A0A077Z305_TRITR Loading...

LIM domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z305, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 131 aa.

						>A0A077Z305_TRITR|A0A077Z305
MSAEQLCFSCSKKIYANKAVFVFGQIYHLEHFTCHRCHARLSLNVSCHKNDKEILCSNCVCQLLKTCPGCTQPLKGKVVIALNRYWHRECFRCDRCDKVFSNEKYALVDRIPYCKKCVSTFKKRKKKKNLK
					

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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	38.6	Very low	78.2	Confident	240 Å²	240	92.5 Å²	92.5	100%	1.182	53%	0.533	S	S	*	.				0	101.8	0	-69	-62.1	162	0	0	107.9	A3	M1-A3 PolarHBondContact O-N 3.31Å
2	S	55.5	Low	79.3	Confident	118 Å²	118	97 Å²	97	83%	0.825	54%	0.542	S	S	*	.			trans	-72.8	118.3	179.2	-30.3	0	0	0	0	108.3	E4	S2-E4 PolarHBondContact O-N 3.32Å; S2-E4 VanDerWaalsContact O-N 3.09Å
3	A	63.9	Low	80.2	Confident	82 Å²	82	95.7 Å²	95.7	68%	0.678	53%	0.527	S	S	*	.			trans	-64.4	112.1	178.8	0	0	0	0	0	109.9	M1 Q5	M1-A3 PolarHBondContact O-N 3.31Å; A3-Q5 PolarHBondContact O-N 3.24Å; A3-Q5 PolarHBondContact O-NE2 3.11Å
4	E	76.4	Confident	80.9	Confident	127 Å²	127	90.4 Å²	90.4	59%	0.593	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-62.6	122.3	-179.8	-58.6	-170	100.4	0	0	110.2	S2 K13	S2-E4 PolarHBondContact O-N 3.32Å; S2-E4 VanDerWaalsContact O-N 3.09Å; E4-K13 VanDerWaalsContact CD-NZ 3.29Å; E4-K13 WeakPolarHBondContact OE1-CD 3.43Å; E4-K13 WeakPolarHBondContact OE1-CE 3.4Å; E4-K13 IonicContact OE1-NZ 2.62Å; E4-K13 PolarHBondContact OE1-NZ 3.36Å; E4-K13 IonicContact OE2-NZ 3.22Å; E4-K13 PolarHBondContact OE2-NZ 3.44Å
5	Q	85.3	Confident	80.8	Confident	94 Å²	94	96.8 Å²	96.8	44%	0.439	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-87.3	121.1	-179.8	-64.2	-60.7	-55.9	0	0	109.7	A3 I14 I26	A3-Q5 PolarHBondContact O-N 3.24Å; A3-Q5 PolarHBondContact O-NE2 3.11Å; Q5-I14 PolarHBondContact O-N 3.07Å; Q5-I26 HydrophobicContact CB-CD1 3.89Å; Q5-I26 HydrophobicContact CB-CG2 4.17Å; Q5-I26 HydrophobicContact CG-CD1 4.23Å
6	L	91	Very high	80.1	Confident	90 Å²	90	95.4 Å²	95.4	47%	0.471	52%	0.519	S	S	.	.	B	Isolated β-bridge	trans	-101.3	135.6	178.3	-63.3	178.1	0	0	0	110.9	F8 K13 I26	L6-F8 PolarHBondContact O-N 3.16Å; L6-K13 HydrophobicContact CD2-CB 4.41Å; L6-K13 HydrophobicContact CD2-CG 3.71Å; L6-I26 WeakPolarHBondContact O-CG2 3.45Å
7	C	91.2	Very high	79.4	Confident	1 Å²	1	99.6 Å²	99.6	1%	0.007	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-64.3	123.3	173.6	175.4	0	0	0	0	110.3	S9 C10 S11 K12 I14 I26 H31	C7-S9 PolarHBondContact O-N 3.15Å; C7-C10 VanDerWaalsContact CB-SG 3.51Å; C7-C10 PolarHBondContact O-N 3.46Å; C7-C10 VanDerWaalsContact SG-SG 3.64Å; C7-S11 WeakPolarHBondContact O-CA 3.33Å; C7-S11 PolarHBondContact O-N 3.38Å; C7-K12 PolarHBondContact N-O 3.37Å; C7-I14 HydrophobicContact CB-CD1 3.86Å; C7-I14 HydrophobicContact CB-CG1 3.88Å; C7-I26 CarbonylContact C-O 3.55Å; C7-I26 WeakPolarHBondContact CA-O 3.22Å; C7-H31 PolarHBondContact SG-ND1 3.02Å
8	F	89.1	Confident	79.3	Confident	69 Å²	69	102.6 Å²	102.6	30%	0.303	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-30.4	-179.5	-176.2	-97.4	0	0	0	113.1	L6 Q25 I26 Y27	L6-F8 PolarHBondContact O-N 3.16Å; F8-Q25 HydrophobicContact CB-CB 4.01Å; F8-Q25 HydrophobicContact CB-CG 4.4Å; F8-Q25 HydrophobicContact CD2-CB 4.3Å; F8-Q25 VanDerWaalsContact CD2-CD 3.42Å; F8-Q25 HydrophobicContact CD2-CG 3.76Å; F8-Q25 HydrophobicContact CE2-CG 4.15Å; F8-Q25 HydrophobicContact CG-CB 4.13Å; F8-Q25 HydrophobicContact CG-CG 4.02Å; F8-I26 PolarHBondContact N-O 3.46Å; F8-Y27 HydrophobicContact CB-CD1 4.27Å; F8-Y27 HydrophobicContact CB-CE1 3.75Å; F8-Y27 HydrophobicContact CB-CE2 4.39Å; F8-Y27 AromaticContact CD1-CE1 3.75Å; F8-Y27 HydrophobicContact CD1-CE1 3.75Å; F8-Y27 AromaticContact CD1-CZ 3.73Å; F8-Y27 WeakPolarHBondContact CD1-OH 3.49Å; F8-Y27 HydrophobicContact CG-CE1 4.2Å
9	S	88.1	Confident	79.7	Confident	71 Å²	71	99.2 Å²	99.2	50%	0.497	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-34.6	-177.9	-176.7	0	0	0	0	114.5	C7	C7-S9 PolarHBondContact O-N 3.15Å
10	C	91.2	Very high	80.2	Confident	34 Å²	34	94.7 Å²	94.7	23%	0.23	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-3.7	-176	74.9	0	0	0	0	114.2	C7 K12 H31	C7-C10 VanDerWaalsContact CB-SG 3.51Å; C7-C10 PolarHBondContact O-N 3.46Å; C7-C10 VanDerWaalsContact SG-SG 3.64Å; C10-K12 PolarHBondContact O-N 3.08Å; C10-H31 PolarHBondContact SG-CE1 3.34Å; C10-H31 PolarHBondContact SG-ND1 3.18Å; C10-H31 VanDerWaalsContact SG-ND1 3.35Å
11	S	90.2	Very high	80.6	Confident	91 Å²	91	96.3 Å²	96.3	64%	0.636	51%	0.514	S	S	*	.			trans	57	14.3	-177.2	-52	0	0	0	0	115.2	C7	C7-S11 WeakPolarHBondContact O-CA 3.33Å; C7-S11 PolarHBondContact O-N 3.38Å
12	K	91	Very high	82.9	Confident	147 Å²	147	86.3 Å²	86.3	64%	0.639	47%	0.466	S	S	*	.			trans	-92.4	153.7	175.5	-59.7	178.5	-177.3	178.3	0	110.9	C7 C10	C7-K12 PolarHBondContact N-O 3.37Å; C10-K12 PolarHBondContact O-N 3.08Å
13	K	91.5	Very high	84.4	Confident	80 Å²	80	85.6 Å²	85.6	35%	0.348	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-60.4	139.1	176.7	-65.6	178.1	-179.6	-170.8	0	111.2	E4 L6 Y15 H28	E4-K13 VanDerWaalsContact CD-NZ 3.29Å; E4-K13 WeakPolarHBondContact OE1-CD 3.43Å; E4-K13 WeakPolarHBondContact OE1-CE 3.4Å; E4-K13 IonicContact OE1-NZ 2.62Å; E4-K13 PolarHBondContact OE1-NZ 3.36Å; E4-K13 IonicContact OE2-NZ 3.22Å; E4-K13 PolarHBondContact OE2-NZ 3.44Å; L6-K13 HydrophobicContact CD2-CB 4.41Å; L6-K13 HydrophobicContact CD2-CG 3.71Å; K13-Y15 HydrophobicContact CB-CD2 4.44Å; K13-Y15 HydrophobicContact CB-CE1 4.2Å; K13-Y15 HydrophobicContact CB-CE2 3.76Å; K13-Y15 HydrophobicContact CD-CE1 4.37Å; K13-Y15 WeakPolarHBondContact CD-OH 3.26Å; K13-H28 PolarHBondContact O-NE2 3.13Å
14	I	89.3	Confident	85.5	Confident	21 Å²	21	84.1 Å²	84.1	11%	0.108	44%	0.441	C	S	.	.			trans	-99.9	113.6	174.1	-59.7	-169.1	0	0	0	108.3	Q5 C7 A19 I26	Q5-I14 PolarHBondContact O-N 3.07Å; C7-I14 HydrophobicContact CB-CD1 3.86Å; C7-I14 HydrophobicContact CB-CG1 3.88Å; I14-A19 HydrophobicContact CD1-CB 4.29Å; I14-A19 HydrophobicContact CG2-CB 3.53Å; I14-I26 HydrophobicContact CD1-CB 4.1Å; I14-I26 HydrophobicContact CD1-CD1 3.87Å; I14-I26 HydrophobicContact CD1-CG1 3.6Å; I14-I26 HydrophobicContact CD1-CG2 3.76Å; I14-I26 HydrophobicContact CG2-CD1 4.39Å
15	Y	79.8	Confident	86.1	Confident	187 Å²	187	81 Å²	81	73%	0.733	43%	0.427	S	S	*	.			trans	-99.3	86.8	177.1	-55	-81.3	0	0	0	109.7	K13	K13-Y15 HydrophobicContact CB-CD2 4.44Å; K13-Y15 HydrophobicContact CB-CE1 4.2Å; K13-Y15 HydrophobicContact CB-CE2 3.76Å; K13-Y15 HydrophobicContact CD-CE1 4.37Å; K13-Y15 WeakPolarHBondContact CD-OH 3.26Å
16	A	69.2	Low	86.3	Confident	75 Å²	75	77.7 Å²	77.7	62%	0.62	41%	0.412	S	S	*	.	S	Bend	trans	60.2	161	168.3	0	0	0	0	0	119.7	K18	A16-K18 PolarHBondContact O-N 3.1Å
17	N	69.2	Low	86.3	Confident	167 Å²	167	73.6 Å²	73.6	89%	0.893	39%	0.39	S	S	*	.	S	Bend	trans	35.1	-11.5	170.5	-66.4	0.4	0	0	0	122.8
18	K	76.1	Confident	86.3	Confident	153 Å²	153	75 Å²	75	67%	0.665	40%	0.397	S	S	*	.	S	Bend	trans	-118.5	47.1	178.7	-72.1	-173.9	-177.5	177.5	0	110.9	A16 L29	A16-K18 PolarHBondContact O-N 3.1Å; K18-L29 HydrophobicContact CB-CD1 3.75Å; K18-L29 HydrophobicContact CB-CG 4.42Å; K18-L29 HydrophobicContact CG-CD1 4.04Å; K18-L29 WeakPolarHBondContact O-CG 3.46Å; K18-L29 PolarHBondContact O-N 3.29Å; K18-L29 VanDerWaalsContact O-N 3.17Å
19	A	88.1	Confident	86.2	Confident	38 Å²	38	76 Å²	76	31%	0.314	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.3	-178	0	0	0	0	0	111.1	I14 I26 Y27	I14-A19 HydrophobicContact CD1-CB 4.29Å; I14-A19 HydrophobicContact CG2-CB 3.53Å; A19-I26 HydrophobicContact CB-CD1 3.96Å; A19-I26 HydrophobicContact CB-CG1 4.03Å; A19-Y27 CarbonylContact C-O 3.6Å; A19-Y27 WeakPolarHBondContact CA-O 3.28Å
20	V	89.5	Confident	86.2	Confident	8 Å²	8	78.5 Å²	78.5	5%	0.048	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	127.8	177.6	-119	0	0	0	0	107.8	I26 Y27 L29 F32 L43	V20-I26 WeakPolarHBondContact O-CA 3.4Å; V20-Y27 PolarHBondContact N-O 3.16Å; V20-Y27 PolarHBondContact O-N 3.5Å; V20-L29 HydrophobicContact CG1-CD2 4.46Å; V20-L29 HydrophobicContact CG2-CD2 3.78Å; V20-L29 HydrophobicContact CG2-CG 4.36Å; V20-F32 HydrophobicContact CB-CD1 4.22Å; V20-F32 HydrophobicContact CB-CG 4.26Å; V20-F32 HydrophobicContact CG1-CD1 4.25Å; V20-F32 HydrophobicContact CG1-CE1 4.47Å; V20-F32 HydrophobicContact CG2-CB 3.57Å; V20-F32 HydrophobicContact CG2-CD1 3.88Å; V20-F32 HydrophobicContact CG2-CD2 4.44Å; V20-F32 HydrophobicContact CG2-CG 3.71Å; V20-L43 HydrophobicContact CG1-CD1 4.21Å; V20-L43 HydrophobicContact CG1-CD2 3.77Å; V20-L43 HydrophobicContact CG1-CG 3.75Å
21	F	88.6	Confident	86.2	Confident	130 Å²	130	79.3 Å²	79.3	57%	0.57	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.4	175.5	-171.3	-102.6	0	0	0	109.1	Q25 I26	F21-Q25 CarbonylContact C-O 3.57Å; F21-Q25 WeakPolarHBondContact CA-O 3.33Å; F21-Q25 WeakPolarHBondContact CD2-O 3Å; F21-I26 HydrophobicContact CD2-CB 4.13Å
22	V	87.7	Confident	86.3	Confident	29 Å²	29	75 Å²	75	18%	0.176	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	145.1	179.4	94.5	0	0	0	0	110.1	G24 Q25 Y27 F32 I54	V22-G24 PolarHBondContact O-N 2.68Å; V22-Q25 PolarHBondContact N-O 3.22Å; V22-Q25 PolarHBondContact O-N 3.49Å; V22-Y27 HydrophobicContact CG1-CE2 4.13Å; V22-F32 HydrophobicContact CB-CE2 4.22Å; V22-F32 HydrophobicContact CB-CZ 4.22Å; V22-F32 HydrophobicContact CG1-CD2 4.42Å; V22-F32 HydrophobicContact CG1-CE2 3.36Å; V22-F32 HydrophobicContact CG1-CZ 3.73Å; V22-F32 HydrophobicContact CG2-CZ 4.48Å; V22-I54 HydrophobicContact CG1-CD1 4.04Å
23	F	86.3	Confident	86.3	Confident	104 Å²	104	69.7 Å²	69.7	46%	0.456	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	37.8	-178.3	-57.1	-59.8	0	0	0	113.8	Q25 C47 K49 I54	F23-Q25 PolarHBondContact O-N 3.19Å; F23-C47 VanDerWaalsContact CZ-O 3.25Å; F23-C47 WeakPolarHBondContact CZ-O 3.2Å; F23-K49 HydrophobicContact CB-CB 4.26Å; F23-K49 HydrophobicContact CB-CD 3.76Å; F23-K49 HydrophobicContact CD2-CB 3.55Å; F23-K49 HydrophobicContact CE2-CB 4.08Å; F23-K49 HydrophobicContact CG-CB 3.93Å; F23-K49 HydrophobicContact CG-CD 4.36Å; F23-I54 HydrophobicContact CD2-CD1 4.37Å; F23-I54 HydrophobicContact CE2-CD1 4.25Å
24	G	87.4	Confident	86.4	Confident	50 Å²	50	65.9 Å²	65.9	52%	0.515	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	14.6	-178.5	0	0	0	0	0	114.5	V22	V22-G24 PolarHBondContact O-N 2.68Å
25	Q	88.8	Confident	86.6	Confident	62 Å²	62	69.6 Å²	69.6	29%	0.29	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	150.3	-177.7	-63.8	-59.2	-31.1	0	0	110.3	F8 F21 V22 F23 Y27	F8-Q25 HydrophobicContact CB-CB 4.01Å; F8-Q25 HydrophobicContact CB-CG 4.4Å; F8-Q25 HydrophobicContact CD2-CB 4.3Å; F8-Q25 VanDerWaalsContact CD2-CD 3.42Å; F8-Q25 HydrophobicContact CD2-CG 3.76Å; F8-Q25 HydrophobicContact CE2-CG 4.15Å; F8-Q25 HydrophobicContact CG-CB 4.13Å; F8-Q25 HydrophobicContact CG-CG 4.02Å; F21-Q25 CarbonylContact C-O 3.57Å; F21-Q25 WeakPolarHBondContact CA-O 3.33Å; F21-Q25 WeakPolarHBondContact CD2-O 3Å; V22-Q25 PolarHBondContact N-O 3.22Å; V22-Q25 PolarHBondContact O-N 3.49Å; F23-Q25 PolarHBondContact O-N 3.19Å; Q25-Y27 HydrophobicContact CB-CD2 4.47Å; Q25-Y27 HydrophobicContact CB-CE2 3.59Å
26	I	89.2	Confident	87.1	Confident	24 Å²	24	66.7 Å²	66.7	12%	0.123	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.8	179.2	-160.1	178.6	0	0	0	110.6	Q5 L6 C7 F8 I14 A19 V20 F21	Q5-I26 HydrophobicContact CB-CD1 3.89Å; Q5-I26 HydrophobicContact CB-CG2 4.17Å; Q5-I26 HydrophobicContact CG-CD1 4.23Å; L6-I26 WeakPolarHBondContact O-CG2 3.45Å; C7-I26 CarbonylContact C-O 3.55Å; C7-I26 WeakPolarHBondContact CA-O 3.22Å; F8-I26 PolarHBondContact N-O 3.46Å; I14-I26 HydrophobicContact CD1-CB 4.1Å; I14-I26 HydrophobicContact CD1-CD1 3.87Å; I14-I26 HydrophobicContact CD1-CG1 3.6Å; I14-I26 HydrophobicContact CD1-CG2 3.76Å; I14-I26 HydrophobicContact CG2-CD1 4.39Å; A19-I26 HydrophobicContact CB-CD1 3.96Å; A19-I26 HydrophobicContact CB-CG1 4.03Å; V20-I26 WeakPolarHBondContact O-CA 3.4Å; F21-I26 HydrophobicContact CD2-CB 4.13Å
27	Y	90.9	Very high	88.3	Confident	5 Å²	5	66.1 Å²	66.1	2%	0.02	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	147.9	-178.5	-59.1	-101	0	0	0	110	F8 A19 V20 V22 Q25 F32	F8-Y27 HydrophobicContact CB-CD1 4.27Å; F8-Y27 HydrophobicContact CB-CE1 3.75Å; F8-Y27 HydrophobicContact CB-CE2 4.39Å; F8-Y27 AromaticContact CD1-CE1 3.75Å; F8-Y27 HydrophobicContact CD1-CE1 3.75Å; F8-Y27 AromaticContact CD1-CZ 3.73Å; F8-Y27 WeakPolarHBondContact CD1-OH 3.49Å; F8-Y27 HydrophobicContact CG-CE1 4.2Å; A19-Y27 CarbonylContact C-O 3.6Å; A19-Y27 WeakPolarHBondContact CA-O 3.28Å; V20-Y27 PolarHBondContact N-O 3.16Å; V20-Y27 PolarHBondContact O-N 3.5Å; V22-Y27 HydrophobicContact CG1-CE2 4.13Å; Q25-Y27 HydrophobicContact CB-CD2 4.47Å; Q25-Y27 HydrophobicContact CB-CE2 3.59Å; Y27-F32 HydrophobicContact CD2-CD2 4.04Å; Y27-F32 HydrophobicContact CD2-CE2 4.46Å; Y27-F32 HydrophobicContact CG-CD2 4.04Å
28	H	91	Very high	89.3	Confident	31 Å²	31	64.7 Å²	64.7	14%	0.144	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	145.7	157.5	-63.4	122.3	0	0	0	109	K13 E30 H31 F32	K13-H28 PolarHBondContact O-NE2 3.13Å; H28-E30 HydrophobicContact CB-CG 3.95Å; H28-E30 PolarHBondContact O-N 3.2Å; H28-E30 VanDerWaalsContact O-N 3.15Å; H28-H31 HydrophobicContact CB-CB 4.36Å; H28-H31 AromaticContact CG-ND1 3.74Å; H28-H31 AromaticContact ND1-CE1 3.45Å; H28-H31 PolarHBondContact ND1-CE1 3.36Å; H28-H31 AromaticContact ND1-ND1 3.15Å; H28-H31 PolarHBondContact ND1-ND1 3.08Å; H28-H31 VanDerWaalsContact ND1-ND1 3.15Å; H28-H31 CarbonylContact O-C 3.59Å; H28-H31 PolarHBondContact O-N 3.07Å; H28-F32 PolarHBondContact O-N 3.15Å
29	L	87.5	Confident	90.1	Very high	90 Å²	90	59.6 Å²	59.6	47%	0.471	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-51.9	-37.9	175.5	-76.5	168.6	0	0	0	112.5	K18 V20 F32	K18-L29 HydrophobicContact CB-CD1 3.75Å; K18-L29 HydrophobicContact CB-CG 4.42Å; K18-L29 HydrophobicContact CG-CD1 4.04Å; K18-L29 WeakPolarHBondContact O-CG 3.46Å; K18-L29 PolarHBondContact O-N 3.29Å; K18-L29 VanDerWaalsContact O-N 3.17Å; V20-L29 HydrophobicContact CG1-CD2 4.46Å; V20-L29 HydrophobicContact CG2-CD2 3.78Å; V20-L29 HydrophobicContact CG2-CG 4.36Å; L29-F32 PolarHBondContact O-N 3.4Å
30	E	88.3	Confident	90.1	Very high	122 Å²	122	67.1 Å²	67.1	57%	0.57	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-72.2	-25.6	178.7	68.5	-169.3	113.7	0	0	114.2	H28 T33	H28-E30 HydrophobicContact CB-CG 3.95Å; H28-E30 PolarHBondContact O-N 3.2Å; H28-E30 VanDerWaalsContact O-N 3.15Å; E30-T33 WeakPolarHBondContact O-CG2 3.47Å
31	H	90.2	Very high	90.1	Very high	51 Å²	51	67.3 Å²	67.3	24%	0.236	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-94.9	-2	176.5	-57.7	141.6	0	0	0	112.6	C7 C10 H28 T33	C7-H31 PolarHBondContact SG-ND1 3.02Å; C10-H31 PolarHBondContact SG-CE1 3.34Å; C10-H31 PolarHBondContact SG-ND1 3.18Å; C10-H31 VanDerWaalsContact SG-ND1 3.35Å; H28-H31 HydrophobicContact CB-CB 4.36Å; H28-H31 AromaticContact CG-ND1 3.74Å; H28-H31 AromaticContact ND1-CE1 3.45Å; H28-H31 PolarHBondContact ND1-CE1 3.36Å; H28-H31 AromaticContact ND1-ND1 3.15Å; H28-H31 PolarHBondContact ND1-ND1 3.08Å; H28-H31 VanDerWaalsContact ND1-ND1 3.15Å; H28-H31 CarbonylContact O-C 3.59Å; H28-H31 PolarHBondContact O-N 3.07Å; H31-T33 PolarHBondContact O-N 3.41Å
32	F	92	Very high	89.9	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.009	32%	0.322	C	S	.	.			trans	-84	66.1	172.5	-164.8	-123.4	0	0	0	110.2	V20 V22 Y27 H28 L29 L41 I54	V20-F32 HydrophobicContact CB-CD1 4.22Å; V20-F32 HydrophobicContact CB-CG 4.26Å; V20-F32 HydrophobicContact CG1-CD1 4.25Å; V20-F32 HydrophobicContact CG1-CE1 4.47Å; V20-F32 HydrophobicContact CG2-CB 3.57Å; V20-F32 HydrophobicContact CG2-CD1 3.88Å; V20-F32 HydrophobicContact CG2-CD2 4.44Å; V20-F32 HydrophobicContact CG2-CG 3.71Å; V22-F32 HydrophobicContact CB-CE2 4.22Å; V22-F32 HydrophobicContact CB-CZ 4.22Å; V22-F32 HydrophobicContact CG1-CD2 4.42Å; V22-F32 HydrophobicContact CG1-CE2 3.36Å; V22-F32 HydrophobicContact CG1-CZ 3.73Å; V22-F32 HydrophobicContact CG2-CZ 4.48Å; Y27-F32 HydrophobicContact CD2-CD2 4.04Å; Y27-F32 HydrophobicContact CD2-CE2 4.46Å; Y27-F32 HydrophobicContact CG-CD2 4.04Å; H28-F32 PolarHBondContact O-N 3.15Å; L29-F32 PolarHBondContact O-N 3.4Å; F32-L41 HydrophobicContact CD1-CB 3.57Å; F32-L41 VanDerWaalsContact CD1-O 3.28Å; F32-L41 WeakPolarHBondContact CD1-O 3.42Å; F32-L41 HydrophobicContact CE1-CB 3.39Å; F32-L41 HydrophobicContact CE2-CD1 4.38Å; F32-L41 HydrophobicContact CG-CB 4.2Å; F32-L41 HydrophobicContact CZ-CB 3.9Å; F32-L41 HydrophobicContact CZ-CD1 4.32Å; F32-L41 WeakPolarHBondContact O-CB 3.43Å; F32-L41 PolarHBondContact O-N 2.76Å; F32-I54 HydrophobicContact CD2-CD1 4.14Å; F32-I54 HydrophobicContact CE2-CD1 3.28Å; F32-I54 HydrophobicContact CZ-CD1 3.88Å
33	T	92.8	Very high	89.5	Confident	35 Å²	35	68 Å²	68	22%	0.215	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-126.8	145.5	-174.2	53.4	0	0	0	0	110.9	E30 H31 H35 A39 R40 I54	E30-T33 WeakPolarHBondContact O-CG2 3.47Å; H31-T33 PolarHBondContact O-N 3.41Å; T33-H35 PolarHBondContact O-N 3.24Å; T33-A39 CarbonylContact C-O 3.56Å; T33-A39 WeakPolarHBondContact CA-O 3.32Å; T33-R40 HydrophobicContact CG2-CG 4.03Å; T33-I54 WeakPolarHBondContact O-CG2 3.24Å
34	C	93.6	Very high	89.2	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.362	C	S	.	.			trans	-59	123.7	171	178.6	0	0	0	0	110	R36 C37 H38 A39 L41 I54 C56 C59	C34-R36 PolarHBondContact O-N 2.89Å; C34-C37 VanDerWaalsContact CB-SG 3.54Å; C34-C37 PolarHBondContact SG-SG 2.85Å; C34-H38 WeakPolarHBondContact O-CA 3.48Å; C34-H38 PolarHBondContact O-N 3.06Å; C34-A39 PolarHBondContact N-O 3.28Å; C34-L41 HydrophobicContact CB-CD2 4.27Å; C34-I54 CarbonylContact C-O 3.55Å; C34-I54 WeakPolarHBondContact CA-O 3.33Å; C34-C56 HydrophobicContact CB-CB 4.16Å; C34-C56 PolarHBondContact SG-N 2.85Å; C34-C59 VanDerWaalsContact SG-SG 3.62Å
35	H	91.9	Very high	88.7	Confident	98 Å²	98	71.1 Å²	71.1	45%	0.454	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.1	-179.3	-177	78.9	0	0	0	113.2	T33 H38 E53 I54 L55	T33-H35 PolarHBondContact O-N 3.24Å; H35-H38 PolarHBondContact O-CE1 3.08Å; H35-E53 HydrophobicContact CB-CB 3.74Å; H35-E53 HydrophobicContact CB-CG 3.96Å; H35-E53 IonicContact CD2-OE1 3.35Å; H35-E53 PolarHBondContact CD2-OE1 3.44Å; H35-E53 IonicContact CD2-OE2 3.29Å; H35-E53 PolarHBondContact CD2-OE2 3.49Å; H35-E53 VanDerWaalsContact CD2-OE2 3.29Å; H35-E53 IonicContact CE1-OE1 2.76Å; H35-E53 VanDerWaalsContact CG-CD 3.46Å; H35-E53 IonicContact CG-OE1 3.9Å; H35-E53 IonicContact CG-OE2 3.78Å; H35-E53 IonicContact ND1-OE1 4Å; H35-E53 IonicContact NE2-OE1 3.12Å; H35-E53 PolarHBondContact NE2-OE1 3.3Å; H35-E53 VanDerWaalsContact NE2-OE1 3.12Å; H35-E53 IonicContact NE2-OE2 3.92Å; H35-I54 PolarHBondContact N-O 3.2Å; H35-L55 HydrophobicContact CB-CD2 4.15Å
36	R	90.5	Very high	88.5	Confident	127 Å²	127	72.3 Å²	72.3	48%	0.479	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-44.3	-175.6	-175	178.4	-174.6	-173.4	2.8	114.2	C34 L55 C59 L63	C34-R36 PolarHBondContact O-N 2.89Å; R36-L55 HydrophobicContact CB-CD2 3.66Å; R36-C59 HydrophobicContact CB-CB 4.23Å; R36-L63 VanDerWaalsContact NH1-CD2 3.3Å; R36-L63 VanDerWaalsContact NH1-CG 3.34Å
37	C	93.8	Very high	88.6	Confident	62 Å²	62	72 Å²	72	42%	0.419	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-1	-176.2	68.5	0	0	0	0	113.6	C34 A39 C59	C34-C37 VanDerWaalsContact CB-SG 3.54Å; C34-C37 PolarHBondContact SG-SG 2.85Å; C37-A39 PolarHBondContact O-N 3.02Å; C37-A39 VanDerWaalsContact SG-CB 3.53Å; C37-C59 VanDerWaalsContact SG-SG 3.66Å
38	H	92.1	Very high	88.6	Confident	137 Å²	137	76.1 Å²	76.1	63%	0.634	39%	0.39	S	S	*	.			trans	58.9	6.9	-178.2	-52.5	-67.5	0	0	0	115.4	C34 H35 R40	C34-H38 WeakPolarHBondContact O-CA 3.48Å; C34-H38 PolarHBondContact O-N 3.06Å; H35-H38 PolarHBondContact O-CE1 3.08Å; H38-R40 PolarHBondContact O-N 2.76Å
39	A	90.9	Very high	88.4	Confident	47 Å²	47	78.2 Å²	78.2	39%	0.388	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-60	133.3	174.7	0	0	0	0	0	110.2	T33 C34 C37 L41	T33-A39 CarbonylContact C-O 3.56Å; T33-A39 WeakPolarHBondContact CA-O 3.32Å; C34-A39 PolarHBondContact N-O 3.28Å; C37-A39 PolarHBondContact O-N 3.02Å; C37-A39 VanDerWaalsContact SG-CB 3.53Å; A39-L41 PolarHBondContact O-N 2.64Å
40	R	88.7	Confident	88.1	Confident	195 Å²	195	76.7 Å²	76.7	74%	0.736	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-62.2	124.1	171.2	-75.8	-179	162.8	138.7	-1.5	109.2	T33 H38	T33-R40 HydrophobicContact CG2-CG 4.03Å; H38-R40 PolarHBondContact O-N 2.76Å
41	L	90.8	Very high	87.4	Confident	13 Å²	13	78.3 Å²	78.3	7%	0.068	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-85.8	152	173	-57.2	174.2	0	0	0	107.8	F32 C34 A39 V45 C47 I54 C56	F32-L41 HydrophobicContact CD1-CB 3.57Å; F32-L41 VanDerWaalsContact CD1-O 3.28Å; F32-L41 WeakPolarHBondContact CD1-O 3.42Å; F32-L41 HydrophobicContact CE1-CB 3.39Å; F32-L41 HydrophobicContact CE2-CD1 4.38Å; F32-L41 HydrophobicContact CG-CB 4.2Å; F32-L41 HydrophobicContact CZ-CB 3.9Å; F32-L41 HydrophobicContact CZ-CD1 4.32Å; F32-L41 WeakPolarHBondContact O-CB 3.43Å; F32-L41 PolarHBondContact O-N 2.76Å; C34-L41 HydrophobicContact CB-CD2 4.27Å; A39-L41 PolarHBondContact O-N 2.64Å; L41-V45 HydrophobicContact CD2-CG1 4.27Å; L41-C47 HydrophobicContact CD1-CB 3.82Å; L41-C47 HydrophobicContact CD2-CB 4.3Å; L41-I54 HydrophobicContact CD1-CB 4.34Å; L41-I54 HydrophobicContact CD1-CD1 3.73Å; L41-I54 HydrophobicContact CD1-CG1 3.79Å; L41-I54 HydrophobicContact CD1-CG2 3.71Å; L41-C56 HydrophobicContact CD2-CB 3.67Å
42	S	84.3	Confident	86.6	Confident	51 Å²	51	83.4 Å²	83.4	36%	0.357	43%	0.425	S	S	.	.			trans	-128.8	166.5	171.5	69.6	0	0	0	0	108.8	N44 V45	S42-N44 PolarHBondContact O-N 3.25Å; S42-N44 VanDerWaalsContact O-N 3.08Å; S42-N44 PolarHBondContact OG-N 3.1Å; S42-V45 PolarHBondContact O-N 2.86Å; S42-V45 WeakPolarHBondContact OG-CG2 3.44Å
43	L	77.6	Confident	86.3	Confident	123 Å²	123	86.5 Å²	86.5	64%	0.644	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.8	175.7	-69.8	172.1	0	0	0	112.9	V20	V20-L43 HydrophobicContact CG1-CD1 4.21Å; V20-L43 HydrophobicContact CG1-CD2 3.77Å; V20-L43 HydrophobicContact CG1-CG 3.75Å
44	N	80.9	Confident	86.1	Confident	154 Å²	154	85.2 Å²	85.2	82%	0.824	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-5.3	179.4	-58.6	-10	0	0	0	112.7	S42	S42-N44 PolarHBondContact O-N 3.25Å; S42-N44 VanDerWaalsContact O-N 3.08Å; S42-N44 PolarHBondContact OG-N 3.1Å
45	V	77.2	Confident	86	Confident	65 Å²	65	85.8 Å²	85.8	39%	0.394	43%	0.434	S	S	.	.	S	Bend	trans	-106.2	122.3	-178.8	174.3	0	0	0	0	109.6	L41 S42 C47	L41-V45 HydrophobicContact CD2-CG1 4.27Å; S42-V45 PolarHBondContact O-N 2.86Å; S42-V45 WeakPolarHBondContact OG-CG2 3.44Å; V45-C47 PolarHBondContact O-N 3.15Å
46	S	84.7	Confident	86.1	Confident	87 Å²	87	81.7 Å²	81.7	61%	0.608	42%	0.416	S	S	*	.			trans	-57	124.9	171.5	-56.1	0	0	0	0	110.7	S57	S46-S57 VanDerWaalsContact C-OG 3.27Å; S46-S57 WeakPolarHBondContact CB-OG 3.49Å; S46-S57 PolarHBondContact O-N 2.78Å; S46-S57 VanDerWaalsContact O-N 3.15Å; S46-S57 PolarHBondContact O-OG 3.07Å
47	C	90.7	Very high	86.2	Confident	16 Å²	16	77.3 Å²	77.3	11%	0.108	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	162.3	178.7	55.4	0	0	0	0	109.9	F23 L41 V45 I54 L55	F23-C47 VanDerWaalsContact CZ-O 3.25Å; F23-C47 WeakPolarHBondContact CZ-O 3.2Å; L41-C47 HydrophobicContact CD1-CB 3.82Å; L41-C47 HydrophobicContact CD2-CB 4.3Å; V45-C47 PolarHBondContact O-N 3.15Å; C47-I54 HydrophobicContact CB-CD1 3.98Å; C47-I54 HydrophobicContact CB-CG1 4.05Å; C47-L55 CarbonylContact C-O 3.56Å; C47-L55 VanDerWaalsContact CA-O 3.3Å; C47-L55 WeakPolarHBondContact CA-O 3.14Å
48	H	90.7	Very high	86.1	Confident	93 Å²	93	80.6 Å²	80.6	43%	0.431	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	134.5	178.7	-58.5	-100.6	0	0	0	109.6	I54 L55 S57 V60	H48-I54 CarbonylContact O-C 3.52Å; H48-I54 WeakPolarHBondContact O-CA 3.17Å; H48-I54 WeakPolarHBondContact O-CG1 3.38Å; H48-L55 PolarHBondContact N-O 3.46Å; H48-L55 PolarHBondContact O-N 2.82Å; H48-S57 PolarHBondContact NE2-OG 3.3Å; H48-V60 HydrophobicContact CB-CG2 3.87Å
49	K	88	Confident	86.2	Confident	75 Å²	75	74.7 Å²	74.7	33%	0.326	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.7	172.7	176.8	-178.1	176.6	-166	0	110	F23	F23-K49 HydrophobicContact CB-CB 4.26Å; F23-K49 HydrophobicContact CB-CD 3.76Å; F23-K49 HydrophobicContact CD2-CB 3.55Å; F23-K49 HydrophobicContact CE2-CB 4.08Å; F23-K49 HydrophobicContact CG-CB 3.93Å; F23-K49 HydrophobicContact CG-CD 4.36Å
50	N	79.8	Confident	86.1	Confident	57 Å²	57	73.6 Å²	73.6	31%	0.305	38%	0.381	S	S	.	.			trans	-101.6	-177.4	160.8	74.2	33.3	0	0	0	109.4	K52 E53	N50-K52 PolarHBondContact O-N 3.47Å; N50-K52 PolarHBondContact OD1-N 3.23Å; N50-E53 PolarHBondContact N-O 3.2Å; N50-E53 PolarHBondContact ND2-OE2 3.1Å; N50-E53 WeakPolarHBondContact OD1-CA 3.45Å; N50-E53 WeakPolarHBondContact OD1-CB 3.19Å; N50-E53 PolarHBondContact OD1-N 3.09Å; N50-E53 PolarHBondContact OD1-O 2.87Å
51	D	73.6	Confident	86.2	Confident	156 Å²	156	66.7 Å²	66.7	83%	0.834	36%	0.362	S	S	*	.	S	Bend	trans	-53.2	-25.2	-176	-69.6	-67.7	0	0	0	115.2
52	K	75.2	Confident	86.2	Confident	159 Å²	159	71.1 Å²	71.1	69%	0.691	38%	0.383	S	S	*	.	S	Bend	trans	-132.8	-16	-173.5	-63.6	-170.4	178.3	-170.2	0	115.1	N50	N50-K52 PolarHBondContact O-N 3.47Å; N50-K52 PolarHBondContact OD1-N 3.23Å
53	E	84.3	Confident	86.4	Confident	67 Å²	67	70.3 Å²	70.3	31%	0.313	37%	0.374	S	S	.	.			trans	-142.6	154.3	-164.2	-62.5	161.8	-175.9	0	0	110.6	H35 N50	H35-E53 HydrophobicContact CB-CB 3.74Å; H35-E53 HydrophobicContact CB-CG 3.96Å; H35-E53 IonicContact CD2-OE1 3.35Å; H35-E53 PolarHBondContact CD2-OE1 3.44Å; H35-E53 IonicContact CD2-OE2 3.29Å; H35-E53 PolarHBondContact CD2-OE2 3.49Å; H35-E53 VanDerWaalsContact CD2-OE2 3.29Å; H35-E53 IonicContact CE1-OE1 2.76Å; H35-E53 VanDerWaalsContact CG-CD 3.46Å; H35-E53 IonicContact CG-OE1 3.9Å; H35-E53 IonicContact CG-OE2 3.78Å; H35-E53 IonicContact ND1-OE1 4Å; H35-E53 IonicContact NE2-OE1 3.12Å; H35-E53 PolarHBondContact NE2-OE1 3.3Å; H35-E53 VanDerWaalsContact NE2-OE1 3.12Å; H35-E53 IonicContact NE2-OE2 3.92Å; N50-E53 PolarHBondContact N-O 3.2Å; N50-E53 PolarHBondContact ND2-OE2 3.1Å; N50-E53 WeakPolarHBondContact OD1-CA 3.45Å; N50-E53 WeakPolarHBondContact OD1-CB 3.19Å; N50-E53 PolarHBondContact OD1-N 3.09Å; N50-E53 PolarHBondContact OD1-O 2.87Å
54	I	89.8	Confident	87	Confident	8 Å²	8	67.6 Å²	67.6	4%	0.041	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	138.4	170.1	-163.2	170.6	0	0	0	110.1	V22 F23 F32 T33 C34 H35 L41 C47 H48	V22-I54 HydrophobicContact CG1-CD1 4.04Å; F23-I54 HydrophobicContact CD2-CD1 4.37Å; F23-I54 HydrophobicContact CE2-CD1 4.25Å; F32-I54 HydrophobicContact CD2-CD1 4.14Å; F32-I54 HydrophobicContact CE2-CD1 3.28Å; F32-I54 HydrophobicContact CZ-CD1 3.88Å; T33-I54 WeakPolarHBondContact O-CG2 3.24Å; C34-I54 CarbonylContact C-O 3.55Å; C34-I54 WeakPolarHBondContact CA-O 3.33Å; H35-I54 PolarHBondContact N-O 3.2Å; L41-I54 HydrophobicContact CD1-CB 4.34Å; L41-I54 HydrophobicContact CD1-CD1 3.73Å; L41-I54 HydrophobicContact CD1-CG1 3.79Å; L41-I54 HydrophobicContact CD1-CG2 3.71Å; C47-I54 HydrophobicContact CB-CD1 3.98Å; C47-I54 HydrophobicContact CB-CG1 4.05Å; H48-I54 CarbonylContact O-C 3.52Å; H48-I54 WeakPolarHBondContact O-CA 3.17Å; H48-I54 WeakPolarHBondContact O-CG1 3.38Å
55	L	91.8	Very high	87.5	Confident	11 Å²	11	66 Å²	66	6%	0.058	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.7	-179.3	-65.2	173.3	0	0	0	110	H35 R36 C47 H48 C59 V60 L63	H35-L55 HydrophobicContact CB-CD2 4.15Å; R36-L55 HydrophobicContact CB-CD2 3.66Å; C47-L55 CarbonylContact C-O 3.56Å; C47-L55 VanDerWaalsContact CA-O 3.3Å; C47-L55 WeakPolarHBondContact CA-O 3.14Å; H48-L55 PolarHBondContact N-O 3.46Å; H48-L55 PolarHBondContact O-N 2.82Å; L55-C59 HydrophobicContact CB-CB 4.48Å; L55-C59 HydrophobicContact CD2-CB 4.45Å; L55-V60 HydrophobicContact CB-CG2 3.56Å; L55-V60 HydrophobicContact CD1-CG2 4.16Å; L55-L63 HydrophobicContact CD1-CD1 3.6Å
56	C	93.7	Very high	88.4	Confident	13 Å²	13	64.8 Å²	64.8	9%	0.088	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	153.8	169.4	69	0	0	0	0	110.5	C34 L41 N58 C59 V60	C34-C56 HydrophobicContact CB-CB 4.16Å; C34-C56 PolarHBondContact SG-N 2.85Å; L41-C56 HydrophobicContact CD2-CB 3.67Å; C56-N58 PolarHBondContact O-N 2.93Å; C56-N58 VanDerWaalsContact O-N 3.14Å; C56-C59 PolarHBondContact O-N 3.35Å; C56-C59 PolarHBondContact SG-N 3.12Å; C56-C59 VanDerWaalsContact SG-N 3.35Å; C56-V60 PolarHBondContact O-N 3.25Å
57	S	91.4	Very high	88.9	Confident	35 Å²	35	60.6 Å²	60.6	25%	0.245	31%	0.309	C	S	.	.	H	α-helix	trans	-54.5	-34.2	178.2	-66.2	0	0	0	0	113.4	S46 H48 V60 C61	S46-S57 VanDerWaalsContact C-OG 3.27Å; S46-S57 WeakPolarHBondContact CB-OG 3.49Å; S46-S57 PolarHBondContact O-N 2.78Å; S46-S57 VanDerWaalsContact O-N 3.15Å; S46-S57 PolarHBondContact O-OG 3.07Å; H48-S57 PolarHBondContact NE2-OG 3.3Å; S57-V60 PolarHBondContact O-N 2.91Å; S57-C61 VanDerWaalsContact O-CB 3.24Å; S57-C61 WeakPolarHBondContact O-CB 3.43Å; S57-C61 PolarHBondContact O-N 2.88Å
58	N	92.1	Very high	89	Confident	131 Å²	131	62.6 Å²	62.6	70%	0.701	32%	0.322	S	S	*	.	H	α-helix	trans	-62.2	-47.9	174.9	-71.7	-5.6	0	0	0	111.9	C56 V60 C61 Q62	C56-N58 PolarHBondContact O-N 2.93Å; C56-N58 VanDerWaalsContact O-N 3.14Å; N58-V60 VanDerWaalsContact C-N 3.34Å; N58-V60 PolarHBondContact O-N 3.02Å; N58-C61 PolarHBondContact O-N 3.38Å; N58-Q62 VanDerWaalsContact O-CG 3.3Å; N58-Q62 WeakPolarHBondContact O-CG 3.18Å; N58-Q62 PolarHBondContact O-N 3.32Å
59	C	93.1	Very high	89.1	Confident	13 Å²	13	60 Å²	60	9%	0.088	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-38.8	179.2	-77.8	0	0	0	0	111.9	C34 R36 C37 L55 C56 Q62 L63	C34-C59 VanDerWaalsContact SG-SG 3.62Å; R36-C59 HydrophobicContact CB-CB 4.23Å; C37-C59 VanDerWaalsContact SG-SG 3.66Å; L55-C59 HydrophobicContact CB-CB 4.48Å; L55-C59 HydrophobicContact CD2-CB 4.45Å; C56-C59 PolarHBondContact O-N 3.35Å; C56-C59 PolarHBondContact SG-N 3.12Å; C56-C59 VanDerWaalsContact SG-N 3.35Å; C59-Q62 PolarHBondContact O-N 3.34Å; C59-L63 VanDerWaalsContact O-CG 3.28Å; C59-L63 WeakPolarHBondContact O-CG 3.46Å; C59-L63 PolarHBondContact O-N 2.97Å
60	V	90.6	Very high	89.4	Confident	24 Å²	24	58.6 Å²	58.6	15%	0.145	32%	0.319	C	S	.	.	H	α-helix	trans	-63.6	-50.3	174.7	176.8	0	0	0	0	110.5	H48 L55 C56 S57 N58 Q62 L63 L64	H48-V60 HydrophobicContact CB-CG2 3.87Å; L55-V60 HydrophobicContact CB-CG2 3.56Å; L55-V60 HydrophobicContact CD1-CG2 4.16Å; C56-V60 PolarHBondContact O-N 3.25Å; S57-V60 PolarHBondContact O-N 2.91Å; N58-V60 VanDerWaalsContact C-N 3.34Å; N58-V60 PolarHBondContact O-N 3.02Å; V60-Q62 PolarHBondContact O-N 3.44Å; V60-L63 WeakPolarHBondContact O-CA 3.47Å; V60-L63 WeakPolarHBondContact O-CB 3.28Å; V60-L63 PolarHBondContact O-N 2.96Å; V60-L64 HydrophobicContact CG1-CD1 3.99Å; V60-L64 HydrophobicContact CG1-CG 4.29Å; V60-L64 WeakPolarHBondContact O-CG 3.14Å; V60-L64 PolarHBondContact O-N 2.8Å
61	C	90.3	Very high	90	Very high	50 Å²	50	60.9 Å²	60.9	34%	0.338	34%	0.335	S	S	.	.	H	α-helix	trans	-54.9	-42.6	178.1	-172.1	0	0	0	0	111.6	S57 N58 L64 K65	S57-C61 VanDerWaalsContact O-CB 3.24Å; S57-C61 WeakPolarHBondContact O-CB 3.43Å; S57-C61 PolarHBondContact O-N 2.88Å; N58-C61 PolarHBondContact O-N 3.38Å; C61-L64 PolarHBondContact O-N 3.47Å; C61-K65 VanDerWaalsContact O-CG 3.3Å; C61-K65 WeakPolarHBondContact O-CG 3.47Å; C61-K65 PolarHBondContact O-N 3.29Å; C61-K65 VanDerWaalsContact O-N 3.12Å; C61-K65 WeakPolarHBondContact SG-CE 3.44Å; C61-K65 PolarHBondContact SG-NZ 2.86Å
62	Q	89.8	Confident	91.1	Very high	106 Å²	106	58.8 Å²	58.8	50%	0.495	32%	0.321	S	S	.	.	H	α-helix	trans	-64.4	-42.7	175.1	-68.9	-63.1	-11.2	0	0	112.4	N58 C59 V60 L64 K65 T66	N58-Q62 VanDerWaalsContact O-CG 3.3Å; N58-Q62 WeakPolarHBondContact O-CG 3.18Å; N58-Q62 PolarHBondContact O-N 3.32Å; C59-Q62 PolarHBondContact O-N 3.34Å; V60-Q62 PolarHBondContact O-N 3.44Å; Q62-L64 PolarHBondContact O-N 3.02Å; Q62-K65 PolarHBondContact O-N 2.77Å; Q62-K65 VanDerWaalsContact O-N 3.13Å; Q62-T66 PolarHBondContact O-N 3.3Å; Q62-T66 PolarHBondContact O-OG1 3.35Å
63	L	88.7	Confident	92	Very high	34 Å²	34	54.7 Å²	54.7	18%	0.178	31%	0.31	C	S	.	.	H	α-helix	trans	-63.5	-27.9	175.8	-70.1	169	0	0	0	113.2	R36 L55 C59 V60	R36-L63 VanDerWaalsContact NH1-CD2 3.3Å; R36-L63 VanDerWaalsContact NH1-CG 3.34Å; L55-L63 HydrophobicContact CD1-CD1 3.6Å; C59-L63 VanDerWaalsContact O-CG 3.28Å; C59-L63 WeakPolarHBondContact O-CG 3.46Å; C59-L63 PolarHBondContact O-N 2.97Å; V60-L63 WeakPolarHBondContact O-CA 3.47Å; V60-L63 WeakPolarHBondContact O-CB 3.28Å; V60-L63 PolarHBondContact O-N 2.96Å
64	L	90.2	Very high	92.5	Very high	66 Å²	66	53.3 Å²	53.3	35%	0.346	31%	0.305	S	S	.	.	H	α-helix	trans	-83.3	-16.6	177.1	-61.5	178.7	0	0	0	112.9	V60 C61 Q62 L74 Y85	V60-L64 HydrophobicContact CG1-CD1 3.99Å; V60-L64 HydrophobicContact CG1-CG 4.29Å; V60-L64 WeakPolarHBondContact O-CG 3.14Å; V60-L64 PolarHBondContact O-N 2.8Å; C61-L64 PolarHBondContact O-N 3.47Å; Q62-L64 PolarHBondContact O-N 3.02Å; L64-L74 WeakPolarHBondContact O-CD1 3.21Å; L64-Y85 HydrophobicContact CB-CD2 4.04Å; L64-Y85 HydrophobicContact CB-CE2 4.06Å; L64-Y85 HydrophobicContact CD2-CD2 3.97Å; L64-Y85 HydrophobicContact CD2-CE2 3.83Å; L64-Y85 HydrophobicContact CG-CE2 4.35Å; L64-Y85 WeakPolarHBondContact O-CD2 3.5Å
65	K	92.6	Very high	92.6	Very high	120 Å²	120	60.8 Å²	60.8	52%	0.522	34%	0.337	S	S	.	.	H	α-helix	trans	-97.6	-11.1	179.2	-72.8	173.3	176.1	176.5	0	113.7	C61 Q62 P73 L74	C61-K65 VanDerWaalsContact O-CG 3.3Å; C61-K65 WeakPolarHBondContact O-CG 3.47Å; C61-K65 PolarHBondContact O-N 3.29Å; C61-K65 VanDerWaalsContact O-N 3.12Å; C61-K65 WeakPolarHBondContact SG-CE 3.44Å; C61-K65 PolarHBondContact SG-NZ 2.86Å; Q62-K65 PolarHBondContact O-N 2.77Å; Q62-K65 VanDerWaalsContact O-N 3.13Å; K65-P73 WeakPolarHBondContact O-CA 3.2Å; K65-L74 PolarHBondContact O-N 2.78Å
66	T	95.2	Very high	92.5	Very high	39 Å²	39	63.9 Å²	63.9	24%	0.239	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-114.8	134.3	-177	-53.9	0	0	0	0	111	Q62 P68 T71	Q62-T66 PolarHBondContact O-N 3.3Å; Q62-T66 PolarHBondContact O-OG1 3.35Å; T66-P68 WeakPolarHBondContact O-CD 3.33Å; T66-T71 WeakPolarHBondContact CG2-O 3.09Å
67	C	95.8	Very high	92.3	Very high	0 Å²	0	72.7 Å²	72.7	0%	0	41%	0.409	C	S	.	.			trans	-72.7	125.7	176.5	179.9	0	0	0	0	110.9	G69 T71 Q72 L74 H87 C90	C67-G69 VanDerWaalsContact C-N 3.26Å; C67-G69 PolarHBondContact O-N 3.08Å; C67-G69 PolarHBondContact SG-N 3.42Å; C67-T71 WeakPolarHBondContact O-CA 3.39Å; C67-T71 PolarHBondContact O-N 3.29Å; C67-Q72 PolarHBondContact N-O 3.23Å; C67-L74 HydrophobicContact CB-CD2 3.71Å; C67-L74 HydrophobicContact CB-CG 4.39Å; C67-H87 VanDerWaalsContact CB-ND1 3.33Å; C67-H87 WeakPolarHBondContact CB-ND1 3.07Å; C67-H87 PolarHBondContact SG-N 3.29Å; C67-H87 VanDerWaalsContact SG-N 3.38Å; C67-C90 WeakPolarHBondContact SG-CB 3.11Å
68	P	92.2	Very high	92.4	Very high	57 Å²	57	73.7 Å²	73.7	37%	0.37	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.5	179.3	-16.9	28.4	0	0	0	114.2	T66 R84 Y85 W86	T66-P68 WeakPolarHBondContact O-CD 3.33Å; P68-R84 HydrophobicContact CG-CB 3.8Å; P68-R84 HydrophobicContact CG-CG 3.99Å; P68-Y85 WeakPolarHBondContact CD-O 3.33Å; P68-W86 HydrophobicContact CB-CD2 4.44Å; P68-W86 HydrophobicContact CB-CE3 4.28Å; P68-W86 HydrophobicContact CB-CH2 3.56Å; P68-W86 HydrophobicContact CB-CZ2 3.71Å; P68-W86 HydrophobicContact CB-CZ3 3.87Å; P68-W86 HydrophobicContact CG-CD2 4.06Å; P68-W86 HydrophobicContact CG-CE3 4.37Å; P68-W86 HydrophobicContact CG-CH2 4.06Å; P68-W86 HydrophobicContact CG-CZ2 3.69Å; P68-W86 HydrophobicContact CG-CZ3 4.37Å
69	G	92.2	Very high	92.5	Very high	39 Å²	39	69.4 Å²	69.4	40%	0.402	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-29.3	-177.9	0	0	0	0	0	114.4	C67 W86	C67-G69 VanDerWaalsContact C-N 3.26Å; C67-G69 PolarHBondContact O-N 3.08Å; C67-G69 PolarHBondContact SG-N 3.42Å; G69-W86 VanDerWaalsContact N-CZ3 3.3Å
70	C	94.8	Very high	92.4	Very high	45 Å²	45	74.5 Å²	74.5	30%	0.304	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	-3.1	179.7	67.2	0	0	0	0	114.3	Q72 H87 C90	C70-Q72 PolarHBondContact O-N 3.19Å; C70-H87 PolarHBondContact SG-ND1 2.81Å; C70-C90 VanDerWaalsContact SG-SG 3.66Å
71	T	93.6	Very high	92.4	Very high	105 Å²	105	73.7 Å²	73.7	64%	0.644	41%	0.412	S	S	*	.			trans	60.7	9.8	-177.7	69.6	0	0	0	0	115.8	T66 C67	T66-T71 WeakPolarHBondContact CG2-O 3.09Å; C67-T71 WeakPolarHBondContact O-CA 3.39Å; C67-T71 PolarHBondContact O-N 3.29Å
72	Q	95.3	Very high	92.3	Very high	113 Å²	113	73.7 Å²	73.7	53%	0.528	41%	0.409	S	S	.	.	S	Bend	trans	-89.9	154.8	176.6	-64.6	-60	-35.5	0	0	112	C67 C70	C67-Q72 PolarHBondContact N-O 3.23Å; C70-Q72 PolarHBondContact O-N 3.19Å
73	P	95.4	Very high	92.1	Very high	73 Å²	73	75.9 Å²	75.9	47%	0.474	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-54.3	139.6	171.5	-24.4	34.1	0	0	0	111.7	K65 H87	K65-P73 WeakPolarHBondContact O-CA 3.2Å; P73-H87 PolarHBondContact O-CE1 3.17Å; P73-H87 PolarHBondContact O-NE2 3.18Å
74	L	94.6	Very high	92.1	Very high	38 Å²	38	78 Å²	78	20%	0.199	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-69.1	133.6	178.8	-68.7	158.9	0	0	0	110.6	L64 K65 C67 V78 Y85 H87	L64-L74 WeakPolarHBondContact O-CD1 3.21Å; K65-L74 PolarHBondContact O-N 2.78Å; C67-L74 HydrophobicContact CB-CD2 3.71Å; C67-L74 HydrophobicContact CB-CG 4.39Å; L74-V78 HydrophobicContact CB-CG1 4.08Å; L74-V78 HydrophobicContact CD2-CG1 3.78Å; L74-V78 HydrophobicContact CG-CG1 4.37Å; L74-Y85 HydrophobicContact CD1-CG 4.32Å; L74-H87 WeakPolarHBondContact CA-NE2 3.32Å
75	K	91.6	Very high	92.3	Very high	164 Å²	164	79 Å²	79	71%	0.713	43%	0.429	S	S	*	.			trans	-131.4	143.9	176.4	-61.6	178.5	-175.8	179	0	110.2	H87	K75-H87 PolarHBondContact N-NE2 2.83Å
76	G	89.3	Confident	92.4	Very high	77 Å²	77	74.5 Å²	74.5	79%	0.794	41%	0.409	S	S	*	.	S	Bend	trans	63.4	-143.5	174.5	0	0	0	0	0	114
77	K	89.7	Confident	92.4	Very high	197 Å²	197	73.9 Å²	73.9	86%	0.857	40%	0.403	S	S	*	.	S	Bend	trans	-74.8	128.6	-179.1	-67.7	-177.3	-179.7	178.3	0	110.6
78	V	93.9	Very high	92.3	Very high	56 Å²	56	81.1 Å²	81.1	34%	0.339	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	158.9	-179.1	-62.3	0	0	0	0	111.5	L74 Y85 W86	L74-V78 HydrophobicContact CB-CG1 4.08Å; L74-V78 HydrophobicContact CD2-CG1 3.78Å; L74-V78 HydrophobicContact CG-CG1 4.37Å; V78-Y85 HydrophobicContact CG2-CD1 3.76Å; V78-W86 CarbonylContact C-O 3.53Å; V78-W86 VanDerWaalsContact CA-O 3.24Å; V78-W86 WeakPolarHBondContact CA-O 3.42Å; V78-W86 WeakPolarHBondContact CB-O 3.33Å
79	V	93.5	Very high	92.4	Very high	41 Å²	41	84.9 Å²	84.9	25%	0.248	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134	169.4	179	0	0	0	0	108.5	W86 R88 F91	V79-W86 PolarHBondContact N-O 3Å; V79-W86 PolarHBondContact O-N 3.24Å; V79-R88 HydrophobicContact CG2-CB 4.19Å; V79-R88 HydrophobicContact CG2-CG 4.04Å; V79-F91 HydrophobicContact CG1-CD1 4.13Å
80	I	91.6	Very high	92.6	Very high	121 Å²	121	83.7 Å²	83.7	62%	0.621	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	114	173.9	-53.2	179.5	0	0	0	108.1	Y85	I80-Y85 HydrophobicContact CD1-CD1 4.31Å; I80-Y85 HydrophobicContact CD1-CE1 3.69Å; I80-Y85 HydrophobicContact CG1-CD1 3.73Å; I80-Y85 HydrophobicContact CG1-CE1 3.63Å
81	A	90.1	Very high	92.6	Very high	6 Å²	6	81.8 Å²	81.8	5%	0.05	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	146.3	176.9	0	0	0	0	0	110.1	N83 R84 W86 F91	A81-N83 VanDerWaalsContact C-N 3.26Å; A81-N83 PolarHBondContact O-N 2.93Å; A81-R84 PolarHBondContact N-O 3Å; A81-R84 CarbonylContact O-C 3.55Å; A81-R84 PolarHBondContact O-N 3Å; A81-W86 PolarHBondContact O-NE1 3.13Å; A81-F91 HydrophobicContact CB-CD1 4.24Å; A81-F91 HydrophobicContact CB-CD2 3.93Å; A81-F91 HydrophobicContact CB-CE1 3.77Å; A81-F91 HydrophobicContact CB-CE2 3.43Å; A81-F91 VanDerWaalsContact CB-CE2 3.43Å; A81-F91 HydrophobicContact CB-CG 4.33Å; A81-F91 HydrophobicContact CB-CZ 3.35Å
82	L	87.9	Confident	92.7	Very high	50 Å²	50	80.9 Å²	80.9	26%	0.262	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	39	177.5	-45.5	179.5	0	0	0	113.1	R84 W86 F91 Y105 L107	L82-R84 WeakPolarHBondContact O-CG 3.49Å; L82-R84 PolarHBondContact O-N 2.87Å; L82-R84 VanDerWaalsContact O-N 3.08Å; L82-W86 HydrophobicContact CD1-CZ2 4.05Å; L82-F91 HydrophobicContact CD1-CE2 4.22Å; L82-F91 HydrophobicContact CG-CE2 4.37Å; L82-Y105 HydrophobicContact CD2-CE2 4.26Å; L82-L107 HydrophobicContact CD1-CD2 3.81Å; L82-L107 HydrophobicContact CD2-CD1 3.34Å; L82-L107 HydrophobicContact CD2-CD2 3.46Å; L82-L107 VanDerWaalsContact CD2-CD2 3.46Å; L82-L107 HydrophobicContact CD2-CG 3.95Å; L82-L107 HydrophobicContact CG-CD2 4.26Å
83	N	85.4	Confident	92.7	Very high	153 Å²	153	75.5 Å²	75.5	82%	0.818	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	31.2	-175.2	-65.8	36.6	0	0	0	113.2	A81	A81-N83 VanDerWaalsContact C-N 3.26Å; A81-N83 PolarHBondContact O-N 2.93Å
84	R	89.9	Confident	92.7	Very high	77 Å²	77	76.5 Å²	76.5	29%	0.291	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	159.6	179.6	-68.8	-74.6	143.6	90	1.2	109.7	P68 A81 L82	P68-R84 HydrophobicContact CG-CB 3.8Å; P68-R84 HydrophobicContact CG-CG 3.99Å; A81-R84 PolarHBondContact N-O 3Å; A81-R84 CarbonylContact O-C 3.55Å; A81-R84 PolarHBondContact O-N 3Å; L82-R84 WeakPolarHBondContact O-CG 3.49Å; L82-R84 PolarHBondContact O-N 2.87Å; L82-R84 VanDerWaalsContact O-N 3.08Å
85	Y	93.7	Very high	92.6	Very high	88 Å²	88	79.2 Å²	79.2	35%	0.345	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.7	172.5	-62.5	-86.2	0	0	0	109.3	L64 P68 L74 V78 I80	L64-Y85 HydrophobicContact CB-CD2 4.04Å; L64-Y85 HydrophobicContact CB-CE2 4.06Å; L64-Y85 HydrophobicContact CD2-CD2 3.97Å; L64-Y85 HydrophobicContact CD2-CE2 3.83Å; L64-Y85 HydrophobicContact CG-CE2 4.35Å; L64-Y85 WeakPolarHBondContact O-CD2 3.5Å; P68-Y85 WeakPolarHBondContact CD-O 3.33Å; L74-Y85 HydrophobicContact CD1-CG 4.32Å; V78-Y85 HydrophobicContact CG2-CD1 3.76Å; I80-Y85 HydrophobicContact CD1-CD1 4.31Å; I80-Y85 HydrophobicContact CD1-CE1 3.69Å; I80-Y85 HydrophobicContact CG1-CD1 3.73Å; I80-Y85 HydrophobicContact CG1-CE1 3.63Å
86	W	95.3	Very high	92.8	Very high	26 Å²	26	74.3 Å²	74.3	10%	0.098	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.4	-175.7	-59.8	74.1	0	0	0	110.3	P68 G69 V78 V79 A81 L82 F91	P68-W86 HydrophobicContact CB-CD2 4.44Å; P68-W86 HydrophobicContact CB-CE3 4.28Å; P68-W86 HydrophobicContact CB-CH2 3.56Å; P68-W86 HydrophobicContact CB-CZ2 3.71Å; P68-W86 HydrophobicContact CB-CZ3 3.87Å; P68-W86 HydrophobicContact CG-CD2 4.06Å; P68-W86 HydrophobicContact CG-CE3 4.37Å; P68-W86 HydrophobicContact CG-CH2 4.06Å; P68-W86 HydrophobicContact CG-CZ2 3.69Å; P68-W86 HydrophobicContact CG-CZ3 4.37Å; G69-W86 VanDerWaalsContact N-CZ3 3.3Å; V78-W86 CarbonylContact C-O 3.53Å; V78-W86 VanDerWaalsContact CA-O 3.24Å; V78-W86 WeakPolarHBondContact CA-O 3.42Å; V78-W86 WeakPolarHBondContact CB-O 3.33Å; V79-W86 PolarHBondContact N-O 3Å; V79-W86 PolarHBondContact O-N 3.24Å; A81-W86 PolarHBondContact O-NE1 3.13Å; L82-W86 HydrophobicContact CD1-CZ2 4.05Å; W86-F91 HydrophobicContact CB-CB 3.94Å; W86-F91 HydrophobicContact CD2-CB 4.47Å; W86-F91 AromaticContact CD2-CD2 3.81Å; W86-F91 HydrophobicContact CD2-CD2 3.81Å; W86-F91 HydrophobicContact CE3-CD2 4.14Å; W86-F91 HydrophobicContact CG-CB 4.23Å; W86-F91 HydrophobicContact CG-CD2 4.02Å; W86-F91 HydrophobicContact CG-CG 4.45Å
87	H	95.6	Very high	93	Very high	25 Å²	25	75.2 Å²	75.2	12%	0.116	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	142.3	158	-61.1	118.4	0	0	0	109	C67 C70 P73 L74 K75 E89 C90 F91	C67-H87 VanDerWaalsContact CB-ND1 3.33Å; C67-H87 WeakPolarHBondContact CB-ND1 3.07Å; C67-H87 PolarHBondContact SG-N 3.29Å; C67-H87 VanDerWaalsContact SG-N 3.38Å; C70-H87 PolarHBondContact SG-ND1 2.81Å; P73-H87 PolarHBondContact O-CE1 3.17Å; P73-H87 PolarHBondContact O-NE2 3.18Å; L74-H87 WeakPolarHBondContact CA-NE2 3.32Å; K75-H87 PolarHBondContact N-NE2 2.83Å; H87-E89 HydrophobicContact CB-CG 4.15Å; H87-E89 PolarHBondContact O-N 2.62Å; H87-C90 HydrophobicContact CB-CB 3.91Å; H87-C90 PolarHBondContact O-N 3.22Å; H87-F91 PolarHBondContact O-N 2.83Å; H87-F91 VanDerWaalsContact O-N 3.1Å
88	R	93.5	Very high	93.3	Very high	152 Å²	152	69.9 Å²	69.9	57%	0.574	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-44.2	-179.8	-166.6	-178.5	-170.9	-153.5	4.4	111.8	V79 C90 V99	V79-R88 HydrophobicContact CG2-CB 4.19Å; V79-R88 HydrophobicContact CG2-CG 4.04Å; R88-C90 VanDerWaalsContact C-N 3.32Å; R88-C90 PolarHBondContact O-N 3.34Å; R88-V99 WeakPolarHBondContact O-CG1 3.43Å
89	E	94.2	Very high	93.3	Very high	137 Å²	137	69.9 Å²	69.9	64%	0.64	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.7	177.1	67.3	-155.3	78.4	0	0	114.8	H87 R92	H87-E89 HydrophobicContact CB-CG 4.15Å; H87-E89 PolarHBondContact O-N 2.62Å; E89-R92 WeakPolarHBondContact O-CD 3.36Å; E89-R92 PolarHBondContact O-NH1 3.2Å; E89-R92 VanDerWaalsContact O-NH1 3.15Å
90	C	95.3	Very high	93.3	Very high	13 Å²	13	68.4 Å²	68.4	9%	0.088	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-23.8	178.8	-70.6	0	0	0	0	112.3	C67 C70 H87 R88 R92	C67-C90 WeakPolarHBondContact SG-CB 3.11Å; C70-C90 VanDerWaalsContact SG-SG 3.66Å; H87-C90 HydrophobicContact CB-CB 3.91Å; H87-C90 PolarHBondContact O-N 3.22Å; R88-C90 VanDerWaalsContact C-N 3.32Å; R88-C90 PolarHBondContact O-N 3.34Å; C90-R92 VanDerWaalsContact C-N 3.33Å; C90-R92 PolarHBondContact O-N 2.86Å; C90-R92 VanDerWaalsContact O-N 3.09Å
91	F	95.5	Very high	92.8	Very high	5 Å²	5	66.2 Å²	66.2	2%	0.022	32%	0.318	C	S	.	.	S	Bend	trans	-84	80.9	173.2	-163.8	-112.4	0	0	0	110.5	V79 A81 L82 W86 H87 F100 Y105 P112	V79-F91 HydrophobicContact CG1-CD1 4.13Å; A81-F91 HydrophobicContact CB-CD1 4.24Å; A81-F91 HydrophobicContact CB-CD2 3.93Å; A81-F91 HydrophobicContact CB-CE1 3.77Å; A81-F91 HydrophobicContact CB-CE2 3.43Å; A81-F91 VanDerWaalsContact CB-CE2 3.43Å; A81-F91 HydrophobicContact CB-CG 4.33Å; A81-F91 HydrophobicContact CB-CZ 3.35Å; L82-F91 HydrophobicContact CD1-CE2 4.22Å; L82-F91 HydrophobicContact CG-CE2 4.37Å; W86-F91 HydrophobicContact CB-CB 3.94Å; W86-F91 HydrophobicContact CD2-CB 4.47Å; W86-F91 AromaticContact CD2-CD2 3.81Å; W86-F91 HydrophobicContact CD2-CD2 3.81Å; W86-F91 HydrophobicContact CE3-CD2 4.14Å; W86-F91 HydrophobicContact CG-CB 4.23Å; W86-F91 HydrophobicContact CG-CD2 4.02Å; W86-F91 HydrophobicContact CG-CG 4.45Å; H87-F91 PolarHBondContact O-N 2.83Å; H87-F91 VanDerWaalsContact O-N 3.1Å; F91-F100 HydrophobicContact CD1-CB 4.17Å; F91-F100 AromaticContact CD1-CD2 3.7Å; F91-F100 HydrophobicContact CD1-CD2 3.7Å; F91-F100 HydrophobicContact CD1-CG 4.41Å; F91-F100 HydrophobicContact CE1-CB 4.33Å; F91-F100 AromaticContact CE1-CD2 3.68Å; F91-F100 HydrophobicContact CE1-CD2 3.68Å; F91-F100 HydrophobicContact CE1-CE2 4.48Å; F91-F100 HydrophobicContact CE1-CG 4.37Å; F91-F100 HydrophobicContact CG-CD2 4.36Å; F91-F100 HydrophobicContact CZ-CD2 4.32Å; F91-F100 VanDerWaalsContact O-CD2 3.32Å; F91-F100 WeakPolarHBondContact O-CD2 3.46Å; F91-F100 PolarHBondContact O-N 3.28Å; F91-Y105 AromaticContact CE1-CD1 3.76Å; F91-Y105 HydrophobicContact CE1-CD1 3.76Å; F91-Y105 AromaticContact CE1-CE1 3.72Å; F91-Y105 HydrophobicContact CE1-CE1 3.72Å; F91-Y105 HydrophobicContact CE1-CG 4.28Å; F91-Y105 AromaticContact CZ-CD1 3.93Å; F91-Y105 HydrophobicContact CZ-CD1 3.93Å; F91-Y105 HydrophobicContact CZ-CD2 4.12Å; F91-Y105 AromaticContact CZ-CE1 3.74Å; F91-Y105 HydrophobicContact CZ-CE1 3.74Å; F91-Y105 AromaticContact CZ-CE2 3.94Å; F91-Y105 HydrophobicContact CZ-CE2 3.94Å; F91-Y105 HydrophobicContact CZ-CG 4.12Å; F91-Y105 AromaticContact CZ-CZ 3.74Å; F91-P112 HydrophobicContact CD2-CG 4.4Å; F91-P112 HydrophobicContact CE2-CB 3.95Å; F91-P112 HydrophobicContact CE2-CG 3.98Å; F91-P112 HydrophobicContact CZ-CB 4.11Å
92	R	95.7	Very high	92.4	Very high	87 Å²	87	73.5 Å²	73.5	33%	0.328	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-135	163.8	-173.4	67.6	-177.6	-176	-94.5	-3.8	112.3	E89 C90 D94 D97 K98 V99	E89-R92 WeakPolarHBondContact O-CD 3.36Å; E89-R92 PolarHBondContact O-NH1 3.2Å; E89-R92 VanDerWaalsContact O-NH1 3.15Å; C90-R92 VanDerWaalsContact C-N 3.33Å; C90-R92 PolarHBondContact O-N 2.86Å; C90-R92 VanDerWaalsContact O-N 3.09Å; R92-D94 PolarHBondContact O-N 3.42Å; R92-D97 WeakPolarHBondContact CD-O 3.32Å; R92-D97 WeakPolarHBondContact CD-OD1 3.3Å; R92-D97 IonicContact CZ-OD1 3.74Å; R92-D97 IonicContact NE-OD1 3.54Å; R92-D97 PolarHBondContact NE-OD1 3.39Å; R92-D97 IonicContact NH2-OD1 2.78Å; R92-K98 CarbonylContact C-O 3.55Å; R92-K98 VanDerWaalsContact CA-O 3.28Å; R92-K98 WeakPolarHBondContact CA-O 3.36Å; R92-K98 WeakPolarHBondContact CB-O 3.42Å; R92-V99 HydrophobicContact CB-CG2 4.15Å
93	C	96	Very high	92.1	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.365	C	S	.	.			trans	-62.9	119.5	174.5	-179	0	0	0	0	110.2	R95 C96 D97 K98 F100 P112 C114	C93-R95 PolarHBondContact O-N 3.45Å; C93-C96 PolarHBondContact O-N 3.15Å; C93-D97 WeakPolarHBondContact O-CA 3.3Å; C93-D97 PolarHBondContact O-N 2.94Å; C93-K98 HydrophobicContact CB-CB 4.37Å; C93-K98 PolarHBondContact N-O 3.02Å; C93-F100 HydrophobicContact CB-CE1 4.22Å; C93-F100 HydrophobicContact CB-CZ 3.76Å; C93-F100 VanDerWaalsContact N-CE2 3.35Å; C93-F100 VanDerWaalsContact N-CZ 3.32Å; C93-P112 WeakPolarHBondContact CA-O 3.42Å; C93-C114 HydrophobicContact CB-CB 4.09Å; C93-C114 PolarHBondContact SG-N 3.26Å
94	D	93.9	Very high	92.3	Very high	93 Å²	93	77.6 Å²	77.6	50%	0.497	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21	-178.9	177.6	78.8	0	0	0	114.2	R92 I111 P112 Y113	R92-D94 PolarHBondContact O-N 3.42Å; D94-I111 HydrophobicContact CB-CG2 3.27Å; D94-I111 VanDerWaalsContact CG-CG2 3.44Å; D94-P112 PolarHBondContact N-O 3.14Å; D94-P112 VanDerWaalsContact N-O 3.08Å; D94-Y113 HydrophobicContact CB-CD1 4.36Å; D94-Y113 HydrophobicContact CB-CE1 3.76Å; D94-Y113 PolarHBondContact OD2-OH 3.02Å
95	R	93.3	Very high	92.5	Very high	95 Å²	95	78.2 Å²	78.2	36%	0.358	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-36.7	177.9	175.7	179.1	-81.2	-145.5	3.1	114.4	C93 Y113 C117	C93-R95 PolarHBondContact O-N 3.45Å; R95-Y113 HydrophobicContact CB-CD1 4.07Å; R95-Y113 HydrophobicContact CB-CE1 3.93Å; R95-C117 HydrophobicContact CB-CB 4.16Å; R95-C117 HydrophobicContact CG-CB 4.48Å
96	C	95	Very high	92.5	Very high	61 Å²	61	75.8 Å²	75.8	41%	0.412	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	9.3	-166.5	76.9	0	0	0	0	113.4	C93 K98	C93-C96 PolarHBondContact O-N 3.15Å; C96-K98 PolarHBondContact O-N 3.48Å; C96-K98 VanDerWaalsContact SG-CB 3.6Å
97	D	95.1	Very high	92.3	Very high	96 Å²	96	78.6 Å²	78.6	51%	0.513	38%	0.384	S	S	.	.			trans	54.9	11.7	179.3	-63.3	-63.4	0	0	0	116.2	R92 C93 V99	R92-D97 WeakPolarHBondContact CD-O 3.32Å; R92-D97 WeakPolarHBondContact CD-OD1 3.3Å; R92-D97 IonicContact CZ-OD1 3.74Å; R92-D97 IonicContact NE-OD1 3.54Å; R92-D97 PolarHBondContact NE-OD1 3.39Å; R92-D97 IonicContact NH2-OD1 2.78Å; C93-D97 WeakPolarHBondContact O-CA 3.3Å; C93-D97 PolarHBondContact O-N 2.94Å; D97-V99 PolarHBondContact O-N 2.86Å; D97-V99 VanDerWaalsContact O-N 3.1Å
98	K	94.9	Very high	92	Very high	86 Å²	86	79.7 Å²	79.7	37%	0.374	39%	0.392	S	S	.	.			trans	-66.3	115.1	177.3	-172.9	-177.3	-172.4	-174.4	0	109.6	R92 C93 C96 E103	R92-K98 CarbonylContact C-O 3.55Å; R92-K98 VanDerWaalsContact CA-O 3.28Å; R92-K98 WeakPolarHBondContact CA-O 3.36Å; R92-K98 WeakPolarHBondContact CB-O 3.42Å; C93-K98 HydrophobicContact CB-CB 4.37Å; C93-K98 PolarHBondContact N-O 3.02Å; C96-K98 PolarHBondContact O-N 3.48Å; C96-K98 VanDerWaalsContact SG-CB 3.6Å; K98-E103 WeakPolarHBondContact CE-OE2 3.22Å; K98-E103 IonicContact NZ-OE1 2.64Å; K98-E103 PolarHBondContact NZ-OE1 3.03Å; K98-E103 IonicContact NZ-OE2 3.69Å; K98-E103 PolarHBondContact NZ-OE2 3.31Å
99	V	94.5	Very high	91.7	Very high	56 Å²	56	79.4 Å²	79.4	34%	0.339	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-65.4	133.8	172.8	176.6	0	0	0	0	110.3	R88 R92 D97 S101	R88-V99 WeakPolarHBondContact O-CG1 3.43Å; R92-V99 HydrophobicContact CB-CG2 4.15Å; D97-V99 PolarHBondContact O-N 2.86Å; D97-V99 VanDerWaalsContact O-N 3.1Å; V99-S101 PolarHBondContact O-N 2.85Å
100	F	92.8	Very high	91.4	Very high	10 Å²	10	82.6 Å²	82.6	4%	0.044	41%	0.408	C	S	.	.			trans	-84.1	110.6	175.7	-53.7	-63.4	0	0	0	109.6	F91 C93 P112 C114	F91-F100 HydrophobicContact CD1-CB 4.17Å; F91-F100 AromaticContact CD1-CD2 3.7Å; F91-F100 HydrophobicContact CD1-CD2 3.7Å; F91-F100 HydrophobicContact CD1-CG 4.41Å; F91-F100 HydrophobicContact CE1-CB 4.33Å; F91-F100 AromaticContact CE1-CD2 3.68Å; F91-F100 HydrophobicContact CE1-CD2 3.68Å; F91-F100 HydrophobicContact CE1-CE2 4.48Å; F91-F100 HydrophobicContact CE1-CG 4.37Å; F91-F100 HydrophobicContact CG-CD2 4.36Å; F91-F100 HydrophobicContact CZ-CD2 4.32Å; F91-F100 VanDerWaalsContact O-CD2 3.32Å; F91-F100 WeakPolarHBondContact O-CD2 3.46Å; F91-F100 PolarHBondContact O-N 3.28Å; C93-F100 HydrophobicContact CB-CE1 4.22Å; C93-F100 HydrophobicContact CB-CZ 3.76Å; C93-F100 VanDerWaalsContact N-CE2 3.35Å; C93-F100 VanDerWaalsContact N-CZ 3.32Å; F100-P112 HydrophobicContact CE2-CB 3.87Å; F100-P112 HydrophobicContact CE2-CG 4.45Å; F100-C114 HydrophobicContact CE1-CB 3.8Å; F100-C114 HydrophobicContact CZ-CB 4.45Å
101	S	81.9	Confident	91.1	Very high	74 Å²	74	85 Å²	85	52%	0.517	42%	0.42	S	S	.	.	S	Bend	trans	-86.9	-69.6	173.8	50.8	0	0	0	0	110.9	V99	V99-S101 PolarHBondContact O-N 2.85Å
102	N	81	Confident	91	Very high	160 Å²	160	85.2 Å²	85.2	86%	0.856	42%	0.422	S	S	*	.	S	Bend	trans	-130.2	5.2	178.4	-71.7	12.1	0	0	0	112.4
103	E	82.7	Confident	91	Very high	94 Å²	94	82 Å²	82	44%	0.439	41%	0.41	S	S	.	.	S	Bend	trans	-83.8	149	-176.9	-66.6	176.3	121.3	0	0	111.8	K98 Y105	K98-E103 WeakPolarHBondContact CE-OE2 3.22Å; K98-E103 IonicContact NZ-OE1 2.64Å; K98-E103 PolarHBondContact NZ-OE1 3.03Å; K98-E103 IonicContact NZ-OE2 3.69Å; K98-E103 PolarHBondContact NZ-OE2 3.31Å; E103-Y105 PolarHBondContact O-N 2.87Å
104	K	88.8	Confident	91	Very high	194 Å²	194	82.6 Å²	82.6	84%	0.843	41%	0.414	S	S	*	.			trans	-65	133.6	171	-64.4	-174.4	179.4	-176.3	0	110.4
105	Y	93.1	Very high	90.9	Very high	91 Å²	91	86.5 Å²	86.5	36%	0.357	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	166.2	166.9	63.7	-87.8	0	0	0	110.1	L82 F91 E103 L107 P112 Y113	L82-Y105 HydrophobicContact CD2-CE2 4.26Å; F91-Y105 AromaticContact CE1-CD1 3.76Å; F91-Y105 HydrophobicContact CE1-CD1 3.76Å; F91-Y105 AromaticContact CE1-CE1 3.72Å; F91-Y105 HydrophobicContact CE1-CE1 3.72Å; F91-Y105 HydrophobicContact CE1-CG 4.28Å; F91-Y105 AromaticContact CZ-CD1 3.93Å; F91-Y105 HydrophobicContact CZ-CD1 3.93Å; F91-Y105 HydrophobicContact CZ-CD2 4.12Å; F91-Y105 AromaticContact CZ-CE1 3.74Å; F91-Y105 HydrophobicContact CZ-CE1 3.74Å; F91-Y105 AromaticContact CZ-CE2 3.94Å; F91-Y105 HydrophobicContact CZ-CE2 3.94Å; F91-Y105 HydrophobicContact CZ-CG 4.12Å; F91-Y105 AromaticContact CZ-CZ 3.74Å; E103-Y105 PolarHBondContact O-N 2.87Å; Y105-L107 HydrophobicContact CD2-CD2 4.21Å; Y105-L107 HydrophobicContact CD2-CG 4.38Å; Y105-L107 HydrophobicContact CE2-CD2 4.07Å; Y105-L107 HydrophobicContact CE2-CG 4.16Å; Y105-P112 HydrophobicContact CD2-CB 4.32Å; Y105-Y113 WeakPolarHBondContact CA-O 3.37Å
106	A	93.7	Very high	90.9	Very high	36 Å²	36	90 Å²	90	30%	0.298	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	148.6	171.6	0	0	0	0	0	109.3	Y113 V118	A106-Y113 PolarHBondContact N-O 3.47Å; A106-Y113 PolarHBondContact O-N 3.3Å; A106-V118 HydrophobicContact CB-CG2 3.81Å
107	L	91.8	Very high	90.8	Very high	85 Å²	85	87.6 Å²	87.6	45%	0.445	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.7	178.5	-62.8	169.7	0	0	0	110.5	L82 Y105 I111 P112	L82-L107 HydrophobicContact CD1-CD2 3.81Å; L82-L107 HydrophobicContact CD2-CD1 3.34Å; L82-L107 HydrophobicContact CD2-CD2 3.46Å; L82-L107 VanDerWaalsContact CD2-CD2 3.46Å; L82-L107 HydrophobicContact CD2-CG 3.95Å; L82-L107 HydrophobicContact CG-CD2 4.26Å; Y105-L107 HydrophobicContact CD2-CD2 4.21Å; Y105-L107 HydrophobicContact CD2-CG 4.38Å; Y105-L107 HydrophobicContact CE2-CD2 4.07Å; Y105-L107 HydrophobicContact CE2-CG 4.16Å; L107-I111 WeakPolarHBondContact CA-O 3.28Å; L107-P112 HydrophobicContact CD2-CB 4.21Å
108	V	89.9	Confident	90.7	Very high	48 Å²	48	83.9 Å²	83.9	29%	0.291	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.1	165.6	-176.9	0	0	0	0	105.4	R110 I111 Y113 V118	V108-R110 PolarHBondContact O-N 3.37Å; V108-I111 PolarHBondContact N-O 2.82Å; V108-I111 WeakPolarHBondContact O-CB 3.25Å; V108-I111 PolarHBondContact O-N 3.35Å; V108-Y113 HydrophobicContact CB-CD2 3.76Å; V108-Y113 HydrophobicContact CB-CE2 3.71Å; V108-Y113 HydrophobicContact CG2-CD2 3.78Å; V108-Y113 HydrophobicContact CG2-CE2 4.19Å; V108-V118 HydrophobicContact CG2-CG2 4.24Å
109	D	87.4	Confident	90.3	Very high	146 Å²	146	82.3 Å²	82.3	78%	0.781	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	41.2	-177.5	-56.3	-45.5	0	0	0	113.9	I111	D109-I111 PolarHBondContact O-N 3.01Å
110	R	86.8	Confident	89.7	Confident	204 Å²	204	82.5 Å²	82.5	77%	0.77	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	8.2	-175.7	-55.3	-174.5	-73.9	-149.4	1.5	115.3	V108	V108-R110 PolarHBondContact O-N 3.37Å
111	I	90.2	Very high	88.9	Confident	64 Å²	64	85.7 Å²	85.7	33%	0.328	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.6	174.3	-58.3	174.3	0	0	0	109.2	D94 L107 V108 D109 Y113	D94-I111 HydrophobicContact CB-CG2 3.27Å; D94-I111 VanDerWaalsContact CG-CG2 3.44Å; L107-I111 WeakPolarHBondContact CA-O 3.28Å; V108-I111 PolarHBondContact N-O 2.82Å; V108-I111 WeakPolarHBondContact O-CB 3.25Å; V108-I111 PolarHBondContact O-N 3.35Å; D109-I111 PolarHBondContact O-N 3.01Å; I111-Y113 HydrophobicContact CB-CD2 4.47Å; I111-Y113 HydrophobicContact CB-CE2 3.74Å; I111-Y113 HydrophobicContact CG2-CD2 4.28Å; I111-Y113 HydrophobicContact CG2-CE2 3.55Å; I111-Y113 VanDerWaalsContact O-CD2 3.26Å; I111-Y113 WeakPolarHBondContact O-CD2 3.09Å
112	P	93.8	Very high	88.3	Confident	10 Å²	10	89.5 Å²	89.5	7%	0.065	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	129.9	-177.9	33.5	-35.7	0	0	0	112.1	F91 C93 D94 F100 Y105 L107	F91-P112 HydrophobicContact CD2-CG 4.4Å; F91-P112 HydrophobicContact CE2-CB 3.95Å; F91-P112 HydrophobicContact CE2-CG 3.98Å; F91-P112 HydrophobicContact CZ-CB 4.11Å; C93-P112 WeakPolarHBondContact CA-O 3.42Å; D94-P112 PolarHBondContact N-O 3.14Å; D94-P112 VanDerWaalsContact N-O 3.08Å; F100-P112 HydrophobicContact CE2-CB 3.87Å; F100-P112 HydrophobicContact CE2-CG 4.45Å; Y105-P112 HydrophobicContact CD2-CB 4.32Å; L107-P112 HydrophobicContact CD2-CB 4.21Å
113	Y	95.2	Very high	87.7	Confident	19 Å²	19	89.2 Å²	89.2	8%	0.075	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	147.5	178	-70.3	-82.2	0	0	0	111.4	D94 R95 Y105 A106 V108 I111 C117 V118 F121	D94-Y113 HydrophobicContact CB-CD1 4.36Å; D94-Y113 HydrophobicContact CB-CE1 3.76Å; D94-Y113 PolarHBondContact OD2-OH 3.02Å; R95-Y113 HydrophobicContact CB-CD1 4.07Å; R95-Y113 HydrophobicContact CB-CE1 3.93Å; Y105-Y113 WeakPolarHBondContact CA-O 3.37Å; A106-Y113 PolarHBondContact N-O 3.47Å; A106-Y113 PolarHBondContact O-N 3.3Å; V108-Y113 HydrophobicContact CB-CD2 3.76Å; V108-Y113 HydrophobicContact CB-CE2 3.71Å; V108-Y113 HydrophobicContact CG2-CD2 3.78Å; V108-Y113 HydrophobicContact CG2-CE2 4.19Å; I111-Y113 HydrophobicContact CB-CD2 4.47Å; I111-Y113 HydrophobicContact CB-CE2 3.74Å; I111-Y113 HydrophobicContact CG2-CD2 4.28Å; I111-Y113 HydrophobicContact CG2-CE2 3.55Å; I111-Y113 VanDerWaalsContact O-CD2 3.26Å; I111-Y113 WeakPolarHBondContact O-CD2 3.09Å; Y113-C117 HydrophobicContact CD1-CB 4.31Å; Y113-V118 HydrophobicContact CG-CG2 4.23Å; Y113-F121 AromaticContact CD1-CE2 3.95Å; Y113-F121 HydrophobicContact CD1-CE2 3.95Å; Y113-F121 AromaticContact CE1-CE2 3.72Å; Y113-F121 HydrophobicContact CE1-CE2 3.72Å; Y113-F121 HydrophobicContact CE1-CZ 4.16Å
114	C	94.7	Very high	86.7	Confident	12 Å²	12	92.9 Å²	92.9	8%	0.081	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	155.9	171.3	79.7	0	0	0	0	111.2	C93 F100 K116 C117 V118	C93-C114 HydrophobicContact CB-CB 4.09Å; C93-C114 PolarHBondContact SG-N 3.26Å; F100-C114 HydrophobicContact CE1-CB 3.8Å; F100-C114 HydrophobicContact CZ-CB 4.45Å; C114-K116 PolarHBondContact O-N 3.47Å; C114-K116 VanDerWaalsContact O-N 3.15Å; C114-C117 PolarHBondContact O-N 2.97Å; C114-C117 VanDerWaalsContact O-N 3.08Å; C114-C117 PolarHBondContact SG-N 3.36Å; C114-C117 VanDerWaalsContact SG-N 3.36Å; C114-C117 PolarHBondContact SG-SG 3.46Å; C114-V118 PolarHBondContact O-N 3.42Å
115	K	92.4	Very high	85.5	Confident	175 Å²	175	91.6 Å²	91.6	76%	0.761	43%	0.426	S	S	*	.	H	α-helix	trans	-51.5	-40.8	179.5	-171	178.4	179.9	-177.6	0	112.6	S119	K115-S119 PolarHBondContact O-N 3.29Å; K115-S119 VanDerWaalsContact O-N 3.07Å; K115-S119 PolarHBondContact O-OG 2.94Å
116	K	92.8	Very high	84	Confident	168 Å²	168	95.5 Å²	95.5	73%	0.73	45%	0.445	S	S	*	.	H	α-helix	trans	-60.9	-54.2	177.2	-65.7	-174.8	-179.3	-177.8	0	110.8	C114 V118 S119 T120	C114-K116 PolarHBondContact O-N 3.47Å; C114-K116 VanDerWaalsContact O-N 3.15Å; K116-V118 PolarHBondContact O-N 3.12Å; K116-S119 PolarHBondContact O-N 3.31Å; K116-S119 PolarHBondContact O-OG 3.26Å; K116-T120 PolarHBondContact O-N 3.17Å; K116-T120 VanDerWaalsContact O-N 3.16Å; K116-T120 PolarHBondContact O-OG1 3.17Å; K116-T120 VanDerWaalsContact O-OG1 3.13Å
117	C	93.9	Very high	82.3	Confident	11 Å²	11	102.1 Å²	102.1	7%	0.074	47%	0.467	C	S	.	.	H	α-helix	trans	-61.8	-41	-178.8	-68.2	0	0	0	0	113	R95 Y113 C114 S119 T120 F121	R95-C117 HydrophobicContact CB-CB 4.16Å; R95-C117 HydrophobicContact CG-CB 4.48Å; Y113-C117 HydrophobicContact CD1-CB 4.31Å; C114-C117 PolarHBondContact O-N 2.97Å; C114-C117 VanDerWaalsContact O-N 3.08Å; C114-C117 PolarHBondContact SG-N 3.36Å; C114-C117 VanDerWaalsContact SG-N 3.36Å; C114-C117 PolarHBondContact SG-SG 3.46Å; C117-S119 PolarHBondContact O-N 2.85Å; C117-T120 WeakPolarHBondContact O-CB 3.24Å; C117-T120 PolarHBondContact O-N 2.96Å; C117-F121 WeakPolarHBondContact O-CD2 3.46Å; C117-F121 PolarHBondContact O-N 2.9Å
118	V	91.7	Very high	80.7	Confident	19 Å²	19	106.5 Å²	106.5	12%	0.115	48%	0.483	C	S	.	.	H	α-helix	trans	-62.6	-43.2	175.4	176	0	0	0	0	111.9	A106 V108 Y113 C114 K116 T120 F121 K122	A106-V118 HydrophobicContact CB-CG2 3.81Å; V108-V118 HydrophobicContact CG2-CG2 4.24Å; Y113-V118 HydrophobicContact CG-CG2 4.23Å; C114-V118 PolarHBondContact O-N 3.42Å; K116-V118 PolarHBondContact O-N 3.12Å; V118-T120 PolarHBondContact O-N 3.27Å; V118-F121 WeakPolarHBondContact O-CB 3.3Å; V118-F121 PolarHBondContact O-N 3.09Å; V118-F121 VanDerWaalsContact O-N 3.1Å; V118-K122 PolarHBondContact O-N 2.89Å
119	S	87.9	Confident	79.1	Confident	52 Å²	52	111.2 Å²	111.2	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-61	-34.3	177.3	72.4	0	0	0	0	112.4	K115 K116 C117 K122 K123	K115-S119 PolarHBondContact O-N 3.29Å; K115-S119 VanDerWaalsContact O-N 3.07Å; K115-S119 PolarHBondContact O-OG 2.94Å; K116-S119 PolarHBondContact O-N 3.31Å; K116-S119 PolarHBondContact O-OG 3.26Å; C117-S119 PolarHBondContact O-N 2.85Å; S119-K122 PolarHBondContact O-N 2.89Å; S119-K123 WeakPolarHBondContact O-CG 3.42Å; S119-K123 PolarHBondContact O-N 2.89Å; S119-K123 VanDerWaalsContact O-N 3.08Å
120	T	80.5	Confident	77.6	Confident	61 Å²	61	111.6 Å²	111.6	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-65.1	-38.7	174.5	-51	0	0	0	0	112.3	K116 C117 V118 R124	K116-T120 PolarHBondContact O-N 3.17Å; K116-T120 VanDerWaalsContact O-N 3.16Å; K116-T120 PolarHBondContact O-OG1 3.17Å; K116-T120 VanDerWaalsContact O-OG1 3.13Å; C117-T120 WeakPolarHBondContact O-CB 3.24Å; C117-T120 PolarHBondContact O-N 2.96Å; V118-T120 PolarHBondContact O-N 3.27Å; T120-R124 PolarHBondContact O-N 2.86Å
121	F	75.8	Confident	75.6	Confident	76 Å²	76	114 Å²	114	33%	0.333	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-47.1	173.1	-78.6	-75.4	0	0	0	112	Y113 C117 V118 K123 R124 K125	Y113-F121 AromaticContact CD1-CE2 3.95Å; Y113-F121 HydrophobicContact CD1-CE2 3.95Å; Y113-F121 AromaticContact CE1-CE2 3.72Å; Y113-F121 HydrophobicContact CE1-CE2 3.72Å; Y113-F121 HydrophobicContact CE1-CZ 4.16Å; C117-F121 WeakPolarHBondContact O-CD2 3.46Å; C117-F121 PolarHBondContact O-N 2.9Å; V118-F121 WeakPolarHBondContact O-CB 3.3Å; V118-F121 PolarHBondContact O-N 3.09Å; V118-F121 VanDerWaalsContact O-N 3.1Å; F121-K123 VanDerWaalsContact C-N 3.33Å; F121-K123 PolarHBondContact O-N 3.15Å; F121-R124 PolarHBondContact O-N 2.95Å; F121-K125 PolarHBondContact O-N 2.82Å; F121-K125 VanDerWaalsContact O-N 3.16Å
122	K	69.8	Low	74.8	Confident	154 Å²	154	116.6 Å²	116.6	67%	0.67	53%	0.534	S	S	*	.	H	α-helix	trans	-60.8	-40.6	-179.1	-70.9	-172.6	176.6	-173.2	0	112.2	V118 S119 R124 K125 K126	V118-K122 PolarHBondContact O-N 2.89Å; S119-K122 PolarHBondContact O-N 2.89Å; K122-R124 VanDerWaalsContact C-N 3.35Å; K122-R124 PolarHBondContact O-N 3.43Å; K122-K125 PolarHBondContact O-N 3.26Å; K122-K126 PolarHBondContact O-N 3.15Å; K122-K126 VanDerWaalsContact O-N 3.15Å
123	K	68.2	Low	73.8	Confident	154 Å²	154	122.2 Å²	122.2	67%	0.67	56%	0.558	S	S	*	*	H	α-helix	trans	-62.8	-38.5	176.8	-73.2	-178.5	179.8	-175.6	0	112.6	S119 F121 K127	S119-K123 WeakPolarHBondContact O-CG 3.42Å; S119-K123 PolarHBondContact O-N 2.89Å; S119-K123 VanDerWaalsContact O-N 3.08Å; F121-K123 VanDerWaalsContact C-N 3.33Å; F121-K123 PolarHBondContact O-N 3.15Å; K123-K127 PolarHBondContact O-N 3.32Å
124	R	63.3	Low	72.6	Confident	171 Å²	171	127.9 Å²	127.9	65%	0.645	59%	0.585	S	S	*	*	H	α-helix	trans	-69.1	-40.8	178.4	-79.6	-176.6	155.1	170.6	-2.3	113.1	T120 F121 K122 K127 K128	T120-R124 PolarHBondContact O-N 2.86Å; F121-R124 PolarHBondContact O-N 2.95Å; K122-R124 VanDerWaalsContact C-N 3.35Å; K122-R124 PolarHBondContact O-N 3.43Å; R124-K127 PolarHBondContact O-N 3.41Å; R124-K128 PolarHBondContact O-N 3.46Å
125	K	62.3	Low	71.3	Confident	167 Å²	167	134.7 Å²	134.7	73%	0.726	62%	0.615	S	S	*	*	H	α-helix	trans	-63.7	-42.1	174.5	-90.6	-169.9	173	-179.2	0	111.9	F121 K122 K127 K128 N129	F121-K125 PolarHBondContact O-N 2.82Å; F121-K125 VanDerWaalsContact O-N 3.16Å; K122-K125 PolarHBondContact O-N 3.26Å; K125-K127 VanDerWaalsContact C-N 3.32Å; K125-K127 PolarHBondContact O-N 2.7Å; K125-K128 PolarHBondContact O-N 3.01Å; K125-K128 VanDerWaalsContact O-N 3.11Å; K125-N129 PolarHBondContact O-N 3.08Å
126	K	60.9	Low	70	Confident	173 Å²	173	132.2 Å²	132.2	75%	0.752	61%	0.606	S	S	*	*	H	α-helix	trans	-62.6	-35.9	179	-131.1	179.7	-177	-174.7	0	113	K122	K122-K126 PolarHBondContact O-N 3.15Å; K122-K126 VanDerWaalsContact O-N 3.15Å
127	K	59.2	Low	68.5	Low	175 Å²	175	129.8 Å²	129.8	76%	0.761	60%	0.597	S	S	*	*	H	α-helix	trans	-70.7	-25.9	174.5	-82.7	-169.2	171.9	-171.7	0	114.2	K123 R124 K125	K123-K127 PolarHBondContact O-N 3.32Å; R124-K127 PolarHBondContact O-N 3.41Å; K125-K127 VanDerWaalsContact C-N 3.32Å; K125-K127 PolarHBondContact O-N 2.7Å
128	K	57.1	Low	66.7	Low	177 Å²	177	138.3 Å²	138.3	77%	0.77	64%	0.635	S	S	*	*	H	α-helix	trans	-78.9	-24.8	176.6	-86.9	-167.5	171.5	-168.7	0	113.5	R124 K125 L130	R124-K128 PolarHBondContact O-N 3.46Å; K125-K128 PolarHBondContact O-N 3.01Å; K125-K128 VanDerWaalsContact O-N 3.11Å; K128-L130 VanDerWaalsContact C-N 3.31Å
129	N	57.5	Low	64.8	Low	147 Å²	147	147.5 Å²	147.5	79%	0.786	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	9.5	176.8	-71.7	5.7	0	0	0	113.4	K125	K125-N129 PolarHBondContact O-N 3.08Å
130	L	56.1	Low	62.8	Low	155 Å²	155	155.4 Å²	155.4	81%	0.812	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	20.6	179	-156.4	71.8	0	0	0	111.5	K128	K128-L130 VanDerWaalsContact C-N 3.31Å
131	K	43.4	Very low	61.2	Low	255 Å²	255	164 Å²	164	100%	1.109	73%	0.73	S	S	*	*			trans	-125.2	0	168.4	-81.8	-166.8	172.9	-166.6	0	108.5

Retrieved 131 of 131 residues in 123.9 ms (Link to these results)

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