrophobicContact CG2-CD1 3.37Å; I10-L14 HydrophobicContact CG2-CG 4.34Å; I10-L14 WeakPolarHBondContact O-CB 3.44Å; I10-L14 WeakPolarHBondContact O-CD1 3.46Å; I10-L14 WeakPolarHBondContact O-CG 3.23Å; I10-L14 PolarHBondContact O-N 3.23Å; K11-L14 PolarHBondContact O-N 3.41Å; L14-I16 PolarHBondContact O-N 3.35Å; L14-F17 PolarHBondContact O-N 3.06Å; L14-T18 WeakPolarHBondContact O-CG2 3.46Å; L14-T18 PolarHBondContact O-N 3.46Å; L14-T18 PolarHBondContact O-OG1 3.38Å; L14-T18 VanDerWaalsContact O-OG1 3.06Å; L14-V43 HydrophobicContact CD2-CG2 3.9Å; L14-E83 WeakPolarHBondContact CD1-OE1 3.42Å; L14-I86 HydrophobicContact CD1-CD1 3.08Å; L14-I86 HydrophobicContact CD2-CD1 3.5Å; L14-I86 VanDerWaalsContact CD2-CD1 3.5Å; L14-I86 HydrophobicContact CD2-CG1 4.38Å; L14-I86 HydrophobicContact CG-CD1 3.89Å
15	F	53.1	Low	54.8	Low	178 Å²	178	103.7 Å²	103.7	78%	0.781	54%	0.539	S	S	*	.	H	α-helix	trans	-61.9	-31	179.9	-155.1	-97	0	0	0	112.7	K11 F13 T18	K11-F15 WeakPolarHBondContact O-CB 3.47Å; K11-F15 PolarHBondContact O-N 3.11Å; K11-F15 VanDerWaalsContact O-N 3.08Å; F13-F15 PolarHBondContact O-N 3.1Å; F15-T18 PolarHBondContact O-OG1 3.08Å
16	I	52.3	Low	57.1	Low	124 Å²	124	102.4 Å²	102.4	64%	0.636	53%	0.528	S	S	*	.	H	α-helix	trans	-79.4	-36.8	176.7	-63.7	-176.6	0	0	0	111.6	F13 L14	F13-I16 PolarHBondContact O-N 3.34Å; L14-I16 PolarHBondContact O-N 3.35Å
17	F	50.5	Low	59.1	Low	102 Å²	102	101.9 Å²	101.9	45%	0.447	52%	0.52	S	S	.	.	H	α-helix	trans	-86.4	-20	-175.2	-84.7	-88.8	0	0	0	114.8	F13 L14 G19 N20	F13-F17 HydrophobicContact CD1-CD2 4.1Å; F13-F17 AromaticContact CD1-CE2 3.8Å; F13-F17 HydrophobicContact CD1-CE2 3.8Å; F13-F17 AromaticContact CE1-CE2 3.98Å; F13-F17 HydrophobicContact CE1-CE2 3.98Å; F13-F17 WeakPolarHBondContact O-CD2 3.49Å; F13-F17 PolarHBondContact O-N 3.31Å; L14-F17 PolarHBondContact O-N 3.06Å; F17-G19 PolarHBondContact O-N 3.29Å; F17-G19 VanDerWaalsContact O-N 3.13Å; F17-N20 PolarHBondContact O-N 2.87Å
18	T	53	Low	61	Low	92 Å²	92	99.5 Å²	99.5	56%	0.564	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.3	177.7	41.3	0	0	0	0	114.8	L14 F15	L14-T18 WeakPolarHBondContact O-CG2 3.46Å; L14-T18 PolarHBondContact O-N 3.46Å; L14-T18 PolarHBondContact O-OG1 3.38Å; L14-T18 VanDerWaalsContact O-OG1 3.06Å; F15-T18 PolarHBondContact O-OG1 3.08Å
19	G	50.8	Low	63	Low	68 Å²	68	95.3 Å²	95.3	70%	0.701	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-17.4	-178.6	0	0	0	0	0	115.7	F17	F17-G19 PolarHBondContact O-N 3.29Å; F17-G19 VanDerWaalsContact O-N 3.13Å
20	N	52.5	Low	64.7	Low	162 Å²	162	97.6 Å²	97.6	87%	0.866	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.4	12.2	-167.6	-118.8	-19.3	0	0	0	115.7	F17	F17-N20 PolarHBondContact O-N 2.87Å
21	M	58.6	Low	66.4	Low	67 Å²	67	98.9 Å²	98.9	33%	0.33	50%	0.504	S	S	.	.			trans	-78.2	131.9	174.1	-129.5	172.1	95.6	0	0	110.1	R23 Q25 Y27	M21-R23 PolarHBondContact O-N 3.08Å; M21-Q25 WeakPolarHBondContact CE-O 3.45Å; M21-Y27 VanDerWaalsContact CE-CB 3.47Å; M21-Y27 WeakPolarHBondContact SD-CB 3.49Å; M21-Y27 HydrophobicContact SD-CD2 4.47Å; M21-Y27 HydrophobicContact SD-CG 4.08Å
22	S	55.3	Low	68.3	Low	56 Å²	56	96.3 Å²	96.3	39%	0.392	49%	0.491	S	S	.	.			trans	-58	134	172.7	81.4	0	0	0	0	108.7	S24 Q25	S22-S24 PolarHBondContact O-N 2.94Å; S22-Q25 PolarHBondContact O-N 3.28Å; S22-Q25 WeakPolarHBondContact OG-CB 3.19Å; S22-Q25 VanDerWaalsContact OG-CD 3.27Å; S22-Q25 VanDerWaalsContact OG-CG 3.25Å; S22-Q25 WeakPolarHBondContact OG-CG 3.43Å; S22-Q25 PolarHBondContact OG-OE1 3.14Å
23	R	59.2	Low	70.1	Confident	227 Å²	227	96.9 Å²	96.9	86%	0.857	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	1	-171.1	-67.8	-175.7	-179.4	170.8	0.5	115	M21	M21-R23 PolarHBondContact O-N 3.08Å
24	S	68.1	Low	71.8	Confident	101 Å²	101	93.2 Å²	93.2	71%	0.706	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	-3.1	-167.9	-48.2	0	0	0	0	113.9	S22	S22-S24 PolarHBondContact O-N 2.94Å
25	Q	83.2	Confident	73.6	Confident	129 Å²	129	100.1 Å²	100.1	60%	0.603	52%	0.515	S	S	*	.			trans	-106.6	139.4	-176.6	-72.3	177.6	-49.4	0	0	112	M21 S22 P45	M21-Q25 WeakPolarHBondContact CE-O 3.45Å; S22-Q25 PolarHBondContact O-N 3.28Å; S22-Q25 WeakPolarHBondContact OG-CB 3.19Å; S22-Q25 VanDerWaalsContact OG-CD 3.27Å; S22-Q25 VanDerWaalsContact OG-CG 3.25Å; S22-Q25 WeakPolarHBondContact OG-CG 3.43Å; S22-Q25 PolarHBondContact OG-OE1 3.14Å; Q25-P45 WeakPolarHBondContact O-CG 3.5Å
26	I	91	Very high	75.4	Confident	36 Å²	36	97.8 Å²	97.8	19%	0.185	51%	0.507	C	S	.	.			trans	-79.2	129.2	170.8	-58.3	173.2	0	0	0	108	Y28 V42 L44 M48 G67	I26-Y28 HydrophobicContact CB-CE2 4.02Å; I26-Y28 HydrophobicContact CG2-CD2 4.35Å; I26-Y28 HydrophobicContact CG2-CE1 4.28Å; I26-Y28 HydrophobicContact CG2-CE2 3.71Å; I26-V42 HydrophobicContact CG2-CG1 3.29Å; I26-L44 HydrophobicContact CD1-CD2 4.17Å; I26-L44 HydrophobicContact CG1-CD2 4.12Å; I26-L44 HydrophobicContact CG2-CD2 4.18Å; I26-M48 HydrophobicContact CD1-CE 4.07Å; I26-M48 HydrophobicContact CG1-CE 4.41Å; I26-M48 HydrophobicContact CG1-SD 4.41Å; I26-G67 VanDerWaalsContact CD1-O 3.28Å; I26-G67 WeakPolarHBondContact CD1-O 3.38Å
27	Y	91.3	Very high	77.3	Confident	73 Å²	73	94.9 Å²	94.9	29%	0.286	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.6	175.1	171	-90.6	0	0	0	111.1	M21 V42 V43	M21-Y27 VanDerWaalsContact CE-CB 3.47Å; M21-Y27 WeakPolarHBondContact SD-CB 3.49Å; M21-Y27 HydrophobicContact SD-CD2 4.47Å; M21-Y27 HydrophobicContact SD-CG 4.08Å; Y27-V42 CarbonylContact O-C 3.55Å; Y27-V42 WeakPolarHBondContact O-CA 3.4Å; Y27-V43 HydrophobicContact CD1-CB 4.2Å; Y27-V43 HydrophobicContact CD1-CG2 3.91Å; Y27-V43 PolarHBondContact N-O 3.34Å; Y27-V43 PolarHBondContact O-N 2.78Å
28	Y	92.3	Very high	79.4	Confident	72 Å²	72	91.6 Å²	91.6	28%	0.282	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.3	178.7	-60.2	-95.3	0	0	0	108.5	I26 V42 V68 Q69	I26-Y28 HydrophobicContact CB-CE2 4.02Å; I26-Y28 HydrophobicContact CG2-CD2 4.35Å; I26-Y28 HydrophobicContact CG2-CE1 4.28Å; I26-Y28 HydrophobicContact CG2-CE2 3.71Å; Y28-V42 HydrophobicContact CD1-CG1 4.25Å; Y28-V42 HydrophobicContact CD1-CG2 3.66Å; Y28-V42 HydrophobicContact CE1-CG1 4.13Å; Y28-V42 HydrophobicContact CE1-CG2 4Å; Y28-V68 HydrophobicContact CE1-CG1 4.06Å; Y28-Q69 VanDerWaalsContact CE1-O 3.27Å; Y28-Q69 WeakPolarHBondContact CE1-O 3.43Å; Y28-Q69 PolarHBondContact OH-N 3.24Å
29	S	91.3	Very high	81.3	Confident	6 Å²	6	88 Å²	88	4%	0.042	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-71.4	163.2	175.7	83.8	0	0	0	0	112.1	R40 H41	S29-R40 PolarHBondContact O-NE 3.45Å; S29-R40 WeakPolarHBondContact OG-CG 3.19Å; S29-H41 WeakPolarHBondContact CB-CE1 3.45Å; S29-H41 VanDerWaalsContact CB-ND1 3.35Å; S29-H41 WeakPolarHBondContact CB-ND1 3.43Å; S29-H41 WeakPolarHBondContact CB-NE2 3.43Å; S29-H41 WeakPolarHBondContact CB-O 3.31Å; S29-H41 PolarHBondContact N-O 3.34Å; S29-H41 PolarHBondContact OG-N 2.96Å; S29-H41 PolarHBondContact OG-ND1 3.15Å; S29-H41 PolarHBondContact OG-O 3.32Å
30	N	90.6	Very high	83.4	Confident	140 Å²	140	87.5 Å²	87.5	75%	0.749	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-57.6	149.5	162.2	-67.7	-25.3	0	0	0	110.2
31	V	90.3	Very high	85.3	Confident	58 Å²	58	81.2 Å²	81.2	35%	0.352	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-77.8	135.5	173.4	-178	0	0	0	0	108.3	E38 Y39 W74	V31-E38 HydrophobicContact CG1-CB 3.9Å; V31-E38 HydrophobicContact CG1-CG 4.35Å; V31-Y39 WeakPolarHBondContact CA-O 3.46Å; V31-W74 HydrophobicContact CG1-CH2 4.22Å; V31-W74 HydrophobicContact CG2-CH2 4.33Å; V31-W74 HydrophobicContact CG2-CZ2 4.34Å
32	Y	91.3	Very high	86.9	Confident	75 Å²	75	78 Å²	78	29%	0.294	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.6	169.6	49.9	-81	0	0	0	108.3	E38 Y39	Y32-E38 CarbonylContact O-C 3.58Å; Y32-Y39 HydrophobicContact CD2-CD2 4.18Å; Y32-Y39 HydrophobicContact CD2-CG 4.22Å; Y32-Y39 HydrophobicContact CE2-CD2 4.25Å; Y32-Y39 AromaticContact CE2-CG 3.88Å; Y32-Y39 HydrophobicContact CE2-CG 3.88Å; Y32-Y39 PolarHBondContact N-O 2.78Å; Y32-Y39 PolarHBondContact O-N 2.91Å
33	M	90.2	Very high	88.6	Confident	124 Å²	124	76 Å²	76	61%	0.611	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.9	-171.6	54.3	-176.6	68.1	0	0	111.1	Y37 E38	M33-Y37 VanDerWaalsContact CA-O 3.28Å; M33-Y37 WeakPolarHBondContact CA-O 3.46Å; M33-E38 HydrophobicContact CB-CG 4.29Å; M33-E38 HydrophobicContact CE-CG 4.37Å
34	D	90.3	Very high	90.2	Very high	54 Å²	54	65.2 Å²	65.2	29%	0.289	32%	0.322	S	S	.	.			trans	-112.4	-165.8	165	67.5	22.2	0	0	0	109.6	Q36 Y37 Y39 L93	D34-Q36 PolarHBondContact O-N 2.82Å; D34-Q36 WeakPolarHBondContact OD1-CA 3.29Å; D34-Q36 PolarHBondContact OD1-N 3Å; D34-Y37 PolarHBondContact N-O 2.75Å; D34-Y37 PolarHBondContact OD1-N 3.12Å; D34-Y39 HydrophobicContact CB-CE2 4.25Å; D34-Y39 WeakPolarHBondContact OD2-CE2 3.35Å; D34-Y39 VanDerWaalsContact OD2-CZ 3.3Å; D34-Y39 PolarHBondContact OD2-OH 2.93Å; D34-L93 VanDerWaalsContact O-CD1 3.26Å; D34-L93 WeakPolarHBondContact O-CD1 3.44Å
35	D	90.9	Very high	91.2	Very high	158 Å²	158	60.8 Å²	60.8	85%	0.845	29%	0.29	S	S	*	.	S	Bend	trans	-69.2	-12.5	-178.4	-58.7	-36.1	0	0	0	114.1
36	Q	90.8	Very high	91.3	Very high	130 Å²	130	62.7 Å²	62.7	61%	0.607	30%	0.299	S	S	*	.	S	Bend	trans	-123.6	-32.3	-171.7	-63	-171.4	-7.7	0	0	113.8	D34 L93	D34-Q36 PolarHBondContact O-N 2.82Å; D34-Q36 WeakPolarHBondContact OD1-CA 3.29Å; D34-Q36 PolarHBondContact OD1-N 3Å; Q36-L93 PolarHBondContact O-N 3.05Å
37	Y	93.1	Very high	91.1	Very high	63 Å²	63	65.4 Å²	65.4	25%	0.247	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.5	-170.2	-60.8	-86.2	0	0	0	112.8	M33 D34 Y39 R90 R91 P92	M33-Y37 VanDerWaalsContact CA-O 3.28Å; M33-Y37 WeakPolarHBondContact CA-O 3.46Å; D34-Y37 PolarHBondContact N-O 2.75Å; D34-Y37 PolarHBondContact OD1-N 3.12Å; Y37-Y39 WeakPolarHBondContact O-CE2 2.76Å; Y37-R90 HydrophobicContact CD1-CB 4.5Å; Y37-R90 HydrophobicContact CD1-CG 4.25Å; Y37-R91 CarbonylContact C-O 3.58Å; Y37-R91 VanDerWaalsContact CA-O 3.3Å; Y37-R91 WeakPolarHBondContact CA-O 3.28Å; Y37-P92 HydrophobicContact CD1-CB 4.25Å; Y37-P92 HydrophobicContact CE1-CB 4.17Å
38	E	93.4	Very high	90.9	Very high	32 Å²	32	64 Å²	64	15%	0.15	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	145.2	159.2	-59.1	176	164.4	0	0	109.5	V31 Y32 M33 W74 R90 R91 L93	V31-E38 HydrophobicContact CG1-CB 3.9Å; V31-E38 HydrophobicContact CG1-CG 4.35Å; Y32-E38 CarbonylContact O-C 3.58Å; M33-E38 HydrophobicContact CB-CG 4.29Å; M33-E38 HydrophobicContact CE-CG 4.37Å; E38-W74 HydrophobicContact CB-CH2 4.05Å; E38-W74 HydrophobicContact CB-CZ3 4.48Å; E38-R90 CarbonylContact O-C 3.55Å; E38-R90 WeakPolarHBondContact O-CA 3.26Å; E38-R91 PolarHBondContact N-O 2.8Å; E38-R91 PolarHBondContact O-N 3.23Å; E38-R91 IonicContact OE1-NH2 3.62Å; E38-R91 IonicContact OE2-CZ 2.8Å; E38-R91 IonicContact OE2-NE 3.15Å; E38-R91 PolarHBondContact OE2-NE 2.87Å; E38-R91 IonicContact OE2-NH2 3.87Å; E38-R91 PolarHBondContact OE2-NH2 2.94Å; E38-L93 HydrophobicContact CG-CD2 3.46Å; E38-L93 VanDerWaalsContact CG-CD2 3.46Å; E38-L93 HydrophobicContact CG-CG 4.3Å
39	Y	93.4	Very high	90.6	Very high	16 Å²	16	61.3 Å²	61.3	6%	0.063	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148.6	-178.6	-56.9	-90.4	0	0	0	110.3	V31 Y32 D34 Y37 Y77 F89 R90	V31-Y39 WeakPolarHBondContact CA-O 3.46Å; Y32-Y39 HydrophobicContact CD2-CD2 4.18Å; Y32-Y39 HydrophobicContact CD2-CG 4.22Å; Y32-Y39 HydrophobicContact CE2-CD2 4.25Å; Y32-Y39 AromaticContact CE2-CG 3.88Å; Y32-Y39 HydrophobicContact CE2-CG 3.88Å; Y32-Y39 PolarHBondContact N-O 2.78Å; Y32-Y39 PolarHBondContact O-N 2.91Å; D34-Y39 HydrophobicContact CB-CE2 4.25Å; D34-Y39 WeakPolarHBondContact OD2-CE2 3.35Å; D34-Y39 VanDerWaalsContact OD2-CZ 3.3Å; D34-Y39 PolarHBondContact OD2-OH 2.93Å; Y37-Y39 WeakPolarHBondContact O-CE2 2.76Å; Y39-Y77 HydrophobicContact CD1-CE1 4.02Å; Y39-Y77 HydrophobicContact CE1-CE1 4.48Å; Y39-F89 WeakPolarHBondContact CA-O 3.17Å; Y39-R90 HydrophobicContact CD1-CB 3.64Å; Y39-R90 HydrophobicContact CE1-CB 3.77Å
40	R	93.8	Very high	90.5	Very high	59 Å²	59	68 Å²	68	22%	0.223	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	148.8	172.7	172.2	179.5	-78.9	165.1	-3.5	108.1	S29 W74 F89	S29-R40 PolarHBondContact O-NE 3.45Å; S29-R40 WeakPolarHBondContact OG-CG 3.19Å; R40-W74 HydrophobicContact CB-CH2 3.76Å; R40-W74 HydrophobicContact CB-CZ2 4.48Å; R40-W74 HydrophobicContact CB-CZ3 3.88Å; R40-F89 PolarHBondContact N-O 3.26Å; R40-F89 VanDerWaalsContact N-O 3.12Å; R40-F89 PolarHBondContact O-N 3.18Å
41	H	92.4	Very high	90.4	Very high	30 Å²	30	68.3 Å²	68.3	14%	0.139	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	145.6	165.1	63.7	-92.5	0	0	0	110.7	S29 I86 L87 L88	S29-H41 WeakPolarHBondContact CB-CE1 3.45Å; S29-H41 VanDerWaalsContact CB-ND1 3.35Å; S29-H41 WeakPolarHBondContact CB-ND1 3.43Å; S29-H41 WeakPolarHBondContact CB-NE2 3.43Å; S29-H41 WeakPolarHBondContact CB-O 3.31Å; S29-H41 PolarHBondContact N-O 3.34Å; S29-H41 PolarHBondContact OG-N 2.96Å; S29-H41 PolarHBondContact OG-ND1 3.15Å; S29-H41 PolarHBondContact OG-O 3.32Å; H41-I86 HydrophobicContact CB-CG2 4.18Å; H41-L87 CarbonylContact C-O 3.41Å; H41-L87 VanDerWaalsContact CA-O 3.27Å; H41-L87 WeakPolarHBondContact CA-O 3.36Å; H41-L88 HydrophobicContact CB-CD2 3.74Å
42	V	93.1	Very high	90.3	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	128.1	175.3	178	0	0	0	0	107.7	I26 Y27 Y28 L44 V68 I86 L87 F89	I26-V42 HydrophobicContact CG2-CG1 3.29Å; Y27-V42 CarbonylContact O-C 3.55Å; Y27-V42 WeakPolarHBondContact O-CA 3.4Å; Y28-V42 HydrophobicContact CD1-CG1 4.25Å; Y28-V42 HydrophobicContact CD1-CG2 3.66Å; Y28-V42 HydrophobicContact CE1-CG1 4.13Å; Y28-V42 HydrophobicContact CE1-CG2 4Å; V42-L44 HydrophobicContact CG1-CD2 4.49Å; V42-V68 HydrophobicContact CG1-CG1 4.17Å; V42-V68 HydrophobicContact CG1-CG2 4.17Å; V42-V68 HydrophobicContact CG2-CG1 4.25Å; V42-I86 WeakPolarHBondContact O-CA 3.44Å; V42-L87 HydrophobicContact CB-CB 4.37Å; V42-L87 PolarHBondContact N-O 2.97Å; V42-L87 PolarHBondContact O-N 3.36Å; V42-F89 HydrophobicContact CB-CD2 4.4Å; V42-F89 HydrophobicContact CB-CE2 4.03Å; V42-F89 HydrophobicContact CG2-CD2 3.87Å; V42-F89 HydrophobicContact CG2-CE2 3.79Å
43	V	91.9	Very high	90.2	Very high	12 Å²	12	64.2 Å²	64.2	7%	0.073	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	114	178.8	-173.3	0	0	0	0	108	L14 Y27 H85 I86	L14-V43 HydrophobicContact CD2-CG2 3.9Å; Y27-V43 HydrophobicContact CD1-CB 4.2Å; Y27-V43 HydrophobicContact CD1-CG2 3.91Å; Y27-V43 PolarHBondContact N-O 3.34Å; Y27-V43 PolarHBondContact O-N 2.78Å; V43-H85 WeakPolarHBondContact CA-O 3.4Å; V43-I86 HydrophobicContact CG2-CG1 4.45Å
44	L	91.3	Very high	90	Very high	2 Å²	2	66 Å²	66	1%	0.01	31%	0.314	C	S	.	.			trans	-80.9	147.9	175.9	-63.9	179.3	0	0	0	110.6	I26 V42 M48 V52 V68 H85 L87	I26-L44 HydrophobicContact CD1-CD2 4.17Å; I26-L44 HydrophobicContact CG1-CD2 4.12Å; I26-L44 HydrophobicContact CG2-CD2 4.18Å; V42-L44 HydrophobicContact CG1-CD2 4.49Å; L44-M48 HydrophobicContact CB-CB 4.43Å; L44-M48 HydrophobicContact CD2-CE 4.49Å; L44-V52 HydrophobicContact CD1-CG2 3.45Å; L44-V52 VanDerWaalsContact CD1-CG2 3.45Å; L44-V68 HydrophobicContact CD2-CG2 3.73Å; L44-H85 PolarHBondContact N-O 2.91Å; L44-L87 HydrophobicContact CD1-CD1 3.83Å; L44-L87 HydrophobicContact CD1-CG 4.19Å; L44-L87 HydrophobicContact CD2-CD1 4.42Å; L44-L87 HydrophobicContact CG-CD1 4.12Å; L44-L87 HydrophobicContact CG-CG 4.41Å
45	P	90.2	Very high	89.8	Confident	8 Å²	8	68.6 Å²	68.6	5%	0.052	34%	0.336	C	S	.	.			trans	-53.1	143.2	162.9	-25.9	34.5	0	0	0	111.7	Q25 V47 M48 A49	Q25-P45 WeakPolarHBondContact O-CG 3.5Å; P45-V47 HydrophobicContact CB-CG2 3.89Å; P45-V47 PolarHBondContact O-N 3.14Å; P45-V47 VanDerWaalsContact O-N 3.08Å; P45-M48 HydrophobicContact CB-CG 4.42Å; P45-M48 HydrophobicContact CB-SD 4.28Å; P45-M48 HydrophobicContact CG-SD 3.78Å; P45-M48 PolarHBondContact O-N 2.8Å; P45-A49 PolarHBondContact O-N 2.86Å; P45-A49 VanDerWaalsContact O-N 3.08Å
46	Q	84.4	Confident	89.8	Confident	168 Å²	168	64.8 Å²	64.8	79%	0.785	31%	0.313	S	S	*	.	H	α-helix	trans	-53.9	-34.4	178.3	-76	-175	-3.5	0	0	112.9	M48 A49	Q46-M48 PolarHBondContact O-N 2.83Å; Q46-A49 PolarHBondContact O-N 3.12Å
47	V	86.1	Confident	89.9	Confident	93 Å²	93	62.5 Å²	62.5	56%	0.564	31%	0.305	S	S	*	.	H	α-helix	trans	-65.3	-24.1	178.2	-62.9	0	0	0	0	113.3	P45 K50	P45-V47 HydrophobicContact CB-CG2 3.89Å; P45-V47 PolarHBondContact O-N 3.14Å; P45-V47 VanDerWaalsContact O-N 3.08Å; V47-K50 WeakPolarHBondContact O-CD 3.42Å; V47-K50 WeakPolarHBondContact O-CE 3.05Å; V47-K50 WeakPolarHBondContact O-CG 3.28Å
48	M	88.1	Confident	89.8	Confident	45 Å²	45	59.8 Å²	59.8	22%	0.222	30%	0.295	C	S	.	.	H	α-helix	trans	-95.3	-29.3	178.5	-65.7	171.5	70.7	0	0	112.4	I26 L44 P45 Q46 K50 Y51 L66	I26-M48 HydrophobicContact CD1-CE 4.07Å; I26-M48 HydrophobicContact CG1-CE 4.41Å; I26-M48 HydrophobicContact CG1-SD 4.41Å; L44-M48 HydrophobicContact CB-CB 4.43Å; L44-M48 HydrophobicContact CD2-CE 4.49Å; P45-M48 HydrophobicContact CB-CG 4.42Å; P45-M48 HydrophobicContact CB-SD 4.28Å; P45-M48 HydrophobicContact CG-SD 3.78Å; P45-M48 PolarHBondContact O-N 2.8Å; Q46-M48 PolarHBondContact O-N 2.83Å; M48-K50 PolarHBondContact O-N 2.9Å; M48-Y51 WeakPolarHBondContact O-CB 3.14Å; M48-Y51 WeakPolarHBondContact O-CD2 3.39Å; M48-Y51 PolarHBondContact O-N 2.86Å; M48-L66 WeakPolarHBondContact CE-O 3.48Å
49	A	86.7	Confident	89.9	Confident	14 Å²	14	61 Å²	61	12%	0.116	31%	0.306	C	S	.	.	H	α-helix	trans	-55.5	-27.2	-178.9	0	0	0	0	0	113.9	P45 Q46 Y51 V52 H85	P45-A49 PolarHBondContact O-N 2.86Å; P45-A49 VanDerWaalsContact O-N 3.08Å; Q46-A49 PolarHBondContact O-N 3.12Å; A49-Y51 PolarHBondContact O-N 2.8Å; A49-V52 WeakPolarHBondContact O-CB 3.35Å; A49-V52 PolarHBondContact O-N 3.06Å; A49-H85 HydrophobicContact CB-CB 3.47Å; A49-H85 VanDerWaalsContact CB-CB 3.47Å
50	K	87.5	Confident	89.9	Confident	147 Å²	147	63.3 Å²	63.3	64%	0.639	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.9	175.6	70.2	-172.7	-175.3	-179.9	0	114.3	V47 M48	V47-K50 WeakPolarHBondContact O-CD 3.42Å; V47-K50 WeakPolarHBondContact O-CE 3.05Å; V47-K50 WeakPolarHBondContact O-CG 3.28Å; M48-K50 PolarHBondContact O-N 2.9Å
51	Y	89.2	Confident	89.9	Confident	147 Å²	147	65.8 Å²	65.8	58%	0.576	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-7.3	178.2	-55.8	-65	0	0	0	112.7	M48 A49 P53	M48-Y51 WeakPolarHBondContact O-CB 3.14Å; M48-Y51 WeakPolarHBondContact O-CD2 3.39Å; M48-Y51 PolarHBondContact O-N 2.86Å; A49-Y51 PolarHBondContact O-N 2.8Å; Y51-P53 WeakPolarHBondContact O-CD 3.4Å
52	V	88.8	Confident	89.9	Confident	13 Å²	13	67.2 Å²	67.2	8%	0.079	34%	0.342	C	S	.	.	S	Bend	trans	-73.8	121.7	176.6	-178.1	0	0	0	0	108.5	L44 A49 L66 L87	L44-V52 HydrophobicContact CD1-CG2 3.45Å; L44-V52 VanDerWaalsContact CD1-CG2 3.45Å; A49-V52 WeakPolarHBondContact O-CB 3.35Å; A49-V52 PolarHBondContact O-N 3.06Å; V52-L66 HydrophobicContact CG2-CD1 4.01Å; V52-L87 HydrophobicContact CG1-CD2 3.88Å; V52-L87 HydrophobicContact CG2-CD2 4.33Å
53	P	88	Confident	90	Very high	34 Å²	34	67.2 Å²	67.2	22%	0.221	34%	0.342	C	S	.	.			trans	-66.2	137	175.7	27.5	-33	0	0	0	110.2	Y51 H56 I58	Y51-P53 WeakPolarHBondContact O-CD 3.4Å; P53-H56 VanDerWaalsContact CB-CE1 3.47Å; P53-H56 WeakPolarHBondContact CB-CE1 3.27Å; P53-I58 HydrophobicContact CG-CG2 3.4Å; P53-I58 VanDerWaalsContact CG-CG2 3.4Å
54	K	85.9	Confident	90.1	Very high	162 Å²	162	71.1 Å²	71.1	70%	0.704	36%	0.356	S	S	*	.	S	Bend	trans	-95.4	-12.5	177.9	-60.2	-178.1	-177.7	-178.3	0	113.1
55	S	86.9	Confident	90.2	Very high	107 Å²	107	78.6 Å²	78.6	75%	0.748	39%	0.39	S	S	*	.	S	Bend	trans	-84.2	-21.7	-173.4	53.7	0	0	0	0	113.8
56	H	89.9	Confident	90.2	Very high	78 Å²	78	79.4 Å²	79.4	36%	0.361	39%	0.394	S	S	.	.	S	Bend	trans	-155.2	163.5	-174	62.5	-76.5	0	0	0	111.4	P53 E62 I79	P53-H56 VanDerWaalsContact CB-CE1 3.47Å; P53-H56 WeakPolarHBondContact CB-CE1 3.27Å; H56-E62 IonicContact NE2-OE1 3.19Å; H56-E62 PolarHBondContact NE2-OE1 2.94Å; H56-E62 IonicContact NE2-OE2 3.83Å; H56-I79 WeakPolarHBondContact O-CD1 3.42Å
57	L	92.7	Very high	90.6	Very high	82 Å²	82	73 Å²	73	43%	0.429	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-73.3	133	171.9	-64.5	167.3	0	0	0	109.4	Q76 I79	L57-Q76 HydrophobicContact CD2-CB 4.43Å; L57-Q76 HydrophobicContact CD2-CG 3.9Å; L57-I79 HydrophobicContact CD2-CG1 3.79Å
58	I	92.7	Very high	90.9	Very high	7 Å²	7	68.7 Å²	68.7	4%	0.036	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-72.4	133.6	179.8	68.2	-154.9	0	0	0	111.3	P53 E62 W63 Q76 L87	P53-I58 HydrophobicContact CG-CG2 3.4Å; P53-I58 VanDerWaalsContact CG-CG2 3.4Å; I58-E62 WeakPolarHBondContact CA-OE2 3.16Å; I58-E62 HydrophobicContact CB-CB 3.97Å; I58-E62 HydrophobicContact CG2-CB 4.44Å; I58-W63 HydrophobicContact CD1-CB 3.7Å; I58-W63 HydrophobicContact CG1-CB 3.89Å; I58-W63 HydrophobicContact CG1-CG 4.36Å; I58-Q76 HydrophobicContact CG1-CB 4.07Å; I58-Q76 HydrophobicContact CG1-CG 4.48Å; I58-L87 HydrophobicContact CD1-CD1 3.74Å; I58-L87 HydrophobicContact CD1-CD2 3.68Å; I58-L87 HydrophobicContact CD1-CG 4.26Å
59	S	94.1	Very high	91.2	Very high	56 Å²	56	73.7 Å²	73.7	39%	0.392	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-73	169.6	172	62.1	0	0	0	0	112.2	D61 E62 W63	S59-D61 VanDerWaalsContact C-N 3.32Å; S59-D61 PolarHBondContact O-N 3.32Å; S59-E62 WeakPolarHBondContact CB-OE2 3.38Å; S59-E62 PolarHBondContact N-OE2 2.74Å; S59-E62 PolarHBondContact O-N 3.29Å; S59-E62 WeakPolarHBondContact OG-CG 3.32Å; S59-E62 PolarHBondContact OG-OE2 3.04Å; S59-W63 PolarHBondContact O-N 2.84Å; S59-W63 VanDerWaalsContact O-N 3.13Å
60	E	94	Very high	91.5	Very high	66 Å²	66	74 Å²	74	31%	0.308	37%	0.369	S	S	.	.	H	α-helix	trans	-54.9	-45.3	177.3	176.5	156.3	-176.8	0	0	113.2	E62 W63 R64	E60-E62 VanDerWaalsContact C-N 3.34Å; E60-E62 PolarHBondContact O-N 2.76Å; E60-W63 VanDerWaalsContact CA-NE1 3.3Å; E60-W63 HydrophobicContact CB-CZ2 3.99Å; E60-W63 HydrophobicContact CG-CH2 3.99Å; E60-W63 HydrophobicContact CG-CZ2 3.47Å; E60-W63 VanDerWaalsContact CG-CZ2 3.47Å; E60-R64 HydrophobicContact CG-CG 4.46Å; E60-R64 WeakPolarHBondContact O-CB 3.44Å; E60-R64 WeakPolarHBondContact O-CG 3.45Å; E60-R64 PolarHBondContact O-N 2.95Å; E60-R64 VanDerWaalsContact O-N 3.11Å; E60-R64 IonicContact OE1-CZ 3.26Å; E60-R64 VanDerWaalsContact OE1-CZ 3.26Å; E60-R64 IonicContact OE1-NE 2.91Å; E60-R64 PolarHBondContact OE1-NE 3.2Å; E60-R64 IonicContact OE1-NH2 2.75Å; E60-R64 PolarHBondContact OE1-NH2 3.21Å
61	D	93.3	Very high	91.7	Very high	111 Å²	111	69.8 Å²	69.8	59%	0.594	36%	0.358	S	S	*	.	H	α-helix	trans	-63.8	-39	177.8	-69.1	-78.5	0	0	0	112.6	S59 R64 Q65	S59-D61 VanDerWaalsContact C-N 3.32Å; S59-D61 PolarHBondContact O-N 3.32Å; D61-R64 PolarHBondContact O-N 3.06Å; D61-Q65 WeakPolarHBondContact O-CB 3.3Å; D61-Q65 VanDerWaalsContact O-CG 3.23Å; D61-Q65 WeakPolarHBondContact O-CG 3.48Å; D61-Q65 PolarHBondContact O-N 2.73Å
62	E	93.8	Very high	91.8	Very high	59 Å²	59	72.9 Å²	72.9	28%	0.276	37%	0.369	S	S	.	.	H	α-helix	trans	-68.6	-47.5	-177.8	-72.9	173	120.7	0	0	112.4	H56 I58 S59 E60 R64 Q65 L66	H56-E62 IonicContact NE2-OE1 3.19Å; H56-E62 PolarHBondContact NE2-OE1 2.94Å; H56-E62 IonicContact NE2-OE2 3.83Å; I58-E62 WeakPolarHBondContact CA-OE2 3.16Å; I58-E62 HydrophobicContact CB-CB 3.97Å; I58-E62 HydrophobicContact CG2-CB 4.44Å; S59-E62 WeakPolarHBondContact CB-OE2 3.38Å; S59-E62 PolarHBondContact N-OE2 2.74Å; S59-E62 PolarHBondContact O-N 3.29Å; S59-E62 WeakPolarHBondContact OG-CG 3.32Å; S59-E62 PolarHBondContact OG-OE2 3.04Å; E60-E62 VanDerWaalsContact C-N 3.34Å; E60-E62 PolarHBondContact O-N 2.76Å; E62-R64 VanDerWaalsContact C-N 3.28Å; E62-R64 PolarHBondContact O-N 2.8Å; E62-Q65 PolarHBondContact O-N 3.04Å; E62-L66 WeakPolarHBondContact O-CG 3.49Å; E62-L66 PolarHBondContact O-N 2.8Å
63	W	93.6	Very high	92	Very high	1 Å²	1	73.9 Å²	73.9	0%	0.004	38%	0.382	C	S	.	.	H	α-helix	trans	-69	-29.2	176.8	60.1	-108.7	0	0	0	112.4	I58 S59 E60 L66 V68 Q70 F89	I58-W63 HydrophobicContact CD1-CB 3.7Å; I58-W63 HydrophobicContact CG1-CB 3.89Å; I58-W63 HydrophobicContact CG1-CG 4.36Å; S59-W63 PolarHBondContact O-N 2.84Å; S59-W63 VanDerWaalsContact O-N 3.13Å; E60-W63 VanDerWaalsContact CA-NE1 3.3Å; E60-W63 HydrophobicContact CB-CZ2 3.99Å; E60-W63 HydrophobicContact CG-CH2 3.99Å; E60-W63 HydrophobicContact CG-CZ2 3.47Å; E60-W63 VanDerWaalsContact CG-CZ2 3.47Å; W63-L66 PolarHBondContact O-N 2.62Å; W63-V68 HydrophobicContact CB-CB 4.4Å; W63-V68 HydrophobicContact CE3-CB 3.91Å; W63-V68 HydrophobicContact CE3-CG1 3.94Å; W63-V68 WeakPolarHBondContact CZ3-O 3.27Å; W63-V68 VanDerWaalsContact O-CB 3.29Å; W63-V68 WeakPolarHBondContact O-CB 3.37Å; W63-V68 PolarHBondContact O-N 3.28Å; W63-V68 VanDerWaalsContact O-N 3.1Å; W63-Q70 VanDerWaalsContact CE2-NE2 3.3Å; W63-Q70 HydrophobicContact CE3-CG 4.18Å; W63-Q70 HydrophobicContact CH2-CG 3.22Å; W63-Q70 HydrophobicContact CZ2-CG 3.85Å; W63-Q70 HydrophobicContact CZ3-CG 3.4Å; W63-F89 HydrophobicContact CB-CE1 4.38Å; W63-F89 HydrophobicContact CB-CZ 4.03Å; W63-F89 AromaticContact CD1-CE1 3.5Å; W63-F89 HydrophobicContact CD2-CE1 4.24Å; W63-F89 HydrophobicContact CD2-CZ 4.34Å; W63-F89 AromaticContact CG-CE1 3.83Å; W63-F89 HydrophobicContact CG-CE1 3.83Å; W63-F89 AromaticContact CG-CZ 3.89Å; W63-F89 HydrophobicContact CG-CZ 3.89Å; W63-F89 AromaticContact NE1-CE1 3.63Å
64	R	94	Very high	92.4	Very high	94 Å²	94	72.6 Å²	72.6	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-65.8	-39.9	171.5	-75.6	-177.9	-179.5	-67.9	-3.7	111.9	E60 D61 E62 L66 G67 Q70	E60-R64 HydrophobicContact CG-CG 4.46Å; E60-R64 WeakPolarHBondContact O-CB 3.44Å; E60-R64 WeakPolarHBondContact O-CG 3.45Å; E60-R64 PolarHBondContact O-N 2.95Å; E60-R64 VanDerWaalsContact O-N 3.11Å; E60-R64 IonicContact OE1-CZ 3.26Å; E60-R64 VanDerWaalsContact OE1-CZ 3.26Å; E60-R64 IonicContact OE1-NE 2.91Å; E60-R64 PolarHBondContact OE1-NE 3.2Å; E60-R64 IonicContact OE1-NH2 2.75Å; E60-R64 PolarHBondContact OE1-NH2 3.21Å; D61-R64 PolarHBondContact O-N 3.06Å; E62-R64 VanDerWaalsContact C-N 3.28Å; E62-R64 PolarHBondContact O-N 2.8Å; R64-L66 VanDerWaalsContact C-N 3.28Å; R64-L66 PolarHBondContact O-N 2.64Å; R64-G67 WeakPolarHBondContact O-CA 3.25Å; R64-G67 PolarHBondContact O-N 2.72Å; R64-Q70 PolarHBondContact NH2-O 3.01Å; R64-Q70 VanDerWaalsContact NH2-O 3.12Å
65	Q	93.5	Very high	92.8	Very high	158 Å²	158	69.4 Å²	69.4	74%	0.738	36%	0.362	S	S	*	.	H	α-helix	trans	-65.4	-31.6	175	-75.3	172.6	42.3	0	0	112.5	D61 E62 G67	D61-Q65 WeakPolarHBondContact O-CB 3.3Å; D61-Q65 VanDerWaalsContact O-CG 3.23Å; D61-Q65 WeakPolarHBondContact O-CG 3.48Å; D61-Q65 PolarHBondContact O-N 2.73Å; E62-Q65 PolarHBondContact O-N 3.04Å; Q65-G67 PolarHBondContact O-N 3.13Å
66	L	91.1	Very high	93.2	Very high	26 Å²	26	64.6 Å²	64.6	14%	0.136	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-2.4	169.5	-66.4	173.5	0	0	0	113	M48 V52 E62 W63 R64 V68	M48-L66 WeakPolarHBondContact CE-O 3.48Å; V52-L66 HydrophobicContact CG2-CD1 4.01Å; E62-L66 WeakPolarHBondContact O-CG 3.49Å; E62-L66 PolarHBondContact O-N 2.8Å; W63-L66 PolarHBondContact O-N 2.62Å; R64-L66 VanDerWaalsContact C-N 3.28Å; R64-L66 PolarHBondContact O-N 2.64Å; L66-V68 VanDerWaalsContact C-N 3.35Å
67	G	91.9	Very high	93.3	Very high	34 Å²	34	63.6 Å²	63.6	35%	0.351	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	7.4	179.9	0	0	0	0	0	114.3	I26 R64 Q65 Q69	I26-G67 VanDerWaalsContact CD1-O 3.28Å; I26-G67 WeakPolarHBondContact CD1-O 3.38Å; R64-G67 WeakPolarHBondContact O-CA 3.25Å; R64-G67 PolarHBondContact O-N 2.72Å; Q65-G67 PolarHBondContact O-N 3.13Å; G67-Q69 PolarHBondContact O-N 2.87Å
68	V	93.4	Very high	93.2	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.006	32%	0.316	C	S	.	.			trans	-69.8	128.1	170.8	179.3	0	0	0	0	108.7	Y28 V42 L44 W63 L66 L87 F89	Y28-V68 HydrophobicContact CE1-CG1 4.06Å; V42-V68 HydrophobicContact CG1-CG1 4.17Å; V42-V68 HydrophobicContact CG1-CG2 4.17Å; V42-V68 HydrophobicContact CG2-CG1 4.25Å; L44-V68 HydrophobicContact CD2-CG2 3.73Å; W63-V68 HydrophobicContact CB-CB 4.4Å; W63-V68 HydrophobicContact CE3-CB 3.91Å; W63-V68 HydrophobicContact CE3-CG1 3.94Å; W63-V68 WeakPolarHBondContact CZ3-O 3.27Å; W63-V68 VanDerWaalsContact O-CB 3.29Å; W63-V68 WeakPolarHBondContact O-CB 3.37Å; W63-V68 PolarHBondContact O-N 3.28Å; W63-V68 VanDerWaalsContact O-N 3.1Å; L66-V68 VanDerWaalsContact C-N 3.35Å; V68-L87 HydrophobicContact CG2-CD1 4.02Å; V68-F89 HydrophobicContact CG1-CE2 4.35Å; V68-F89 HydrophobicContact CG1-CZ 4.46Å
69	Q	94.2	Very high	93	Very high	151 Å²	151	64.9 Å²	64.9	71%	0.706	33%	0.327	S	S	*	.			trans	-117.9	115.8	-178.5	-65.4	-177.7	-3.3	0	0	110.1	Y28 G67	Y28-Q69 VanDerWaalsContact CE1-O 3.27Å; Y28-Q69 WeakPolarHBondContact CE1-O 3.43Å; Y28-Q69 PolarHBondContact OH-N 3.24Å; G67-Q69 PolarHBondContact O-N 2.87Å
70	Q	92.7	Very high	92.6	Very high	19 Å²	19	63 Å²	63	9%	0.089	31%	0.312	C	S	.	.			trans	-149	167.4	175.2	58.5	-165.7	17.7	0	0	110.3	W63 R64 W74	W63-Q70 VanDerWaalsContact CE2-NE2 3.3Å; W63-Q70 HydrophobicContact CE3-CG 4.18Å; W63-Q70 HydrophobicContact CH2-CG 3.22Å; W63-Q70 HydrophobicContact CZ2-CG 3.85Å; W63-Q70 HydrophobicContact CZ3-CG 3.4Å; R64-Q70 PolarHBondContact NH2-O 3.01Å; R64-Q70 VanDerWaalsContact NH2-O 3.12Å; Q70-W74 HydrophobicContact CG-CB 4.14Å; Q70-W74 HydrophobicContact CG-CG 4.11Å
71	S	92.9	Very high	91.9	Very high	60 Å²	60	68.1 Å²	68.1	42%	0.42	34%	0.336	S	S	.	.			trans	-61	171.1	174.1	52.3	0	0	0	0	111.5	W74 R91	S71-W74 PolarHBondContact OG-NE1 2.98Å; S71-R91 PolarHBondContact OG-NH1 3.27Å
72	R	91	Very high	91.5	Very high	212 Å²	212	67.4 Å²	67.4	80%	0.8	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	153.6	177.6	-65.6	-177.2	180	-176.1	-1.1	111.5
73	G	92.7	Very high	91.2	Very high	33 Å²	33	66.2 Å²	66.2	34%	0.34	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	3.3	171.3	0	0	0	0	0	115.8	R91	G73-R91 WeakPolarHBondContact O-CG 3.46Å
74	W	95.9	Very high	90.8	Very high	7 Å²	7	68 Å²	68	3%	0.027	34%	0.343	C	S	.	.			trans	-80	131	171.3	-72.9	100	0	0	0	111	V31 E38 R40 Q70 S71 F89 R91	V31-W74 HydrophobicContact CG1-CH2 4.22Å; V31-W74 HydrophobicContact CG2-CH2 4.33Å; V31-W74 HydrophobicContact CG2-CZ2 4.34Å; E38-W74 HydrophobicContact CB-CH2 4.05Å; E38-W74 HydrophobicContact CB-CZ3 4.48Å; R40-W74 HydrophobicContact CB-CH2 3.76Å; R40-W74 HydrophobicContact CB-CZ2 4.48Å; R40-W74 HydrophobicContact CB-CZ3 3.88Å; Q70-W74 HydrophobicContact CG-CB 4.14Å; Q70-W74 HydrophobicContact CG-CG 4.11Å; S71-W74 PolarHBondContact OG-NE1 2.98Å; W74-F89 HydrophobicContact CB-CB 4.42Å; W74-F89 HydrophobicContact CB-CD1 4.36Å; W74-F89 HydrophobicContact CD2-CB 4.36Å; W74-F89 HydrophobicContact CE3-CB 3.61Å; W74-F89 HydrophobicContact CZ3-CB 4.26Å; W74-R91 HydrophobicContact CD2-CB 3.94Å; W74-R91 HydrophobicContact CE3-CB 3.83Å; W74-R91 HydrophobicContact CG-CB 4.41Å; W74-R91 HydrophobicContact CZ3-CB 4.17Å
75	I	94.7	Very high	90.6	Very high	95 Å²	95	65 Å²	65	49%	0.487	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.9	-174.8	-59.5	165.4	0	0	0	108.4	Y77 F89 R90	I75-Y77 PolarHBondContact O-N 3.34Å; I75-F89 CarbonylContact O-C 3.54Å; I75-F89 WeakPolarHBondContact O-CA 3.36Å; I75-R90 PolarHBondContact N-O 3.13Å; I75-R90 PolarHBondContact O-N 3.47Å
76	Q	94.9	Very high	90.5	Very high	7 Å²	7	57.6 Å²	57.6	3%	0.033	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	121.6	170	-168.6	-169.6	20.8	0	0	108.3	L57 I58 M78 L88 F89	L57-Q76 HydrophobicContact CD2-CB 4.43Å; L57-Q76 HydrophobicContact CD2-CG 3.9Å; I58-Q76 HydrophobicContact CG1-CB 4.07Å; I58-Q76 HydrophobicContact CG1-CG 4.48Å; Q76-M78 PolarHBondContact NE2-O 2.93Å; Q76-L88 VanDerWaalsContact CA-O 3.31Å; Q76-L88 WeakPolarHBondContact CA-O 3.15Å; Q76-L88 WeakPolarHBondContact CG-O 3.35Å; Q76-F89 HydrophobicContact CB-CD1 4.25Å; Q76-F89 HydrophobicContact CB-CE1 4.09Å
77	Y	92.8	Very high	90.6	Very high	56 Å²	56	56.4 Å²	56.4	22%	0.22	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-14.5	-175.6	76.7	-85.6	0	0	0	113.8	Y39 I75 L88 R90	Y39-Y77 HydrophobicContact CD1-CE1 4.02Å; Y39-Y77 HydrophobicContact CE1-CE1 4.48Å; I75-Y77 PolarHBondContact O-N 3.34Å; Y77-L88 HydrophobicContact CD1-CB 4.2Å; Y77-L88 WeakPolarHBondContact CD1-O 3.45Å; Y77-L88 HydrophobicContact CE1-CB 3.64Å; Y77-L88 PolarHBondContact N-O 3.28Å; Y77-L88 VanDerWaalsContact N-O 3.14Å; Y77-R90 HydrophobicContact CD1-CB 3.87Å; Y77-R90 HydrophobicContact CD1-CG 4.08Å; Y77-R90 HydrophobicContact CE1-CB 4.44Å; Y77-R90 HydrophobicContact CG-CB 4.4Å; Y77-R90 HydrophobicContact CG-CG 4.18Å
78	M	90.1	Very high	90.7	Very high	67 Å²	67	55 Å²	55	33%	0.33	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	144.7	-178.7	-172.5	178.5	-70.9	0	0	111.1	Y7 Q76 L88	Y7-M78 PolarHBondContact OH-SD 3.48Å; Q76-M78 PolarHBondContact NE2-O 2.93Å; M78-L88 HydrophobicContact CB-CD1 4.13Å; M78-L88 HydrophobicContact CG-CD1 4.4Å; M78-L88 HydrophobicContact SD-CD1 4.35Å
79	I	88.8	Confident	90.8	Very high	50 Å²	50	55 Å²	55	26%	0.256	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	127.8	167.3	-57.6	173	0	0	0	107.5	H56 L57	H56-I79 WeakPolarHBondContact O-CD1 3.42Å; L57-I79 HydrophobicContact CD2-CG1 3.79Å
80	H	85.1	Confident	90.8	Very high	16 Å²	16	52 Å²	52	7%	0.074	26%	0.259	C	S	.	.			trans	-96.3	91.7	174.2	-174.6	43.3	0	0	0	109.5	P82 E83 L88	H80-P82 VanDerWaalsContact C-CD 3.49Å; H80-E83 IonicContact CD2-OE2 2.87Å; H80-E83 IonicContact CE1-OE2 3.58Å; H80-E83 IonicContact NE2-OE2 2.64Å; H80-E83 PolarHBondContact NE2-OE2 3.08Å; H80-E83 CarbonylContact O-C 3.19Å; H80-E83 PolarHBondContact O-N 3.41Å; H80-E83 VanDerWaalsContact O-N 3.15Å; H80-L88 HydrophobicContact CB-CD1 4.34Å
81	E	79.6	Confident	91	Very high	173 Å²	173	54.5 Å²	54.5	81%	0.808	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-40.9	-172.7	-63.7	-178.2	111.8	0	0	114.8	E83	E81-E83 VanDerWaalsContact C-N 3.29Å; E81-E83 PolarHBondContact O-N 3.36Å
82	P	86	Confident	91	Very high	97 Å²	97	55 Å²	55	63%	0.63	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-31.3	178.3	-23.8	35.5	0	0	0	113.7	H80	H80-P82 VanDerWaalsContact C-CD 3.49Å
83	E	86.1	Confident	91	Very high	34 Å²	34	47.4 Å²	47.4	16%	0.159	24%	0.244	C	C	.	.			trans	-133.9	76.4	-175.4	-59.5	169	99.3	0	0	109.9	L14 H80 E81 H85 I86	L14-E83 WeakPolarHBondContact CD1-OE1 3.42Å; H80-E83 IonicContact CD2-OE2 2.87Å; H80-E83 IonicContact CE1-OE2 3.58Å; H80-E83 IonicContact NE2-OE2 2.64Å; H80-E83 PolarHBondContact NE2-OE2 3.08Å; H80-E83 CarbonylContact O-C 3.19Å; H80-E83 PolarHBondContact O-N 3.41Å; H80-E83 VanDerWaalsContact O-N 3.15Å; E81-E83 VanDerWaalsContact C-N 3.29Å; E81-E83 PolarHBondContact O-N 3.36Å; E83-H85 PolarHBondContact O-N 3.36Å; E83-I86 HydrophobicContact CB-CD1 3.66Å; E83-I86 HydrophobicContact CB-CG1 4.01Å; E83-I86 HydrophobicContact CG-CD1 4.39Å; E83-I86 WeakPolarHBondContact O-CB 3.17Å; E83-I86 PolarHBondContact O-N 3.21Å
84	P	86.6	Confident	90.5	Very high	37 Å²	37	51.1 Å²	51.1	24%	0.24	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-11.7	-172.7	28.5	-37.2	0	0	0	113.7	I86	P84-I86 PolarHBondContact O-N 3.49Å
85	H	88.8	Confident	89.1	Confident	32 Å²	32	61.9 Å²	61.9	15%	0.148	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-2.8	173.8	65	-78.3	0	0	0	112.3	V43 L44 A49 E83	V43-H85 WeakPolarHBondContact CA-O 3.4Å; L44-H85 PolarHBondContact N-O 2.91Å; A49-H85 HydrophobicContact CB-CB 3.47Å; A49-H85 VanDerWaalsContact CB-CB 3.47Å; E83-H85 PolarHBondContact O-N 3.36Å
86	I	91.4	Very high	87.4	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.3	-177.8	-51.5	-176.5	0	0	0	109	L14 H41 V42 V43 E83 P84 L88	L14-I86 HydrophobicContact CD1-CD1 3.08Å; L14-I86 HydrophobicContact CD2-CD1 3.5Å; L14-I86 VanDerWaalsContact CD2-CD1 3.5Å; L14-I86 HydrophobicContact CD2-CG1 4.38Å; L14-I86 HydrophobicContact CG-CD1 3.89Å; H41-I86 HydrophobicContact CB-CG2 4.18Å; V42-I86 WeakPolarHBondContact O-CA 3.44Å; V43-I86 HydrophobicContact CG2-CG1 4.45Å; E83-I86 HydrophobicContact CB-CD1 3.66Å; E83-I86 HydrophobicContact CB-CG1 4.01Å; E83-I86 HydrophobicContact CG-CD1 4.39Å; E83-I86 WeakPolarHBondContact O-CB 3.17Å; E83-I86 PolarHBondContact O-N 3.21Å; P84-I86 PolarHBondContact O-N 3.49Å; I86-L88 HydrophobicContact CG2-CD2 4.09Å
87	L	92.9	Very high	87	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	123.4	177.9	-58.3	-179.6	0	0	0	109.2	H41 V42 L44 V52 I58 V68 F89	H41-L87 CarbonylContact C-O 3.41Å; H41-L87 VanDerWaalsContact CA-O 3.27Å; H41-L87 WeakPolarHBondContact CA-O 3.36Å; V42-L87 HydrophobicContact CB-CB 4.37Å; V42-L87 PolarHBondContact N-O 2.97Å; V42-L87 PolarHBondContact O-N 3.36Å; L44-L87 HydrophobicContact CD1-CD1 3.83Å; L44-L87 HydrophobicContact CD1-CG 4.19Å; L44-L87 HydrophobicContact CD2-CD1 4.42Å; L44-L87 HydrophobicContact CG-CD1 4.12Å; L44-L87 HydrophobicContact CG-CG 4.41Å; V52-L87 HydrophobicContact CG1-CD2 3.88Å; V52-L87 HydrophobicContact CG2-CD2 4.33Å; I58-L87 HydrophobicContact CD1-CD1 3.74Å; I58-L87 HydrophobicContact CD1-CD2 3.68Å; I58-L87 HydrophobicContact CD1-CG 4.26Å; V68-L87 HydrophobicContact CG2-CD1 4.02Å; L87-F89 HydrophobicContact CB-CD2 4.22Å; L87-F89 HydrophobicContact CB-CE2 3.46Å; L87-F89 VanDerWaalsContact CB-CE2 3.46Å; L87-F89 HydrophobicContact CB-CZ 3.9Å; L87-F89 HydrophobicContact CD1-CE2 4.19Å; L87-F89 HydrophobicContact CD1-CZ 4.08Å; L87-F89 HydrophobicContact CG-CE2 4.5Å
88	L	93.7	Very high	86.7	Confident	6 Å²	6	73.3 Å²	73.3	3%	0.031	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	113.5	-178.7	-59.5	177.5	0	0	0	109.8	H41 Q76 Y77 M78 H80 I86	H41-L88 HydrophobicContact CB-CD2 3.74Å; Q76-L88 VanDerWaalsContact CA-O 3.31Å; Q76-L88 WeakPolarHBondContact CA-O 3.15Å; Q76-L88 WeakPolarHBondContact CG-O 3.35Å; Y77-L88 HydrophobicContact CD1-CB 4.2Å; Y77-L88 WeakPolarHBondContact CD1-O 3.45Å; Y77-L88 HydrophobicContact CE1-CB 3.64Å; Y77-L88 PolarHBondContact N-O 3.28Å; Y77-L88 VanDerWaalsContact N-O 3.14Å; M78-L88 HydrophobicContact CB-CD1 4.13Å; M78-L88 HydrophobicContact CG-CD1 4.4Å; M78-L88 HydrophobicContact SD-CD1 4.35Å; H80-L88 HydrophobicContact CB-CD1 4.34Å; I86-L88 HydrophobicContact CG2-CD2 4.09Å
89	F	95.9	Very high	86.5	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	147.5	-179	-64.8	-79	0	0	0	111.6	Y39 R40 V42 W63 V68 W74 I75 Q76 L87	Y39-F89 WeakPolarHBondContact CA-O 3.17Å; R40-F89 PolarHBondContact N-O 3.26Å; R40-F89 VanDerWaalsContact N-O 3.12Å; R40-F89 PolarHBondContact O-N 3.18Å; V42-F89 HydrophobicContact CB-CD2 4.4Å; V42-F89 HydrophobicContact CB-CE2 4.03Å; V42-F89 HydrophobicContact CG2-CD2 3.87Å; V42-F89 HydrophobicContact CG2-CE2 3.79Å; W63-F89 HydrophobicContact CB-CE1 4.38Å; W63-F89 HydrophobicContact CB-CZ 4.03Å; W63-F89 AromaticContact CD1-CE1 3.5Å; W63-F89 HydrophobicContact CD2-CE1 4.24Å; W63-F89 HydrophobicContact CD2-CZ 4.34Å; W63-F89 AromaticContact CG-CE1 3.83Å; W63-F89 HydrophobicContact CG-CE1 3.83Å; W63-F89 AromaticContact CG-CZ 3.89Å; W63-F89 HydrophobicContact CG-CZ 3.89Å; W63-F89 AromaticContact NE1-CE1 3.63Å; V68-F89 HydrophobicContact CG1-CE2 4.35Å; V68-F89 HydrophobicContact CG1-CZ 4.46Å; W74-F89 HydrophobicContact CB-CB 4.42Å; W74-F89 HydrophobicContact CB-CD1 4.36Å; W74-F89 HydrophobicContact CD2-CB 4.36Å; W74-F89 HydrophobicContact CE3-CB 3.61Å; W74-F89 HydrophobicContact CZ3-CB 4.26Å; I75-F89 CarbonylContact O-C 3.54Å; I75-F89 WeakPolarHBondContact O-CA 3.36Å; Q76-F89 HydrophobicContact CB-CD1 4.25Å; Q76-F89 HydrophobicContact CB-CE1 4.09Å; L87-F89 HydrophobicContact CB-CD2 4.22Å; L87-F89 HydrophobicContact CB-CE2 3.46Å; L87-F89 VanDerWaalsContact CB-CE2 3.46Å; L87-F89 HydrophobicContact CB-CZ 3.9Å; L87-F89 HydrophobicContact CD1-CE2 4.19Å; L87-F89 HydrophobicContact CD1-CZ 4.08Å; L87-F89 HydrophobicContact CG-CE2 4.5Å
90	R	95.3	Very high	86.4	Confident	89 Å²	89	75 Å²	75	34%	0.336	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154.3	166.4	75.2	-176.6	174.9	178.5	-2.5	111.1	Y37 E38 Y39 I75 Y77	Y37-R90 HydrophobicContact CD1-CB 4.5Å; Y37-R90 HydrophobicContact CD1-CG 4.25Å; E38-R90 CarbonylContact O-C 3.55Å; E38-R90 WeakPolarHBondContact O-CA 3.26Å; Y39-R90 HydrophobicContact CD1-CB 3.64Å; Y39-R90 HydrophobicContact CE1-CB 3.77Å; I75-R90 PolarHBondContact N-O 3.13Å; I75-R90 PolarHBondContact O-N 3.47Å; Y77-R90 HydrophobicContact CD1-CB 3.87Å; Y77-R90 HydrophobicContact CD1-CG 4.08Å; Y77-R90 HydrophobicContact CE1-CB 4.44Å; Y77-R90 HydrophobicContact CG-CB 4.4Å; Y77-R90 HydrophobicContact CG-CG 4.18Å
91	R	95	Very high	86.4	Confident	71 Å²	71	78.7 Å²	78.7	27%	0.268	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	132.2	175.1	178.3	170.1	75.5	155.9	6.6	109	Y37 E38 S71 G73 W74	Y37-R91 CarbonylContact C-O 3.58Å; Y37-R91 VanDerWaalsContact CA-O 3.3Å; Y37-R91 WeakPolarHBondContact CA-O 3.28Å; E38-R91 PolarHBondContact N-O 2.8Å; E38-R91 PolarHBondContact O-N 3.23Å; E38-R91 IonicContact OE1-NH2 3.62Å; E38-R91 IonicContact OE2-CZ 2.8Å; E38-R91 IonicContact OE2-NE 3.15Å; E38-R91 PolarHBondContact OE2-NE 2.87Å; E38-R91 IonicContact OE2-NH2 3.87Å; E38-R91 PolarHBondContact OE2-NH2 2.94Å; S71-R91 PolarHBondContact OG-NH1 3.27Å; G73-R91 WeakPolarHBondContact O-CG 3.46Å; W74-R91 HydrophobicContact CD2-CB 3.94Å; W74-R91 HydrophobicContact CE3-CB 3.83Å; W74-R91 HydrophobicContact CG-CB 4.41Å; W74-R91 HydrophobicContact CZ3-CB 4.17Å
92	P	93.5	Very high	86.9	Confident	71 Å²	71	72.4 Å²	72.4	46%	0.461	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	140.9	176.5	26.1	-33.5	0	0	0	110.5	Y37	Y37-P92 HydrophobicContact CD1-CB 4.25Å; Y37-P92 HydrophobicContact CE1-CB 4.17Å
93	L	91.1	Very high	87	Confident	51 Å²	51	70.6 Å²	70.6	27%	0.267	34%	0.339	S	S	.	.			trans	-66.7	133.5	171.7	-71.7	169.1	0	0	0	109.5	D34 Q36 E38 R95	D34-L93 VanDerWaalsContact O-CD1 3.26Å; D34-L93 WeakPolarHBondContact O-CD1 3.44Å; Q36-L93 PolarHBondContact O-N 3.05Å; E38-L93 HydrophobicContact CG-CD2 3.46Å; E38-L93 VanDerWaalsContact CG-CD2 3.46Å; E38-L93 HydrophobicContact CG-CG 4.3Å; L93-R95 PolarHBondContact O-N 3.02Å
94	S	82.4	Confident	87	Confident	111 Å²	111	73.5 Å²	73.5	78%	0.776	35%	0.353	S	S	*	.			trans	-65.9	99.9	165	-95	0	0	0	0	107.8	H96	S94-H96 PolarHBondContact O-N 2.94Å
95	R	67.1	Low	87.1	Confident	233 Å²	233	76.5 Å²	76.5	88%	0.879	36%	0.362	S	S	*	.			trans	-72	111.8	166.9	-71	-168.8	-79.1	-172.6	-3.7	107.4	L93	L93-R95 PolarHBondContact O-N 3.02Å
96	H	57.8	Low	86.9	Confident	251 Å²	251	80.5 Å²	80.5	100%	1.162	38%	0.381	S	S	*	.			trans	-77.6	0	164	-79.9	-69.2	0	0	0	110.1	S94	S94-H96 PolarHBondContact O-N 2.94Å

Retrieved 96 of 96 residues in 737.2 ms (Link to these results)

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