A0A087WS98_MOUSE Loading...

ARP3 actin-related protein 3

AlphaFold DB , UniProt , Accession A0A087WS98, Species MOUSE (Mus musculus, Mouse), Gene Actr3, Length 129 aa.

						>A0A087WS98_MOUSE|A0A087WS98|Actr3
MKGVDDLDFFIGDEAIEKPTYATKWPIRHGIVEDWDLMERFMEQVIFKYLRAEPEDHYFLLTEPPLNTPENREYTAEIMFESFNVPGLYIAVQAVLALAASWTSRQVGERTLTGTVIDSGDGVTHVIPV
					

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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	41.4	Very low	69	Low	244 Å²	244	99.7 Å²	99.7	100%	1.202	52%	0.522	S	S	*	.				0	96.9	0	-166.4	173.1	-176.3	0	0	105.4	G3	M1-G3 PolarHBondContact O-N 3.48Å
2	K	45.4	Very low	71.1	Confident	164 Å²	164	94.9 Å²	94.9	71%	0.713	52%	0.515	S	S	*	.			trans	-57.3	125.1	176.4	-77.5	-178.2	174.3	-179.9	0	107.2	D6	K2-D6 HydrophobicContact CB-CB 4.44Å
3	G	53.2	Low	72.9	Confident	34 Å²	34	97.2 Å²	97.2	35%	0.351	53%	0.527	S	S	.	.			trans	-77.3	168.4	-174.1	0	0	0	0	0	111.8	M1 D5 D6	M1-G3 PolarHBondContact O-N 3.48Å; G3-D5 PolarHBondContact O-N 3.3Å; G3-D6 PolarHBondContact N-OD2 3.12Å; G3-D6 WeakPolarHBondContact O-CB 3.3Å; G3-D6 PolarHBondContact O-N 3.03Å; G3-D6 VanDerWaalsContact O-N 3.1Å
4	V	57.5	Low	74.4	Confident	125 Å²	125	94.7 Å²	94.7	76%	0.758	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-60.4	-30.3	173	-175.7	0	0	0	0	110.9	D6 L7	V4-D6 VanDerWaalsContact C-N 3.3Å; V4-D6 PolarHBondContact O-N 2.98Å; V4-L7 PolarHBondContact O-N 2.73Å
5	D	60.2	Low	75.8	Confident	147 Å²	147	89.6 Å²	89.6	79%	0.786	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-68.2	-24.9	176.9	-58.1	-29.7	0	0	0	113.2	G3 L7 D8	G3-D5 PolarHBondContact O-N 3.3Å; D5-L7 PolarHBondContact O-N 3.37Å; D5-D8 PolarHBondContact O-N 3.13Å
6	D	62.2	Low	76.9	Confident	59 Å²	59	90.9 Å²	90.9	32%	0.316	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-70.5	-16.5	175.5	-79.8	-46.7	0	0	0	112.5	K2 G3 V4 R40	K2-D6 HydrophobicContact CB-CB 4.44Å; G3-D6 PolarHBondContact N-OD2 3.12Å; G3-D6 WeakPolarHBondContact O-CB 3.3Å; G3-D6 PolarHBondContact O-N 3.03Å; G3-D6 VanDerWaalsContact O-N 3.1Å; V4-D6 VanDerWaalsContact C-N 3.3Å; V4-D6 PolarHBondContact O-N 2.98Å; D6-R40 PolarHBondContact O-NH1 3.46Å; D6-R40 IonicContact OD1-CZ 3.75Å; D6-R40 IonicContact OD1-NH1 3.79Å; D6-R40 IonicContact OD1-NH2 2.8Å; D6-R40 PolarHBondContact OD1-NH2 2.9Å
7	L	69	Low	77.9	Confident	124 Å²	124	94.4 Å²	94.4	65%	0.649	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-96.8	-6.5	-179	-60.2	172	0	0	0	113	V4 D5 F9	V4-L7 PolarHBondContact O-N 2.73Å; D5-L7 PolarHBondContact O-N 3.37Å; L7-F9 PolarHBondContact O-N 3.07Å
8	D	87	Confident	78.7	Confident	86 Å²	86	93.9 Å²	93.9	46%	0.46	50%	0.496	S	S	.	.			trans	-93.3	75.7	-178.5	-171.5	27.6	0	0	0	111.7	D5 Y21	D5-D8 PolarHBondContact O-N 3.13Å; D8-Y21 PolarHBondContact OD1-OH 3.22Å; D8-Y21 PolarHBondContact OD2-OH 2.8Å
9	F	92.3	Very high	79.1	Confident	40 Å²	40	95.6 Å²	95.6	18%	0.175	51%	0.513	C	S	.	.			trans	-146	162	172.9	69.6	-82.7	0	0	0	111.8	L7 I11 R40 Q44	L7-F9 PolarHBondContact O-N 3.07Å; F9-I11 HydrophobicContact CD2-CG2 4.04Å; F9-I11 HydrophobicContact CE2-CG2 3.98Å; F9-R40 HydrophobicContact CE1-CB 4.39Å; F9-R40 HydrophobicContact CE1-CG 4.43Å; F9-R40 HydrophobicContact CE2-CB 3.85Å; F9-R40 HydrophobicContact CZ-CB 3.69Å; F9-R40 HydrophobicContact CZ-CG 4.17Å; F9-Q44 HydrophobicContact CD2-CG 4.38Å; F9-Q44 HydrophobicContact CE2-CG 3.38Å; F9-Q44 HydrophobicContact CZ-CG 3.57Å
10	F	94.4	Very high	79.9	Confident	58 Å²	58	97.2 Å²	97.2	25%	0.254	53%	0.526	S	S	.	.			trans	-125.7	153.6	177.8	-58	-85.1	0	0	0	109.4	E14 A15 K18 Y21	F10-E14 HydrophobicContact CB-CB 4.06Å; F10-E14 HydrophobicContact CD1-CB 4.15Å; F10-E14 HydrophobicContact CG-CB 4.48Å; F10-A15 HydrophobicContact CB-CB 4.17Å; F10-A15 WeakPolarHBondContact O-CB 3.26Å; F10-K18 HydrophobicContact CD2-CG 4.04Å; F10-K18 HydrophobicContact CE2-CD 4.45Å; F10-K18 HydrophobicContact CE2-CG 4.27Å; F10-K18 HydrophobicContact CG-CG 4.33Å; F10-Y21 HydrophobicContact CD2-CD1 4.37Å; F10-Y21 HydrophobicContact CD2-CD2 4.49Å; F10-Y21 HydrophobicContact CD2-CE1 4.32Å; F10-Y21 HydrophobicContact CD2-CE2 4.45Å; F10-Y21 HydrophobicContact CD2-CG 4.47Å; F10-Y21 HydrophobicContact CE2-CD2 4.35Å; F10-Y21 HydrophobicContact CE2-CE1 4.06Å; F10-Y21 AromaticContact CE2-CE2 3.89Å; F10-Y21 HydrophobicContact CE2-CE2 3.89Å; F10-Y21 AromaticContact CE2-CZ 3.73Å
11	I	95.9	Very high	80.5	Confident	16 Å²	16	96.6 Å²	96.6	8%	0.082	52%	0.517	C	S	.	.			trans	-127.6	162.7	174.1	67.4	156.7	0	0	0	110.7	F9 F41 Q44 V45 Y49	F9-I11 HydrophobicContact CD2-CG2 4.04Å; F9-I11 HydrophobicContact CE2-CG2 3.98Å; I11-F41 HydrophobicContact CB-CD2 3.77Å; I11-F41 HydrophobicContact CB-CE2 4.02Å; I11-F41 HydrophobicContact CD1-CD2 3.74Å; I11-F41 HydrophobicContact CD1-CE2 3.73Å; I11-F41 HydrophobicContact CD1-CG 4.36Å; I11-F41 HydrophobicContact CD1-CZ 4.35Å; I11-F41 HydrophobicContact CG1-CD2 4.39Å; I11-F41 HydrophobicContact CG1-CE2 4.44Å; I11-F41 HydrophobicContact CG2-CD2 3.82Å; I11-Q44 HydrophobicContact CD1-CB 3.52Å; I11-Q44 HydrophobicContact CG1-CB 3.84Å; I11-Q44 HydrophobicContact CG1-CG 4.48Å; I11-Q44 HydrophobicContact CG2-CB 4.35Å; I11-Q44 HydrophobicContact CG2-CG 4.36Å; I11-V45 HydrophobicContact CD1-CG2 3.72Å; I11-Y49 HydrophobicContact CD1-CD2 4.07Å; I11-Y49 HydrophobicContact CD1-CE2 3.59Å; I11-Y49 HydrophobicContact CG1-CD2 4.49Å; I11-Y49 HydrophobicContact CG1-CE2 3.54Å
12	G	94.8	Very high	82.9	Confident	42 Å²	42	89.3 Å²	89.3	43%	0.433	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	-142.9	177.8	0	0	0	0	0	112.9	E14 A15 I16	G12-E14 PolarHBondContact O-N 3.17Å; G12-A15 WeakPolarHBondContact O-CB 3.46Å; G12-A15 PolarHBondContact O-N 3.16Å; G12-I16 PolarHBondContact O-N 2.98Å
13	D	94.6	Very high	85.2	Confident	125 Å²	125	85.1 Å²	85.1	67%	0.668	48%	0.484	S	S	*	.	H	α-helix	trans	-59.1	-35.2	-177.6	-61.8	-21.5	0	0	0	112.2	A15 I16 E17	D13-A15 PolarHBondContact O-N 3.36Å; D13-I16 PolarHBondContact O-N 3.25Å; D13-E17 WeakPolarHBondContact O-CG 3.5Å; D13-E17 PolarHBondContact O-N 3.13Å
14	E	94.1	Very high	87.2	Confident	62 Å²	62	90.2 Å²	90.2	29%	0.29	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-33.1	176.4	-67.6	178.8	-126.7	0	0	112.1	F10 G12 I16 K18 K48 Y49	F10-E14 HydrophobicContact CB-CB 4.06Å; F10-E14 HydrophobicContact CD1-CB 4.15Å; F10-E14 HydrophobicContact CG-CB 4.48Å; G12-E14 PolarHBondContact O-N 3.17Å; E14-I16 VanDerWaalsContact C-N 3.34Å; E14-K18 WeakPolarHBondContact O-CG 3.2Å; E14-K48 WeakPolarHBondContact OE1-CE 3.29Å; E14-K48 IonicContact OE1-NZ 2.61Å; E14-K48 PolarHBondContact OE1-NZ 3.17Å; E14-K48 IonicContact OE2-NZ 3.07Å; E14-K48 PolarHBondContact OE2-NZ 2.84Å; E14-Y49 PolarHBondContact OE1-OH 3.37Å
15	A	94.6	Very high	89	Confident	18 Å²	18	92.7 Å²	92.7	15%	0.149	49%	0.492	C	S	.	.	H	α-helix	trans	-71.6	-30.9	175.8	0	0	0	0	0	112.4	F10 G12 D13	F10-A15 HydrophobicContact CB-CB 4.17Å; F10-A15 WeakPolarHBondContact O-CB 3.26Å; G12-A15 WeakPolarHBondContact O-CB 3.46Å; G12-A15 PolarHBondContact O-N 3.16Å; D13-A15 PolarHBondContact O-N 3.36Å
16	I	93.1	Very high	90.7	Very high	111 Å²	111	86.8 Å²	86.8	57%	0.569	46%	0.462	S	S	*	.	H	α-helix	trans	-76.3	-36.3	179.9	-61.1	173.8	0	0	0	110.4	G12 D13 E14 K18	G12-I16 PolarHBondContact O-N 2.98Å; D13-I16 PolarHBondContact O-N 3.25Å; E14-I16 VanDerWaalsContact C-N 3.34Å; I16-K18 PolarHBondContact O-N 3.18Å
17	E	94	Very high	92.3	Very high	149 Å²	149	87.6 Å²	87.6	70%	0.696	47%	0.465	S	S	*	.	S	Bend	trans	-76.8	-3.1	-179.3	-68.9	-178.1	173.8	0	0	114.1	D13 P19	D13-E17 WeakPolarHBondContact O-CG 3.5Å; D13-E17 PolarHBondContact O-N 3.13Å; E17-P19 WeakPolarHBondContact O-CD 3.29Å
18	K	92.1	Very high	93.5	Very high	87 Å²	87	88.8 Å²	88.8	38%	0.378	46%	0.461	S	S	.	.			trans	-109.6	81.5	-177.4	-65.2	-71.6	-179.3	-174.4	0	111.4	F10 E14 I16 T20 Y21	F10-K18 HydrophobicContact CD2-CG 4.04Å; F10-K18 HydrophobicContact CE2-CD 4.45Å; F10-K18 HydrophobicContact CE2-CG 4.27Å; F10-K18 HydrophobicContact CG-CG 4.33Å; E14-K18 WeakPolarHBondContact O-CG 3.2Å; I16-K18 PolarHBondContact O-N 3.18Å; K18-T20 PolarHBondContact O-N 3.19Å; K18-Y21 HydrophobicContact CB-CD2 3.97Å; K18-Y21 PolarHBondContact O-N 3.02Å
19	P	87.6	Confident	93.7	Very high	125 Å²	125	91.1 Å²	91.1	81%	0.812	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-12.5	-175.4	28.8	-37.4	0	0	0	114.2	E17 Y21	E17-P19 WeakPolarHBondContact O-CD 3.29Å; P19-Y21 VanDerWaalsContact C-N 3.32Å
20	T	93.6	Very high	93.7	Very high	127 Å²	127	91.1 Å²	91.1	78%	0.779	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-10.6	175.1	54.2	0	0	0	0	113.4	K18	K18-T20 PolarHBondContact O-N 3.19Å
21	Y	92.9	Very high	93.7	Very high	86 Å²	86	90.7 Å²	90.7	34%	0.337	48%	0.48	S	S	.	.	S	Bend	trans	-103.3	148.2	178.5	-73.7	-107.7	0	0	0	110.3	D8 F10 K18 P19 T23	D8-Y21 PolarHBondContact OD1-OH 3.22Å; D8-Y21 PolarHBondContact OD2-OH 2.8Å; F10-Y21 HydrophobicContact CD2-CD1 4.37Å; F10-Y21 HydrophobicContact CD2-CD2 4.49Å; F10-Y21 HydrophobicContact CD2-CE1 4.32Å; F10-Y21 HydrophobicContact CD2-CE2 4.45Å; F10-Y21 HydrophobicContact CD2-CG 4.47Å; F10-Y21 HydrophobicContact CE2-CD2 4.35Å; F10-Y21 HydrophobicContact CE2-CE1 4.06Å; F10-Y21 AromaticContact CE2-CE2 3.89Å; F10-Y21 HydrophobicContact CE2-CE2 3.89Å; F10-Y21 AromaticContact CE2-CZ 3.73Å; K18-Y21 HydrophobicContact CB-CD2 3.97Å; K18-Y21 PolarHBondContact O-N 3.02Å; P19-Y21 VanDerWaalsContact C-N 3.32Å; Y21-T23 PolarHBondContact O-N 2.89Å
22	A	92.1	Very high	93.8	Very high	90 Å²	90	91.1 Å²	91.1	74%	0.744	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-78.7	120.3	172.6	0	0	0	0	0	110
23	T	93.4	Very high	93.8	Very high	77 Å²	77	94.7 Å²	94.7	47%	0.472	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-78.5	130.2	174.1	-45	0	0	0	0	110.6	Y21 W25	Y21-T23 PolarHBondContact O-N 2.89Å; T23-W25 HydrophobicContact CG2-CZ2 4.47Å
24	K	94.8	Very high	94	Very high	140 Å²	140	91.3 Å²	91.3	61%	0.609	47%	0.47	S	S	*	.			trans	-128.1	150.1	175.1	-64	-175	-179	-179.2	0	110	L37	K24-L37 HydrophobicContact CB-CD1 3.59Å; K24-L37 HydrophobicContact CD-CD1 3.72Å; K24-L37 HydrophobicContact CG-CD1 4.34Å
25	W	95.2	Very high	94.1	Very high	178 Å²	178	90.7 Å²	90.7	67%	0.674	47%	0.465	S	S	*	.			trans	-114.7	114.7	-179.9	-59.4	95.2	0	0	0	108.7	T23 I27	T23-W25 HydrophobicContact CG2-CZ2 4.47Å; W25-I27 PolarHBondContact O-N 3.39Å
26	P	96.7	Very high	94.2	Very high	23 Å²	23	95.4 Å²	95.4	15%	0.149	49%	0.488	C	S	.	.	S	Bend	trans	-72.3	-19.7	-179.3	27.5	-33.5	0	0	0	112.9	E33 D34 L37 M38	P26-E33 PolarHBondContact O-N 2.97Å; P26-D34 PolarHBondContact O-N 3.13Å; P26-L37 HydrophobicContact CB-CB 3.92Å; P26-M38 HydrophobicContact CB-CB 4.21Å; P26-M38 HydrophobicContact CB-SD 4.25Å; P26-M38 HydrophobicContact CG-SD 4.17Å
27	I	96	Very high	94.3	Very high	76 Å²	76	92.3 Å²	92.3	39%	0.39	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.8	-178.6	-64.1	170.7	0	0	0	109.2	W25 I31 V32 M38	W25-I27 PolarHBondContact O-N 3.39Å; I27-I31 CarbonylContact C-O 3.56Å; I27-I31 VanDerWaalsContact CA-O 3.29Å; I27-I31 WeakPolarHBondContact CA-O 3Å; I27-V32 HydrophobicContact CD1-CG2 4.43Å; I27-V32 HydrophobicContact CG1-CG2 3.95Å; I27-M38 HydrophobicContact CD1-CE 4.44Å; I27-M38 HydrophobicContact CD1-SD 4.12Å; I27-M38 HydrophobicContact CG1-SD 4.27Å
28	R	94.1	Very high	94.5	Very high	148 Å²	148	86.2 Å²	86.2	56%	0.558	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	137	167.7	-59.4	-160.5	-176.5	-179	-4.3	110.4	G30 I31 E33	R28-G30 PolarHBondContact O-N 3.33Å; R28-I31 PolarHBondContact N-O 3.25Å; R28-I31 PolarHBondContact O-N 2.79Å; R28-I31 VanDerWaalsContact O-O 3.13Å; R28-E33 HydrophobicContact CB-CG 4.22Å; R28-E33 WeakPolarHBondContact CD-OE2 3.37Å; R28-E33 HydrophobicContact CG-CG 4.45Å; R28-E33 WeakPolarHBondContact CG-OE2 3.23Å; R28-E33 IonicContact NE-OE2 3.55Å
29	H	91.6	Very high	94.7	Very high	136 Å²	136	84.5 Å²	84.5	63%	0.63	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	34.2	-177.8	-58	-64.1	0	0	0	114	I31 G122 V123	H29-I31 VanDerWaalsContact C-N 3.31Å; H29-I31 PolarHBondContact O-N 2.61Å; H29-G122 PolarHBondContact ND1-O 3.3Å; H29-V123 HydrophobicContact CB-CG2 3.68Å; H29-V123 WeakPolarHBondContact O-CG2 3.47Å
30	G	91.9	Very high	95.1	Very high	39 Å²	39	82.6 Å²	82.6	40%	0.402	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-2.1	-179.9	0	0	0	0	0	115.6	R28 P64	R28-G30 PolarHBondContact O-N 3.33Å; G30-P64 WeakPolarHBondContact O-CG 3.49Å
31	I	94.7	Very high	95.3	Very high	50 Å²	50	80.2 Å²	80.2	26%	0.256	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	138.6	179.6	-57.1	-63.8	0	0	0	110.1	I27 R28 H29 E33 P64 N71	I27-I31 CarbonylContact C-O 3.56Å; I27-I31 VanDerWaalsContact CA-O 3.29Å; I27-I31 WeakPolarHBondContact CA-O 3Å; R28-I31 PolarHBondContact N-O 3.25Å; R28-I31 PolarHBondContact O-N 2.79Å; R28-I31 VanDerWaalsContact O-O 3.13Å; H29-I31 VanDerWaalsContact C-N 3.31Å; H29-I31 PolarHBondContact O-N 2.61Å; I31-E33 PolarHBondContact O-N 3.47Å; I31-P64 HydrophobicContact CD1-CG 3.7Å; I31-N71 WeakPolarHBondContact CG2-ND2 3.24Å
32	V	96.9	Very high	95.5	Very high	24 Å²	24	77.2 Å²	77.2	15%	0.145	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	122.7	172.9	-177.9	0	0	0	0	108.7	I27 W35 M38	I27-V32 HydrophobicContact CD1-CG2 4.43Å; I27-V32 HydrophobicContact CG1-CG2 3.95Å; V32-W35 HydrophobicContact CB-CD2 4.37Å; V32-W35 HydrophobicContact CB-CE3 4.5Å; V32-W35 HydrophobicContact CB-CH2 3.91Å; V32-W35 HydrophobicContact CB-CZ2 3.76Å; V32-W35 HydrophobicContact CB-CZ3 4.29Å; V32-W35 HydrophobicContact CG1-CD2 3.64Å; V32-W35 HydrophobicContact CG1-CE3 3.8Å; V32-W35 HydrophobicContact CG1-CG 4.14Å; V32-W35 HydrophobicContact CG1-CH2 4.11Å; V32-W35 HydrophobicContact CG1-CZ2 3.97Å; V32-W35 HydrophobicContact CG1-CZ3 4.05Å; V32-W35 HydrophobicContact CG2-CH2 4.01Å; V32-W35 HydrophobicContact CG2-CZ2 4.36Å; V32-W35 HydrophobicContact CG2-CZ3 4.27Å; V32-M38 HydrophobicContact CG1-CB 3.82Å; V32-M38 HydrophobicContact CG1-CG 4.03Å; V32-M38 HydrophobicContact CG2-CG 4.22Å; V32-M38 HydrophobicContact CG2-SD 4.37Å
33	E	96.3	Very high	95.7	Very high	117 Å²	117	75.9 Å²	75.9	55%	0.547	36%	0.361	S	S	.	.			trans	-109.6	-21.1	177.6	-68.2	-169.6	169.9	0	0	112.9	P26 R28 I31	P26-E33 PolarHBondContact O-N 2.97Å; R28-E33 HydrophobicContact CB-CG 4.22Å; R28-E33 WeakPolarHBondContact CD-OE2 3.37Å; R28-E33 HydrophobicContact CG-CG 4.45Å; R28-E33 WeakPolarHBondContact CG-OE2 3.23Å; R28-E33 IonicContact NE-OE2 3.55Å; I31-E33 PolarHBondContact O-N 3.47Å
34	D	97.6	Very high	95.8	Very high	54 Å²	54	74 Å²	74	29%	0.289	35%	0.347	S	S	.	.			trans	-130	97.3	178.9	-170.2	-34.3	0	0	0	109.6	P26 D36 L37 M38	P26-D34 PolarHBondContact O-N 3.13Å; D34-D36 PolarHBondContact OD1-N 3.17Å; D34-L37 HydrophobicContact CB-CB 4.2Å; D34-L37 HydrophobicContact CB-CD1 4.13Å; D34-L37 HydrophobicContact CB-CG 4.31Å; D34-L37 VanDerWaalsContact CG-CG 3.47Å; D34-L37 WeakPolarHBondContact OD1-CG 3.43Å; D34-L37 PolarHBondContact OD1-N 3.25Å; D34-L37 VanDerWaalsContact OD2-CD1 3.23Å; D34-L37 WeakPolarHBondContact OD2-CD1 3.42Å; D34-L37 WeakPolarHBondContact OD2-CG 3.26Å; D34-M38 WeakPolarHBondContact O-CB 3.33Å; D34-M38 PolarHBondContact O-N 3.37Å
35	W	97.4	Very high	95.9	Very high	49 Å²	49	69.5 Å²	69.5	19%	0.186	33%	0.331	C	S	.	.	H	α-helix	trans	-71.9	-32.4	-176.3	-72.2	102.1	0	0	0	113.1	V32 L37 M38 E39 N71 Y74 T75 I78	V32-W35 HydrophobicContact CB-CD2 4.37Å; V32-W35 HydrophobicContact CB-CE3 4.5Å; V32-W35 HydrophobicContact CB-CH2 3.91Å; V32-W35 HydrophobicContact CB-CZ2 3.76Å; V32-W35 HydrophobicContact CB-CZ3 4.29Å; V32-W35 HydrophobicContact CG1-CD2 3.64Å; V32-W35 HydrophobicContact CG1-CE3 3.8Å; V32-W35 HydrophobicContact CG1-CG 4.14Å; V32-W35 HydrophobicContact CG1-CH2 4.11Å; V32-W35 HydrophobicContact CG1-CZ2 3.97Å; V32-W35 HydrophobicContact CG1-CZ3 4.05Å; V32-W35 HydrophobicContact CG2-CH2 4.01Å; V32-W35 HydrophobicContact CG2-CZ2 4.36Å; V32-W35 HydrophobicContact CG2-CZ3 4.27Å; W35-L37 VanDerWaalsContact C-N 3.33Å; W35-L37 PolarHBondContact O-N 2.89Å; W35-M38 HydrophobicContact CE3-CB 4.49Å; W35-M38 PolarHBondContact O-N 3.2Å; W35-E39 WeakPolarHBondContact O-CB 3.26Å; W35-E39 PolarHBondContact O-N 3.27Å; W35-N71 HydrophobicContact CH2-CB 4.32Å; W35-N71 WeakPolarHBondContact CH2-O 3.47Å; W35-N71 HydrophobicContact CZ2-CB 3.8Å; W35-Y74 HydrophobicContact CZ2-CD2 4.46Å; W35-T75 VanDerWaalsContact CH2-OG1 3.32Å; W35-T75 WeakPolarHBondContact CH2-OG1 3.49Å; W35-I78 HydrophobicContact CE3-CD1 3.65Å; W35-I78 HydrophobicContact CZ3-CD1 4.2Å
36	D	95.7	Very high	96.1	Very high	118 Å²	118	61.3 Å²	61.3	63%	0.631	30%	0.3	S	S	*	.	H	α-helix	trans	-63	-43.4	175.7	-69.3	-23.4	0	0	0	110.5	D34 R40	D34-D36 PolarHBondContact OD1-N 3.17Å; D36-R40 VanDerWaalsContact O-CG 3.29Å; D36-R40 WeakPolarHBondContact O-CG 3.44Å; D36-R40 PolarHBondContact O-N 3.26Å
37	L	96.1	Very high	96	Very high	46 Å²	46	64.6 Å²	64.6	24%	0.241	31%	0.312	C	S	.	.	H	α-helix	trans	-69.3	-36.2	173.9	-69.6	-177.4	0	0	0	112.3	K24 P26 D34 W35 F41	K24-L37 HydrophobicContact CB-CD1 3.59Å; K24-L37 HydrophobicContact CD-CD1 3.72Å; K24-L37 HydrophobicContact CG-CD1 4.34Å; P26-L37 HydrophobicContact CB-CB 3.92Å; D34-L37 HydrophobicContact CB-CB 4.2Å; D34-L37 HydrophobicContact CB-CD1 4.13Å; D34-L37 HydrophobicContact CB-CG 4.31Å; D34-L37 VanDerWaalsContact CG-CG 3.47Å; D34-L37 WeakPolarHBondContact OD1-CG 3.43Å; D34-L37 PolarHBondContact OD1-N 3.25Å; D34-L37 VanDerWaalsContact OD2-CD1 3.23Å; D34-L37 WeakPolarHBondContact OD2-CD1 3.42Å; D34-L37 WeakPolarHBondContact OD2-CG 3.26Å; W35-L37 VanDerWaalsContact C-N 3.33Å; W35-L37 PolarHBondContact O-N 2.89Å; L37-F41 VanDerWaalsContact O-CB 3.31Å; L37-F41 WeakPolarHBondContact O-CB 3.29Å; L37-F41 PolarHBondContact O-N 3.48Å
38	M	97.8	Very high	96	Very high	21 Å²	21	64.4 Å²	64.4	10%	0.103	31%	0.309	C	S	.	.	H	α-helix	trans	-65.8	-43.9	179.1	-168.2	64.4	-157.9	0	0	111.7	P26 I27 V32 D34 W35 F41 M42	P26-M38 HydrophobicContact CB-CB 4.21Å; P26-M38 HydrophobicContact CB-SD 4.25Å; P26-M38 HydrophobicContact CG-SD 4.17Å; I27-M38 HydrophobicContact CD1-CE 4.44Å; I27-M38 HydrophobicContact CD1-SD 4.12Å; I27-M38 HydrophobicContact CG1-SD 4.27Å; V32-M38 HydrophobicContact CG1-CB 3.82Å; V32-M38 HydrophobicContact CG1-CG 4.03Å; V32-M38 HydrophobicContact CG2-CG 4.22Å; V32-M38 HydrophobicContact CG2-SD 4.37Å; D34-M38 WeakPolarHBondContact O-CB 3.33Å; D34-M38 PolarHBondContact O-N 3.37Å; W35-M38 HydrophobicContact CE3-CB 4.49Å; W35-M38 PolarHBondContact O-N 3.2Å; M38-F41 HydrophobicContact CE-CD1 4.19Å; M38-F41 WeakPolarHBondContact O-CB 3.28Å; M38-F41 PolarHBondContact O-N 3.34Å; M38-M42 HydrophobicContact CE-CE 3.4Å; M38-M42 VanDerWaalsContact CE-CE 3.4Å; M38-M42 HydrophobicContact CE-CG 4.06Å; M38-M42 HydrophobicContact CG-CE 3.92Å; M38-M42 WeakPolarHBondContact O-CG 3.34Å; M38-M42 PolarHBondContact O-N 3.24Å
39	E	97.3	Very high	96.1	Very high	51 Å²	51	62 Å²	62	24%	0.238	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-46.6	176.2	-176	178.6	-164.9	0	0	111.1	W35 F41 M42 E43 I78 S82 F83	W35-E39 WeakPolarHBondContact O-CB 3.26Å; W35-E39 PolarHBondContact O-N 3.27Å; E39-F41 VanDerWaalsContact C-N 3.26Å; E39-F41 PolarHBondContact O-N 3.03Å; E39-M42 PolarHBondContact O-N 3.3Å; E39-E43 WeakPolarHBondContact O-CB 3.24Å; E39-E43 PolarHBondContact O-N 3.02Å; E39-I78 HydrophobicContact CB-CD1 4.27Å; E39-I78 HydrophobicContact CB-CG2 4.31Å; E39-I78 HydrophobicContact CG-CG2 3.87Å; E39-S82 WeakPolarHBondContact OE1-CB 3.37Å; E39-S82 PolarHBondContact OE1-OG 3.04Å; E39-F83 HydrophobicContact CG-CZ 4.28Å
40	R	95.4	Very high	96.3	Very high	84 Å²	84	60.9 Å²	60.9	32%	0.317	30%	0.298	S	S	.	.	H	α-helix	trans	-58.8	-38.2	173.9	-73.6	177.8	-171.7	-139.7	-0.3	112.3	D6 F9 D36 Q44	D6-R40 PolarHBondContact O-NH1 3.46Å; D6-R40 IonicContact OD1-CZ 3.75Å; D6-R40 IonicContact OD1-NH1 3.79Å; D6-R40 IonicContact OD1-NH2 2.8Å; D6-R40 PolarHBondContact OD1-NH2 2.9Å; F9-R40 HydrophobicContact CE1-CB 4.39Å; F9-R40 HydrophobicContact CE1-CG 4.43Å; F9-R40 HydrophobicContact CE2-CB 3.85Å; F9-R40 HydrophobicContact CZ-CB 3.69Å; F9-R40 HydrophobicContact CZ-CG 4.17Å; D36-R40 VanDerWaalsContact O-CG 3.29Å; D36-R40 WeakPolarHBondContact O-CG 3.44Å; D36-R40 PolarHBondContact O-N 3.26Å; R40-Q44 PolarHBondContact O-N 2.88Å
41	F	96.9	Very high	96.6	Very high	78 Å²	78	69 Å²	69	34%	0.342	32%	0.317	S	S	.	.	H	α-helix	trans	-64.7	-48.2	175.3	178.7	-89.6	0	0	0	111.4	I11 L37 M38 E39 E43 Q44 V45	I11-F41 HydrophobicContact CB-CD2 3.77Å; I11-F41 HydrophobicContact CB-CE2 4.02Å; I11-F41 HydrophobicContact CD1-CD2 3.74Å; I11-F41 HydrophobicContact CD1-CE2 3.73Å; I11-F41 HydrophobicContact CD1-CG 4.36Å; I11-F41 HydrophobicContact CD1-CZ 4.35Å; I11-F41 HydrophobicContact CG1-CD2 4.39Å; I11-F41 HydrophobicContact CG1-CE2 4.44Å; I11-F41 HydrophobicContact CG2-CD2 3.82Å; L37-F41 VanDerWaalsContact O-CB 3.31Å; L37-F41 WeakPolarHBondContact O-CB 3.29Å; L37-F41 PolarHBondContact O-N 3.48Å; M38-F41 HydrophobicContact CE-CD1 4.19Å; M38-F41 WeakPolarHBondContact O-CB 3.28Å; M38-F41 PolarHBondContact O-N 3.34Å; E39-F41 VanDerWaalsContact C-N 3.26Å; E39-F41 PolarHBondContact O-N 3.03Å; F41-E43 VanDerWaalsContact C-N 3.35Å; F41-E43 PolarHBondContact O-N 3.45Å; F41-Q44 PolarHBondContact O-N 2.87Å; F41-V45 HydrophobicContact CD1-CG2 4.05Å; F41-V45 HydrophobicContact CE1-CG2 3.63Å; F41-V45 HydrophobicContact CZ-CG2 3.88Å; F41-V45 WeakPolarHBondContact O-CG2 3.45Å; F41-V45 PolarHBondContact O-N 3.45Å
42	M	97.6	Very high	96.7	Very high	23 Å²	23	67.8 Å²	67.8	11%	0.113	31%	0.314	C	S	.	.	H	α-helix	trans	-60.4	-43.1	176.9	-69.7	-177	-177.1	0	0	111.9	M38 E39 Q44 V45 I46 I78 M79 F83	M38-M42 HydrophobicContact CE-CE 3.4Å; M38-M42 VanDerWaalsContact CE-CE 3.4Å; M38-M42 HydrophobicContact CE-CG 4.06Å; M38-M42 HydrophobicContact CG-CE 3.92Å; M38-M42 WeakPolarHBondContact O-CG 3.34Å; M38-M42 PolarHBondContact O-N 3.24Å; E39-M42 PolarHBondContact O-N 3.3Å; M42-Q44 PolarHBondContact O-N 3.24Å; M42-V45 PolarHBondContact O-N 3.02Å; M42-I46 WeakPolarHBondContact O-CB 3.47Å; M42-I46 VanDerWaalsContact O-CG1 3.31Å; M42-I46 WeakPolarHBondContact O-CG1 3.34Å; M42-I46 PolarHBondContact O-N 3.47Å; M42-I78 HydrophobicContact SD-CG2 4.33Å; M42-M79 HydrophobicContact SD-SD 3.93Å; M42-F83 HydrophobicContact CB-CE2 3.79Å; M42-F83 HydrophobicContact CB-CZ 3.98Å; M42-F83 HydrophobicContact SD-CE2 4.39Å
43	E	96.3	Very high	96.7	Very high	61 Å²	61	71.2 Å²	71.2	29%	0.285	33%	0.328	S	S	.	.	H	α-helix	trans	-55.9	-49.3	176.9	-176.7	-176.6	-139.5	0	0	111.1	E39 F41 I46 F47 F83	E39-E43 WeakPolarHBondContact O-CB 3.24Å; E39-E43 PolarHBondContact O-N 3.02Å; F41-E43 VanDerWaalsContact C-N 3.35Å; F41-E43 PolarHBondContact O-N 3.45Å; E43-I46 PolarHBondContact O-N 3.22Å; E43-F47 HydrophobicContact CG-CD2 3.84Å; E43-F47 HydrophobicContact CG-CE2 4.21Å; E43-F47 VanDerWaalsContact O-CD2 3.31Å; E43-F47 WeakPolarHBondContact O-CD2 3.28Å; E43-F47 PolarHBondContact O-N 3.39Å; E43-F83 HydrophobicContact CB-CE1 4.01Å; E43-F83 HydrophobicContact CB-CZ 4.05Å; E43-F83 HydrophobicContact CG-CE1 4.42Å
44	Q	96.1	Very high	96.8	Very high	39 Å²	39	65.7 Å²	65.7	18%	0.182	30%	0.303	C	S	.	.	I	π-helix	trans	-64	-43.5	176.8	-71.9	-62.6	-58.6	0	0	112	F9 I11 R40 F41 M42 I46 K48 Y49	F9-Q44 HydrophobicContact CD2-CG 4.38Å; F9-Q44 HydrophobicContact CE2-CG 3.38Å; F9-Q44 HydrophobicContact CZ-CG 3.57Å; I11-Q44 HydrophobicContact CD1-CB 3.52Å; I11-Q44 HydrophobicContact CG1-CB 3.84Å; I11-Q44 HydrophobicContact CG1-CG 4.48Å; I11-Q44 HydrophobicContact CG2-CB 4.35Å; I11-Q44 HydrophobicContact CG2-CG 4.36Å; R40-Q44 PolarHBondContact O-N 2.88Å; F41-Q44 PolarHBondContact O-N 2.87Å; M42-Q44 PolarHBondContact O-N 3.24Å; Q44-I46 PolarHBondContact O-N 3.34Å; Q44-K48 WeakPolarHBondContact O-CA 3.32Å; Q44-K48 VanDerWaalsContact O-CB 3.23Å; Q44-K48 WeakPolarHBondContact O-CB 3.37Å; Q44-K48 PolarHBondContact O-N 3.07Å; Q44-Y49 HydrophobicContact CB-CE2 4.44Å; Q44-Y49 WeakPolarHBondContact O-CD2 3.47Å; Q44-Y49 PolarHBondContact O-N 3.05Å
45	V	97.3	Very high	96.8	Very high	45 Å²	45	68 Å²	68	27%	0.273	31%	0.312	S	S	.	.	I	π-helix	trans	-56.9	-49.5	176.9	170.7	0	0	0	0	111.1	I11 F41 M42 Y49 L50	I11-V45 HydrophobicContact CD1-CG2 3.72Å; F41-V45 HydrophobicContact CD1-CG2 4.05Å; F41-V45 HydrophobicContact CE1-CG2 3.63Å; F41-V45 HydrophobicContact CZ-CG2 3.88Å; F41-V45 WeakPolarHBondContact O-CG2 3.45Å; F41-V45 PolarHBondContact O-N 3.45Å; M42-V45 PolarHBondContact O-N 3.02Å; V45-Y49 PolarHBondContact O-N 2.77Å; V45-L50 HydrophobicContact CG1-CD1 3.98Å; V45-L50 HydrophobicContact CG1-CG 4.25Å; V45-L50 WeakPolarHBondContact O-CB 3.46Å; V45-L50 WeakPolarHBondContact O-CG 3.22Å; V45-L50 PolarHBondContact O-N 2.91Å
46	I	97.8	Very high	96.9	Very high	5 Å²	5	71.6 Å²	71.6	3%	0.026	34%	0.335	C	S	.	.	I	π-helix	trans	-68.4	-53.6	-175.1	-66.6	167.7	0	0	0	111	M42 E43 Q44 R51 A52 P54 F59 M79 F83	M42-I46 WeakPolarHBondContact O-CB 3.47Å; M42-I46 VanDerWaalsContact O-CG1 3.31Å; M42-I46 WeakPolarHBondContact O-CG1 3.34Å; M42-I46 PolarHBondContact O-N 3.47Å; E43-I46 PolarHBondContact O-N 3.22Å; Q44-I46 PolarHBondContact O-N 3.34Å; I46-R51 PolarHBondContact O-N 3.3Å; I46-A52 PolarHBondContact O-N 3.11Å; I46-P54 HydrophobicContact CG2-CB 4.21Å; I46-P54 HydrophobicContact CG2-CG 4.19Å; I46-F59 HydrophobicContact CD1-CE1 4.19Å; I46-F59 HydrophobicContact CD1-CZ 4.33Å; I46-F59 HydrophobicContact CG1-CE1 4.11Å; I46-F59 HydrophobicContact CG1-CZ 4.34Å; I46-M79 HydrophobicContact CD1-CE 4.47Å; I46-F83 HydrophobicContact CD1-CD1 4.35Å; I46-F83 HydrophobicContact CD1-CD2 4.08Å; I46-F83 HydrophobicContact CD1-CE2 4.23Å; I46-F83 HydrophobicContact CD1-CG 4.16Å; I46-F83 HydrophobicContact CD1-CZ 4.45Å
47	F	96.4	Very high	97	Very high	92 Å²	92	70.3 Å²	70.3	40%	0.404	33%	0.325	S	S	.	.	I	π-helix	trans	-86.7	-38.4	-170.3	-65.4	-68.3	0	0	0	113.9	E43 R51 P54 F83	E43-F47 HydrophobicContact CG-CD2 3.84Å; E43-F47 HydrophobicContact CG-CE2 4.21Å; E43-F47 VanDerWaalsContact O-CD2 3.31Å; E43-F47 WeakPolarHBondContact O-CD2 3.28Å; E43-F47 PolarHBondContact O-N 3.39Å; F47-R51 WeakPolarHBondContact O-CA 3.2Å; F47-P54 HydrophobicContact CE1-CG 4.16Å; F47-P54 HydrophobicContact CZ-CG 3.89Å; F47-F83 HydrophobicContact CE2-CD1 4.11Å; F47-F83 HydrophobicContact CE2-CE1 4.13Å
48	K	95	Very high	97.1	Very high	73 Å²	73	77.2 Å²	77.2	32%	0.317	35%	0.349	S	S	.	.	I	π-helix	trans	-87.2	-48.5	-176.5	-178.8	-177.2	171.5	-168.2	0	112.4	E14 Q44 R51	E14-K48 WeakPolarHBondContact OE1-CE 3.29Å; E14-K48 IonicContact OE1-NZ 2.61Å; E14-K48 PolarHBondContact OE1-NZ 3.17Å; E14-K48 IonicContact OE2-NZ 3.07Å; E14-K48 PolarHBondContact OE2-NZ 2.84Å; Q44-K48 WeakPolarHBondContact O-CA 3.32Å; Q44-K48 VanDerWaalsContact O-CB 3.23Å; Q44-K48 WeakPolarHBondContact O-CB 3.37Å; Q44-K48 PolarHBondContact O-N 3.07Å; K48-R51 WeakPolarHBondContact O-CG 3.5Å
49	Y	95.8	Very high	97.1	Very high	98 Å²	98	77.8 Å²	77.8	38%	0.384	35%	0.351	S	S	.	.	I	π-helix	trans	-88.3	-54.1	-172.9	-64.6	-82.7	0	0	0	112.5	I11 E14 Q44 V45	I11-Y49 HydrophobicContact CD1-CD2 4.07Å; I11-Y49 HydrophobicContact CD1-CE2 3.59Å; I11-Y49 HydrophobicContact CG1-CD2 4.49Å; I11-Y49 HydrophobicContact CG1-CE2 3.54Å; E14-Y49 PolarHBondContact OE1-OH 3.37Å; Q44-Y49 HydrophobicContact CB-CE2 4.44Å; Q44-Y49 WeakPolarHBondContact O-CD2 3.47Å; Q44-Y49 PolarHBondContact O-N 3.05Å; V45-Y49 PolarHBondContact O-N 2.77Å
50	L	97.3	Very high	97.2	Very high	112 Å²	112	80 Å²	80	59%	0.586	36%	0.364	S	S	*	.	I	π-helix	trans	-76.1	-29.9	178.7	-64.1	176.5	0	0	0	112.2	V45 A52	V45-L50 HydrophobicContact CG1-CD1 3.98Å; V45-L50 HydrophobicContact CG1-CG 4.25Å; V45-L50 WeakPolarHBondContact O-CB 3.46Å; V45-L50 WeakPolarHBondContact O-CG 3.22Å; V45-L50 PolarHBondContact O-N 2.91Å; L50-A52 HydrophobicContact CB-CB 4.38Å; L50-A52 PolarHBondContact O-N 3.38Å
51	R	97.5	Very high	97.3	Very high	210 Å²	210	77.9 Å²	77.9	79%	0.792	36%	0.359	S	S	*	.			trans	53.7	42.5	-176.9	-55.8	179.9	-178.4	-175.5	-1.1	111.9	I46 F47 K48	I46-R51 PolarHBondContact O-N 3.3Å; F47-R51 WeakPolarHBondContact O-CA 3.2Å; K48-R51 WeakPolarHBondContact O-CG 3.5Å
52	A	95.6	Very high	97.4	Very high	23 Å²	23	77.8 Å²	77.8	19%	0.19	37%	0.365	C	S	.	.			trans	-102.7	148.1	-179.7	0	0	0	0	0	110.5	I46 L50 P54	I46-A52 PolarHBondContact O-N 3.11Å; L50-A52 HydrophobicContact CB-CB 4.38Å; L50-A52 PolarHBondContact O-N 3.38Å; A52-P54 WeakPolarHBondContact O-CD 3.46Å
53	E	97.7	Very high	97.3	Very high	96 Å²	96	77.1 Å²	77.1	45%	0.449	36%	0.361	S	S	.	.			trans	-83.8	109.2	163.9	-170.3	61.5	-106.9	0	0	107.6	E55 D56 H57	E53-E55 HydrophobicContact CG-CB 4.34Å; E53-E55 PolarHBondContact O-N 3.39Å; E53-D56 HydrophobicContact CB-CB 4.47Å; E53-D56 PolarHBondContact O-N 2.81Å; E53-D56 VanDerWaalsContact O-N 3.13Å; E53-H57 PolarHBondContact O-ND1 3.07Å
54	P	98.1	Very high	97.2	Very high	2 Å²	2	74.9 Å²	74.9	1%	0.013	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-60.6	-29.6	-175.1	22.8	-34	0	0	0	113.1	I46 F47 A52 D56 H57 F59 F83 V85 P86	I46-P54 HydrophobicContact CG2-CB 4.21Å; I46-P54 HydrophobicContact CG2-CG 4.19Å; F47-P54 HydrophobicContact CE1-CG 4.16Å; F47-P54 HydrophobicContact CZ-CG 3.89Å; A52-P54 WeakPolarHBondContact O-CD 3.46Å; P54-D56 PolarHBondContact O-N 3.46Å; P54-H57 PolarHBondContact O-N 3.42Å; P54-F59 HydrophobicContact CB-CE2 4.01Å; P54-F59 HydrophobicContact CB-CZ 4.19Å; P54-F83 HydrophobicContact CB-CB 4.17Å; P54-F83 WeakPolarHBondContact CB-O 3.27Å; P54-F83 HydrophobicContact CG-CB 4.29Å; P54-F83 WeakPolarHBondContact CG-O 3.41Å; P54-V85 HydrophobicContact CB-CG1 4.03Å; P54-P86 VanDerWaalsContact O-CD 3.23Å; P54-P86 WeakPolarHBondContact O-CD 3.45Å
55	E	98.3	Very high	96.9	Very high	101 Å²	101	75.1 Å²	75.1	47%	0.472	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-62.7	-20.5	178	-60.1	-171.3	178.4	0	0	113.6	E53 N84 P86	E53-E55 HydrophobicContact CG-CB 4.34Å; E53-E55 PolarHBondContact O-N 3.39Å; E55-N84 HydrophobicContact CG-CB 3.67Å; E55-N84 WeakPolarHBondContact OE1-CB 3.5Å; E55-N84 PolarHBondContact OE1-ND2 3.03Å; E55-P86 VanDerWaalsContact O-CD 3.3Å; E55-P86 WeakPolarHBondContact O-CD 3.26Å; E55-P86 VanDerWaalsContact O-CG 3.26Å; E55-P86 WeakPolarHBondContact O-CG 3.48Å
56	D	98.4	Very high	96.5	Very high	125 Å²	125	79.7 Å²	79.7	67%	0.668	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-96.8	-1.1	-178.8	-73.4	-29.1	0	0	0	113.5	E53 P54	E53-D56 HydrophobicContact CB-CB 4.47Å; E53-D56 PolarHBondContact O-N 2.81Å; E53-D56 VanDerWaalsContact O-N 3.13Å; P54-D56 PolarHBondContact O-N 3.46Å
57	H	98.4	Very high	96.4	Very high	91 Å²	91	80.5 Å²	80.5	42%	0.421	38%	0.383	S	S	.	.			trans	-133.5	138.9	-167.7	-62.2	84.2	0	0	0	113.6	E53 P54 F59 P86	E53-H57 PolarHBondContact O-ND1 3.07Å; P54-H57 PolarHBondContact O-N 3.42Å; H57-F59 HydrophobicContact CB-CD2 4.47Å; H57-F59 HydrophobicContact CB-CE2 3.94Å; H57-F59 WeakPolarHBondContact O-CD2 3.45Å; H57-P86 VanDerWaalsContact O-CD 3.24Å; H57-P86 WeakPolarHBondContact O-CD 3.25Å; H57-P86 WeakPolarHBondContact O-CG 3.46Å
58	Y	98.5	Very high	96.4	Very high	192 Å²	192	78.9 Å²	78.9	75%	0.753	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	137.1	164.5	-62.8	-26.6	0	0	0	110.9	P86 G87	Y58-P86 HydrophobicContact CD1-CB 4.25Å; Y58-P86 HydrophobicContact CD1-CG 3.8Å; Y58-P86 HydrophobicContact CE1-CB 3.86Å; Y58-P86 HydrophobicContact CE1-CG 3.87Å; Y58-G87 WeakPolarHBondContact CA-O 3.48Å
59	F	98.6	Very high	96.5	Very high	32 Å²	32	78.9 Å²	78.9	14%	0.14	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.4	178.3	-76.4	-103.2	0	0	0	111	I46 P54 H57 M79 V85 G87 L88 Y89	I46-F59 HydrophobicContact CD1-CE1 4.19Å; I46-F59 HydrophobicContact CD1-CZ 4.33Å; I46-F59 HydrophobicContact CG1-CE1 4.11Å; I46-F59 HydrophobicContact CG1-CZ 4.34Å; P54-F59 HydrophobicContact CB-CE2 4.01Å; P54-F59 HydrophobicContact CB-CZ 4.19Å; H57-F59 HydrophobicContact CB-CD2 4.47Å; H57-F59 HydrophobicContact CB-CE2 3.94Å; H57-F59 WeakPolarHBondContact O-CD2 3.45Å; F59-M79 HydrophobicContact CB-CE 3.94Å; F59-M79 HydrophobicContact CD1-CE 3.76Å; F59-M79 HydrophobicContact CD2-CE 4.08Å; F59-M79 HydrophobicContact CE1-CE 4.27Å; F59-M79 HydrophobicContact CG-CE 3.64Å; F59-V85 HydrophobicContact CD2-CB 4.07Å; F59-V85 HydrophobicContact CD2-CG1 3.44Å; F59-V85 VanDerWaalsContact CD2-CG1 3.44Å; F59-V85 HydrophobicContact CE2-CG1 3.63Å; F59-V85 HydrophobicContact CG-CG1 4.27Å; F59-G87 PolarHBondContact N-O 2.61Å; F59-L88 HydrophobicContact CB-CD1 4.01Å; F59-L88 WeakPolarHBondContact O-CA 3.2Å; F59-Y89 PolarHBondContact O-N 3.22Å
60	L	98.6	Very high	96.6	Very high	97 Å²	97	79.2 Å²	79.2	51%	0.508	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	115.2	165.2	-176.1	155.4	0	0	0	107.9	T62 Y89 A91 L96	L60-T62 HydrophobicContact CD2-CG2 4.42Å; L60-Y89 CarbonylContact C-O 3.58Å; L60-Y89 VanDerWaalsContact CA-O 3.29Å; L60-Y89 WeakPolarHBondContact CA-O 3.37Å; L60-Y89 HydrophobicContact CD1-CD1 3.92Å; L60-Y89 HydrophobicContact CG-CD1 4.09Å; L60-A91 HydrophobicContact CD2-CB 4.46Å; L60-L96 HydrophobicContact CD2-CD1 4.08Å
61	L	98.3	Very high	96.6	Very high	41 Å²	41	75 Å²	75	22%	0.215	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	163.2	175.2	-59.7	-175.5	0	0	0	110.5	T75 M79 L88 Y89 I90 A91	L61-T75 HydrophobicContact CD1-CG2 3.62Å; L61-M79 HydrophobicContact CD1-CG 3.86Å; L61-M79 HydrophobicContact CD1-SD 3.99Å; L61-L88 HydrophobicContact CD1-CD1 3.94Å; L61-L88 HydrophobicContact CG-CD1 3.96Å; L61-Y89 PolarHBondContact N-O 3.24Å; L61-I90 HydrophobicContact CB-CG1 4.48Å; L61-I90 WeakPolarHBondContact O-CA 3.37Å; L61-A91 PolarHBondContact O-N 2.86Å
62	T	97.4	Very high	96.6	Very high	76 Å²	76	69.6 Å²	69.6	47%	0.466	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.3	-179.5	69.5	0	0	0	0	111.7	L60 A91 L96	L60-T62 HydrophobicContact CD2-CG2 4.42Å; T62-A91 VanDerWaalsContact CA-O 3.27Å; T62-A91 WeakPolarHBondContact CA-O 3.39Å; T62-L96 HydrophobicContact CG2-CD1 3.53Å
63	E	96.6	Very high	96.8	Very high	9 Å²	9	74.8 Å²	74.8	4%	0.042	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	156.9	174.4	71.9	-169.4	160.1	0	0	111.3	N67 R72 I90 A91 Q93	E63-N67 HydrophobicContact CB-CB 4.1Å; E63-N67 HydrophobicContact CG-CB 4.26Å; E63-N67 PolarHBondContact OE2-ND2 2.98Å; E63-R72 VanDerWaalsContact CD-NH2 3.27Å; E63-R72 IonicContact OE1-CZ 2.93Å; E63-R72 IonicContact OE1-NE 3.46Å; E63-R72 PolarHBondContact OE1-NE 2.8Å; E63-R72 IonicContact OE1-NH2 3.56Å; E63-R72 PolarHBondContact OE1-NH2 2.93Å; E63-R72 IonicContact OE2-CZ 2.89Å; E63-R72 IonicContact OE2-NE 2.7Å; E63-R72 PolarHBondContact OE2-NE 2.86Å; E63-R72 IonicContact OE2-NH2 2.85Å; E63-R72 PolarHBondContact OE2-NH2 3.27Å; E63-I90 HydrophobicContact CB-CG2 4.03Å; E63-I90 VanDerWaalsContact CD-CG2 3.44Å; E63-I90 HydrophobicContact CG-CG2 3.9Å; E63-A91 PolarHBondContact N-O 2.9Å; E63-Q93 WeakPolarHBondContact O-CG 3.41Å; E63-Q93 PolarHBondContact O-N 2.82Å; E63-Q93 VanDerWaalsContact O-N 3.09Å
64	P	94.2	Very high	96.8	Very high	13 Å²	13	75.8 Å²	75.8	8%	0.084	37%	0.372	C	S	.	.			trans	-69.9	159.1	173.9	31.1	-37.2	0	0	0	111.6	G30 I31 L66 N67	G30-P64 WeakPolarHBondContact O-CG 3.49Å; I31-P64 HydrophobicContact CD1-CG 3.7Å; P64-L66 PolarHBondContact O-N 3.44Å; P64-L66 VanDerWaalsContact O-N 3.11Å; P64-N67 HydrophobicContact CG-CB 4.04Å; P64-N67 WeakPolarHBondContact O-CB 3.4Å; P64-N67 PolarHBondContact O-N 2.94Å; P64-N67 VanDerWaalsContact O-N 3.17Å
65	P	89.9	Confident	96.8	Very high	44 Å²	44	76.5 Å²	76.5	29%	0.286	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.1	-177.9	28	-40.8	0	0	0	114.7	V92 I127	P65-V92 HydrophobicContact CB-CG1 4.22Å; P65-I127 HydrophobicContact CB-CD1 4Å; P65-I127 HydrophobicContact CB-CG1 4.44Å; P65-I127 HydrophobicContact CG-CD1 3.54Å; P65-I127 HydrophobicContact CG-CG1 4.12Å
66	L	88.4	Confident	96.8	Very high	142 Å²	142	73 Å²	73	74%	0.743	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	24.4	-177.1	-60.5	177.2	0	0	0	112.3	P64	P64-L66 PolarHBondContact O-N 3.44Å; P64-L66 VanDerWaalsContact O-N 3.11Å
67	N	94.9	Very high	96.8	Very high	22 Å²	22	71.6 Å²	71.6	12%	0.118	35%	0.354	C	S	.	.			trans	-65	139	172.2	-163.7	33.2	0	0	0	110.3	E63 P64 N71	E63-N67 HydrophobicContact CB-CB 4.1Å; E63-N67 HydrophobicContact CG-CB 4.26Å; E63-N67 PolarHBondContact OE2-ND2 2.98Å; P64-N67 HydrophobicContact CG-CB 4.04Å; P64-N67 WeakPolarHBondContact O-CB 3.4Å; P64-N67 PolarHBondContact O-N 2.94Å; P64-N67 VanDerWaalsContact O-N 3.17Å; N67-N71 WeakPolarHBondContact OD1-CB 3.4Å; N67-N71 PolarHBondContact OD1-ND2 3.45Å
68	T	96.6	Very high	96.8	Very high	57 Å²	57	68 Å²	68	35%	0.35	34%	0.338	S	S	.	.			trans	-76.3	152.2	179.5	81.7	0	0	0	0	110.6	E70 N71 R72	T68-E70 WeakPolarHBondContact CB-OE2 3.44Å; T68-E70 PolarHBondContact O-N 2.88Å; T68-E70 PolarHBondContact OG1-OE2 3.43Å; T68-N71 PolarHBondContact O-N 2.62Å; T68-N71 PolarHBondContact OG1-N 3.09Å; T68-R72 PolarHBondContact O-N 2.82Å; T68-R72 VanDerWaalsContact O-N 3.16Å
69	P	97.2	Very high	96.8	Very high	73 Å²	73	59 Å²	59	47%	0.474	30%	0.302	S	S	.	.	H	α-helix	trans	-55.1	-37.5	174.3	-25.6	35.5	0	0	0	112.8	N71 R72 E73	P69-N71 PolarHBondContact O-N 2.86Å; P69-R72 WeakPolarHBondContact O-CB 3.31Å; P69-R72 PolarHBondContact O-N 3.02Å; P69-E73 WeakPolarHBondContact O-CG 3.49Å; P69-E73 PolarHBondContact O-N 3.06Å
70	E	97.8	Very high	96.8	Very high	105 Å²	105	61.9 Å²	61.9	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-64.6	-41.9	-179.4	-56.2	77	-169.2	0	0	111.5	T68 R72 E73 Y74	T68-E70 WeakPolarHBondContact CB-OE2 3.44Å; T68-E70 PolarHBondContact O-N 2.88Å; T68-E70 PolarHBondContact OG1-OE2 3.43Å; E70-R72 VanDerWaalsContact C-N 3.3Å; E70-R72 PolarHBondContact O-N 3.42Å; E70-E73 WeakPolarHBondContact O-CB 3.31Å; E70-E73 PolarHBondContact O-N 3.34Å; E70-Y74 WeakPolarHBondContact O-CD2 3.42Å; E70-Y74 PolarHBondContact O-N 2.91Å
71	N	97.9	Very high	96.8	Very high	23 Å²	23	64 Å²	64	12%	0.123	32%	0.323	C	S	.	.	H	α-helix	trans	-65.3	-36.3	174.9	-75.7	-8.5	0	0	0	112.1	I31 W35 N67 T68 P69 E73 T75	I31-N71 WeakPolarHBondContact CG2-ND2 3.24Å; W35-N71 HydrophobicContact CH2-CB 4.32Å; W35-N71 WeakPolarHBondContact CH2-O 3.47Å; W35-N71 HydrophobicContact CZ2-CB 3.8Å; N67-N71 WeakPolarHBondContact OD1-CB 3.4Å; N67-N71 PolarHBondContact OD1-ND2 3.45Å; T68-N71 PolarHBondContact O-N 2.62Å; T68-N71 PolarHBondContact OG1-N 3.09Å; P69-N71 PolarHBondContact O-N 2.86Å; N71-E73 VanDerWaalsContact C-N 3.34Å; N71-T75 PolarHBondContact O-N 2.93Å; N71-T75 PolarHBondContact O-OG1 3.17Å
72	R	98.1	Very high	96.8	Very high	98 Å²	98	64.9 Å²	64.9	37%	0.37	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-40.6	174.7	-171.4	-175.8	-70.1	138.7	-3	110.7	E63 T68 P69 E70 T75 A76 I90	E63-R72 VanDerWaalsContact CD-NH2 3.27Å; E63-R72 IonicContact OE1-CZ 2.93Å; E63-R72 IonicContact OE1-NE 3.46Å; E63-R72 PolarHBondContact OE1-NE 2.8Å; E63-R72 IonicContact OE1-NH2 3.56Å; E63-R72 PolarHBondContact OE1-NH2 2.93Å; E63-R72 IonicContact OE2-CZ 2.89Å; E63-R72 IonicContact OE2-NE 2.7Å; E63-R72 PolarHBondContact OE2-NE 2.86Å; E63-R72 IonicContact OE2-NH2 2.85Å; E63-R72 PolarHBondContact OE2-NH2 3.27Å; T68-R72 PolarHBondContact O-N 2.82Å; T68-R72 VanDerWaalsContact O-N 3.16Å; P69-R72 WeakPolarHBondContact O-CB 3.31Å; P69-R72 PolarHBondContact O-N 3.02Å; E70-R72 VanDerWaalsContact C-N 3.3Å; E70-R72 PolarHBondContact O-N 3.42Å; R72-T75 PolarHBondContact O-N 2.92Å; R72-A76 PolarHBondContact O-N 3.11Å; R72-I90 HydrophobicContact CG-CD1 3.68Å
73	E	98.3	Very high	96.8	Very high	132 Å²	132	61.8 Å²	61.8	62%	0.617	31%	0.312	S	S	*	.	H	α-helix	trans	-63.1	-47.4	174.9	-73.9	171.8	-172.2	0	0	111.6	P69 E70 N71 T75 A76 E77	P69-E73 WeakPolarHBondContact O-CG 3.49Å; P69-E73 PolarHBondContact O-N 3.06Å; E70-E73 WeakPolarHBondContact O-CB 3.31Å; E70-E73 PolarHBondContact O-N 3.34Å; N71-E73 VanDerWaalsContact C-N 3.34Å; E73-T75 VanDerWaalsContact C-N 3.3Å; E73-T75 PolarHBondContact O-N 3.46Å; E73-A76 CarbonylContact O-C 3.47Å; E73-A76 WeakPolarHBondContact O-CA 3.17Å; E73-A76 WeakPolarHBondContact O-CB 3.38Å; E73-A76 PolarHBondContact O-N 2.89Å; E73-E77 PolarHBondContact O-N 2.86Å
74	Y	98.3	Very high	96.9	Very high	117 Å²	117	65.5 Å²	65.5	46%	0.459	33%	0.332	S	S	.	.	H	α-helix	trans	-59.4	-39.4	175.5	-78.1	-54.9	0	0	0	113	W35 E70 A76 E77 I78	W35-Y74 HydrophobicContact CZ2-CD2 4.46Å; E70-Y74 WeakPolarHBondContact O-CD2 3.42Å; E70-Y74 PolarHBondContact O-N 2.91Å; Y74-A76 VanDerWaalsContact C-N 3.31Å; Y74-A76 PolarHBondContact O-N 3.24Å; Y74-E77 PolarHBondContact O-N 3.29Å; Y74-I78 WeakPolarHBondContact O-CG1 3.34Å; Y74-I78 PolarHBondContact O-N 3.49Å
75	T	98.3	Very high	97.1	Very high	17 Å²	17	65.1 Å²	65.1	10%	0.104	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-44.3	173.9	-56.9	0	0	0	0	110.8	W35 L61 N71 R72 E73 M79 I90	W35-T75 VanDerWaalsContact CH2-OG1 3.32Å; W35-T75 WeakPolarHBondContact CH2-OG1 3.49Å; L61-T75 HydrophobicContact CD1-CG2 3.62Å; N71-T75 PolarHBondContact O-N 2.93Å; N71-T75 PolarHBondContact O-OG1 3.17Å; R72-T75 PolarHBondContact O-N 2.92Å; E73-T75 VanDerWaalsContact C-N 3.3Å; E73-T75 PolarHBondContact O-N 3.46Å; T75-M79 WeakPolarHBondContact O-CB 3.38Å; T75-M79 WeakPolarHBondContact O-CG 3.32Å; T75-M79 PolarHBondContact O-N 3.17Å; T75-M79 VanDerWaalsContact O-N 3.11Å; T75-I90 HydrophobicContact CG2-CD1 3.94Å
76	A	98.4	Very high	97.5	Very high	27 Å²	27	66.2 Å²	66.2	22%	0.223	34%	0.337	C	S	.	.	H	α-helix	trans	-66.6	-42.3	178.7	0	0	0	0	0	112.1	R72 E73 Y74 M79 F80 L88	R72-A76 PolarHBondContact O-N 3.11Å; E73-A76 CarbonylContact O-C 3.47Å; E73-A76 WeakPolarHBondContact O-CA 3.17Å; E73-A76 WeakPolarHBondContact O-CB 3.38Å; E73-A76 PolarHBondContact O-N 2.89Å; Y74-A76 VanDerWaalsContact C-N 3.31Å; Y74-A76 PolarHBondContact O-N 3.24Å; A76-M79 PolarHBondContact O-N 3.16Å; A76-F80 HydrophobicContact CB-CD2 4.33Å; A76-F80 WeakPolarHBondContact O-CB 3.2Å; A76-F80 VanDerWaalsContact O-CD2 3.24Å; A76-F80 WeakPolarHBondContact O-CD2 3.5Å; A76-F80 PolarHBondContact O-N 2.98Å; A76-L88 HydrophobicContact CB-CD2 3.95Å
77	E	98.6	Very high	98	Very high	95 Å²	95	60.2 Å²	60.2	44%	0.444	31%	0.309	S	S	.	.	H	α-helix	trans	-55.7	-53.2	175.8	-174.4	-179	154.1	0	0	110.7	E73 Y74 M79 F80 E81	E73-E77 PolarHBondContact O-N 2.86Å; Y74-E77 PolarHBondContact O-N 3.29Å; E77-M79 PolarHBondContact O-N 3.28Å; E77-F80 PolarHBondContact O-N 3.18Å; E77-E81 HydrophobicContact CG-CG 4.29Å; E77-E81 WeakPolarHBondContact O-CA 3.22Å; E77-E81 VanDerWaalsContact O-CB 3.26Å; E77-E81 WeakPolarHBondContact O-CB 3.47Å; E77-E81 WeakPolarHBondContact O-CG 3.23Å; E77-E81 PolarHBondContact O-N 3.19Å
78	I	98.4	Very high	98.1	Very high	16 Å²	16	61 Å²	61	8%	0.082	31%	0.314	C	S	.	.	I	π-helix	trans	-57.8	-48.3	177.8	-69.3	164.9	0	0	0	111.2	W35 E39 M42 Y74 F80 S82 F83	W35-I78 HydrophobicContact CE3-CD1 3.65Å; W35-I78 HydrophobicContact CZ3-CD1 4.2Å; E39-I78 HydrophobicContact CB-CD1 4.27Å; E39-I78 HydrophobicContact CB-CG2 4.31Å; E39-I78 HydrophobicContact CG-CG2 3.87Å; M42-I78 HydrophobicContact SD-CG2 4.33Å; Y74-I78 WeakPolarHBondContact O-CG1 3.34Å; Y74-I78 PolarHBondContact O-N 3.49Å; I78-F80 PolarHBondContact O-N 3.25Å; I78-S82 WeakPolarHBondContact O-CA 3.33Å; I78-S82 VanDerWaalsContact O-CB 3.22Å; I78-S82 WeakPolarHBondContact O-CB 3.4Å; I78-S82 PolarHBondContact O-N 3.45Å; I78-F83 HydrophobicContact CG2-CD2 3.94Å; I78-F83 HydrophobicContact CG2-CE2 3.51Å; I78-F83 HydrophobicContact CG2-CZ 4.42Å; I78-F83 PolarHBondContact O-N 3.33Å
79	M	98.6	Very high	98.2	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.01	33%	0.325	C	S	.	.	I	π-helix	trans	-66	-38.6	-176.2	-67.2	-59.5	-58	0	0	112.9	M42 I46 F59 L61 T75 A76 E77 F83 N84 V85 L88	M42-M79 HydrophobicContact SD-SD 3.93Å; I46-M79 HydrophobicContact CD1-CE 4.47Å; F59-M79 HydrophobicContact CB-CE 3.94Å; F59-M79 HydrophobicContact CD1-CE 3.76Å; F59-M79 HydrophobicContact CD2-CE 4.08Å; F59-M79 HydrophobicContact CE1-CE 4.27Å; F59-M79 HydrophobicContact CG-CE 3.64Å; L61-M79 HydrophobicContact CD1-CG 3.86Å; L61-M79 HydrophobicContact CD1-SD 3.99Å; T75-M79 WeakPolarHBondContact O-CB 3.38Å; T75-M79 WeakPolarHBondContact O-CG 3.32Å; T75-M79 PolarHBondContact O-N 3.17Å; T75-M79 VanDerWaalsContact O-N 3.11Å; A76-M79 PolarHBondContact O-N 3.16Å; E77-M79 PolarHBondContact O-N 3.28Å; M79-F83 HydrophobicContact CE-CD2 4.46Å; M79-F83 CarbonylContact O-C 3.54Å; M79-F83 WeakPolarHBondContact O-CB 3.48Å; M79-F83 HydrophobicContact SD-CD2 3.81Å; M79-F83 HydrophobicContact SD-CE2 4.31Å; M79-N84 PolarHBondContact O-N 3.46Å; M79-V85 HydrophobicContact CB-CG2 4.03Å; M79-V85 HydrophobicContact CE-CG1 3.66Å; M79-V85 WeakPolarHBondContact O-CG2 3.44Å; M79-V85 PolarHBondContact O-N 2.89Å; M79-V85 VanDerWaalsContact O-N 3.17Å; M79-L88 HydrophobicContact CB-CD1 4.33Å; M79-L88 HydrophobicContact CB-CD2 3.91Å; M79-L88 HydrophobicContact CG-CD1 4.13Å; M79-L88 HydrophobicContact CG-CD2 4.17Å
80	F	98.7	Very high	98.3	Very high	94 Å²	94	63.3 Å²	63.3	41%	0.412	31%	0.309	S	S	.	.	I	π-helix	trans	-84.7	-43.5	-179.7	-75.5	-61.5	0	0	0	113.3	A76 E77 I78 N84 V85 L88	A76-F80 HydrophobicContact CB-CD2 4.33Å; A76-F80 WeakPolarHBondContact O-CB 3.2Å; A76-F80 VanDerWaalsContact O-CD2 3.24Å; A76-F80 WeakPolarHBondContact O-CD2 3.5Å; A76-F80 PolarHBondContact O-N 2.98Å; E77-F80 PolarHBondContact O-N 3.18Å; I78-F80 PolarHBondContact O-N 3.25Å; F80-N84 VanDerWaalsContact O-CA 3.26Å; F80-N84 WeakPolarHBondContact O-CA 3.31Å; F80-N84 PolarHBondContact O-N 2.87Å; F80-N84 PolarHBondContact O-OD1 3.18Å; F80-V85 HydrophobicContact CD1-CG2 3.84Å; F80-V85 VanDerWaalsContact CD1-O 3.26Å; F80-V85 WeakPolarHBondContact CD1-O 3.41Å; F80-V85 HydrophobicContact CE1-CG2 3.88Å; F80-V85 WeakPolarHBondContact CE1-O 3.49Å; F80-V85 HydrophobicContact CG-CG2 4.48Å; F80-L88 HydrophobicContact CE1-CB 4.38Å; F80-L88 HydrophobicContact CE2-CB 3.85Å; F80-L88 HydrophobicContact CE2-CD2 4.11Å; F80-L88 HydrophobicContact CZ-CB 3.63Å
81	E	98.3	Very high	98.3	Very high	142 Å²	142	58.6 Å²	58.6	66%	0.664	29%	0.288	S	S	*	.	I	π-helix	trans	-87.7	-36.8	-172.5	-57.7	-166.2	-174.7	0	0	113	E77	E77-E81 HydrophobicContact CG-CG 4.29Å; E77-E81 WeakPolarHBondContact O-CA 3.22Å; E77-E81 VanDerWaalsContact O-CB 3.26Å; E77-E81 WeakPolarHBondContact O-CB 3.47Å; E77-E81 WeakPolarHBondContact O-CG 3.23Å; E77-E81 PolarHBondContact O-N 3.19Å
82	S	97.3	Very high	98.2	Very high	59 Å²	59	59.4 Å²	59.4	41%	0.413	29%	0.294	S	S	.	.	I	π-helix	trans	-89.1	-39.1	178.3	-59.4	0	0	0	0	112.6	E39 I78	E39-S82 WeakPolarHBondContact OE1-CB 3.37Å; E39-S82 PolarHBondContact OE1-OG 3.04Å; I78-S82 WeakPolarHBondContact O-CA 3.33Å; I78-S82 VanDerWaalsContact O-CB 3.22Å; I78-S82 WeakPolarHBondContact O-CB 3.4Å; I78-S82 PolarHBondContact O-N 3.45Å
83	F	97.9	Very high	98.1	Very high	11 Å²	11	57.7 Å²	57.7	5%	0.048	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-2.6	-174.8	-58.1	-54.6	0	0	0	114.7	E39 M42 E43 I46 F47 P54 I78 M79 V85	E39-F83 HydrophobicContact CG-CZ 4.28Å; M42-F83 HydrophobicContact CB-CE2 3.79Å; M42-F83 HydrophobicContact CB-CZ 3.98Å; M42-F83 HydrophobicContact SD-CE2 4.39Å; E43-F83 HydrophobicContact CB-CE1 4.01Å; E43-F83 HydrophobicContact CB-CZ 4.05Å; E43-F83 HydrophobicContact CG-CE1 4.42Å; I46-F83 HydrophobicContact CD1-CD1 4.35Å; I46-F83 HydrophobicContact CD1-CD2 4.08Å; I46-F83 HydrophobicContact CD1-CE2 4.23Å; I46-F83 HydrophobicContact CD1-CG 4.16Å; I46-F83 HydrophobicContact CD1-CZ 4.45Å; F47-F83 HydrophobicContact CE2-CD1 4.11Å; F47-F83 HydrophobicContact CE2-CE1 4.13Å; P54-F83 HydrophobicContact CB-CB 4.17Å; P54-F83 WeakPolarHBondContact CB-O 3.27Å; P54-F83 HydrophobicContact CG-CB 4.29Å; P54-F83 WeakPolarHBondContact CG-O 3.41Å; I78-F83 HydrophobicContact CG2-CD2 3.94Å; I78-F83 HydrophobicContact CG2-CE2 3.51Å; I78-F83 HydrophobicContact CG2-CZ 4.42Å; I78-F83 PolarHBondContact O-N 3.33Å; M79-F83 HydrophobicContact CE-CD2 4.46Å; M79-F83 CarbonylContact O-C 3.54Å; M79-F83 WeakPolarHBondContact O-CB 3.48Å; M79-F83 HydrophobicContact SD-CD2 3.81Å; M79-F83 HydrophobicContact SD-CE2 4.31Å; F83-V85 HydrophobicContact CB-CG1 4.25Å; F83-V85 PolarHBondContact O-N 2.89Å; F83-V85 VanDerWaalsContact O-N 3.13Å
84	N	98.3	Very high	97.9	Very high	86 Å²	86	51.5 Å²	51.5	46%	0.46	26%	0.261	S	S	.	.			trans	52.4	34	176.2	-65.4	-31.8	0	0	0	114.4	E55 M79 F80	E55-N84 HydrophobicContact CG-CB 3.67Å; E55-N84 WeakPolarHBondContact OE1-CB 3.5Å; E55-N84 PolarHBondContact OE1-ND2 3.03Å; M79-N84 PolarHBondContact O-N 3.46Å; F80-N84 VanDerWaalsContact O-CA 3.26Å; F80-N84 WeakPolarHBondContact O-CA 3.31Å; F80-N84 PolarHBondContact O-N 2.87Å; F80-N84 PolarHBondContact O-OD1 3.18Å
85	V	98.6	Very high	97.8	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.03	25%	0.254	C	S	.	.			trans	-63.8	138.1	-177.7	-59.2	0	0	0	0	111.2	P54 F59 M79 F80 F83 G87 L88	P54-V85 HydrophobicContact CB-CG1 4.03Å; F59-V85 HydrophobicContact CD2-CB 4.07Å; F59-V85 HydrophobicContact CD2-CG1 3.44Å; F59-V85 VanDerWaalsContact CD2-CG1 3.44Å; F59-V85 HydrophobicContact CE2-CG1 3.63Å; F59-V85 HydrophobicContact CG-CG1 4.27Å; M79-V85 HydrophobicContact CB-CG2 4.03Å; M79-V85 HydrophobicContact CE-CG1 3.66Å; M79-V85 WeakPolarHBondContact O-CG2 3.44Å; M79-V85 PolarHBondContact O-N 2.89Å; M79-V85 VanDerWaalsContact O-N 3.17Å; F80-V85 HydrophobicContact CD1-CG2 3.84Å; F80-V85 VanDerWaalsContact CD1-O 3.26Å; F80-V85 WeakPolarHBondContact CD1-O 3.41Å; F80-V85 HydrophobicContact CE1-CG2 3.88Å; F80-V85 WeakPolarHBondContact CE1-O 3.49Å; F80-V85 HydrophobicContact CG-CG2 4.48Å; F83-V85 HydrophobicContact CB-CG1 4.25Å; F83-V85 PolarHBondContact O-N 2.89Å; F83-V85 VanDerWaalsContact O-N 3.13Å; V85-G87 PolarHBondContact O-N 3.34Å; V85-L88 HydrophobicContact CG2-CB 4.27Å
86	P	98.3	Very high	97.7	Very high	68 Å²	68	50.3 Å²	50.3	44%	0.442	26%	0.264	S	S	.	.	S	Bend	trans	-73.3	-11.6	179.9	30.6	-38	0	0	0	112.8	P54 E55 H57 Y58	P54-P86 VanDerWaalsContact O-CD 3.23Å; P54-P86 WeakPolarHBondContact O-CD 3.45Å; E55-P86 VanDerWaalsContact O-CD 3.3Å; E55-P86 WeakPolarHBondContact O-CD 3.26Å; E55-P86 VanDerWaalsContact O-CG 3.26Å; E55-P86 WeakPolarHBondContact O-CG 3.48Å; H57-P86 VanDerWaalsContact O-CD 3.24Å; H57-P86 WeakPolarHBondContact O-CD 3.25Å; H57-P86 WeakPolarHBondContact O-CG 3.46Å; Y58-P86 HydrophobicContact CD1-CB 4.25Å; Y58-P86 HydrophobicContact CD1-CG 3.8Å; Y58-P86 HydrophobicContact CE1-CB 3.86Å; Y58-P86 HydrophobicContact CE1-CG 3.87Å
87	G	98.5	Very high	97.5	Very high	16 Å²	16	51.3 Å²	51.3	17%	0.165	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173	142.3	178.1	0	0	0	0	0	112.6	Y58 F59 V85	Y58-G87 WeakPolarHBondContact CA-O 3.48Å; F59-G87 PolarHBondContact N-O 2.61Å; V85-G87 PolarHBondContact O-N 3.34Å
88	L	98.8	Very high	97.3	Very high	39 Å²	39	47.8 Å²	47.8	20%	0.204	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135	-178.1	-179.6	66.6	0	0	0	110.2	F59 L61 A76 M79 F80 V85 I90	F59-L88 HydrophobicContact CB-CD1 4.01Å; F59-L88 WeakPolarHBondContact O-CA 3.2Å; L61-L88 HydrophobicContact CD1-CD1 3.94Å; L61-L88 HydrophobicContact CG-CD1 3.96Å; A76-L88 HydrophobicContact CB-CD2 3.95Å; M79-L88 HydrophobicContact CB-CD1 4.33Å; M79-L88 HydrophobicContact CB-CD2 3.91Å; M79-L88 HydrophobicContact CG-CD1 4.13Å; M79-L88 HydrophobicContact CG-CD2 4.17Å; F80-L88 HydrophobicContact CE1-CB 4.38Å; F80-L88 HydrophobicContact CE2-CB 3.85Å; F80-L88 HydrophobicContact CE2-CD2 4.11Å; F80-L88 HydrophobicContact CZ-CB 3.63Å; V85-L88 HydrophobicContact CG2-CB 4.27Å; L88-I90 HydrophobicContact CD1-CG1 4.42Å; L88-I90 HydrophobicContact CD2-CD1 4.07Å; L88-I90 HydrophobicContact CD2-CG1 4.16Å; L88-I90 HydrophobicContact CG-CG1 4.11Å
89	Y	98.5	Very high	97	Very high	149 Å²	149	48.5 Å²	48.5	58%	0.584	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.7	166.5	-174.9	-112	0	0	0	109.6	F59 L60 L61 A91	F59-Y89 PolarHBondContact O-N 3.22Å; L60-Y89 CarbonylContact C-O 3.58Å; L60-Y89 VanDerWaalsContact CA-O 3.29Å; L60-Y89 WeakPolarHBondContact CA-O 3.37Å; L60-Y89 HydrophobicContact CD1-CD1 3.92Å; L60-Y89 HydrophobicContact CG-CD1 4.09Å; L61-Y89 PolarHBondContact N-O 3.24Å; Y89-A91 HydrophobicContact CD1-CB 4.08Å; Y89-A91 HydrophobicContact CE1-CB 3.66Å
90	I	98.3	Very high	96.8	Very high	29 Å²	29	51.2 Å²	51.2	15%	0.149	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	118.2	176.2	-54.2	174.3	0	0	0	107.6	L61 E63 R72 T75 L88	L61-I90 HydrophobicContact CB-CG1 4.48Å; L61-I90 WeakPolarHBondContact O-CA 3.37Å; E63-I90 HydrophobicContact CB-CG2 4.03Å; E63-I90 VanDerWaalsContact CD-CG2 3.44Å; E63-I90 HydrophobicContact CG-CG2 3.9Å; R72-I90 HydrophobicContact CG-CD1 3.68Å; T75-I90 HydrophobicContact CG2-CD1 3.94Å; L88-I90 HydrophobicContact CD1-CG1 4.42Å; L88-I90 HydrophobicContact CD2-CD1 4.07Å; L88-I90 HydrophobicContact CD2-CG1 4.16Å; L88-I90 HydrophobicContact CG-CG1 4.11Å
91	A	97.4	Very high	96.4	Very high	5 Å²	5	49 Å²	49	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141.3	-174.2	0	0	0	0	0	111.5	L60 L61 T62 E63 Y89 Q93 L96	L60-A91 HydrophobicContact CD2-CB 4.46Å; L61-A91 PolarHBondContact O-N 2.86Å; T62-A91 VanDerWaalsContact CA-O 3.27Å; T62-A91 WeakPolarHBondContact CA-O 3.39Å; E63-A91 PolarHBondContact N-O 2.9Å; Y89-A91 HydrophobicContact CD1-CB 4.08Å; Y89-A91 HydrophobicContact CE1-CB 3.66Å; A91-Q93 PolarHBondContact O-N 2.78Å; A91-L96 HydrophobicContact CB-CD1 3.79Å; A91-L96 HydrophobicContact CB-CD2 3.86Å; A91-L96 HydrophobicContact CB-CG 3.83Å
92	V	95.9	Very high	96.1	Very high	41 Å²	41	46 Å²	46	25%	0.248	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	128.5	172.1	179.3	0	0	0	0	109.5	P65 A94 V95 L96	P65-V92 HydrophobicContact CB-CG1 4.22Å; V92-A94 VanDerWaalsContact C-N 3.26Å; V92-A94 HydrophobicContact CG1-CB 4.31Å; V92-A94 PolarHBondContact O-N 3.25Å; V92-V95 HydrophobicContact CB-CG2 4.25Å; V92-V95 PolarHBondContact O-N 2.7Å; V92-L96 PolarHBondContact O-N 2.66Å
93	Q	95.9	Very high	95.7	Very high	62 Å²	62	49.2 Å²	49.2	29%	0.29	28%	0.283	S	S	.	.	H	α-helix	trans	-51.6	-41.4	-176.7	-71.9	167.2	-21.8	0	0	113.4	E63 A91 V95 L96 A97	E63-Q93 WeakPolarHBondContact O-CG 3.41Å; E63-Q93 PolarHBondContact O-N 2.82Å; E63-Q93 VanDerWaalsContact O-N 3.09Å; A91-Q93 PolarHBondContact O-N 2.78Å; Q93-V95 PolarHBondContact O-N 2.89Å; Q93-L96 PolarHBondContact O-N 3.28Å; Q93-A97 PolarHBondContact O-N 3.27Å
94	A	95.3	Very high	95.2	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-42.4	179.5	0	0	0	0	0	113.1	V92 L96 A97 L98 V116 I127 V129	V92-A94 VanDerWaalsContact C-N 3.26Å; V92-A94 HydrophobicContact CG1-CB 4.31Å; V92-A94 PolarHBondContact O-N 3.25Å; A94-L96 VanDerWaalsContact C-N 3.32Å; A94-L96 PolarHBondContact O-N 3.41Å; A94-A97 WeakPolarHBondContact O-CB 3.48Å; A94-A97 PolarHBondContact O-N 3.1Å; A94-L98 PolarHBondContact O-N 3.31Å; A94-V116 HydrophobicContact CB-CB 4.13Å; A94-V116 HydrophobicContact CB-CG1 4.33Å; A94-V116 HydrophobicContact CB-CG2 4.08Å; A94-V116 WeakPolarHBondContact O-CG2 3.07Å; A94-I127 HydrophobicContact CB-CB 4.06Å; A94-I127 HydrophobicContact CB-CD1 3.61Å; A94-I127 HydrophobicContact CB-CG1 4.46Å; A94-I127 HydrophobicContact CB-CG2 3.89Å; A94-V129 HydrophobicContact CB-CG2 3.93Å
95	V	95.3	Very high	94.2	Very high	51 Å²	51	59 Å²	59	31%	0.309	32%	0.321	S	S	.	.	H	α-helix	trans	-65.7	-40.8	179.7	-178	0	0	0	0	110.2	V92 Q93 L98 A99 L112 V129	V92-V95 HydrophobicContact CB-CG2 4.25Å; V92-V95 PolarHBondContact O-N 2.7Å; Q93-V95 PolarHBondContact O-N 2.89Å; V95-L98 PolarHBondContact O-N 3.4Å; V95-A99 PolarHBondContact O-N 3.05Å; V95-L112 HydrophobicContact CG1-CD1 4.31Å; V95-L112 HydrophobicContact CG1-CD2 4.08Å; V95-V129 HydrophobicContact CG2-CG1 3.95Å
96	L	96.1	Very high	93.4	Very high	59 Å²	59	67.5 Å²	67.5	31%	0.309	36%	0.36	S	S	.	.	H	α-helix	trans	-65.7	-38.3	175.6	-62.5	-177.4	0	0	0	112.2	L60 T62 A91 V92 Q93 A94 L98 A99 A100	L60-L96 HydrophobicContact CD2-CD1 4.08Å; T62-L96 HydrophobicContact CG2-CD1 3.53Å; A91-L96 HydrophobicContact CB-CD1 3.79Å; A91-L96 HydrophobicContact CB-CD2 3.86Å; A91-L96 HydrophobicContact CB-CG 3.83Å; V92-L96 PolarHBondContact O-N 2.66Å; Q93-L96 PolarHBondContact O-N 3.28Å; A94-L96 VanDerWaalsContact C-N 3.32Å; A94-L96 PolarHBondContact O-N 3.41Å; L96-L98 VanDerWaalsContact C-N 3.34Å; L96-L98 PolarHBondContact O-N 3.2Å; L96-A99 PolarHBondContact O-N 3.21Å; L96-A100 PolarHBondContact O-N 2.85Å
97	A	94.8	Very high	92.5	Very high	48 Å²	48	67 Å²	67	40%	0.397	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-41.2	175.4	0	0	0	0	0	111.6	Q93 A94 A100 S101 V116	Q93-A97 PolarHBondContact O-N 3.27Å; A94-A97 WeakPolarHBondContact O-CB 3.48Å; A94-A97 PolarHBondContact O-N 3.1Å; A97-A100 PolarHBondContact O-N 3.01Å; A97-S101 PolarHBondContact O-N 3Å; A97-V116 HydrophobicContact CB-CG1 3.97Å
98	L	93.5	Very high	91.4	Very high	20 Å²	20	70.5 Å²	70.5	11%	0.105	39%	0.391	C	S	.	.	H	α-helix	trans	-64.8	-44.3	172.6	-73.6	174.2	0	0	0	112.1	A94 V95 L96 A100 S101 L112 V116 V129	A94-L98 PolarHBondContact O-N 3.31Å; V95-L98 PolarHBondContact O-N 3.4Å; L96-L98 VanDerWaalsContact C-N 3.34Å; L96-L98 PolarHBondContact O-N 3.2Å; L98-A100 VanDerWaalsContact C-N 3.26Å; L98-A100 PolarHBondContact O-N 3.19Å; L98-S101 VanDerWaalsContact O-CB 3.28Å; L98-S101 WeakPolarHBondContact O-CB 3.42Å; L98-S101 PolarHBondContact O-N 3.48Å; L98-S101 PolarHBondContact O-OG 3.42Å; L98-L112 HydrophobicContact CB-CD2 4.49Å; L98-L112 VanDerWaalsContact CD1-O 3.29Å; L98-L112 WeakPolarHBondContact CD1-O 3.07Å; L98-V116 HydrophobicContact CD1-CG2 3.94Å; L98-V116 HydrophobicContact CD2-CG2 3.84Å; L98-V116 HydrophobicContact CG-CG2 3.48Å; L98-V116 VanDerWaalsContact CG-CG2 3.48Å; L98-V129 HydrophobicContact CD1-CB 3.49Å; L98-V129 VanDerWaalsContact CD1-CB 3.49Å; L98-V129 HydrophobicContact CD1-CG1 3.93Å; L98-V129 HydrophobicContact CD1-CG2 3.69Å
99	A	93.8	Very high	90.6	Very high	32 Å²	32	75.5 Å²	75.5	26%	0.264	41%	0.414	S	S	.	.	H	α-helix	trans	-59.7	-37.9	176.6	0	0	0	0	0	112	V95 L96 S101 W102 L112	V95-A99 PolarHBondContact O-N 3.05Å; L96-A99 PolarHBondContact O-N 3.21Å; A99-S101 VanDerWaalsContact C-N 3.27Å; A99-S101 PolarHBondContact O-N 3.22Å; A99-W102 HydrophobicContact CB-CE3 4.39Å; A99-W102 HydrophobicContact CB-CZ3 4.36Å; A99-W102 VanDerWaalsContact O-CB 3.29Å; A99-W102 WeakPolarHBondContact O-CB 3.29Å; A99-W102 PolarHBondContact O-N 3.31Å; A99-L112 HydrophobicContact CB-CD2 4.31Å
100	A	93.2	Very high	90.2	Very high	58 Å²	58	77.7 Å²	77.7	48%	0.479	42%	0.421	S	S	.	.	H	α-helix	trans	-63	-33	175.6	0	0	0	0	0	112.4	L96 A97 L98 W102 T103	L96-A100 PolarHBondContact O-N 2.85Å; A97-A100 PolarHBondContact O-N 3.01Å; L98-A100 VanDerWaalsContact C-N 3.26Å; L98-A100 PolarHBondContact O-N 3.19Å; A100-W102 PolarHBondContact O-N 3.04Å; A100-W102 VanDerWaalsContact O-N 3.16Å; A100-T103 WeakPolarHBondContact O-CB 3.45Å; A100-T103 PolarHBondContact O-N 3.34Å; A100-T103 VanDerWaalsContact O-N 3.17Å; A100-T103 PolarHBondContact O-OG1 3.42Å
101	S	91.3	Very high	89.7	Confident	49 Å²	49	79 Å²	79	34%	0.343	43%	0.43	S	S	.	.	H	α-helix	trans	-61.2	-23.6	178.5	82	0	0	0	0	113.4	A97 L98 A99 T103 S104	A97-S101 PolarHBondContact O-N 3Å; L98-S101 VanDerWaalsContact O-CB 3.28Å; L98-S101 WeakPolarHBondContact O-CB 3.42Å; L98-S101 PolarHBondContact O-N 3.48Å; L98-S101 PolarHBondContact O-OG 3.42Å; A99-S101 VanDerWaalsContact C-N 3.27Å; A99-S101 PolarHBondContact O-N 3.22Å; S101-T103 PolarHBondContact O-N 3.29Å; S101-T103 VanDerWaalsContact O-N 3.13Å; S101-S104 WeakPolarHBondContact O-CB 3.29Å; S101-S104 PolarHBondContact O-N 2.89Å
102	W	91.4	Very high	89.4	Confident	78 Å²	78	82.5 Å²	82.5	30%	0.295	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-17	177.9	-60.5	-11.3	0	0	0	114.1	A99 A100 R110 T111 L112	A99-W102 HydrophobicContact CB-CE3 4.39Å; A99-W102 HydrophobicContact CB-CZ3 4.36Å; A99-W102 VanDerWaalsContact O-CB 3.29Å; A99-W102 WeakPolarHBondContact O-CB 3.29Å; A99-W102 PolarHBondContact O-N 3.31Å; A100-W102 PolarHBondContact O-N 3.04Å; A100-W102 VanDerWaalsContact O-N 3.16Å; W102-R110 HydrophobicContact CB-CG 4Å; W102-R110 HydrophobicContact CD2-CB 3.76Å; W102-R110 HydrophobicContact CD2-CG 4.03Å; W102-R110 HydrophobicContact CE3-CB 4.25Å; W102-R110 HydrophobicContact CE3-CG 4.45Å; W102-R110 HydrophobicContact CG-CB 3.93Å; W102-R110 HydrophobicContact CG-CG 3.84Å; W102-R110 HydrophobicContact CZ2-CB 4.26Å; W102-T111 PolarHBondContact NE1-O 3.28Å; W102-L112 HydrophobicContact CH2-CD2 3.75Å; W102-L112 HydrophobicContact CH2-CG 4.01Å; W102-L112 HydrophobicContact CZ2-CD2 3.38Å; W102-L112 HydrophobicContact CZ2-CG 3.66Å
103	T	87.9	Confident	89.3	Confident	126 Å²	126	85.6 Å²	85.6	77%	0.773	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-16.6	174.6	64.1	0	0	0	0	112.4	A100 S101 R105	A100-T103 WeakPolarHBondContact O-CB 3.45Å; A100-T103 PolarHBondContact O-N 3.34Å; A100-T103 VanDerWaalsContact O-N 3.17Å; A100-T103 PolarHBondContact O-OG1 3.42Å; S101-T103 PolarHBondContact O-N 3.29Å; S101-T103 VanDerWaalsContact O-N 3.13Å; T103-R105 PolarHBondContact O-N 2.85Å
104	S	88.9	Confident	89.2	Confident	47 Å²	47	83.8 Å²	83.8	33%	0.329	47%	0.465	S	S	.	.	S	Bend	trans	-68.2	128.9	177.7	178.9	0	0	0	0	111.2	S101 Q106 V107	S101-S104 WeakPolarHBondContact O-CB 3.29Å; S101-S104 PolarHBondContact O-N 2.89Å; S104-Q106 PolarHBondContact O-N 3.47Å; S104-Q106 VanDerWaalsContact O-N 3.12Å; S104-Q106 PolarHBondContact OG-N 3.26Å; S104-V107 PolarHBondContact O-N 2.93Å; S104-V107 VanDerWaalsContact O-N 3.07Å
105	R	76.3	Confident	89.2	Confident	256 Å²	256	88.3 Å²	88.3	97%	0.966	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.4	176.6	-65.1	-176.7	180	170.3	0.4	113.7	T103 V107	T103-R105 PolarHBondContact O-N 2.85Å; R105-V107 VanDerWaalsContact C-N 3.33Å
106	Q	81.9	Confident	89.3	Confident	184 Å²	184	86.5 Å²	86.5	86%	0.86	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-14.8	179.2	-64.7	174	-10.2	0	0	112.3	S104 G108	S104-Q106 PolarHBondContact O-N 3.47Å; S104-Q106 VanDerWaalsContact O-N 3.12Å; S104-Q106 PolarHBondContact OG-N 3.26Å; Q106-G108 PolarHBondContact O-N 2.98Å
107	V	78.7	Confident	89.3	Confident	58 Å²	58	89.6 Å²	89.6	35%	0.352	50%	0.497	S	S	.	.			trans	-91.5	106	-177.4	177	0	0	0	0	108.5	S104 R105 E109	S104-V107 PolarHBondContact O-N 2.93Å; S104-V107 VanDerWaalsContact O-N 3.07Å; R105-V107 VanDerWaalsContact C-N 3.33Å; V107-E109 WeakPolarHBondContact CG1-O 3.5Å
108	G	76.8	Confident	89.2	Confident	88 Å²	88	89.8 Å²	89.8	91%	0.907	49%	0.492	S	S	*	.			trans	-79.3	-19.3	177	0	0	0	0	0	113.9	Q106	Q106-G108 PolarHBondContact O-N 2.98Å
109	E	82.2	Confident	89.3	Confident	145 Å²	145	93.1 Å²	93.1	68%	0.678	52%	0.516	S	S	*	.	S	Bend	trans	-129.1	129.4	-175.2	-174.9	173.3	-166.8	0	0	111.1	V107 T111	V107-E109 WeakPolarHBondContact CG1-O 3.5Å; E109-T111 PolarHBondContact O-N 3.03Å
110	R	89.1	Confident	89.2	Confident	195 Å²	195	93.7 Å²	93.7	74%	0.736	53%	0.525	S	S	*	.			trans	-88.2	93.4	176.8	-63.4	-174.6	-178.8	170.3	-0.4	109.4	W102	W102-R110 HydrophobicContact CB-CG 4Å; W102-R110 HydrophobicContact CD2-CB 3.76Å; W102-R110 HydrophobicContact CD2-CG 4.03Å; W102-R110 HydrophobicContact CE3-CB 4.25Å; W102-R110 HydrophobicContact CE3-CG 4.45Å; W102-R110 HydrophobicContact CG-CB 3.93Å; W102-R110 HydrophobicContact CG-CG 3.84Å; W102-R110 HydrophobicContact CZ2-CB 4.26Å
111	T	88.9	Confident	89.1	Confident	57 Å²	57	99.5 Å²	99.5	35%	0.35	55%	0.548	S	S	.	.			trans	-116.8	146.1	179.1	-177.1	0	0	0	0	111.6	W102 E109 T113	W102-T111 PolarHBondContact NE1-O 3.28Å; E109-T111 PolarHBondContact O-N 3.03Å; T111-T113 VanDerWaalsContact C-N 3.35Å; T111-T113 PolarHBondContact OG1-N 2.68Å
112	L	90.4	Very high	89	Confident	77 Å²	77	99.1 Å²	99.1	40%	0.403	55%	0.552	S	S	.	*	S	Bend	trans	-94.5	6.6	168.8	-67.3	178.4	0	0	0	112.2	V95 L98 A99 W102 V129	V95-L112 HydrophobicContact CG1-CD1 4.31Å; V95-L112 HydrophobicContact CG1-CD2 4.08Å; L98-L112 HydrophobicContact CB-CD2 4.49Å; L98-L112 VanDerWaalsContact CD1-O 3.29Å; L98-L112 WeakPolarHBondContact CD1-O 3.07Å; A99-L112 HydrophobicContact CB-CD2 4.31Å; W102-L112 HydrophobicContact CH2-CD2 3.75Å; W102-L112 HydrophobicContact CH2-CG 4.01Å; W102-L112 HydrophobicContact CZ2-CD2 3.38Å; W102-L112 HydrophobicContact CZ2-CG 3.66Å; L112-V129 VanDerWaalsContact O-CG1 3.28Å; L112-V129 WeakPolarHBondContact O-CG1 3.42Å
113	T	93.3	Very high	89	Confident	106 Å²	106	97.7 Å²	97.7	65%	0.65	55%	0.552	S	S	*	*			trans	-95.1	124.4	175.8	-56.2	0	0	0	0	110.1	T111 V129	T111-T113 VanDerWaalsContact C-N 3.35Å; T111-T113 PolarHBondContact OG1-N 2.68Å; T113-V129 WeakPolarHBondContact CA-O 3.45Å
114	G	93.6	Very high	89.3	Confident	25 Å²	25	95.7 Å²	95.7	26%	0.258	54%	0.54	S	S	.	.	S	Bend	trans	171.3	177.5	-180	0	0	0	0	0	113.1	V129	G114-V129 PolarHBondContact N-O 2.91Å; G114-V129 PolarHBondContact O-N 3Å
115	T	96.1	Very high	89.5	Confident	95 Å²	95	95.4 Å²	95.4	58%	0.583	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.2	173.8	-56.6	0	0	0	0	109.6	V126	T115-V126 HydrophobicContact CG2-CG1 3.72Å
116	V	96.3	Very high	90.4	Very high	13 Å²	13	87.9 Å²	87.9	8%	0.079	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	131.6	173.9	-178.5	0	0	0	0	109.4	A94 A97 L98 D118 V126 I127 V129	A94-V116 HydrophobicContact CB-CB 4.13Å; A94-V116 HydrophobicContact CB-CG1 4.33Å; A94-V116 HydrophobicContact CB-CG2 4.08Å; A94-V116 WeakPolarHBondContact O-CG2 3.07Å; A97-V116 HydrophobicContact CB-CG1 3.97Å; L98-V116 HydrophobicContact CD1-CG2 3.94Å; L98-V116 HydrophobicContact CD2-CG2 3.84Å; L98-V116 HydrophobicContact CG-CG2 3.48Å; L98-V116 VanDerWaalsContact CG-CG2 3.48Å; V116-D118 HydrophobicContact CG1-CB 4.26Å; V116-V126 CarbonylContact O-C 3.55Å; V116-V126 WeakPolarHBondContact O-CA 3.36Å; V116-I127 PolarHBondContact N-O 3.49Å; V116-I127 PolarHBondContact O-N 3.43Å; V116-V129 HydrophobicContact CG2-CG2 4.24Å
117	I	96.4	Very high	91	Very high	125 Å²	125	80.2 Å²	80.2	64%	0.641	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	103.7	168.5	-56.2	172.9	0	0	0	106	H125 V126	I117-H125 WeakPolarHBondContact CA-O 3.37Å; I117-V126 HydrophobicContact CG1-CG1 4.28Å; I117-V126 HydrophobicContact CG1-CG2 4.33Å; I117-V126 HydrophobicContact CG2-CG2 4.36Å
118	D	93.5	Very high	91.8	Very high	52 Å²	52	82.4 Å²	82.4	28%	0.278	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.5	-179.4	-175.6	13.2	0	0	0	109.4	V116 T124 H125	V116-D118 HydrophobicContact CG1-CB 4.26Å; D118-T124 CarbonylContact O-C 3.49Å; D118-T124 VanDerWaalsContact O-CA 3.25Å; D118-T124 WeakPolarHBondContact O-CA 3.23Å; D118-T124 WeakPolarHBondContact O-CG2 3.11Å; D118-H125 PolarHBondContact N-O 3.04Å; D118-H125 PolarHBondContact O-N 3.03Å
119	S	95.3	Very high	92.6	Very high	89 Å²	89	81.9 Å²	81.9	62%	0.622	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	92.2	-179.7	-171.2	0	0	0	0	109.6	T124	S119-T124 PolarHBondContact OG-OG1 3.41Å
120	G	92.3	Very high	93.1	Very high	44 Å²	44	78.7 Å²	78.7	45%	0.454	46%	0.464	S	S	.	.			trans	-86	-175.6	174.3	0	0	0	0	0	112.9	V123	G120-V123 PolarHBondContact N-O 3.29Å
121	D	91.5	Very high	93.3	Very high	180 Å²	180	72.6 Å²	72.6	96%	0.963	45%	0.45	S	S	*	.	S	Bend	trans	-65.1	-45	178.9	178.4	72	0	0	0	112.6
122	G	88.6	Confident	93.5	Very high	41 Å²	41	73.4 Å²	73.4	42%	0.423	46%	0.456	S	S	.	.	S	Bend	trans	-95.9	-23.4	-174.3	0	0	0	0	0	116	H29	H29-G122 PolarHBondContact ND1-O 3.3Å
123	V	91.9	Very high	93.7	Very high	48 Å²	48	73.2 Å²	73.2	29%	0.291	46%	0.459	S	S	.	.			trans	-154	146.7	-173.6	-172.6	0	0	0	0	110.8	H29 G120 H125	H29-V123 HydrophobicContact CB-CG2 3.68Å; H29-V123 WeakPolarHBondContact O-CG2 3.47Å; G120-V123 PolarHBondContact N-O 3.29Å; V123-H125 WeakPolarHBondContact CG1-NE2 3.12Å
124	T	93.3	Very high	93.8	Very high	84 Å²	84	71.2 Å²	71.2	52%	0.515	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131	165.5	-54.4	0	0	0	0	110.1	D118 S119	D118-T124 CarbonylContact O-C 3.49Å; D118-T124 VanDerWaalsContact O-CA 3.25Å; D118-T124 WeakPolarHBondContact O-CA 3.23Å; D118-T124 WeakPolarHBondContact O-CG2 3.11Å; S119-T124 PolarHBondContact OG-OG1 3.41Å
125	H	92.4	Very high	93.8	Very high	41 Å²	41	74.3 Å²	74.3	19%	0.19	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	142.1	176.4	-57.9	104.3	0	0	0	111.4	I117 D118 V123 I127	I117-H125 WeakPolarHBondContact CA-O 3.37Å; D118-H125 PolarHBondContact N-O 3.04Å; D118-H125 PolarHBondContact O-N 3.03Å; V123-H125 WeakPolarHBondContact CG1-NE2 3.12Å; H125-I127 HydrophobicContact CB-CD1 3.67Å; H125-I127 HydrophobicContact CB-CG1 3.77Å
126	V	95.8	Very high	93.6	Very high	98 Å²	98	72.8 Å²	72.8	59%	0.594	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	110.4	167.6	-177	0	0	0	0	107.5	T115 V116 I117	T115-V126 HydrophobicContact CG2-CG1 3.72Å; V116-V126 CarbonylContact O-C 3.55Å; V116-V126 WeakPolarHBondContact O-CA 3.36Å; I117-V126 HydrophobicContact CG1-CG1 4.28Å; I117-V126 HydrophobicContact CG1-CG2 4.33Å; I117-V126 HydrophobicContact CG2-CG2 4.36Å
127	I	95.1	Very high	93.4	Very high	24 Å²	24	77.4 Å²	77.4	12%	0.123	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	108.1	-164.6	-53.6	160.5	0	0	0	108.3	P65 A94 V116 H125 V129	P65-I127 HydrophobicContact CB-CD1 4Å; P65-I127 HydrophobicContact CB-CG1 4.44Å; P65-I127 HydrophobicContact CG-CD1 3.54Å; P65-I127 HydrophobicContact CG-CG1 4.12Å; A94-I127 HydrophobicContact CB-CB 4.06Å; A94-I127 HydrophobicContact CB-CD1 3.61Å; A94-I127 HydrophobicContact CB-CG1 4.46Å; A94-I127 HydrophobicContact CB-CG2 3.89Å; V116-I127 PolarHBondContact N-O 3.49Å; V116-I127 PolarHBondContact O-N 3.43Å; H125-I127 HydrophobicContact CB-CD1 3.67Å; H125-I127 HydrophobicContact CB-CG1 3.77Å; I127-V129 HydrophobicContact CG2-CG2 4.06Å
128	P	95.1	Very high	93.1	Very high	104 Å²	104	73.4 Å²	73.4	68%	0.675	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	126.5	164	30.3	-30.7	0	0	0	108.8
129	V	93	Very high	93.1	Very high	76 Å²	76	75.4 Å²	75.4	46%	0.461	48%	0.483	S	S	.	.			trans	-111.9	0	177.1	-171.9	0	0	0	0	109.4	A94 V95 L98 L112 T113 G114 V116 I127	A94-V129 HydrophobicContact CB-CG2 3.93Å; V95-V129 HydrophobicContact CG2-CG1 3.95Å; L98-V129 HydrophobicContact CD1-CB 3.49Å; L98-V129 VanDerWaalsContact CD1-CB 3.49Å; L98-V129 HydrophobicContact CD1-CG1 3.93Å; L98-V129 HydrophobicContact CD1-CG2 3.69Å; L112-V129 VanDerWaalsContact O-CG1 3.28Å; L112-V129 WeakPolarHBondContact O-CG1 3.42Å; T113-V129 WeakPolarHBondContact CA-O 3.45Å; G114-V129 PolarHBondContact N-O 2.91Å; G114-V129 PolarHBondContact O-N 3Å; V116-V129 HydrophobicContact CG2-CG2 4.24Å; I127-V129 HydrophobicContact CG2-CG2 4.06Å

Retrieved 129 of 129 residues in 202.7 ms (Link to these results)

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