A0A077ZHL3_TRITR Loading...

LIM domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZHL3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 122 aa.

						>A0A077ZHL3_TRITR|A0A077ZHL3
MAEAASLKCSVCCQRPTTSAKFALGRFWCQNHFCCNLCNTALTNVYHTFAEKAYCNGCFRNVVPKCKSCGKPLTEGKEYRKATDEAYWHLECFLCSKCNKQVNVSKFALANNKLICAECAQN
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.9	Very low	69	Low	231 Å²	231	94.6 Å²	94.6	100%	1.138	57%	0.569	S	S	*	*				0	98.8	0	-59	-58.6	-137.6	0	0	107.1	E3	M1-E3 PolarHBondContact O-N 3.4Å; M1-E3 VanDerWaalsContact O-N 3.08Å
2	A	57.5	Low	70.7	Confident	102 Å²	102	90.1 Å²	90.1	84%	0.843	54%	0.544	S	S	*	.			trans	-76.9	98.5	-174.5	0	0	0	0	0	110.4	A4	A2-A4 PolarHBondContact O-N 3.35Å
3	E	53.9	Low	71.6	Confident	157 Å²	157	89.8 Å²	89.8	73%	0.734	55%	0.547	S	S	*	.			trans	40.7	67.8	135.9	-52.4	-59.3	87.1	0	0	116.3	M1 A5	M1-E3 PolarHBondContact O-N 3.4Å; M1-E3 VanDerWaalsContact O-N 3.08Å; E3-A5 HydrophobicContact CB-CB 4.45Å; E3-A5 PolarHBondContact O-N 2.82Å
4	A	56	Low	72.5	Confident	70 Å²	70	92.3 Å²	92.3	58%	0.579	55%	0.549	S	S	*	.			trans	-74.8	27.1	160.7	0	0	0	0	0	112	A2 S6 R15	A2-A4 PolarHBondContact O-N 3.35Å; A4-S6 PolarHBondContact O-N 3.46Å; A4-R15 VanDerWaalsContact CB-NH2 3.31Å; A4-R15 PolarHBondContact O-NH2 2.73Å
5	A	57.1	Low	73.1	Confident	70 Å²	70	96 Å²	96	58%	0.579	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	6.3	-155	0	0	0	0	0	115.8	E3	E3-A5 HydrophobicContact CB-CB 4.45Å; E3-A5 PolarHBondContact O-N 2.82Å
6	S	67.6	Low	73.4	Confident	87 Å²	87	90.8 Å²	90.8	61%	0.608	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.1	12.7	-175.4	56.2	0	0	0	0	115.7	A4 K8	A4-S6 PolarHBondContact O-N 3.46Å; S6-K8 PolarHBondContact O-N 3.08Å
7	L	74.6	Confident	73.4	Confident	52 Å²	52	93.6 Å²	93.6	27%	0.272	54%	0.54	S	S	.	.			trans	-79.9	55.4	169.6	-158.9	99.5	0	0	0	111.1	R15 P16 A20 F27	L7-R15 HydrophobicContact CD2-CG 4.05Å; L7-R15 WeakPolarHBondContact O-CA 3.25Å; L7-P16 WeakPolarHBondContact O-CD 3.05Å; L7-A20 HydrophobicContact CD1-CB 4.49Å; L7-A20 HydrophobicContact CD2-CB 4.12Å; L7-A20 HydrophobicContact CG-CB 4.46Å; L7-F27 HydrophobicContact CB-CD2 4.46Å; L7-F27 HydrophobicContact CD1-CD1 3.3Å; L7-F27 HydrophobicContact CD1-CD2 3.65Å; L7-F27 HydrophobicContact CD1-CE1 3.18Å; L7-F27 HydrophobicContact CD1-CE2 3.56Å; L7-F27 HydrophobicContact CD1-CG 3.53Å; L7-F27 HydrophobicContact CD1-CZ 3.32Å; L7-F27 HydrophobicContact CG-CB 4.36Å; L7-F27 HydrophobicContact CG-CD1 3.98Å; L7-F27 HydrophobicContact CG-CD2 4.12Å; L7-F27 HydrophobicContact CG-CE1 4.32Å; L7-F27 HydrophobicContact CG-CE2 4.46Å; L7-F27 HydrophobicContact CG-CG 3.87Å
8	K	85.2	Confident	73.1	Confident	120 Å²	120	96 Å²	96	52%	0.522	56%	0.557	S	S	.	*			trans	-107.1	135.6	178.2	65.4	-169.5	175.9	-159.3	0	110.5	S6 S10	S6-K8 PolarHBondContact O-N 3.08Å; K8-S10 PolarHBondContact O-N 3.32Å
9	C	87.8	Confident	73.2	Confident	1 Å²	1	93.6 Å²	93.6	1%	0.007	55%	0.546	C	S	.	.	B	Isolated β-bridge	trans	-64.3	131.3	174.6	176.4	0	0	0	0	110	V11 C12 C13 Q14 F27 C29	C9-V11 PolarHBondContact O-N 3.15Å; C9-V11 VanDerWaalsContact O-N 3.13Å; C9-V11 PolarHBondContact SG-N 3.42Å; C9-V11 VanDerWaalsContact SG-N 3.38Å; C9-C12 WeakPolarHBondContact CB-SG 3.49Å; C9-C13 WeakPolarHBondContact O-CA 3.43Å; C9-C13 PolarHBondContact O-N 3.13Å; C9-Q14 WeakPolarHBondContact CB-O 3.39Å; C9-Q14 PolarHBondContact N-O 2.95Å; C9-F27 VanDerWaalsContact CA-O 3.27Å; C9-F27 WeakPolarHBondContact CA-O 3.32Å; C9-C29 VanDerWaalsContact CB-SG 3.52Å; C9-C29 PolarHBondContact SG-N 2.95Å; C9-C29 VanDerWaalsContact SG-N 3.36Å
10	S	84.8	Confident	73.5	Confident	65 Å²	65	91 Å²	91	46%	0.455	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.6	178.5	-151.3	0	0	0	0	114.3	K8 F27	K8-S10 PolarHBondContact O-N 3.32Å; S10-F27 PolarHBondContact N-O 2.93Å
11	V	86.2	Confident	74.1	Confident	86 Å²	86	90.1 Å²	90.1	52%	0.521	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-59.8	-178.7	-177.5	0	0	0	0	111.4	C9 W28 H32	C9-V11 PolarHBondContact O-N 3.15Å; C9-V11 VanDerWaalsContact O-N 3.13Å; C9-V11 PolarHBondContact SG-N 3.42Å; C9-V11 VanDerWaalsContact SG-N 3.38Å; V11-W28 HydrophobicContact CG2-CE3 3.73Å; V11-W28 HydrophobicContact CG2-CZ3 3.52Å; V11-H32 HydrophobicContact CB-CB 3.86Å; V11-H32 HydrophobicContact CG1-CB 4.27Å; V11-H32 HydrophobicContact CG2-CB 3.95Å
12	C	88.4	Confident	75.8	Confident	40 Å²	40	84.7 Å²	84.7	27%	0.27	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-3.3	-178.6	62.6	0	0	0	0	114.6	C9 Q14 C29 H32	C9-C12 WeakPolarHBondContact CB-SG 3.49Å; C12-Q14 HydrophobicContact CB-CG 4.43Å; C12-Q14 WeakPolarHBondContact O-CG 3.32Å; C12-Q14 PolarHBondContact O-N 3.14Å; C12-Q14 PolarHBondContact O-NE2 3.3Å; C12-C29 PolarHBondContact SG-SG 3.13Å; C12-H32 WeakPolarHBondContact CB-CE1 3Å; C12-H32 PolarHBondContact SG-CE1 3.02Å; C12-H32 PolarHBondContact SG-ND1 3.31Å
13	C	82.5	Confident	77.1	Confident	86 Å²	86	80 Å²	80	58%	0.581	46%	0.457	S	S	*	.			trans	58.4	3	-174.5	-152.4	0	0	0	0	114.7	C9	C9-C13 WeakPolarHBondContact O-CA 3.43Å; C9-C13 PolarHBondContact O-N 3.13Å
14	Q	84.9	Confident	78.5	Confident	125 Å²	125	75.6 Å²	75.6	58%	0.584	44%	0.438	S	S	*	.	S	Bend	trans	-90.3	157.3	179.5	-59.6	-50.7	-58.6	0	0	111.5	C9 C12 P16	C9-Q14 WeakPolarHBondContact CB-O 3.39Å; C9-Q14 PolarHBondContact N-O 2.95Å; C12-Q14 HydrophobicContact CB-CG 4.43Å; C12-Q14 WeakPolarHBondContact O-CG 3.32Å; C12-Q14 PolarHBondContact O-N 3.14Å; C12-Q14 PolarHBondContact O-NE2 3.3Å; Q14-P16 WeakPolarHBondContact O-CD 3.4Å
15	R	81	Confident	79.7	Confident	148 Å²	148	75 Å²	75	56%	0.558	44%	0.439	S	S	*	.			trans	-67.8	124.5	169.6	-170.1	-180	-130.3	-173.2	3.3	109.3	A4 L7 T17	A4-R15 VanDerWaalsContact CB-NH2 3.31Å; A4-R15 PolarHBondContact O-NH2 2.73Å; L7-R15 HydrophobicContact CD2-CG 4.05Å; L7-R15 WeakPolarHBondContact O-CA 3.25Å; R15-T17 PolarHBondContact O-N 3.31Å; R15-T17 VanDerWaalsContact O-N 3.08Å
16	P	77.4	Confident	81.2	Confident	13 Å²	13	79 Å²	79	8%	0.084	44%	0.439	C	S	.	.			trans	-63.3	114.8	174.8	-15.5	27.5	0	0	0	109.5	L7 Q14 A20	L7-P16 WeakPolarHBondContact O-CD 3.05Å; Q14-P16 WeakPolarHBondContact O-CD 3.4Å; P16-A20 HydrophobicContact CB-CB 3.61Å; P16-A20 HydrophobicContact CG-CB 3.64Å
17	T	73.8	Confident	82.1	Confident	138 Å²	138	77.6 Å²	77.6	85%	0.847	42%	0.422	S	S	*	.	S	Bend	trans	-79.7	-33.8	-171.5	-27.8	0	0	0	0	113.1	R15	R15-T17 PolarHBondContact O-N 3.31Å; R15-T17 VanDerWaalsContact O-N 3.08Å
18	T	69.1	Low	82.8	Confident	137 Å²	137	77.1 Å²	77.1	84%	0.84	42%	0.416	S	S	*	.	S	Bend	trans	-105.9	-59.3	-171.2	-31.9	0	0	0	0	111.4
19	S	74.6	Confident	82.9	Confident	51 Å²	51	72.4 Å²	72.4	36%	0.357	40%	0.399	S	S	.	.			trans	-141.8	103.3	-177.9	-55.2	0	0	0	0	109.2	Q30	S19-Q30 VanDerWaalsContact CB-OE1 3.27Å; S19-Q30 PolarHBondContact O-N 3.48Å; S19-Q30 PolarHBondContact OG-OE1 3.02Å
20	A	79.7	Confident	82.6	Confident	41 Å²	41	76.3 Å²	76.3	34%	0.339	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.7	169.4	0	0	0	0	0	109.3	L7 P16 F27	L7-A20 HydrophobicContact CD1-CB 4.49Å; L7-A20 HydrophobicContact CD2-CB 4.12Å; L7-A20 HydrophobicContact CG-CB 4.46Å; P16-A20 HydrophobicContact CB-CB 3.61Å; P16-A20 HydrophobicContact CG-CB 3.64Å; A20-F27 HydrophobicContact CB-CD1 3.92Å
21	K	84.7	Confident	82.6	Confident	72 Å²	72	79.3 Å²	79.3	31%	0.313	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	120.3	168	-79.1	-82.8	169.8	170.2	0	108.4	F27 W28 F33 T43	K21-F27 CarbonylContact O-C 3.51Å; K21-F27 WeakPolarHBondContact O-CA 3.12Å; K21-W28 HydrophobicContact CB-CB 4.44Å; K21-W28 PolarHBondContact N-O 2.8Å; K21-W28 PolarHBondContact O-N 2.83Å; K21-F33 HydrophobicContact CB-CB 4.46Å; K21-T43 WeakPolarHBondContact CE-O 3.23Å; K21-T43 PolarHBondContact NZ-O 3.27Å
22	F	85.2	Confident	82.7	Confident	118 Å²	118	78.2 Å²	78.2	52%	0.518	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.6	170.5	-171.2	-103.5	0	0	0	109.3	G25 R26 F27	F22-G25 VanDerWaalsContact CE2-C 3.44Å; F22-G25 WeakPolarHBondContact CE2-O 3.28Å; F22-G25 VanDerWaalsContact CZ-C 3.49Å; F22-R26 WeakPolarHBondContact CA-O 3.44Å; F22-R26 WeakPolarHBondContact CD2-O 3.47Å; F22-F27 HydrophobicContact CB-CD1 4.02Å; F22-F27 HydrophobicContact CB-CE1 3.77Å; F22-F27 HydrophobicContact CB-CZ 4.42Å; F22-F27 AromaticContact CD2-CD1 3.81Å; F22-F27 HydrophobicContact CD2-CD1 3.81Å; F22-F27 AromaticContact CD2-CD2 3.87Å; F22-F27 HydrophobicContact CD2-CD2 3.87Å; F22-F27 AromaticContact CD2-CE1 3.54Å; F22-F27 HydrophobicContact CD2-CE1 3.54Å; F22-F27 AromaticContact CD2-CE2 3.58Å; F22-F27 HydrophobicContact CD2-CE2 3.58Å; F22-F27 AromaticContact CD2-CG 3.98Å; F22-F27 HydrophobicContact CD2-CG 3.98Å; F22-F27 AromaticContact CD2-CZ 3.42Å; F22-F27 HydrophobicContact CD2-CZ 3.42Å; F22-F27 VanDerWaalsContact CD2-CZ 3.42Å; F22-F27 HydrophobicContact CE2-CD2 4.22Å; F22-F27 AromaticContact CE2-CE2 3.8Å; F22-F27 HydrophobicContact CE2-CE2 3.8Å; F22-F27 AromaticContact CE2-CZ 3.97Å; F22-F27 HydrophobicContact CE2-CZ 3.97Å; F22-F27 HydrophobicContact CG-CD1 4.41Å; F22-F27 HydrophobicContact CG-CE1 4.04Å; F22-F27 HydrophobicContact CG-CZ 4.2Å
23	A	84.1	Confident	82.7	Confident	3 Å²	3	76.5 Å²	76.5	3%	0.025	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	149.3	-179.3	0	0	0	0	0	109.4	G25 R26 W28 F33 Y46	A23-G25 PolarHBondContact O-N 3.32Å; A23-R26 PolarHBondContact N-O 3.31Å; A23-R26 PolarHBondContact O-N 3.34Å; A23-W28 PolarHBondContact O-NE1 2.75Å; A23-F33 HydrophobicContact CB-CD2 4.12Å; A23-F33 HydrophobicContact CB-CE1 4.03Å; A23-F33 HydrophobicContact CB-CE2 3.36Å; A23-F33 HydrophobicContact CB-CZ 3.31Å; A23-Y46 HydrophobicContact CB-CE2 4.05Å; A23-Y46 VanDerWaalsContact CB-OH 3.31Å; A23-Y46 WeakPolarHBondContact CB-OH 3.03Å
24	L	82.7	Confident	83.1	Confident	64 Å²	64	74.2 Å²	74.2	34%	0.335	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	34.5	-178.6	-58.6	166.4	0	0	0	112.7	R26 W28 T48 E51 A53	L24-R26 PolarHBondContact O-N 3.48Å; L24-W28 HydrophobicContact CD1-CZ2 4.34Å; L24-T48 HydrophobicContact CD2-CG2 3.49Å; L24-T48 VanDerWaalsContact CD2-CG2 3.49Å; L24-T48 HydrophobicContact CG-CG2 4.13Å; L24-E51 WeakPolarHBondContact CD1-O 3.3Å; L24-A53 HydrophobicContact CD1-CB 4.27Å
25	G	83.2	Confident	83.5	Confident	58 Å²	58	68.3 Å²	68.3	60%	0.598	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	8.6	-177.2	0	0	0	0	0	115.3	F22 A23	F22-G25 VanDerWaalsContact CE2-C 3.44Å; F22-G25 WeakPolarHBondContact CE2-O 3.28Å; F22-G25 VanDerWaalsContact CZ-C 3.49Å; A23-G25 PolarHBondContact O-N 3.32Å
26	R	86.8	Confident	84	Confident	155 Å²	155	64.9 Å²	64.9	59%	0.585	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	162	-177.2	-62.3	-171.3	121.2	111.4	1.4	111.9	F22 A23 L24 W28	F22-R26 WeakPolarHBondContact CA-O 3.44Å; F22-R26 WeakPolarHBondContact CD2-O 3.47Å; A23-R26 PolarHBondContact N-O 3.31Å; A23-R26 PolarHBondContact O-N 3.34Å; L24-R26 PolarHBondContact O-N 3.48Å; R26-W28 HydrophobicContact CB-CZ2 4.5Å; R26-W28 PolarHBondContact O-NE1 2.8Å
27	F	87	Confident	84.6	Confident	56 Å²	56	68.7 Å²	68.7	25%	0.246	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	146.9	172.6	-68.3	-81.2	0	0	0	111.3	L7 C9 S10 A20 K21 F22	L7-F27 HydrophobicContact CB-CD2 4.46Å; L7-F27 HydrophobicContact CD1-CD1 3.3Å; L7-F27 HydrophobicContact CD1-CD2 3.65Å; L7-F27 HydrophobicContact CD1-CE1 3.18Å; L7-F27 HydrophobicContact CD1-CE2 3.56Å; L7-F27 HydrophobicContact CD1-CG 3.53Å; L7-F27 HydrophobicContact CD1-CZ 3.32Å; L7-F27 HydrophobicContact CG-CB 4.36Å; L7-F27 HydrophobicContact CG-CD1 3.98Å; L7-F27 HydrophobicContact CG-CD2 4.12Å; L7-F27 HydrophobicContact CG-CE1 4.32Å; L7-F27 HydrophobicContact CG-CE2 4.46Å; L7-F27 HydrophobicContact CG-CG 3.87Å; C9-F27 VanDerWaalsContact CA-O 3.27Å; C9-F27 WeakPolarHBondContact CA-O 3.32Å; S10-F27 PolarHBondContact N-O 2.93Å; A20-F27 HydrophobicContact CB-CD1 3.92Å; K21-F27 CarbonylContact O-C 3.51Å; K21-F27 WeakPolarHBondContact O-CA 3.12Å; F22-F27 HydrophobicContact CB-CD1 4.02Å; F22-F27 HydrophobicContact CB-CE1 3.77Å; F22-F27 HydrophobicContact CB-CZ 4.42Å; F22-F27 AromaticContact CD2-CD1 3.81Å; F22-F27 HydrophobicContact CD2-CD1 3.81Å; F22-F27 AromaticContact CD2-CD2 3.87Å; F22-F27 HydrophobicContact CD2-CD2 3.87Å; F22-F27 AromaticContact CD2-CE1 3.54Å; F22-F27 HydrophobicContact CD2-CE1 3.54Å; F22-F27 AromaticContact CD2-CE2 3.58Å; F22-F27 HydrophobicContact CD2-CE2 3.58Å; F22-F27 AromaticContact CD2-CG 3.98Å; F22-F27 HydrophobicContact CD2-CG 3.98Å; F22-F27 AromaticContact CD2-CZ 3.42Å; F22-F27 HydrophobicContact CD2-CZ 3.42Å; F22-F27 VanDerWaalsContact CD2-CZ 3.42Å; F22-F27 HydrophobicContact CE2-CD2 4.22Å; F22-F27 AromaticContact CE2-CE2 3.8Å; F22-F27 HydrophobicContact CE2-CE2 3.8Å; F22-F27 AromaticContact CE2-CZ 3.97Å; F22-F27 HydrophobicContact CE2-CZ 3.97Å; F22-F27 HydrophobicContact CG-CD1 4.41Å; F22-F27 HydrophobicContact CG-CE1 4.04Å; F22-F27 HydrophobicContact CG-CZ 4.2Å
28	W	88.6	Confident	85.6	Confident	42 Å²	42	64.7 Å²	64.7	16%	0.159	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145.2	-178.1	-54	83.1	0	0	0	109.2	V11 K21 A23 L24 R26 F33	V11-W28 HydrophobicContact CG2-CE3 3.73Å; V11-W28 HydrophobicContact CG2-CZ3 3.52Å; K21-W28 HydrophobicContact CB-CB 4.44Å; K21-W28 PolarHBondContact N-O 2.8Å; K21-W28 PolarHBondContact O-N 2.83Å; A23-W28 PolarHBondContact O-NE1 2.75Å; L24-W28 HydrophobicContact CD1-CZ2 4.34Å; R26-W28 HydrophobicContact CB-CZ2 4.5Å; R26-W28 PolarHBondContact O-NE1 2.8Å; W28-F33 HydrophobicContact CB-CB 3.73Å; W28-F33 HydrophobicContact CB-CD2 3.99Å; W28-F33 HydrophobicContact CB-CG 4.19Å; W28-F33 AromaticContact CD1-CD2 3.82Å; W28-F33 AromaticContact CD2-CD2 3.76Å; W28-F33 HydrophobicContact CD2-CD2 3.76Å; W28-F33 HydrophobicContact CD2-CE2 4.44Å; W28-F33 HydrophobicContact CE3-CD2 4.25Å; W28-F33 HydrophobicContact CG-CB 4.28Å; W28-F33 AromaticContact CG-CD2 3.58Å; W28-F33 HydrophobicContact CG-CD2 3.58Å; W28-F33 HydrophobicContact CG-CE2 4.39Å; W28-F33 HydrophobicContact CG-CG 4.27Å
29	C	87.9	Confident	86.5	Confident	22 Å²	22	63.8 Å²	63.8	15%	0.149	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	147.8	168	-61.7	0	0	0	0	109.6	C9 C12 N31 H32 F33	C9-C29 VanDerWaalsContact CB-SG 3.52Å; C9-C29 PolarHBondContact SG-N 2.95Å; C9-C29 VanDerWaalsContact SG-N 3.36Å; C12-C29 PolarHBondContact SG-SG 3.13Å; C29-N31 PolarHBondContact O-N 3.07Å; C29-H32 HydrophobicContact CB-CB 4.07Å; C29-H32 WeakPolarHBondContact CB-ND1 3.49Å; C29-H32 PolarHBondContact O-N 2.87Å; C29-F33 PolarHBondContact O-N 3Å
30	Q	82.8	Confident	87.2	Confident	83 Å²	83	65.1 Å²	65.1	39%	0.388	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-36.5	175.1	-177.6	175.8	-35.6	0	0	113.9	S19 T43	S19-Q30 VanDerWaalsContact CB-OE1 3.27Å; S19-Q30 PolarHBondContact O-N 3.48Å; S19-Q30 PolarHBondContact OG-OE1 3.02Å; Q30-T43 HydrophobicContact CG-CG2 4.01Å
31	N	82.9	Confident	87.7	Confident	127 Å²	127	65.3 Å²	65.3	68%	0.679	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-17	179.3	-64.9	-23.1	0	0	0	114.2	C29	C29-N31 PolarHBondContact O-N 3.07Å
32	H	88.3	Confident	87.9	Confident	64 Å²	64	62.1 Å²	62.1	30%	0.296	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-18.1	-179.4	-68	145.8	0	0	0	113.2	V11 C12 C29 C34	V11-H32 HydrophobicContact CB-CB 3.86Å; V11-H32 HydrophobicContact CG1-CB 4.27Å; V11-H32 HydrophobicContact CG2-CB 3.95Å; C12-H32 WeakPolarHBondContact CB-CE1 3Å; C12-H32 PolarHBondContact SG-CE1 3.02Å; C12-H32 PolarHBondContact SG-ND1 3.31Å; C29-H32 HydrophobicContact CB-CB 4.07Å; C29-H32 WeakPolarHBondContact CB-ND1 3.49Å; C29-H32 PolarHBondContact O-N 2.87Å; H32-C34 PolarHBondContact O-N 3.32Å
33	F	89.6	Confident	87.6	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.018	33%	0.328	C	S	.	.			trans	-79.6	89.9	173.4	-166.1	-115.7	0	0	0	109.2	K21 A23 W28 C29 L42 Y46 A53	K21-F33 HydrophobicContact CB-CB 4.46Å; A23-F33 HydrophobicContact CB-CD2 4.12Å; A23-F33 HydrophobicContact CB-CE1 4.03Å; A23-F33 HydrophobicContact CB-CE2 3.36Å; A23-F33 HydrophobicContact CB-CZ 3.31Å; W28-F33 HydrophobicContact CB-CB 3.73Å; W28-F33 HydrophobicContact CB-CD2 3.99Å; W28-F33 HydrophobicContact CB-CG 4.19Å; W28-F33 AromaticContact CD1-CD2 3.82Å; W28-F33 AromaticContact CD2-CD2 3.76Å; W28-F33 HydrophobicContact CD2-CD2 3.76Å; W28-F33 HydrophobicContact CD2-CE2 4.44Å; W28-F33 HydrophobicContact CE3-CD2 4.25Å; W28-F33 HydrophobicContact CG-CB 4.28Å; W28-F33 AromaticContact CG-CD2 3.58Å; W28-F33 HydrophobicContact CG-CD2 3.58Å; W28-F33 HydrophobicContact CG-CE2 4.39Å; W28-F33 HydrophobicContact CG-CG 4.27Å; C29-F33 PolarHBondContact O-N 3Å; F33-L42 HydrophobicContact CD1-CB 3.54Å; F33-L42 HydrophobicContact CD1-CD1 4.45Å; F33-L42 WeakPolarHBondContact CD1-O 3.27Å; F33-L42 HydrophobicContact CE1-CB 3.64Å; F33-L42 HydrophobicContact CE1-CD1 4.02Å; F33-L42 HydrophobicContact CG-CB 4.47Å; F33-L42 HydrophobicContact CZ-CD1 4.27Å; F33-L42 WeakPolarHBondContact O-CB 3.31Å; F33-L42 PolarHBondContact O-N 2.72Å; F33-Y46 AromaticContact CE1-CD1 3.58Å; F33-Y46 HydrophobicContact CE1-CD1 3.58Å; F33-Y46 AromaticContact CE1-CD2 3.75Å; F33-Y46 HydrophobicContact CE1-CD2 3.75Å; F33-Y46 AromaticContact CE1-CE1 3.73Å; F33-Y46 HydrophobicContact CE1-CE1 3.73Å; F33-Y46 AromaticContact CE1-CE2 3.91Å; F33-Y46 HydrophobicContact CE1-CE2 3.91Å; F33-Y46 AromaticContact CE1-CG 3.58Å; F33-Y46 HydrophobicContact CE1-CG 3.58Å; F33-Y46 AromaticContact CE1-CZ 3.89Å; F33-Y46 HydrophobicContact CZ-CD1 4.28Å; F33-Y46 AromaticContact CZ-CD2 3.63Å; F33-Y46 HydrophobicContact CZ-CD2 3.63Å; F33-Y46 HydrophobicContact CZ-CE1 4.26Å; F33-Y46 AromaticContact CZ-CE2 3.61Å; F33-Y46 HydrophobicContact CZ-CE2 3.61Å; F33-Y46 AromaticContact CZ-CG 3.98Å; F33-Y46 HydrophobicContact CZ-CG 3.98Å; F33-Y46 AromaticContact CZ-CZ 3.93Å; F33-A53 HydrophobicContact CE1-CB 4.37Å; F33-A53 HydrophobicContact CE2-CB 3.67Å; F33-A53 HydrophobicContact CZ-CB 3.45Å; F33-A53 VanDerWaalsContact CZ-CB 3.45Å
34	C	91.6	Very high	87.4	Confident	38 Å²	38	66.3 Å²	66.3	26%	0.257	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-123.3	161.9	-176.8	59.3	0	0	0	0	112	H32 N36 N39 T40	H32-C34 PolarHBondContact O-N 3.32Å; C34-N36 PolarHBondContact O-N 2.93Å; C34-N39 WeakPolarHBondContact CB-O 3.21Å; C34-T40 CarbonylContact C-O 3.53Å; C34-T40 WeakPolarHBondContact CA-O 3.08Å; C34-T40 WeakPolarHBondContact CB-O 3.48Å
35	C	93.2	Very high	87.5	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	38%	0.376	C	S	.	.			trans	-64.9	129.5	177.7	174.4	0	0	0	0	110	L37 C38 N39 T40 L42 A53 C55	C35-L37 PolarHBondContact O-N 3.25Å; C35-L37 PolarHBondContact SG-N 3.44Å; C35-L37 VanDerWaalsContact SG-N 3.38Å; C35-C38 WeakPolarHBondContact CB-SG 3.05Å; C35-N39 WeakPolarHBondContact O-CA 3.17Å; C35-N39 PolarHBondContact O-N 3.29Å; C35-T40 PolarHBondContact N-O 2.98Å; C35-L42 HydrophobicContact CB-CD1 4.3Å; C35-L42 HydrophobicContact CB-CD2 4.13Å; C35-L42 HydrophobicContact CB-CG 4.28Å; C35-A53 WeakPolarHBondContact CA-O 3.49Å; C35-C55 HydrophobicContact CB-CB 4.05Å; C35-C55 PolarHBondContact SG-N 2.79Å
36	N	90.5	Very high	87.7	Confident	76 Å²	76	68.5 Å²	68.5	41%	0.406	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.8	179.2	-173.8	96.1	0	0	0	113.7	C34 K52 A53 Y54	C34-N36 PolarHBondContact O-N 2.93Å; N36-K52 HydrophobicContact CB-CB 4.33Å; N36-A53 PolarHBondContact N-O 3.39Å; N36-Y54 HydrophobicContact CB-CE1 4.21Å
37	L	90.9	Very high	87.9	Confident	94 Å²	94	63.3 Å²	63.3	49%	0.492	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-54.7	179.6	-70.5	177.7	0	0	0	113.2	C35 Y54 C58 V62	C35-L37 PolarHBondContact O-N 3.25Å; C35-L37 PolarHBondContact SG-N 3.44Å; C35-L37 VanDerWaalsContact SG-N 3.38Å; L37-Y54 HydrophobicContact CD1-CD1 3.82Å; L37-Y54 HydrophobicContact CD1-CE1 3.77Å; L37-Y54 HydrophobicContact CD2-CE1 4.49Å; L37-Y54 HydrophobicContact CG-CD1 3.86Å; L37-Y54 HydrophobicContact CG-CE1 3.67Å; L37-C58 HydrophobicContact CB-CB 4.06Å; L37-C58 HydrophobicContact CD1-CB 3.92Å; L37-V62 HydrophobicContact CD1-CG1 3.52Å
38	C	93.5	Very high	87.9	Confident	54 Å²	54	62.7 Å²	62.7	37%	0.365	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-1.6	-175.3	65.5	0	0	0	0	114	C35 T40	C35-C38 WeakPolarHBondContact CB-SG 3.05Å; C38-T40 PolarHBondContact O-N 3.43Å; C38-T40 PolarHBondContact SG-OG1 3.43Å
39	N	88.5	Confident	87.8	Confident	117 Å²	117	63.3 Å²	63.3	63%	0.626	35%	0.348	S	S	*	.			trans	53.5	18.2	-175	-68.6	-58.2	0	0	0	114.8	C34 C35	C34-N39 WeakPolarHBondContact CB-O 3.21Å; C35-N39 WeakPolarHBondContact O-CA 3.17Å; C35-N39 PolarHBondContact O-N 3.29Å
40	T	90.2	Very high	87.6	Confident	80 Å²	80	65.6 Å²	65.6	49%	0.491	37%	0.368	S	S	.	.			trans	-71.3	133.3	174.3	-53.9	0	0	0	0	110.4	C34 C35 C38 L42	C34-T40 CarbonylContact C-O 3.53Å; C34-T40 WeakPolarHBondContact CA-O 3.08Å; C34-T40 WeakPolarHBondContact CB-O 3.48Å; C35-T40 PolarHBondContact N-O 2.98Å; C38-T40 PolarHBondContact O-N 3.43Å; C38-T40 PolarHBondContact SG-OG1 3.43Å; T40-L42 PolarHBondContact O-N 2.87Å
41	A	88.7	Confident	87.8	Confident	45 Å²	45	70 Å²	70	37%	0.372	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-58.9	119.6	177.7	0	0	0	0	0	111.4	T43	A41-T43 VanDerWaalsContact C-N 3.26Å; A41-T43 HydrophobicContact CB-CG2 4.24Å; A41-T43 PolarHBondContact O-N 2.91Å; A41-T43 VanDerWaalsContact O-N 3.12Å
42	L	89.3	Confident	88.1	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.026	38%	0.377	C	S	.	.			trans	-88.5	58.9	-177.3	-68.5	177.7	0	0	0	110.6	F33 C35 T40 A53 C55	F33-L42 HydrophobicContact CD1-CB 3.54Å; F33-L42 HydrophobicContact CD1-CD1 4.45Å; F33-L42 WeakPolarHBondContact CD1-O 3.27Å; F33-L42 HydrophobicContact CE1-CB 3.64Å; F33-L42 HydrophobicContact CE1-CD1 4.02Å; F33-L42 HydrophobicContact CG-CB 4.47Å; F33-L42 HydrophobicContact CZ-CD1 4.27Å; F33-L42 WeakPolarHBondContact O-CB 3.31Å; F33-L42 PolarHBondContact O-N 2.72Å; C35-L42 HydrophobicContact CB-CD1 4.3Å; C35-L42 HydrophobicContact CB-CD2 4.13Å; C35-L42 HydrophobicContact CB-CG 4.28Å; T40-L42 PolarHBondContact O-N 2.87Å; L42-A53 HydrophobicContact CD1-CB 3.54Å; L42-C55 VanDerWaalsContact CD2-CA 3.5Å; L42-C55 HydrophobicContact CD2-CB 3.66Å
43	T	79.5	Confident	88.2	Confident	63 Å²	63	65.9 Å²	65.9	39%	0.387	37%	0.365	S	S	.	.	S	Bend	trans	-74.1	-38	-174.1	48.9	0	0	0	0	112.8	K21 Q30 A41	K21-T43 WeakPolarHBondContact CE-O 3.23Å; K21-T43 PolarHBondContact NZ-O 3.27Å; Q30-T43 HydrophobicContact CG-CG2 4.01Å; A41-T43 VanDerWaalsContact C-N 3.26Å; A41-T43 HydrophobicContact CB-CG2 4.24Å; A41-T43 PolarHBondContact O-N 2.91Å; A41-T43 VanDerWaalsContact O-N 3.12Å
44	N	80	Confident	88.3	Confident	145 Å²	145	66.5 Å²	66.5	78%	0.775	37%	0.367	S	S	*	.	S	Bend	trans	-104.8	-75.9	-171.1	-146.7	32.3	0	0	0	112.9
45	V	83.9	Confident	88.3	Confident	95 Å²	95	65.8 Å²	65.8	58%	0.576	36%	0.363	S	S	*	.			trans	-113.9	131.2	-179.5	-178.1	0	0	0	0	109.4
46	Y	89.1	Confident	88.1	Confident	74 Å²	74	70.6 Å²	70.6	29%	0.29	39%	0.389	S	S	.	.			trans	-143.2	161.7	174.2	68.3	-86	0	0	0	110.5	A23 F33 T48 A53	A23-Y46 HydrophobicContact CB-CE2 4.05Å; A23-Y46 VanDerWaalsContact CB-OH 3.31Å; A23-Y46 WeakPolarHBondContact CB-OH 3.03Å; F33-Y46 AromaticContact CE1-CD1 3.58Å; F33-Y46 HydrophobicContact CE1-CD1 3.58Å; F33-Y46 AromaticContact CE1-CD2 3.75Å; F33-Y46 HydrophobicContact CE1-CD2 3.75Å; F33-Y46 AromaticContact CE1-CE1 3.73Å; F33-Y46 HydrophobicContact CE1-CE1 3.73Å; F33-Y46 AromaticContact CE1-CE2 3.91Å; F33-Y46 HydrophobicContact CE1-CE2 3.91Å; F33-Y46 AromaticContact CE1-CG 3.58Å; F33-Y46 HydrophobicContact CE1-CG 3.58Å; F33-Y46 AromaticContact CE1-CZ 3.89Å; F33-Y46 HydrophobicContact CZ-CD1 4.28Å; F33-Y46 AromaticContact CZ-CD2 3.63Å; F33-Y46 HydrophobicContact CZ-CD2 3.63Å; F33-Y46 HydrophobicContact CZ-CE1 4.26Å; F33-Y46 AromaticContact CZ-CE2 3.61Å; F33-Y46 HydrophobicContact CZ-CE2 3.61Å; F33-Y46 AromaticContact CZ-CG 3.98Å; F33-Y46 HydrophobicContact CZ-CG 3.98Å; F33-Y46 AromaticContact CZ-CZ 3.93Å; Y46-T48 HydrophobicContact CD2-CG2 4.21Å; Y46-T48 HydrophobicContact CE2-CG2 3.92Å; Y46-A53 HydrophobicContact CD2-CB 4.39Å
47	H	89.4	Confident	88	Confident	46 Å²	46	69.2 Å²	69.2	21%	0.213	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140	175	-59.3	-77.4	0	0	0	109.1	A53 Y54 N56 F59	H47-A53 CarbonylContact O-C 3.26Å; H47-A53 WeakPolarHBondContact O-CA 3.13Å; H47-Y54 PolarHBondContact N-O 3.12Å; H47-Y54 PolarHBondContact O-N 3.49Å; H47-N56 PolarHBondContact NE2-ND2 3.42Å; H47-F59 HydrophobicContact CB-CB 3.95Å; H47-F59 HydrophobicContact CB-CD1 3.76Å; H47-F59 HydrophobicContact CB-CD2 3.24Å; H47-F59 HydrophobicContact CB-CE1 4.04Å; H47-F59 HydrophobicContact CB-CE2 3.52Å; H47-F59 HydrophobicContact CB-CG 3.35Å; H47-F59 HydrophobicContact CB-CZ 3.91Å; H47-F59 AromaticContact CD2-CD1 3.79Å; H47-F59 AromaticContact CD2-CG 3.89Å; H47-F59 AromaticContact CG-CD1 3.67Å; H47-F59 AromaticContact CG-CE1 3.98Å; H47-F59 AromaticContact CG-CG 3.73Å
48	T	87.2	Confident	88.1	Confident	43 Å²	43	65.7 Å²	65.7	26%	0.264	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	144.3	171.1	53.2	0	0	0	0	109	L24 Y46 K52 F59 E75	L24-T48 HydrophobicContact CD2-CG2 3.49Å; L24-T48 VanDerWaalsContact CD2-CG2 3.49Å; L24-T48 HydrophobicContact CG-CG2 4.13Å; Y46-T48 HydrophobicContact CD2-CG2 4.21Å; Y46-T48 HydrophobicContact CE2-CG2 3.92Å; T48-K52 CarbonylContact C-O 3.48Å; T48-K52 VanDerWaalsContact CA-O 3.26Å; T48-K52 WeakPolarHBondContact CA-O 3.2Å; T48-F59 WeakPolarHBondContact O-CE2 3.33Å; T48-E75 VanDerWaalsContact CB-OE2 3.3Å; T48-E75 WeakPolarHBondContact CB-OE2 3.44Å; T48-E75 PolarHBondContact OG1-OE2 2.86Å
49	F	86.6	Confident	87.9	Confident	55 Å²	55	63.4 Å²	63.4	24%	0.241	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	132.3	170.4	-170.4	-109.4	0	0	0	108	E51 K52 Y54 F59 V62 V63	F49-E51 PolarHBondContact O-N 3.26Å; F49-K52 PolarHBondContact N-O 3.32Å; F49-K52 PolarHBondContact O-N 3.15Å; F49-Y54 HydrophobicContact CB-CD2 3.96Å; F49-Y54 HydrophobicContact CB-CE2 3.8Å; F49-Y54 WeakPolarHBondContact O-CE2 3.48Å; F49-F59 HydrophobicContact CB-CD2 4.17Å; F49-F59 HydrophobicContact CB-CE2 3.89Å; F49-F59 HydrophobicContact CD2-CE2 4.42Å; F49-F59 HydrophobicContact CG-CE2 4.46Å; F49-V62 HydrophobicContact CB-CG2 4.36Å; F49-V62 HydrophobicContact CD1-CB 4.17Å; F49-V62 HydrophobicContact CD1-CG2 4.01Å; F49-V62 WeakPolarHBondContact CE1-O 3.31Å; F49-V62 HydrophobicContact CG-CG2 4.37Å; F49-V63 HydrophobicContact CD2-CB 4.46Å; F49-V63 HydrophobicContact CD2-CG2 4.22Å; F49-V63 HydrophobicContact CE2-CG2 4.13Å
50	A	85.1	Confident	87.8	Confident	69 Å²	69	64 Å²	64	57%	0.57	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	47	-179.1	0	0	0	0	0	112.9	K52	A50-K52 PolarHBondContact O-N 3.37Å; A50-K52 VanDerWaalsContact O-N 3.1Å
51	E	85.7	Confident	87.6	Confident	176 Å²	176	66 Å²	66	82%	0.822	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	18.3	-180	-56.6	176.9	88.8	0	0	115.3	L24 F49	L24-E51 WeakPolarHBondContact CD1-O 3.3Å; F49-E51 PolarHBondContact O-N 3.26Å
52	K	89.6	Confident	87.6	Confident	98 Å²	98	65.9 Å²	65.9	43%	0.426	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.7	178.3	-68	178.2	179.4	-163	0	110.8	N36 T48 F49 A50 Y54	N36-K52 HydrophobicContact CB-CB 4.33Å; T48-K52 CarbonylContact C-O 3.48Å; T48-K52 VanDerWaalsContact CA-O 3.26Å; T48-K52 WeakPolarHBondContact CA-O 3.2Å; F49-K52 PolarHBondContact N-O 3.32Å; F49-K52 PolarHBondContact O-N 3.15Å; A50-K52 PolarHBondContact O-N 3.37Å; A50-K52 VanDerWaalsContact O-N 3.1Å; K52-Y54 HydrophobicContact CB-CD2 4.43Å; K52-Y54 HydrophobicContact CB-CE2 3.51Å; K52-Y54 VanDerWaalsContact O-CD2 3.29Å; K52-Y54 WeakPolarHBondContact O-CD2 3.4Å; K52-Y54 VanDerWaalsContact O-CE2 3.32Å; K52-Y54 WeakPolarHBondContact O-CE2 3.16Å
53	A	89.7	Confident	87.6	Confident	6 Å²	6	65.9 Å²	65.9	5%	0.05	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	134.9	179.8	0	0	0	0	0	111.4	L24 F33 C35 N36 L42 Y46 H47	L24-A53 HydrophobicContact CD1-CB 4.27Å; F33-A53 HydrophobicContact CE1-CB 4.37Å; F33-A53 HydrophobicContact CE2-CB 3.67Å; F33-A53 HydrophobicContact CZ-CB 3.45Å; F33-A53 VanDerWaalsContact CZ-CB 3.45Å; C35-A53 WeakPolarHBondContact CA-O 3.49Å; N36-A53 PolarHBondContact N-O 3.39Å; L42-A53 HydrophobicContact CD1-CB 3.54Å; Y46-A53 HydrophobicContact CD2-CB 4.39Å; H47-A53 CarbonylContact O-C 3.26Å; H47-A53 WeakPolarHBondContact O-CA 3.13Å
54	Y	91.8	Very high	88	Confident	17 Å²	17	64 Å²	64	7%	0.067	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.6	-178.3	-58.4	-93.5	0	0	0	111	N36 L37 H47 F49 K52 C58 V62	N36-Y54 HydrophobicContact CB-CE1 4.21Å; L37-Y54 HydrophobicContact CD1-CD1 3.82Å; L37-Y54 HydrophobicContact CD1-CE1 3.77Å; L37-Y54 HydrophobicContact CD2-CE1 4.49Å; L37-Y54 HydrophobicContact CG-CD1 3.86Å; L37-Y54 HydrophobicContact CG-CE1 3.67Å; H47-Y54 PolarHBondContact N-O 3.12Å; H47-Y54 PolarHBondContact O-N 3.49Å; F49-Y54 HydrophobicContact CB-CD2 3.96Å; F49-Y54 HydrophobicContact CB-CE2 3.8Å; F49-Y54 WeakPolarHBondContact O-CE2 3.48Å; K52-Y54 HydrophobicContact CB-CD2 4.43Å; K52-Y54 HydrophobicContact CB-CE2 3.51Å; K52-Y54 VanDerWaalsContact O-CD2 3.29Å; K52-Y54 WeakPolarHBondContact O-CD2 3.4Å; K52-Y54 VanDerWaalsContact O-CE2 3.32Å; K52-Y54 WeakPolarHBondContact O-CE2 3.16Å; Y54-C58 HydrophobicContact CD1-CB 4.44Å; Y54-V62 HydrophobicContact CD1-CG1 4.27Å; Y54-V62 HydrophobicContact CD1-CG2 4.01Å; Y54-V62 HydrophobicContact CD2-CG2 4.15Å; Y54-V62 HydrophobicContact CE1-CB 4.47Å; Y54-V62 HydrophobicContact CE1-CG1 3.84Å; Y54-V62 HydrophobicContact CE1-CG2 4.05Å; Y54-V62 HydrophobicContact CE2-CG2 4.21Å; Y54-V62 HydrophobicContact CG-CG2 4.06Å
55	C	92.4	Very high	88.5	Confident	24 Å²	24	61.3 Å²	61.3	16%	0.162	33%	0.325	C	S	.	.			trans	-72.8	162.5	170.2	72.2	0	0	0	0	109.8	C35 L42 G57 C58 F59	C35-C55 HydrophobicContact CB-CB 4.05Å; C35-C55 PolarHBondContact SG-N 2.79Å; L42-C55 VanDerWaalsContact CD2-CA 3.5Å; L42-C55 HydrophobicContact CD2-CB 3.66Å; C55-G57 VanDerWaalsContact C-N 3.25Å; C55-G57 PolarHBondContact O-N 2.75Å; C55-C58 PolarHBondContact O-N 2.88Å; C55-C58 VanDerWaalsContact SG-CB 3.52Å; C55-C58 PolarHBondContact SG-N 3.29Å; C55-F59 WeakPolarHBondContact O-CB 3.27Å; C55-F59 PolarHBondContact O-N 3.2Å
56	N	88.1	Confident	88.8	Confident	101 Å²	101	56.9 Å²	56.9	54%	0.54	30%	0.298	S	S	.	.	H	α-helix	trans	-53.9	-39.8	-178.1	-173.8	-97.8	0	0	0	113.7	H47 R60	H47-N56 PolarHBondContact NE2-ND2 3.42Å; N56-R60 PolarHBondContact O-N 2.86Å
57	G	88.2	Confident	88.8	Confident	46 Å²	46	60 Å²	60	47%	0.474	31%	0.313	S	S	.	.	H	α-helix	trans	-67.1	-50.3	177.5	0	0	0	0	0	113.2	C55 N61	C55-G57 VanDerWaalsContact C-N 3.25Å; C55-G57 PolarHBondContact O-N 2.75Å; G57-N61 PolarHBondContact O-ND2 2.77Å
58	C	92.8	Very high	88.7	Confident	21 Å²	21	61.3 Å²	61.3	14%	0.142	33%	0.328	C	S	.	.	H	α-helix	trans	-70.1	-36.8	179.5	-71.4	0	0	0	0	112.7	L37 Y54 C55 R60 N61 V62	L37-C58 HydrophobicContact CB-CB 4.06Å; L37-C58 HydrophobicContact CD1-CB 3.92Å; Y54-C58 HydrophobicContact CD1-CB 4.44Å; C55-C58 PolarHBondContact O-N 2.88Å; C55-C58 VanDerWaalsContact SG-CB 3.52Å; C55-C58 PolarHBondContact SG-N 3.29Å; C58-R60 VanDerWaalsContact C-N 3.29Å; C58-R60 PolarHBondContact O-N 3.46Å; C58-N61 WeakPolarHBondContact O-CB 3.26Å; C58-N61 PolarHBondContact O-N 3.1Å; C58-V62 PolarHBondContact O-N 3.32Å
59	F	89.9	Confident	88.8	Confident	6 Å²	6	61.9 Å²	61.9	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-56.2	-45.3	178	177.7	-106.2	0	0	0	110.9	H47 T48 F49 C55 N61 V62 V63 T74	H47-F59 HydrophobicContact CB-CB 3.95Å; H47-F59 HydrophobicContact CB-CD1 3.76Å; H47-F59 HydrophobicContact CB-CD2 3.24Å; H47-F59 HydrophobicContact CB-CE1 4.04Å; H47-F59 HydrophobicContact CB-CE2 3.52Å; H47-F59 HydrophobicContact CB-CG 3.35Å; H47-F59 HydrophobicContact CB-CZ 3.91Å; H47-F59 AromaticContact CD2-CD1 3.79Å; H47-F59 AromaticContact CD2-CG 3.89Å; H47-F59 AromaticContact CG-CD1 3.67Å; H47-F59 AromaticContact CG-CE1 3.98Å; H47-F59 AromaticContact CG-CG 3.73Å; T48-F59 WeakPolarHBondContact O-CE2 3.33Å; F49-F59 HydrophobicContact CB-CD2 4.17Å; F49-F59 HydrophobicContact CB-CE2 3.89Å; F49-F59 HydrophobicContact CD2-CE2 4.42Å; F49-F59 HydrophobicContact CG-CE2 4.46Å; C55-F59 WeakPolarHBondContact O-CB 3.27Å; C55-F59 PolarHBondContact O-N 3.2Å; F59-N61 PolarHBondContact O-N 2.83Å; F59-N61 VanDerWaalsContact O-N 3.1Å; F59-V62 HydrophobicContact CD2-CG2 4.45Å; F59-V62 VanDerWaalsContact O-CG2 3.25Å; F59-V62 WeakPolarHBondContact O-CG2 3.5Å; F59-V62 PolarHBondContact O-N 2.91Å; F59-V62 VanDerWaalsContact O-N 3.12Å; F59-V63 HydrophobicContact CD1-CB 4.45Å; F59-V63 HydrophobicContact CD1-CG1 4.03Å; F59-V63 HydrophobicContact CD2-CB 4.43Å; F59-V63 HydrophobicContact CE1-CB 4.03Å; F59-V63 HydrophobicContact CE1-CG1 3.8Å; F59-V63 HydrophobicContact CE1-CG2 4.13Å; F59-V63 HydrophobicContact CE2-CB 4.05Å; F59-V63 HydrophobicContact CE2-CG2 4.22Å; F59-V63 HydrophobicContact CZ-CB 3.83Å; F59-V63 HydrophobicContact CZ-CG1 4.14Å; F59-V63 HydrophobicContact CZ-CG2 3.71Å; F59-V63 WeakPolarHBondContact O-CB 3.15Å; F59-V63 WeakPolarHBondContact O-CG1 3.04Å; F59-V63 PolarHBondContact O-N 3.12Å; F59-T74 HydrophobicContact CE1-CG2 3.74Å; F59-T74 HydrophobicContact CZ-CG2 4.02Å
60	R	87.1	Confident	88.8	Confident	128 Å²	128	61.3 Å²	61.3	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-57.3	-24.7	175.8	176.1	-179.3	-76.9	-113	1.6	113.6	N56 C58 K65	N56-R60 PolarHBondContact O-N 2.86Å; C58-R60 VanDerWaalsContact C-N 3.29Å; C58-R60 PolarHBondContact O-N 3.46Å; R60-K65 WeakPolarHBondContact O-CE 3.37Å; R60-K65 PolarHBondContact O-NZ 3.3Å
61	N	86.4	Confident	88.9	Confident	123 Å²	123	64.6 Å²	64.6	66%	0.658	34%	0.344	S	S	*	.	H	α-helix	trans	-87	-27.5	179.9	-65.5	-35.7	0	0	0	112.9	G57 C58 F59	G57-N61 PolarHBondContact O-ND2 2.77Å; C58-N61 WeakPolarHBondContact O-CB 3.26Å; C58-N61 PolarHBondContact O-N 3.1Å; F59-N61 PolarHBondContact O-N 2.83Å; F59-N61 VanDerWaalsContact O-N 3.1Å
62	V	88.3	Confident	89	Confident	43 Å²	43	57.7 Å²	57.7	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-93.4	-33	-179.8	-62.3	0	0	0	0	112.8	L37 F49 Y54 C58 F59	L37-V62 HydrophobicContact CD1-CG1 3.52Å; F49-V62 HydrophobicContact CB-CG2 4.36Å; F49-V62 HydrophobicContact CD1-CB 4.17Å; F49-V62 HydrophobicContact CD1-CG2 4.01Å; F49-V62 WeakPolarHBondContact CE1-O 3.31Å; F49-V62 HydrophobicContact CG-CG2 4.37Å; Y54-V62 HydrophobicContact CD1-CG1 4.27Å; Y54-V62 HydrophobicContact CD1-CG2 4.01Å; Y54-V62 HydrophobicContact CD2-CG2 4.15Å; Y54-V62 HydrophobicContact CE1-CB 4.47Å; Y54-V62 HydrophobicContact CE1-CG1 3.84Å; Y54-V62 HydrophobicContact CE1-CG2 4.05Å; Y54-V62 HydrophobicContact CE2-CG2 4.21Å; Y54-V62 HydrophobicContact CG-CG2 4.06Å; C58-V62 PolarHBondContact O-N 3.32Å; F59-V62 HydrophobicContact CD2-CG2 4.45Å; F59-V62 VanDerWaalsContact O-CG2 3.25Å; F59-V62 WeakPolarHBondContact O-CG2 3.5Å; F59-V62 PolarHBondContact O-N 2.91Å; F59-V62 VanDerWaalsContact O-N 3.12Å
63	V	88.3	Confident	88.8	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.03	30%	0.295	C	S	.	.	S	Bend	trans	-76.9	135.8	-179.2	73.2	0	0	0	0	110.4	F49 F59 P72 L73	F49-V63 HydrophobicContact CD2-CB 4.46Å; F49-V63 HydrophobicContact CD2-CG2 4.22Å; F49-V63 HydrophobicContact CE2-CG2 4.13Å; F59-V63 HydrophobicContact CD1-CB 4.45Å; F59-V63 HydrophobicContact CD1-CG1 4.03Å; F59-V63 HydrophobicContact CD2-CB 4.43Å; F59-V63 HydrophobicContact CE1-CB 4.03Å; F59-V63 HydrophobicContact CE1-CG1 3.8Å; F59-V63 HydrophobicContact CE1-CG2 4.13Å; F59-V63 HydrophobicContact CE2-CB 4.05Å; F59-V63 HydrophobicContact CE2-CG2 4.22Å; F59-V63 HydrophobicContact CZ-CB 3.83Å; F59-V63 HydrophobicContact CZ-CG1 4.14Å; F59-V63 HydrophobicContact CZ-CG2 3.71Å; F59-V63 WeakPolarHBondContact O-CB 3.15Å; F59-V63 WeakPolarHBondContact O-CG1 3.04Å; F59-V63 PolarHBondContact O-N 3.12Å; V63-P72 HydrophobicContact CG1-CB 3.34Å; V63-P72 HydrophobicContact CG2-CB 4.5Å; V63-L73 WeakPolarHBondContact CG2-O 3.25Å
64	P	88.7	Confident	88.3	Confident	24 Å²	24	55 Å²	55	16%	0.156	31%	0.306	C	S	.	.			trans	-63.2	146.4	174.4	25.4	-32.9	0	0	0	110.7	L73 Y87	P64-L73 HydrophobicContact CB-CD1 4.14Å; P64-L73 HydrophobicContact CG-CB 4.36Å; P64-L73 HydrophobicContact CG-CD1 4.22Å; P64-L73 WeakPolarHBondContact O-CB 3.35Å; P64-L73 WeakPolarHBondContact O-CG 3.3Å; P64-L73 PolarHBondContact O-N 2.76Å; P64-Y87 HydrophobicContact CB-CD1 4.06Å; P64-Y87 HydrophobicContact CB-CD2 3.57Å; P64-Y87 HydrophobicContact CB-CE1 4.28Å; P64-Y87 HydrophobicContact CB-CE2 3.86Å; P64-Y87 HydrophobicContact CB-CG 3.73Å; P64-Y87 HydrophobicContact CG-CD1 4.29Å; P64-Y87 HydrophobicContact CG-CE1 4.4Å; P64-Y87 HydrophobicContact CG-CG 4.42Å
65	K	90	Very high	87.2	Confident	88 Å²	88	60 Å²	60	38%	0.383	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-109.4	142.3	-178.5	-61	172	-168.5	163.6	0	109.9	R60 K67	R60-K65 WeakPolarHBondContact O-CE 3.37Å; R60-K65 PolarHBondContact O-NZ 3.3Å; K65-K67 PolarHBondContact O-N 2.98Å
66	C	90.6	Very high	86	Confident	1 Å²	1	63 Å²	63	1%	0.007	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-62.7	119.8	171.8	178.6	0	0	0	0	109.8	S68 C69 G70 K71 L73 Y87 H89	C66-S68 PolarHBondContact O-N 3.18Å; C66-S68 PolarHBondContact SG-N 3.21Å; C66-S68 VanDerWaalsContact SG-N 3.43Å; C66-C69 WeakPolarHBondContact CB-SG 3.11Å; C66-C69 PolarHBondContact SG-N 3.4Å; C66-C69 VanDerWaalsContact SG-N 3.39Å; C66-G70 WeakPolarHBondContact O-CA 3.39Å; C66-G70 PolarHBondContact O-N 2.95Å; C66-K71 PolarHBondContact N-O 3.1Å; C66-L73 HydrophobicContact CB-CD2 4.2Å; C66-Y87 CarbonylContact C-O 3.52Å; C66-Y87 VanDerWaalsContact CA-O 3.26Å; C66-Y87 WeakPolarHBondContact CA-O 2.83Å; C66-H89 VanDerWaalsContact CB-CE1 3.49Å; C66-H89 WeakPolarHBondContact CB-CE1 3.39Å; C66-H89 WeakPolarHBondContact CB-ND1 3.48Å
67	K	88.8	Confident	85.3	Confident	139 Å²	139	64 Å²	64	60%	0.604	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.9	177	-73.9	-81.2	-174.1	172.2	0	113.1	K65 A86 Y87 W88	K65-K67 PolarHBondContact O-N 2.98Å; K67-A86 HydrophobicContact CG-CB 4.23Å; K67-Y87 PolarHBondContact N-O 2.65Å; K67-W88 HydrophobicContact CB-CD2 4.37Å; K67-W88 HydrophobicContact CB-CH2 4.48Å; K67-W88 HydrophobicContact CB-CZ2 3.71Å; K67-W88 HydrophobicContact CG-CZ2 4.22Å
68	S	87.8	Confident	85.1	Confident	74 Å²	74	68.9 Å²	68.9	52%	0.517	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-46.8	179.8	174.3	0	0	0	0	113.5	C66 W88	C66-S68 PolarHBondContact O-N 3.18Å; C66-S68 PolarHBondContact SG-N 3.21Å; C66-S68 VanDerWaalsContact SG-N 3.43Å; S68-W88 VanDerWaalsContact CB-CD1 3.43Å
69	C	88.1	Confident	84.9	Confident	56 Å²	56	73.1 Å²	73.1	38%	0.378	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-7.1	-177.9	73.8	0	0	0	0	114.7	C66 K71 H89	C66-C69 WeakPolarHBondContact CB-SG 3.11Å; C66-C69 PolarHBondContact SG-N 3.4Å; C66-C69 VanDerWaalsContact SG-N 3.39Å; C69-K71 PolarHBondContact O-N 3.4Å; C69-K71 VanDerWaalsContact O-N 3.15Å; C69-H89 PolarHBondContact SG-CE1 2.96Å; C69-H89 PolarHBondContact SG-ND1 3.17Å
70	G	86.5	Confident	84.8	Confident	42 Å²	42	78.2 Å²	78.2	43%	0.433	41%	0.407	S	S	.	.			trans	72.8	-2.7	-179.5	0	0	0	0	0	115.4	C66	C66-G70 WeakPolarHBondContact O-CA 3.39Å; C66-G70 PolarHBondContact O-N 2.95Å
71	K	88.6	Confident	84.9	Confident	139 Å²	139	76.6 Å²	76.6	60%	0.604	40%	0.404	S	S	*	.			trans	-79.4	145	-179.1	-62.8	177.4	-179.2	176.5	0	111.4	C66 C69	C66-K71 PolarHBondContact N-O 3.1Å; C69-K71 PolarHBondContact O-N 3.4Å; C69-K71 VanDerWaalsContact O-N 3.15Å
72	P	86.6	Confident	84.9	Confident	30 Å²	30	71.6 Å²	71.6	20%	0.195	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-65.6	139.4	175.9	27.7	-34.2	0	0	0	111.3	V63 T74	V63-P72 HydrophobicContact CG1-CB 3.34Å; V63-P72 HydrophobicContact CG2-CB 4.5Å; P72-T74 PolarHBondContact O-N 3.23Å; P72-T74 VanDerWaalsContact O-N 3.1Å
73	L	86.7	Confident	84.7	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.021	39%	0.387	C	S	.	.			trans	-84.1	80.8	177.8	-62.1	163.3	0	0	0	108.8	V63 P64 C66 Y79 Y87 H89	V63-L73 WeakPolarHBondContact CG2-O 3.25Å; P64-L73 HydrophobicContact CB-CD1 4.14Å; P64-L73 HydrophobicContact CG-CB 4.36Å; P64-L73 HydrophobicContact CG-CD1 4.22Å; P64-L73 WeakPolarHBondContact O-CB 3.35Å; P64-L73 WeakPolarHBondContact O-CG 3.3Å; P64-L73 PolarHBondContact O-N 2.76Å; C66-L73 HydrophobicContact CB-CD2 4.2Å; L73-Y79 HydrophobicContact CB-CD1 4.26Å; L73-Y79 HydrophobicContact CB-CG 4.37Å; L73-Y79 HydrophobicContact CD1-CD2 4.31Å; L73-Y79 HydrophobicContact CD1-CG 4.15Å; L73-Y79 HydrophobicContact CD2-CG 4.41Å; L73-Y87 HydrophobicContact CD1-CD1 4.35Å; L73-Y87 HydrophobicContact CD1-CG 4.01Å; L73-H89 WeakPolarHBondContact CD2-CD2 3.31Å; L73-H89 VanDerWaalsContact CD2-NE2 3.3Å; L73-H89 WeakPolarHBondContact CD2-NE2 3.46Å
74	T	78.7	Confident	84.4	Confident	45 Å²	45	78.1 Å²	78.1	28%	0.276	42%	0.415	S	S	.	.			trans	-63.5	151.6	-179.6	47.4	0	0	0	0	112.4	F59 P72 G76 K77	F59-T74 HydrophobicContact CE1-CG2 3.74Å; F59-T74 HydrophobicContact CZ-CG2 4.02Å; P72-T74 PolarHBondContact O-N 3.23Å; P72-T74 VanDerWaalsContact O-N 3.1Å; T74-G76 PolarHBondContact O-N 3.36Å; T74-K77 PolarHBondContact O-N 3.34Å
75	E	67.4	Low	84.1	Confident	121 Å²	121	84.4 Å²	84.4	57%	0.565	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	137.1	169.8	-71.3	-165.3	83.5	0	0	111.1	T48	T48-E75 VanDerWaalsContact CB-OE2 3.3Å; T48-E75 WeakPolarHBondContact CB-OE2 3.44Å; T48-E75 PolarHBondContact OG1-OE2 2.86Å
76	G	67.4	Low	84	Confident	88 Å²	88	80.7 Å²	80.7	91%	0.907	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.3	-11.4	-179.4	0	0	0	0	0	115.4	T74	T74-G76 PolarHBondContact O-N 3.36Å
77	K	75	Confident	84	Confident	120 Å²	120	82.4 Å²	82.4	52%	0.522	44%	0.435	S	S	.	.	S	Bend	trans	-99.5	133.6	168.5	-68.9	-163.3	174.5	-163.3	0	110.7	T74	T74-K77 PolarHBondContact O-N 3.34Å
78	E	83.1	Confident	84.1	Confident	150 Å²	150	76.1 Å²	76.1	70%	0.701	41%	0.407	S	S	*	.			trans	-69.9	136.7	173.6	-60.3	179.4	92.4	0	0	110.5	L90	E78-L90 HydrophobicContact CB-CD1 3.26Å; E78-L90 HydrophobicContact CB-CD2 4.41Å; E78-L90 HydrophobicContact CB-CG 3.55Å; E78-L90 HydrophobicContact CG-CD1 4.05Å; E78-L90 PolarHBondContact O-N 2.87Å
79	Y	88.1	Confident	84.2	Confident	110 Å²	110	73.2 Å²	73.2	43%	0.431	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	156.2	178.6	63	-94.5	0	0	0	111.2	L73 Y87 W88	L73-Y79 HydrophobicContact CB-CD1 4.26Å; L73-Y79 HydrophobicContact CB-CG 4.37Å; L73-Y79 HydrophobicContact CD1-CD2 4.31Å; L73-Y79 HydrophobicContact CD1-CG 4.15Å; L73-Y79 HydrophobicContact CD2-CG 4.41Å; Y79-Y87 AromaticContact CD2-CD1 3.87Å; Y79-Y87 HydrophobicContact CD2-CD1 3.87Å; Y79-Y87 AromaticContact CE2-CD1 3.8Å; Y79-Y87 HydrophobicContact CE2-CD1 3.8Å; Y79-Y87 HydrophobicContact CE2-CE1 4.12Å; Y79-W88 CarbonylContact C-O 3.51Å; Y79-W88 VanDerWaalsContact CA-O 3.27Å; Y79-W88 WeakPolarHBondContact CA-O 3.5Å; Y79-W88 VanDerWaalsContact CB-O 3.31Å; Y79-W88 WeakPolarHBondContact CB-O 3.39Å
80	R	89.3	Confident	84.2	Confident	112 Å²	112	73.1 Å²	73.1	42%	0.423	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.1	176.4	-149.5	73.7	-174.6	152.3	-0.6	109.6	Y87 W88 L90 F93 V104	R80-Y87 CarbonylContact O-C 3.58Å; R80-Y87 WeakPolarHBondContact O-CA 3.32Å; R80-W88 PolarHBondContact N-O 3.39Å; R80-W88 PolarHBondContact O-N 3.02Å; R80-L90 HydrophobicContact CB-CD2 4.3Å; R80-F93 HydrophobicContact CB-CB 4.27Å; R80-F93 HydrophobicContact CB-CD1 4.28Å; R80-F93 HydrophobicContact CB-CD2 4.31Å; R80-F93 HydrophobicContact CB-CG 4.03Å; R80-F93 HydrophobicContact CG-CD1 3.88Å; R80-F93 HydrophobicContact CG-CE1 4.06Å; R80-F93 HydrophobicContact CG-CG 4.14Å; R80-V104 HydrophobicContact CG-CB 4.17Å; R80-V104 HydrophobicContact CG-CG2 4.07Å
81	K	89.3	Confident	84.3	Confident	95 Å²	95	78 Å²	78	41%	0.413	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	108.8	169.8	-177.9	178.3	-178.8	172.7	0	108.2	T83 D84 Y87 V104	K81-T83 WeakPolarHBondContact CE-O 3.44Å; K81-T83 WeakPolarHBondContact CG-O 3.12Å; K81-D84 VanDerWaalsContact CE-CA 3.47Å; K81-D84 IonicContact NZ-OD2 2.77Å; K81-D84 PolarHBondContact NZ-OD2 2.77Å; K81-Y87 HydrophobicContact CB-CD1 3.88Å; K81-Y87 HydrophobicContact CB-CE1 3.85Å; K81-Y87 HydrophobicContact CD-CE1 3.67Å; K81-Y87 VanDerWaalsContact CE-OH 3.31Å; K81-Y87 WeakPolarHBondContact CE-OH 3.29Å; K81-Y87 HydrophobicContact CG-CD1 3.97Å; K81-Y87 HydrophobicContact CG-CE1 3.56Å; K81-Y87 PolarHBondContact NZ-OH 3.38Å; K81-V104 WeakPolarHBondContact O-CG2 3.37Å
82	A	85.8	Confident	84.4	Confident	18 Å²	18	72.3 Å²	72.3	15%	0.149	37%	0.37	C	S	.	.			trans	-96.3	-30.1	179.2	0	0	0	0	0	113.2	A86 W88 F93 V104 F107	A82-A86 PolarHBondContact N-O 3.33Å; A82-W88 HydrophobicContact CB-CE3 3.81Å; A82-W88 HydrophobicContact CB-CH2 4.15Å; A82-W88 HydrophobicContact CB-CZ3 3.28Å; A82-F93 HydrophobicContact CB-CE2 3.8Å; A82-F93 HydrophobicContact CB-CZ 3.93Å; A82-V104 HydrophobicContact CB-CG2 3.98Å; A82-F107 HydrophobicContact CB-CD1 4.33Å; A82-F107 HydrophobicContact CB-CE1 3.54Å; A82-F107 HydrophobicContact CB-CE2 4.19Å; A82-F107 HydrophobicContact CB-CZ 3.45Å; A82-F107 VanDerWaalsContact CB-CZ 3.45Å
83	T	84.1	Confident	84.6	Confident	66 Å²	66	71.2 Å²	71.2	41%	0.405	36%	0.362	S	S	.	.	S	Bend	trans	-136.7	-179.2	166.8	73.7	0	0	0	0	109.5	K81 E85 A86 F107	K81-T83 WeakPolarHBondContact CE-O 3.44Å; K81-T83 WeakPolarHBondContact CG-O 3.12Å; T83-E85 PolarHBondContact O-N 3.1Å; T83-A86 HydrophobicContact CG2-CB 4.34Å; T83-A86 PolarHBondContact N-O 3.11Å; T83-A86 PolarHBondContact O-N 2.96Å; T83-A86 WeakPolarHBondContact OG1-CB 3.26Å; T83-A86 PolarHBondContact OG1-N 3.18Å; T83-A86 VanDerWaalsContact OG1-N 3.12Å; T83-F107 HydrophobicContact CG2-CZ 4.26Å
84	D	82.5	Confident	84.9	Confident	118 Å²	118	73.2 Å²	73.2	63%	0.631	37%	0.373	S	S	*	.	S	Bend	trans	-60.2	-32.6	179.6	-162.7	-117.8	0	0	0	113.5	K81 Y87	K81-D84 VanDerWaalsContact CE-CA 3.47Å; K81-D84 IonicContact NZ-OD2 2.77Å; K81-D84 PolarHBondContact NZ-OD2 2.77Å; D84-Y87 WeakPolarHBondContact O-CE2 3.35Å; D84-Y87 VanDerWaalsContact O-CZ 3.28Å; D84-Y87 PolarHBondContact O-OH 2.88Å
85	E	82.3	Confident	85.6	Confident	157 Å²	157	71 Å²	71	73%	0.734	36%	0.359	S	S	*	.	S	Bend	trans	-113.1	-2.1	-175.7	-59.8	177.5	86.3	0	0	113.4	T83	T83-E85 PolarHBondContact O-N 3.1Å
86	A	86.9	Confident	86.6	Confident	9 Å²	9	68 Å²	68	7%	0.074	35%	0.351	C	S	.	.			trans	-117.6	114.4	-174.7	0	0	0	0	0	111.2	K67 A82 T83 W88	K67-A86 HydrophobicContact CG-CB 4.23Å; A82-A86 PolarHBondContact N-O 3.33Å; T83-A86 HydrophobicContact CG2-CB 4.34Å; T83-A86 PolarHBondContact N-O 3.11Å; T83-A86 PolarHBondContact O-N 2.96Å; T83-A86 WeakPolarHBondContact OG1-CB 3.26Å; T83-A86 PolarHBondContact OG1-N 3.18Å; T83-A86 VanDerWaalsContact OG1-N 3.12Å; A86-W88 HydrophobicContact CB-CE3 4.38Å; A86-W88 HydrophobicContact CB-CH2 3.27Å; A86-W88 HydrophobicContact CB-CZ2 4.31Å; A86-W88 HydrophobicContact CB-CZ3 3.29Å; A86-W88 VanDerWaalsContact O-CZ3 3.23Å; A86-W88 WeakPolarHBondContact O-CZ3 3.44Å
87	Y	90.1	Very high	87.8	Confident	38 Å²	38	71.3 Å²	71.3	15%	0.149	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148.8	-176.6	-56.1	-104.7	0	0	0	110.1	P64 C66 K67 L73 Y79 R80 K81 D84	P64-Y87 HydrophobicContact CB-CD1 4.06Å; P64-Y87 HydrophobicContact CB-CD2 3.57Å; P64-Y87 HydrophobicContact CB-CE1 4.28Å; P64-Y87 HydrophobicContact CB-CE2 3.86Å; P64-Y87 HydrophobicContact CB-CG 3.73Å; P64-Y87 HydrophobicContact CG-CD1 4.29Å; P64-Y87 HydrophobicContact CG-CE1 4.4Å; P64-Y87 HydrophobicContact CG-CG 4.42Å; C66-Y87 CarbonylContact C-O 3.52Å; C66-Y87 VanDerWaalsContact CA-O 3.26Å; C66-Y87 WeakPolarHBondContact CA-O 2.83Å; K67-Y87 PolarHBondContact N-O 2.65Å; L73-Y87 HydrophobicContact CD1-CD1 4.35Å; L73-Y87 HydrophobicContact CD1-CG 4.01Å; Y79-Y87 AromaticContact CD2-CD1 3.87Å; Y79-Y87 HydrophobicContact CD2-CD1 3.87Å; Y79-Y87 AromaticContact CE2-CD1 3.8Å; Y79-Y87 HydrophobicContact CE2-CD1 3.8Å; Y79-Y87 HydrophobicContact CE2-CE1 4.12Å; R80-Y87 CarbonylContact O-C 3.58Å; R80-Y87 WeakPolarHBondContact O-CA 3.32Å; K81-Y87 HydrophobicContact CB-CD1 3.88Å; K81-Y87 HydrophobicContact CB-CE1 3.85Å; K81-Y87 HydrophobicContact CD-CE1 3.67Å; K81-Y87 VanDerWaalsContact CE-OH 3.31Å; K81-Y87 WeakPolarHBondContact CE-OH 3.29Å; K81-Y87 HydrophobicContact CG-CD1 3.97Å; K81-Y87 HydrophobicContact CG-CE1 3.56Å; K81-Y87 PolarHBondContact NZ-OH 3.38Å; D84-Y87 WeakPolarHBondContact O-CE2 3.35Å; D84-Y87 VanDerWaalsContact O-CZ 3.28Å; D84-Y87 PolarHBondContact O-OH 2.88Å
88	W	90.7	Very high	88.6	Confident	7 Å²	7	67.8 Å²	67.8	3%	0.027	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	150.1	178	-69.8	-103.1	0	0	0	110.4	K67 S68 Y79 R80 A82 A86 C92 F93 L109	K67-W88 HydrophobicContact CB-CD2 4.37Å; K67-W88 HydrophobicContact CB-CH2 4.48Å; K67-W88 HydrophobicContact CB-CZ2 3.71Å; K67-W88 HydrophobicContact CG-CZ2 4.22Å; S68-W88 VanDerWaalsContact CB-CD1 3.43Å; Y79-W88 CarbonylContact C-O 3.51Å; Y79-W88 VanDerWaalsContact CA-O 3.27Å; Y79-W88 WeakPolarHBondContact CA-O 3.5Å; Y79-W88 VanDerWaalsContact CB-O 3.31Å; Y79-W88 WeakPolarHBondContact CB-O 3.39Å; R80-W88 PolarHBondContact N-O 3.39Å; R80-W88 PolarHBondContact O-N 3.02Å; A82-W88 HydrophobicContact CB-CE3 3.81Å; A82-W88 HydrophobicContact CB-CH2 4.15Å; A82-W88 HydrophobicContact CB-CZ3 3.28Å; A86-W88 HydrophobicContact CB-CE3 4.38Å; A86-W88 HydrophobicContact CB-CH2 3.27Å; A86-W88 HydrophobicContact CB-CZ2 4.31Å; A86-W88 HydrophobicContact CB-CZ3 3.29Å; A86-W88 VanDerWaalsContact O-CZ3 3.23Å; A86-W88 WeakPolarHBondContact O-CZ3 3.44Å; W88-C92 HydrophobicContact CB-CB 4.46Å; W88-F93 HydrophobicContact CB-CB 4.14Å; W88-F93 HydrophobicContact CB-CD2 3.71Å; W88-F93 HydrophobicContact CB-CG 4.37Å; W88-F93 AromaticContact CD2-CD2 3.86Å; W88-F93 HydrophobicContact CD2-CD2 3.86Å; W88-F93 HydrophobicContact CD2-CE2 4.05Å; W88-F93 HydrophobicContact CE3-CD2 4.03Å; W88-F93 AromaticContact CE3-CE2 3.86Å; W88-F93 HydrophobicContact CE3-CE2 3.86Å; W88-F93 AromaticContact CG-CD2 3.74Å; W88-F93 HydrophobicContact CG-CD2 3.74Å; W88-F93 HydrophobicContact CG-CE2 4.41Å; W88-F93 HydrophobicContact CZ3-CE2 4.33Å; W88-L109 HydrophobicContact CH2-CD1 4.22Å; W88-L109 HydrophobicContact CH2-CD2 4.42Å; W88-L109 HydrophobicContact CZ2-CD1 4.37Å; W88-L109 HydrophobicContact CZ2-CD2 3.88Å
89	H	91.2	Very high	89	Confident	13 Å²	13	66.2 Å²	66.2	6%	0.06	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	153.9	163.5	-58.7	100.5	0	0	0	109.6	C66 C69 L73 E91 C92 F93	C66-H89 VanDerWaalsContact CB-CE1 3.49Å; C66-H89 WeakPolarHBondContact CB-CE1 3.39Å; C66-H89 WeakPolarHBondContact CB-ND1 3.48Å; C69-H89 PolarHBondContact SG-CE1 2.96Å; C69-H89 PolarHBondContact SG-ND1 3.17Å; L73-H89 WeakPolarHBondContact CD2-CD2 3.31Å; L73-H89 VanDerWaalsContact CD2-NE2 3.3Å; L73-H89 WeakPolarHBondContact CD2-NE2 3.46Å; H89-E91 HydrophobicContact CB-CG 3.76Å; H89-E91 PolarHBondContact O-N 3.19Å; H89-C92 HydrophobicContact CB-CB 4Å; H89-C92 CarbonylContact O-C 3.55Å; H89-C92 WeakPolarHBondContact O-CA 3.38Å; H89-C92 PolarHBondContact O-N 2.75Å; H89-F93 PolarHBondContact O-N 2.77Å
90	L	88	Confident	89.1	Confident	53 Å²	53	67.6 Å²	67.6	28%	0.277	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-54.8	-42.5	174.6	-66.8	-168.4	0	0	0	112.1	E78 R80 C92 F93	E78-L90 HydrophobicContact CB-CD1 3.26Å; E78-L90 HydrophobicContact CB-CD2 4.41Å; E78-L90 HydrophobicContact CB-CG 3.55Å; E78-L90 HydrophobicContact CG-CD1 4.05Å; E78-L90 PolarHBondContact O-N 2.87Å; R80-L90 HydrophobicContact CB-CD2 4.3Å; L90-C92 VanDerWaalsContact C-N 3.29Å; L90-C92 PolarHBondContact O-N 3.12Å; L90-F93 PolarHBondContact O-N 2.9Å
91	E	88.4	Confident	89.1	Confident	145 Å²	145	69.5 Å²	69.5	68%	0.678	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-68.9	-22.8	174.9	58.7	177.4	96.3	0	0	113.8	H89 L94	H89-E91 HydrophobicContact CB-CG 3.76Å; H89-E91 PolarHBondContact O-N 3.19Å; E91-L94 WeakPolarHBondContact O-CD1 3.45Å; E91-L94 VanDerWaalsContact O-CG 3.32Å; E91-L94 WeakPolarHBondContact O-CG 3.37Å
92	C	90.5	Very high	89.1	Confident	20 Å²	20	65.3 Å²	65.3	14%	0.135	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-91.2	-10.9	177.1	-62.9	0	0	0	0	112.5	W88 H89 L90 L94	W88-C92 HydrophobicContact CB-CB 4.46Å; H89-C92 HydrophobicContact CB-CB 4Å; H89-C92 CarbonylContact O-C 3.55Å; H89-C92 WeakPolarHBondContact O-CA 3.38Å; H89-C92 PolarHBondContact O-N 2.75Å; L90-C92 VanDerWaalsContact C-N 3.29Å; L90-C92 PolarHBondContact O-N 3.12Å; C92-L94 PolarHBondContact O-N 3.22Å
93	F	91.8	Very high	89.1	Confident	7 Å²	7	69.8 Å²	69.8	3%	0.031	35%	0.353	C	S	.	.			trans	-85.7	49.5	-179.4	-154.9	-112.5	0	0	0	111.3	R80 A82 W88 H89 L90 V102 V104 F107 L114	R80-F93 HydrophobicContact CB-CB 4.27Å; R80-F93 HydrophobicContact CB-CD1 4.28Å; R80-F93 HydrophobicContact CB-CD2 4.31Å; R80-F93 HydrophobicContact CB-CG 4.03Å; R80-F93 HydrophobicContact CG-CD1 3.88Å; R80-F93 HydrophobicContact CG-CE1 4.06Å; R80-F93 HydrophobicContact CG-CG 4.14Å; A82-F93 HydrophobicContact CB-CE2 3.8Å; A82-F93 HydrophobicContact CB-CZ 3.93Å; W88-F93 HydrophobicContact CB-CB 4.14Å; W88-F93 HydrophobicContact CB-CD2 3.71Å; W88-F93 HydrophobicContact CB-CG 4.37Å; W88-F93 AromaticContact CD2-CD2 3.86Å; W88-F93 HydrophobicContact CD2-CD2 3.86Å; W88-F93 HydrophobicContact CD2-CE2 4.05Å; W88-F93 HydrophobicContact CE3-CD2 4.03Å; W88-F93 AromaticContact CE3-CE2 3.86Å; W88-F93 HydrophobicContact CE3-CE2 3.86Å; W88-F93 AromaticContact CG-CD2 3.74Å; W88-F93 HydrophobicContact CG-CD2 3.74Å; W88-F93 HydrophobicContact CG-CE2 4.41Å; W88-F93 HydrophobicContact CZ3-CE2 4.33Å; H89-F93 PolarHBondContact O-N 2.77Å; L90-F93 PolarHBondContact O-N 2.9Å; F93-V102 HydrophobicContact CD1-CB 4.11Å; F93-V102 WeakPolarHBondContact CD1-O 3.27Å; F93-V102 HydrophobicContact CE1-CB 3.92Å; F93-V102 HydrophobicContact CE1-CG1 4.45Å; F93-V102 WeakPolarHBondContact CE1-O 3.44Å; F93-V102 HydrophobicContact CZ-CB 4.45Å; F93-V102 PolarHBondContact O-N 3.21Å; F93-V104 HydrophobicContact CE1-CB 4.28Å; F93-V104 HydrophobicContact CZ-CB 4.47Å; F93-F107 HydrophobicContact CZ-CB 4.46Å; F93-F107 HydrophobicContact CZ-CD1 4.21Å; F93-F107 HydrophobicContact CZ-CG 4.26Å; F93-L114 VanDerWaalsContact C-CD2 3.44Å; F93-L114 HydrophobicContact CB-CD2 4.24Å; F93-L114 HydrophobicContact CD1-CD2 4.32Å; F93-L114 HydrophobicContact CD2-CD1 4.13Å; F93-L114 HydrophobicContact CD2-CD2 3.33Å; F93-L114 HydrophobicContact CD2-CG 4.39Å; F93-L114 HydrophobicContact CE2-CD1 3.57Å; F93-L114 HydrophobicContact CE2-CD2 3.62Å; F93-L114 HydrophobicContact CE2-CG 4.26Å; F93-L114 HydrophobicContact CG-CD2 3.72Å; F93-L114 HydrophobicContact CZ-CD1 4.1Å; F93-L114 HydrophobicContact CZ-CD2 4.23Å
94	L	91.9	Very high	89.1	Confident	45 Å²	45	68.2 Å²	68.2	24%	0.236	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-110.7	144.8	-178.5	-59.5	173.6	0	0	0	110.7	E91 C92 S96 K100 Q101	E91-L94 WeakPolarHBondContact O-CD1 3.45Å; E91-L94 VanDerWaalsContact O-CG 3.32Å; E91-L94 WeakPolarHBondContact O-CG 3.37Å; C92-L94 PolarHBondContact O-N 3.22Å; L94-S96 PolarHBondContact O-N 2.84Å; L94-K100 CarbonylContact C-O 3.53Å; L94-K100 VanDerWaalsContact CA-O 3.32Å; L94-K100 WeakPolarHBondContact CA-O 3.13Å; L94-Q101 HydrophobicContact CD2-CB 4.29Å; L94-Q101 HydrophobicContact CD2-CG 3.62Å
95	C	93	Very high	89.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.349	C	S	.	.			trans	-67.5	124.8	177.2	175.5	0	0	0	0	109.7	K97 C98 N99 K100 V102 L114 C116	C95-K97 PolarHBondContact O-N 3.01Å; C95-K97 PolarHBondContact SG-N 3.06Å; C95-C98 WeakPolarHBondContact CB-SG 3.2Å; C95-C98 PolarHBondContact SG-N 2.79Å; C95-N99 WeakPolarHBondContact O-CA 3.36Å; C95-N99 PolarHBondContact O-N 3.18Å; C95-K100 PolarHBondContact N-O 3.32Å; C95-V102 HydrophobicContact CB-CG2 3.72Å; C95-L114 CarbonylContact C-O 3.47Å; C95-L114 WeakPolarHBondContact CA-O 3.45Å; C95-C116 HydrophobicContact CB-CB 4.05Å; C95-C116 PolarHBondContact SG-N 2.89Å; C95-C116 VanDerWaalsContact SG-SG 3.66Å
96	S	89.9	Confident	89.4	Confident	56 Å²	56	67.3 Å²	67.3	39%	0.392	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-5.3	176.7	-70.2	0	0	0	0	114.6	L94 L114	L94-S96 PolarHBondContact O-N 2.84Å; S96-L114 PolarHBondContact N-O 2.98Å; S96-L114 PolarHBondContact OG-O 2.8Å
97	K	91.3	Very high	89.5	Confident	158 Å²	158	69.3 Å²	69.3	69%	0.687	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-56.6	175.9	-67.3	-82.5	-165.6	173.1	0	111.5	C95 I115 C119	C95-K97 PolarHBondContact O-N 3.01Å; C95-K97 PolarHBondContact SG-N 3.06Å; K97-I115 HydrophobicContact CG-CD1 3.57Å; K97-I115 HydrophobicContact CG-CG2 4.32Å; K97-C119 HydrophobicContact CB-CB 3.84Å; K97-C119 HydrophobicContact CG-CB 4.1Å
98	C	93.1	Very high	89.5	Confident	46 Å²	46	69 Å²	69	31%	0.311	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-4.5	-176.4	68.6	0	0	0	0	114.4	C95 K100 C116	C95-C98 WeakPolarHBondContact CB-SG 3.2Å; C95-C98 PolarHBondContact SG-N 2.79Å; C98-K100 HydrophobicContact CB-CG 4.31Å; C98-K100 PolarHBondContact O-N 2.78Å; C98-K100 VanDerWaalsContact O-N 3.08Å; C98-C116 VanDerWaalsContact SG-SG 3.67Å
99	N	90	Very high	89.3	Confident	118 Å²	118	72.8 Å²	72.8	63%	0.631	38%	0.378	S	S	*	.			trans	55	21.5	-176.8	-150.1	65.7	0	0	0	114.9	C95	C95-N99 WeakPolarHBondContact O-CA 3.36Å; C95-N99 PolarHBondContact O-N 3.18Å
100	K	91	Very high	89	Confident	138 Å²	138	74.2 Å²	74.2	60%	0.6	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-93	154.4	175.6	-60	-174.6	179.9	-174.9	0	111.3	L94 C95 C98 V102	L94-K100 CarbonylContact C-O 3.53Å; L94-K100 VanDerWaalsContact CA-O 3.32Å; L94-K100 WeakPolarHBondContact CA-O 3.13Å; C95-K100 PolarHBondContact N-O 3.32Å; C98-K100 HydrophobicContact CB-CG 4.31Å; C98-K100 PolarHBondContact O-N 2.78Å; C98-K100 VanDerWaalsContact O-N 3.08Å; K100-V102 PolarHBondContact O-N 2.93Å
101	Q	88.3	Confident	88.8	Confident	153 Å²	153	79.1 Å²	79.1	72%	0.715	42%	0.418	S	S	*	.	B	Isolated β-bridge	trans	-57.1	127.6	173.7	-70.9	175.6	-88.6	0	0	110.6	L94	L94-Q101 HydrophobicContact CD2-CB 4.29Å; L94-Q101 HydrophobicContact CD2-CG 3.62Å
102	V	89.5	Confident	88.4	Confident	7 Å²	7	79.6 Å²	79.6	4%	0.042	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-89.5	146.9	179.7	-167.5	0	0	0	0	109.4	F93 C95 K100 F107 L114 C116	F93-V102 HydrophobicContact CD1-CB 4.11Å; F93-V102 WeakPolarHBondContact CD1-O 3.27Å; F93-V102 HydrophobicContact CE1-CB 3.92Å; F93-V102 HydrophobicContact CE1-CG1 4.45Å; F93-V102 WeakPolarHBondContact CE1-O 3.44Å; F93-V102 HydrophobicContact CZ-CB 4.45Å; F93-V102 PolarHBondContact O-N 3.21Å; C95-V102 HydrophobicContact CB-CG2 3.72Å; K100-V102 PolarHBondContact O-N 2.93Å; V102-F107 HydrophobicContact CG1-CB 3.36Å; V102-L114 HydrophobicContact CB-CD2 3.98Å; V102-L114 HydrophobicContact CB-CG 4.35Å; V102-L114 HydrophobicContact CG2-CD2 3.7Å; V102-L114 HydrophobicContact CG2-CG 3.97Å; V102-C116 HydrophobicContact CG1-CB 3.96Å; V102-C116 HydrophobicContact CG2-CB 4.15Å
103	N	86.9	Confident	88.1	Confident	112 Å²	112	84.2 Å²	84.2	60%	0.599	44%	0.443	S	S	*	.	B	Isolated β-bridge	trans	-81.2	132.1	173	-77	-8.4	0	0	0	110.8	S105 K106	N103-S105 PolarHBondContact O-N 3.35Å; N103-S105 VanDerWaalsContact O-N 3.13Å; N103-K106 HydrophobicContact CB-CB 4.26Å; N103-K106 CarbonylContact O-C 3.53Å; N103-K106 VanDerWaalsContact O-C 3.26Å; N103-K106 PolarHBondContact O-N 2.89Å
104	V	83.9	Confident	87.9	Confident	33 Å²	33	84.1 Å²	84.1	20%	0.2	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-26	-179.2	72.4	0	0	0	0	113	R80 K81 A82 F93 F107	R80-V104 HydrophobicContact CG-CB 4.17Å; R80-V104 HydrophobicContact CG-CG2 4.07Å; K81-V104 WeakPolarHBondContact O-CG2 3.37Å; A82-V104 HydrophobicContact CB-CG2 3.98Å; F93-V104 HydrophobicContact CE1-CB 4.28Å; F93-V104 HydrophobicContact CZ-CB 4.47Å; V104-F107 WeakPolarHBondContact O-CD1 3.48Å; V104-F107 WeakPolarHBondContact O-CE1 3.1Å
105	S	84.3	Confident	87.9	Confident	109 Å²	109	82.6 Å²	82.6	76%	0.762	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-13	177.6	-44.3	0	0	0	0	113.5	N103	N103-S105 PolarHBondContact O-N 3.35Å; N103-S105 VanDerWaalsContact O-N 3.13Å
106	K	87.1	Confident	87.9	Confident	146 Å²	146	82.9 Å²	82.9	64%	0.635	44%	0.437	S	S	*	.	B	Isolated β-bridge	trans	-142.2	68.5	-171.1	-66.8	-173.4	-179.7	-176.5	0	110.6	N103 A117	N103-K106 HydrophobicContact CB-CB 4.26Å; N103-K106 CarbonylContact O-C 3.53Å; N103-K106 VanDerWaalsContact O-C 3.26Å; N103-K106 PolarHBondContact O-N 2.89Å; K106-A117 HydrophobicContact CB-CB 4Å; K106-A117 PolarHBondContact O-N 3.13Å
107	F	88.8	Confident	87.9	Confident	51 Å²	51	81.5 Å²	81.5	22%	0.224	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	158.5	175.5	72.5	-81.6	0	0	0	110.6	A82 T83 F93 V102 V104 L109 L114 I115	A82-F107 HydrophobicContact CB-CD1 4.33Å; A82-F107 HydrophobicContact CB-CE1 3.54Å; A82-F107 HydrophobicContact CB-CE2 4.19Å; A82-F107 HydrophobicContact CB-CZ 3.45Å; A82-F107 VanDerWaalsContact CB-CZ 3.45Å; T83-F107 HydrophobicContact CG2-CZ 4.26Å; F93-F107 HydrophobicContact CZ-CB 4.46Å; F93-F107 HydrophobicContact CZ-CD1 4.21Å; F93-F107 HydrophobicContact CZ-CG 4.26Å; V102-F107 HydrophobicContact CG1-CB 3.36Å; V104-F107 WeakPolarHBondContact O-CD1 3.48Å; V104-F107 WeakPolarHBondContact O-CE1 3.1Å; F107-L109 HydrophobicContact CD2-CG 4.14Å; F107-L109 HydrophobicContact CE2-CD1 3.99Å; F107-L109 HydrophobicContact CE2-CG 3.88Å; F107-L114 HydrophobicContact CB-CD1 4.02Å; F107-L114 HydrophobicContact CD2-CD1 3.52Å; F107-L114 HydrophobicContact CE2-CD1 4.29Å; F107-L114 HydrophobicContact CG-CD1 4.01Å; F107-I115 WeakPolarHBondContact CA-O 3.36Å
108	A	89.7	Confident	87.9	Confident	32 Å²	32	80.7 Å²	80.7	26%	0.264	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	144.1	169.9	0	0	0	0	0	109.3	I115 A120	A108-I115 HydrophobicContact CB-CB 4.44Å; A108-I115 PolarHBondContact N-O 3.44Å; A108-I115 PolarHBondContact O-N 3.38Å; A108-A120 HydrophobicContact CB-CB 3.65Å
109	L	86.9	Confident	87.9	Confident	87 Å²	87	80 Å²	80	46%	0.455	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	100	170.5	-73.8	169.9	0	0	0	108.7	W88 F107 K113 L114	W88-L109 HydrophobicContact CH2-CD1 4.22Å; W88-L109 HydrophobicContact CH2-CD2 4.42Å; W88-L109 HydrophobicContact CZ2-CD1 4.37Å; W88-L109 HydrophobicContact CZ2-CD2 3.88Å; F107-L109 HydrophobicContact CD2-CG 4.14Å; F107-L109 HydrophobicContact CE2-CD1 3.99Å; F107-L109 HydrophobicContact CE2-CG 3.88Å; L109-K113 WeakPolarHBondContact CA-O 3.45Å; L109-L114 HydrophobicContact CD2-CB 4.49Å; L109-L114 HydrophobicContact CD2-CD1 4.06Å
110	A	85.6	Confident	87.8	Confident	43 Å²	43	77 Å²	77	36%	0.355	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.1	174.8	0	0	0	0	0	108.9	N112 K113 I115	A110-N112 VanDerWaalsContact C-N 3.31Å; A110-N112 PolarHBondContact O-N 3.03Å; A110-K113 PolarHBondContact N-O 3.36Å; A110-K113 WeakPolarHBondContact O-CA 3.47Å; A110-K113 VanDerWaalsContact O-CB 3.28Å; A110-K113 WeakPolarHBondContact O-CB 3.44Å; A110-K113 PolarHBondContact O-N 3.34Å; A110-I115 HydrophobicContact CB-CG1 3.89Å
111	N	83.9	Confident	87.5	Confident	155 Å²	155	78.3 Å²	78.3	83%	0.829	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	42.6	-179	-60.8	-71.9	0	0	0	113.7	K113	N111-K113 PolarHBondContact O-N 3.47Å; N111-K113 VanDerWaalsContact O-N 3.07Å
112	N	78.1	Confident	86.9	Confident	156 Å²	156	80.1 Å²	80.1	83%	0.834	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	10	-173	-57.9	-56	0	0	0	115.1	A110	A110-N112 VanDerWaalsContact C-N 3.31Å; A110-N112 PolarHBondContact O-N 3.03Å
113	K	85.8	Confident	86.7	Confident	116 Å²	116	83.8 Å²	83.8	50%	0.504	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.8	172.5	-50.2	-167.1	89.3	-162.9	0	109.3	L109 A110 N111 I115	L109-K113 WeakPolarHBondContact CA-O 3.45Å; A110-K113 PolarHBondContact N-O 3.36Å; A110-K113 WeakPolarHBondContact O-CA 3.47Å; A110-K113 VanDerWaalsContact O-CB 3.28Å; A110-K113 WeakPolarHBondContact O-CB 3.44Å; A110-K113 PolarHBondContact O-N 3.34Å; N111-K113 PolarHBondContact O-N 3.47Å; N111-K113 VanDerWaalsContact O-N 3.07Å; K113-I115 PolarHBondContact O-N 2.83Å
114	L	87.7	Confident	86.7	Confident	6 Å²	6	82.3 Å²	82.3	3%	0.031	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	125.2	176.2	-171.1	76.1	0	0	0	109.3	F93 C95 S96 V102 F107 L109	F93-L114 VanDerWaalsContact C-CD2 3.44Å; F93-L114 HydrophobicContact CB-CD2 4.24Å; F93-L114 HydrophobicContact CD1-CD2 4.32Å; F93-L114 HydrophobicContact CD2-CD1 4.13Å; F93-L114 HydrophobicContact CD2-CD2 3.33Å; F93-L114 HydrophobicContact CD2-CG 4.39Å; F93-L114 HydrophobicContact CE2-CD1 3.57Å; F93-L114 HydrophobicContact CE2-CD2 3.62Å; F93-L114 HydrophobicContact CE2-CG 4.26Å; F93-L114 HydrophobicContact CG-CD2 3.72Å; F93-L114 HydrophobicContact CZ-CD1 4.1Å; F93-L114 HydrophobicContact CZ-CD2 4.23Å; C95-L114 CarbonylContact C-O 3.47Å; C95-L114 WeakPolarHBondContact CA-O 3.45Å; S96-L114 PolarHBondContact N-O 2.98Å; S96-L114 PolarHBondContact OG-O 2.8Å; V102-L114 HydrophobicContact CB-CD2 3.98Å; V102-L114 HydrophobicContact CB-CG 4.35Å; V102-L114 HydrophobicContact CG2-CD2 3.7Å; V102-L114 HydrophobicContact CG2-CG 3.97Å; F107-L114 HydrophobicContact CB-CD1 4.02Å; F107-L114 HydrophobicContact CD2-CD1 3.52Å; F107-L114 HydrophobicContact CE2-CD1 4.29Å; F107-L114 HydrophobicContact CG-CD1 4.01Å; L109-L114 HydrophobicContact CD2-CB 4.49Å; L109-L114 HydrophobicContact CD2-CD1 4.06Å
115	I	91.9	Very high	86.9	Confident	12 Å²	12	85 Å²	85	6%	0.062	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.2	178.9	-50.3	-77.1	0	0	0	107.9	K97 F107 A108 A110 K113 C119 A120	K97-I115 HydrophobicContact CG-CD1 3.57Å; K97-I115 HydrophobicContact CG-CG2 4.32Å; F107-I115 WeakPolarHBondContact CA-O 3.36Å; A108-I115 HydrophobicContact CB-CB 4.44Å; A108-I115 PolarHBondContact N-O 3.44Å; A108-I115 PolarHBondContact O-N 3.38Å; A110-I115 HydrophobicContact CB-CG1 3.89Å; K113-I115 PolarHBondContact O-N 2.83Å; I115-C119 HydrophobicContact CG2-CB 3.57Å; I115-A120 HydrophobicContact CG2-CB 4.21Å
116	C	93.1	Very high	87	Confident	7 Å²	7	83.6 Å²	83.6	5%	0.047	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	155.5	172.8	63.6	0	0	0	0	111	C95 C98 V102 E118 C119 A120	C95-C116 HydrophobicContact CB-CB 4.05Å; C95-C116 PolarHBondContact SG-N 2.89Å; C95-C116 VanDerWaalsContact SG-SG 3.66Å; C98-C116 VanDerWaalsContact SG-SG 3.67Å; V102-C116 HydrophobicContact CG1-CB 3.96Å; V102-C116 HydrophobicContact CG2-CB 4.15Å; C116-E118 PolarHBondContact O-N 3.19Å; C116-E118 VanDerWaalsContact O-N 3.14Å; C116-C119 PolarHBondContact O-N 3.08Å; C116-C119 VanDerWaalsContact O-N 3.15Å; C116-C119 PolarHBondContact SG-N 3.08Å; C116-C119 VanDerWaalsContact SG-N 3.42Å; C116-A120 WeakPolarHBondContact O-CB 3.13Å; C116-A120 PolarHBondContact O-N 3.4Å
117	A	89.5	Confident	87	Confident	27 Å²	27	79.7 Å²	79.7	22%	0.223	43%	0.434	C	S	.	.	H	α-helix	trans	-54.2	-34.2	177.2	0	0	0	0	0	112.6	K106 A120 Q121	K106-A117 HydrophobicContact CB-CB 4Å; K106-A117 PolarHBondContact O-N 3.13Å; A117-A120 PolarHBondContact O-N 3.43Å; A117-Q121 WeakPolarHBondContact O-CB 3.29Å; A117-Q121 VanDerWaalsContact O-CG 3.25Å; A117-Q121 WeakPolarHBondContact O-CG 3.44Å; A117-Q121 PolarHBondContact O-N 3.49Å; A117-Q121 VanDerWaalsContact O-N 3.13Å; A117-Q121 PolarHBondContact O-NE2 2.88Å
118	E	90.8	Very high	86.9	Confident	140 Å²	140	81.6 Å²	81.6	65%	0.654	45%	0.448	S	S	*	.	H	α-helix	trans	-62	-50.4	177.3	-59.8	169.3	95	0	0	111.9	C116 A120 Q121	C116-E118 PolarHBondContact O-N 3.19Å; C116-E118 VanDerWaalsContact O-N 3.14Å; E118-A120 VanDerWaalsContact C-N 3.27Å; E118-A120 PolarHBondContact O-N 2.99Å; E118-Q121 PolarHBondContact O-N 3.41Å
119	C	92.3	Very high	86.7	Confident	32 Å²	32	85.1 Å²	85.1	22%	0.216	46%	0.461	C	S	.	.	H	α-helix	trans	-76	-12.4	177.3	-66.6	0	0	0	0	114	K97 I115 C116	K97-C119 HydrophobicContact CB-CB 3.84Å; K97-C119 HydrophobicContact CG-CB 4.1Å; I115-C119 HydrophobicContact CG2-CB 3.57Å; C116-C119 PolarHBondContact O-N 3.08Å; C116-C119 VanDerWaalsContact O-N 3.15Å; C116-C119 PolarHBondContact SG-N 3.08Å; C116-C119 VanDerWaalsContact SG-N 3.42Å
120	A	88.6	Confident	86.7	Confident	54 Å²	54	85 Å²	85	45%	0.446	46%	0.462	S	S	.	.	H	α-helix	trans	-84.9	-22.3	174	0	0	0	0	0	112.1	A108 I115 C116 A117 E118	A108-A120 HydrophobicContact CB-CB 3.65Å; I115-A120 HydrophobicContact CG2-CB 4.21Å; C116-A120 WeakPolarHBondContact O-CB 3.13Å; C116-A120 PolarHBondContact O-N 3.4Å; A117-A120 PolarHBondContact O-N 3.43Å; E118-A120 VanDerWaalsContact C-N 3.27Å; E118-A120 PolarHBondContact O-N 2.99Å
121	Q	84.4	Confident	86.8	Confident	166 Å²	166	88.5 Å²	88.5	78%	0.776	47%	0.47	S	S	*	.			trans	-93	-5.7	179.1	-71.1	169.6	102.2	0	0	113.4	A117 E118	A117-Q121 WeakPolarHBondContact O-CB 3.29Å; A117-Q121 VanDerWaalsContact O-CG 3.25Å; A117-Q121 WeakPolarHBondContact O-CG 3.44Å; A117-Q121 PolarHBondContact O-N 3.49Å; A117-Q121 VanDerWaalsContact O-N 3.13Å; A117-Q121 PolarHBondContact O-NE2 2.88Å; E118-Q121 PolarHBondContact O-N 3.41Å
122	N	75.7	Confident	87.1	Confident	191 Å²	191	82.5 Å²	82.5	100%	1.021	44%	0.438	S	S	*	.			trans	-123.9	0	-178.9	177.7	106	0	0	0	111.1

Retrieved 122 of 122 residues in 82.9 ms (Link to these results)

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