A0A087YD94_POEFO Loading...

LSM12 homolog b

AlphaFold DB , UniProt , Accession A0A087YD94, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 196 aa.

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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	37.9	Very low	54.2	Low	247 Å²	247	100.2 Å²	100.2	100%	1.217	62%	0.616	S	S	*	*				0	106.9	0	-66.8	-91.6	-172.3	0	0	106
2	A	35.8	Very low	57.1	Low	104 Å²	104	97.6 Å²	97.6	86%	0.86	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-79.2	128.8	175.6	0	0	0	0	0	107.9
3	A	36.3	Very low	59.7	Low	86 Å²	86	90.5 Å²	90.5	71%	0.711	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-60.7	145.4	167.8	0	0	0	0	0	108.9	G5	A3-G5 PolarHBondContact O-N 3.36Å
4	P	46.4	Very low	62.1	Low	101 Å²	101	84.1 Å²	84.1	66%	0.656	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-54.1	132.6	173.4	22.1	-31	0	0	0	108.9
5	G	46.1	Very low	64.2	Low	35 Å²	35	83.1 Å²	83.1	36%	0.361	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-61.4	149.3	-178.3	0	0	0	0	0	110.4	A3 G7 E8	A3-G5 PolarHBondContact O-N 3.36Å; G5-G7 PolarHBondContact O-N 3.02Å; G5-E8 PolarHBondContact O-N 3.03Å
6	P	41	Very low	66.2	Low	147 Å²	147	78 Å²	78	96%	0.955	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	109.8	173.1	22.3	-30.7	0	0	0	109.3
7	G	53.4	Low	67.9	Low	42 Å²	42	73.9 Å²	73.9	43%	0.433	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	129.1	-18.3	-178.7	0	0	0	0	0	115.3	G5 Y9 Y35	G5-G7 PolarHBondContact O-N 3.02Å; G7-Y9 WeakPolarHBondContact O-CD2 2.87Å; G7-Y9 PolarHBondContact O-N 3.34Å; G7-Y35 WeakPolarHBondContact O-CE1 3.37Å
8	E	60.8	Low	69.4	Low	118 Å²	118	69.8 Å²	69.8	55%	0.551	43%	0.425	S	S	*	.			trans	-83.1	97.7	179.3	-69.5	-176.4	152.3	0	0	111.3	G5	G5-E8 PolarHBondContact O-N 3.03Å
9	Y	68.3	Low	70.9	Confident	151 Å²	151	69.6 Å²	69.6	59%	0.592	42%	0.42	S	S	*	.			trans	-76.4	-36.5	178.1	-73.5	-89.3	0	0	0	112.8	G7 F33 Y35	G7-Y9 WeakPolarHBondContact O-CD2 2.87Å; G7-Y9 PolarHBondContact O-N 3.34Å; Y9-F33 AromaticContact CD2-CE1 3.74Å; Y9-F33 HydrophobicContact CD2-CE1 3.74Å; Y9-F33 HydrophobicContact CD2-CZ 4.26Å; Y9-F33 HydrophobicContact CG-CE1 4.2Å; Y9-Y35 HydrophobicContact CD2-CD1 4.38Å; Y9-Y35 HydrophobicContact CD2-CE1 4.27Å
10	F	82.1	Confident	72.1	Confident	23 Å²	23	67 Å²	67	10%	0.101	41%	0.405	C	S	.	.	S	Bend	trans	-144.3	124.4	-175.3	-51.9	-71.3	0	0	0	111	V16 V30 F33 L40 L61 V67	F10-V16 HydrophobicContact CD1-CG1 4.06Å; F10-V30 HydrophobicContact CB-CG1 3.99Å; F10-V30 HydrophobicContact CB-CG2 4.16Å; F10-F33 HydrophobicContact CD2-CD1 4.42Å; F10-F33 AromaticContact CD2-CD2 3.97Å; F10-F33 HydrophobicContact CD2-CD2 3.97Å; F10-F33 HydrophobicContact CD2-CE2 4.29Å; F10-F33 HydrophobicContact CD2-CG 4.05Å; F10-F33 HydrophobicContact CE2-CD2 4.25Å; F10-F33 HydrophobicContact CE2-CE2 4.15Å; F10-F33 HydrophobicContact CE2-CZ 4.46Å; F10-L40 HydrophobicContact CB-CD1 4.41Å; F10-L40 HydrophobicContact CD2-CD1 3.85Å; F10-L40 HydrophobicContact CD2-CD2 4.47Å; F10-L40 HydrophobicContact CE2-CD1 4.41Å; F10-L40 HydrophobicContact CE2-CD2 4.33Å; F10-L40 HydrophobicContact CG-CD1 4.11Å; F10-L40 HydrophobicContact CZ-CD2 4.43Å; F10-L61 HydrophobicContact CE2-CD1 3.61Å; F10-L61 HydrophobicContact CZ-CD1 4.11Å; F10-V67 HydrophobicContact CD1-CG1 4.46Å; F10-V67 HydrophobicContact CE1-CB 4.22Å; F10-V67 HydrophobicContact CE1-CG1 3.43Å; F10-V67 VanDerWaalsContact CE1-CG1 3.43Å; F10-V67 HydrophobicContact CZ-CB 4.3Å; F10-V67 HydrophobicContact CZ-CG1 3.86Å; F10-V67 HydrophobicContact CZ-CG2 4.29Å
11	S	87.6	Confident	73.2	Confident	48 Å²	48	67.6 Å²	67.6	34%	0.336	41%	0.411	S	S	.	.			trans	-74	132.2	172.5	-48.3	0	0	0	0	110.1	G13 S14	S11-G13 PolarHBondContact O-N 2.9Å; S11-S14 WeakPolarHBondContact CB-OG 3.2Å; S11-S14 VanDerWaalsContact O-CB 3.31Å; S11-S14 WeakPolarHBondContact O-CB 3.24Å; S11-S14 PolarHBondContact O-N 3.2Å; S11-S14 PolarHBondContact O-OG 3.49Å
12	V	89.7	Confident	76	Confident	69 Å²	69	63.2 Å²	63.2	42%	0.418	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	129.3	174.9	172.6	0	0	0	0	109.4	R73 P77	V12-R73 WeakPolarHBondContact O-CD 3.31Å; V12-P77 HydrophobicContact CB-CG 4.23Å; V12-P77 HydrophobicContact CG1-CB 4.49Å; V12-P77 HydrophobicContact CG1-CG 4.09Å
13	G	90.9	Very high	78.7	Confident	5 Å²	5	61 Å²	61	5%	0.052	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-8.5	-176.6	0	0	0	0	0	115.1	S11 V30	S11-G13 PolarHBondContact O-N 2.9Å; G13-V30 PolarHBondContact N-O 3.14Å
14	S	92.5	Very high	81.6	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.007	37%	0.37	C	S	.	.			trans	-66.7	150.4	169	-62.5	0	0	0	0	110.2	S11 E29 V30 H71 D72 R73	S11-S14 WeakPolarHBondContact CB-OG 3.2Å; S11-S14 VanDerWaalsContact O-CB 3.31Å; S11-S14 WeakPolarHBondContact O-CB 3.24Å; S11-S14 PolarHBondContact O-N 3.2Å; S11-S14 PolarHBondContact O-OG 3.49Å; S14-E29 CarbonylContact O-C 3.6Å; S14-E29 WeakPolarHBondContact O-CA 3.32Å; S14-V30 WeakPolarHBondContact O-CG2 3.26Å; S14-V30 PolarHBondContact O-N 2.8Å; S14-H71 CarbonylContact C-O 3.48Å; S14-H71 VanDerWaalsContact CA-O 3.29Å; S14-H71 WeakPolarHBondContact CA-O 3.49Å; S14-H71 WeakPolarHBondContact CB-O 3.49Å; S14-D72 PolarHBondContact OG-OD1 3.45Å; S14-R73 PolarHBondContact OG-N 2.97Å
15	H	94.5	Very high	83.9	Confident	70 Å²	70	64 Å²	64	32%	0.324	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131	172.4	-72.6	55.7	0	0	0	109.8	G28 I70 H71	H15-G28 WeakPolarHBondContact CA-O 3.38Å; H15-I70 HydrophobicContact CB-CB 4.46Å; H15-I70 PolarHBondContact O-N 3.08Å; H15-H71 HydrophobicContact CB-CB 4.17Å; H15-H71 PolarHBondContact N-O 3.33Å; H15-H71 PolarHBondContact O-N 3.5Å; H15-H71 VanDerWaalsContact O-N 3.15Å
16	V	95.4	Very high	86.2	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.006	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.4	-177.1	-58.6	0	0	0	0	111.3	F10 Q27 G28 V30 L40 L42 V67 D68 I69	F10-V16 HydrophobicContact CD1-CG1 4.06Å; V16-Q27 WeakPolarHBondContact O-CA 3.17Å; V16-G28 PolarHBondContact N-O 3.18Å; V16-G28 PolarHBondContact O-N 3.21Å; V16-V30 HydrophobicContact CB-CG2 4.41Å; V16-V30 HydrophobicContact CG1-CG2 3.72Å; V16-V30 HydrophobicContact CG2-CG2 3.77Å; V16-L40 HydrophobicContact CG2-CD2 4.16Å; V16-L42 HydrophobicContact CG2-CD1 4.07Å; V16-L42 HydrophobicContact CG2-CD2 3.51Å; V16-L42 HydrophobicContact CG2-CG 4.46Å; V16-V67 HydrophobicContact CB-CG1 4.3Å; V16-D68 CarbonylContact C-O 3.57Å; V16-D68 VanDerWaalsContact CA-O 3.27Å; V16-D68 WeakPolarHBondContact CA-O 3.46Å; V16-I69 HydrophobicContact CG1-CG1 4.21Å
17	S	95.8	Very high	88.8	Confident	9 Å²	9	61.9 Å²	61.9	6%	0.063	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.8	168.4	-152.8	0	0	0	0	109.2	Q25 L26 V67 D68	S17-Q25 PolarHBondContact OG-NE2 3.49Å; S17-L26 CarbonylContact C-O 3.56Å; S17-L26 WeakPolarHBondContact CA-O 3.42Å; S17-V67 CarbonylContact O-C 3.54Å; S17-V67 VanDerWaalsContact O-CA 3.32Å; S17-V67 WeakPolarHBondContact O-CA 3.48Å; S17-D68 PolarHBondContact N-O 3.13Å; S17-D68 PolarHBondContact O-N 3.07Å
18	C	95.5	Very high	90.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.3	174.4	-62.3	0	0	0	0	109.2	Q25 L26 I59 V64 K66	C18-Q25 WeakPolarHBondContact O-CA 3.48Å; C18-L26 HydrophobicContact CB-CB 4.44Å; C18-L26 PolarHBondContact N-O 3.28Å; C18-L26 PolarHBondContact O-N 2.93Å; C18-I59 HydrophobicContact CB-CD1 4.23Å; C18-V64 HydrophobicContact CB-CG1 4.07Å; C18-K66 WeakPolarHBondContact CA-O 3.45Å
19	L	97	Very high	92.4	Very high	65 Å²	65	56.5 Å²	56.5	34%	0.34	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	116	167.7	-176.8	64.8	0	0	0	108.5	V64 S65 K66	L19-V64 CarbonylContact O-C 3.59Å; L19-V64 WeakPolarHBondContact O-CA 3.46Å; L19-V64 WeakPolarHBondContact O-CG1 3.36Å; L19-S65 WeakPolarHBondContact CG-OG 3.49Å; L19-S65 PolarHBondContact O-N 3.48Å; L19-S65 PolarHBondContact O-OG 2.99Å; L19-K66 HydrophobicContact CB-CB 4.09Å; L19-K66 PolarHBondContact N-O 3.33Å; L19-K66 PolarHBondContact O-N 3.04Å
20	T	95.4	Very high	93.6	Very high	18 Å²	18	49.3 Å²	49.3	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	161.3	176.3	73.8	0	0	0	0	111	L22 G23 Q24 L26 Y63 S65	T20-L22 PolarHBondContact O-N 3.18Å; T20-L22 PolarHBondContact OG1-N 3.11Å; T20-G23 PolarHBondContact O-N 2.7Å; T20-Q24 HydrophobicContact CG2-CB 4.15Å; T20-Q24 PolarHBondContact N-O 3.43Å; T20-Q24 WeakPolarHBondContact OG1-CB 3.44Å; T20-Q24 PolarHBondContact OG1-N 3.45Å; T20-Q24 VanDerWaalsContact OG1-N 3.11Å; T20-Q24 PolarHBondContact OG1-O 3.31Å; T20-L26 HydrophobicContact CG2-CD1 3.99Å; T20-L26 HydrophobicContact CG2-CG 4.44Å; T20-Y63 CarbonylContact C-O 3.6Å; T20-Y63 WeakPolarHBondContact CA-O 3.41Å; T20-S65 PolarHBondContact O-OG 3.39Å
21	C	94.9	Very high	94.2	Very high	79 Å²	79	51.4 Å²	51.4	53%	0.534	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-11.9	173.8	62.5	0	0	0	0	113.9	Y63	C21-Y63 PolarHBondContact N-O 3.39Å
22	L	95.8	Very high	94.4	Very high	156 Å²	156	51.1 Å²	51.1	82%	0.817	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	5.9	173.5	-58.4	179.6	0	0	0	112.8	T20 Q24	T20-L22 PolarHBondContact O-N 3.18Å; T20-L22 PolarHBondContact OG1-N 3.11Å; L22-Q24 VanDerWaalsContact C-N 3.31Å; L22-Q24 PolarHBondContact O-N 3.34Å
23	G	94.2	Very high	94.5	Very high	56 Å²	56	49.2 Å²	49.2	58%	0.577	28%	0.276	S	S	*	.	S	Bend	trans	79.5	8.9	-179.6	0	0	0	0	0	114.6	T20	T20-G23 PolarHBondContact O-N 2.7Å
24	Q	95.3	Very high	94.5	Very high	117 Å²	117	52.6 Å²	52.6	55%	0.547	29%	0.293	S	S	.	.			trans	-78.9	130.8	175.5	-173.3	-178.6	13.2	0	0	110	T20 L22 L26	T20-Q24 HydrophobicContact CG2-CB 4.15Å; T20-Q24 PolarHBondContact N-O 3.43Å; T20-Q24 WeakPolarHBondContact OG1-CB 3.44Å; T20-Q24 PolarHBondContact OG1-N 3.45Å; T20-Q24 VanDerWaalsContact OG1-N 3.11Å; T20-Q24 PolarHBondContact OG1-O 3.31Å; L22-Q24 VanDerWaalsContact C-N 3.31Å; L22-Q24 PolarHBondContact O-N 3.34Å; Q24-L26 HydrophobicContact CG-CD2 4.15Å; Q24-L26 HydrophobicContact CG-CG 4.44Å
25	Q	95.3	Very high	94.2	Very high	135 Å²	135	58.1 Å²	58.1	63%	0.631	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	125.2	174.1	-167.9	169.6	8.1	0	0	110.5	S17 C18	S17-Q25 PolarHBondContact OG-NE2 3.49Å; C18-Q25 WeakPolarHBondContact O-CA 3.48Å
26	L	94.8	Very high	93.9	Very high	28 Å²	28	63.5 Å²	63.5	15%	0.147	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.7	177.6	-60.3	175.1	0	0	0	108.9	S17 C18 T20 Q24 I57 I59	S17-L26 CarbonylContact C-O 3.56Å; S17-L26 WeakPolarHBondContact CA-O 3.42Å; C18-L26 HydrophobicContact CB-CB 4.44Å; C18-L26 PolarHBondContact N-O 3.28Å; C18-L26 PolarHBondContact O-N 2.93Å; T20-L26 HydrophobicContact CG2-CD1 3.99Å; T20-L26 HydrophobicContact CG2-CG 4.44Å; Q24-L26 HydrophobicContact CG-CD2 4.15Å; Q24-L26 HydrophobicContact CG-CG 4.44Å; L26-I57 HydrophobicContact CD2-CD1 4.49Å; L26-I59 HydrophobicContact CB-CD1 4.16Å; L26-I59 HydrophobicContact CD1-CD1 3.79Å; L26-I59 HydrophobicContact CD1-CG1 4.14Å
27	Q	95.3	Very high	93.7	Very high	108 Å²	108	66.2 Å²	66.2	51%	0.505	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	137.6	-178.9	178	176.5	-12	0	0	110.6	V16 C44 I70	V16-Q27 WeakPolarHBondContact O-CA 3.17Å; Q27-C44 PolarHBondContact O-SG 2.83Å; Q27-I70 HydrophobicContact CG-CD1 3.57Å
28	G	95.6	Very high	93.5	Very high	6 Å²	6	71.6 Å²	71.6	6%	0.062	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.1	176.8	177.2	0	0	0	0	0	113.5	H15 V16 K43	H15-G28 WeakPolarHBondContact CA-O 3.38Å; V16-G28 PolarHBondContact N-O 3.18Å; V16-G28 PolarHBondContact O-N 3.21Å; G28-K43 CarbonylContact C-O 3.56Å; G28-K43 VanDerWaalsContact CA-O 3.3Å; G28-K43 WeakPolarHBondContact CA-O 3.38Å
29	E	94.9	Very high	93.4	Very high	41 Å²	41	73.8 Å²	73.8	19%	0.192	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	130.4	173.5	-173.2	-173.5	157.5	0	0	109.6	S14 V31 L42 K43	S14-E29 CarbonylContact O-C 3.6Å; S14-E29 WeakPolarHBondContact O-CA 3.32Å; E29-V31 PolarHBondContact O-N 3.45Å; E29-L42 CarbonylContact O-C 3.57Å; E29-L42 WeakPolarHBondContact O-CA 3.39Å; E29-K43 HydrophobicContact CB-CB 4.44Å; E29-K43 PolarHBondContact N-O 3.38Å; E29-K43 PolarHBondContact O-N 3.29Å; E29-K43 IonicContact OE1-NZ 3.95Å; E29-K43 WeakPolarHBondContact OE2-CE 3.39Å; E29-K43 IonicContact OE2-NZ 3.04Å; E29-K43 PolarHBondContact OE2-NZ 3.14Å
30	V	94.2	Very high	93.3	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	117.1	176.8	177.7	0	0	0	0	109.5	F10 G13 S14 V16 L40 L42	F10-V30 HydrophobicContact CB-CG1 3.99Å; F10-V30 HydrophobicContact CB-CG2 4.16Å; G13-V30 PolarHBondContact N-O 3.14Å; S14-V30 WeakPolarHBondContact O-CG2 3.26Å; S14-V30 PolarHBondContact O-N 2.8Å; V16-V30 HydrophobicContact CB-CG2 4.41Å; V16-V30 HydrophobicContact CG1-CG2 3.72Å; V16-V30 HydrophobicContact CG2-CG2 3.77Å; V30-L40 HydrophobicContact CG1-CD1 3.89Å; V30-L40 HydrophobicContact CG2-CD1 4.18Å; V30-L42 HydrophobicContact CG2-CD2 3.95Å
31	V	93.1	Very high	93.4	Very high	68 Å²	68	71 Å²	71	41%	0.412	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-42	176.8	179.3	0	0	0	0	111	E29 T41 K43	E29-V31 PolarHBondContact O-N 3.45Å; V31-T41 HydrophobicContact CB-CG2 4.08Å; V31-T41 PolarHBondContact N-O 2.96Å; V31-K43 HydrophobicContact CG2-CB 3.52Å
32	A	92.1	Very high	93.4	Very high	42 Å²	42	67.2 Å²	67.2	35%	0.347	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	154.5	-177.4	0	0	0	0	0	110.2	T41	A32-T41 PolarHBondContact O-N 3.2Å
33	F	91.8	Very high	93.4	Very high	28 Å²	28	63 Å²	63	12%	0.123	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	122.9	170.7	179.9	-117.2	0	0	0	109.2	Y9 F10 Y35 M39 L40 L61	Y9-F33 AromaticContact CD2-CE1 3.74Å; Y9-F33 HydrophobicContact CD2-CE1 3.74Å; Y9-F33 HydrophobicContact CD2-CZ 4.26Å; Y9-F33 HydrophobicContact CG-CE1 4.2Å; F10-F33 HydrophobicContact CD2-CD1 4.42Å; F10-F33 AromaticContact CD2-CD2 3.97Å; F10-F33 HydrophobicContact CD2-CD2 3.97Å; F10-F33 HydrophobicContact CD2-CE2 4.29Å; F10-F33 HydrophobicContact CD2-CG 4.05Å; F10-F33 HydrophobicContact CE2-CD2 4.25Å; F10-F33 HydrophobicContact CE2-CE2 4.15Å; F10-F33 HydrophobicContact CE2-CZ 4.46Å; F33-Y35 AromaticContact CD1-CD1 3.58Å; F33-Y35 HydrophobicContact CD1-CD1 3.58Å; F33-Y35 AromaticContact CD1-CE1 3.39Å; F33-Y35 HydrophobicContact CD1-CE1 3.39Å; F33-Y35 HydrophobicContact CD1-CE2 4.44Å; F33-Y35 HydrophobicContact CD1-CG 4.14Å; F33-Y35 AromaticContact CD1-CZ 3.9Å; F33-Y35 AromaticContact CE1-CD1 3.34Å; F33-Y35 HydrophobicContact CE1-CD1 3.34Å; F33-Y35 AromaticContact CE1-CE1 3.52Å; F33-Y35 HydrophobicContact CE1-CE1 3.52Å; F33-Y35 HydrophobicContact CE1-CG 4.09Å; F33-M39 WeakPolarHBondContact CA-O 3.33Å; F33-M39 WeakPolarHBondContact CD2-O 3.39Å; F33-L40 HydrophobicContact CB-CD1 4.45Å; F33-L40 HydrophobicContact CD2-CB 4.17Å; F33-L40 HydrophobicContact CD2-CD1 4.26Å; F33-L61 HydrophobicContact CD2-CD1 4.36Å; F33-L61 HydrophobicContact CE2-CD1 3.43Å; F33-L61 VanDerWaalsContact CE2-CD1 3.43Å; F33-L61 HydrophobicContact CE2-CG 4.37Å; F33-L61 HydrophobicContact CZ-CD1 3.98Å
34	D	91.1	Very high	93.4	Very high	76 Å²	76	61.2 Å²	61.2	41%	0.406	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	113.6	170.7	178.3	53.8	0	0	0	110	Q36 S37 K38 M39	D34-Q36 VanDerWaalsContact C-N 3.35Å; D34-Q36 PolarHBondContact O-N 3.46Å; D34-S37 WeakPolarHBondContact OD2-CB 3.5Å; D34-S37 PolarHBondContact OD2-N 3.35Å; D34-S37 PolarHBondContact OD2-OG 3.44Å; D34-K38 WeakPolarHBondContact O-CA 3.31Å; D34-K38 PolarHBondContact O-N 3.06Å; D34-M39 HydrophobicContact CB-CB 4.39Å; D34-M39 PolarHBondContact N-O 2.79Å; D34-M39 PolarHBondContact O-N 2.85Å
35	Y	87.1	Confident	93.2	Very high	117 Å²	117	59.8 Å²	59.8	46%	0.459	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-37.4	-176	-67.3	-76	0	0	0	112.9	G7 Y9 F33	G7-Y35 WeakPolarHBondContact O-CE1 3.37Å; Y9-Y35 HydrophobicContact CD2-CD1 4.38Å; Y9-Y35 HydrophobicContact CD2-CE1 4.27Å; F33-Y35 AromaticContact CD1-CD1 3.58Å; F33-Y35 HydrophobicContact CD1-CD1 3.58Å; F33-Y35 AromaticContact CD1-CE1 3.39Å; F33-Y35 HydrophobicContact CD1-CE1 3.39Å; F33-Y35 HydrophobicContact CD1-CE2 4.44Å; F33-Y35 HydrophobicContact CD1-CG 4.14Å; F33-Y35 AromaticContact CD1-CZ 3.9Å; F33-Y35 AromaticContact CE1-CD1 3.34Å; F33-Y35 HydrophobicContact CE1-CD1 3.34Å; F33-Y35 AromaticContact CE1-CE1 3.52Å; F33-Y35 HydrophobicContact CE1-CE1 3.52Å; F33-Y35 HydrophobicContact CE1-CG 4.09Å
36	Q	87.8	Confident	93	Very high	183 Å²	183	54.5 Å²	54.5	86%	0.855	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-49.3	-173.5	-173.7	176.5	5.1	0	0	111.5	D34 K38	D34-Q36 VanDerWaalsContact C-N 3.35Å; D34-Q36 PolarHBondContact O-N 3.46Å; Q36-K38 VanDerWaalsContact C-N 3.35Å
37	S	90.1	Very high	92.8	Very high	59 Å²	59	58 Å²	58	41%	0.413	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.8	179.2	66.2	0	0	0	0	113.7	D34 M39	D34-S37 WeakPolarHBondContact OD2-CB 3.5Å; D34-S37 PolarHBondContact OD2-N 3.35Å; D34-S37 PolarHBondContact OD2-OG 3.44Å; S37-M39 PolarHBondContact O-N 2.73Å; S37-M39 WeakPolarHBondContact OG-CB 3.39Å; S37-M39 WeakPolarHBondContact OG-CG 3.47Å
38	K	91.4	Very high	92.6	Very high	122 Å²	122	56.1 Å²	56.1	53%	0.53	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	42.4	-174.5	-56.5	-177.1	179.6	-178.3	0	111.8	D34 Q36 L61	D34-K38 WeakPolarHBondContact O-CA 3.31Å; D34-K38 PolarHBondContact O-N 3.06Å; Q36-K38 VanDerWaalsContact C-N 3.35Å; K38-L61 HydrophobicContact CB-CB 4.3Å; K38-L61 WeakPolarHBondContact O-CB 3.21Å; K38-L61 WeakPolarHBondContact O-CG 3.31Å; K38-L61 PolarHBondContact O-N 3.31Å
39	M	94.7	Very high	92.2	Very high	45 Å²	45	59 Å²	59	22%	0.222	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.8	179.2	-67.5	-66.3	-59.2	0	0	110	F33 D34 S37 L58 I59 N60	F33-M39 WeakPolarHBondContact CA-O 3.33Å; F33-M39 WeakPolarHBondContact CD2-O 3.39Å; D34-M39 HydrophobicContact CB-CB 4.39Å; D34-M39 PolarHBondContact N-O 2.79Å; D34-M39 PolarHBondContact O-N 2.85Å; S37-M39 PolarHBondContact O-N 2.73Å; S37-M39 WeakPolarHBondContact OG-CB 3.39Å; S37-M39 WeakPolarHBondContact OG-CG 3.47Å; M39-L58 HydrophobicContact CE-CB 3.84Å; M39-I59 CarbonylContact C-O 3.54Å; M39-I59 WeakPolarHBondContact CA-O 3.47Å; M39-N60 HydrophobicContact CE-CB 4.3Å; M39-N60 WeakPolarHBondContact SD-CA 3.43Å; M39-N60 HydrophobicContact SD-CB 3.45Å; M39-N60 WeakPolarHBondContact SD-CB 3.32Å
40	L	95.1	Very high	92	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123	176.4	178.5	62.2	0	0	0	110	F10 V16 V30 F33 L42 I59 L61	F10-L40 HydrophobicContact CB-CD1 4.41Å; F10-L40 HydrophobicContact CD2-CD1 3.85Å; F10-L40 HydrophobicContact CD2-CD2 4.47Å; F10-L40 HydrophobicContact CE2-CD1 4.41Å; F10-L40 HydrophobicContact CE2-CD2 4.33Å; F10-L40 HydrophobicContact CG-CD1 4.11Å; F10-L40 HydrophobicContact CZ-CD2 4.43Å; V16-L40 HydrophobicContact CG2-CD2 4.16Å; V30-L40 HydrophobicContact CG1-CD1 3.89Å; V30-L40 HydrophobicContact CG2-CD1 4.18Å; F33-L40 HydrophobicContact CB-CD1 4.45Å; F33-L40 HydrophobicContact CD2-CB 4.17Å; F33-L40 HydrophobicContact CD2-CD1 4.26Å; L40-L42 HydrophobicContact CD1-CD2 4.15Å; L40-L42 HydrophobicContact CD2-CD2 3.97Å; L40-L42 HydrophobicContact CD2-CG 4.41Å; L40-L42 HydrophobicContact CG-CD2 3.83Å; L40-L42 HydrophobicContact CG-CG 4.25Å; L40-I59 HydrophobicContact CB-CB 4.41Å; L40-I59 PolarHBondContact N-O 3.47Å; L40-I59 PolarHBondContact O-N 2.94Å; L40-L61 HydrophobicContact CB-CD2 3.98Å; L40-L61 HydrophobicContact CB-CG 4.24Å; L40-L61 HydrophobicContact CD2-CD2 4.06Å
41	T	96.4	Very high	91.6	Very high	25 Å²	25	69 Å²	69	15%	0.153	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	119.8	175.3	-53.3	0	0	0	0	109.8	V31 A32 V56 I57 L58	V31-T41 HydrophobicContact CB-CG2 4.08Å; V31-T41 PolarHBondContact N-O 2.96Å; A32-T41 PolarHBondContact O-N 3.2Å; T41-V56 HydrophobicContact CG2-CG1 3.57Å; T41-I57 CarbonylContact C-O 3.52Å; T41-I57 WeakPolarHBondContact CA-O 3.33Å; T41-L58 HydrophobicContact CG2-CD1 4.3Å
42	L	96.1	Very high	91.5	Very high	0 Å²	0	73 Å²	73	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	139.7	175.6	-59.4	-171.4	0	0	0	111.4	V16 E29 V30 L40 V56 I57 I59	V16-L42 HydrophobicContact CG2-CD1 4.07Å; V16-L42 HydrophobicContact CG2-CD2 3.51Å; V16-L42 HydrophobicContact CG2-CG 4.46Å; E29-L42 CarbonylContact O-C 3.57Å; E29-L42 WeakPolarHBondContact O-CA 3.39Å; V30-L42 HydrophobicContact CG2-CD2 3.95Å; L40-L42 HydrophobicContact CD1-CD2 4.15Å; L40-L42 HydrophobicContact CD2-CD2 3.97Å; L40-L42 HydrophobicContact CD2-CG 4.41Å; L40-L42 HydrophobicContact CG-CD2 3.83Å; L40-L42 HydrophobicContact CG-CG 4.25Å; L42-V56 CarbonylContact O-C 3.59Å; L42-V56 WeakPolarHBondContact O-CA 3.24Å; L42-I57 PolarHBondContact N-O 3.33Å; L42-I57 PolarHBondContact O-N 3.22Å; L42-I59 HydrophobicContact CD1-CD1 3.48Å; L42-I59 VanDerWaalsContact CD1-CD1 3.48Å; L42-I59 HydrophobicContact CG-CD1 3.89Å
43	K	95.2	Very high	91.5	Very high	68 Å²	68	75.1 Å²	75.1	30%	0.296	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	118.9	163.9	-176.3	-173.7	72.9	-170.5	0	108.5	G28 E29 V31 N54 D55	G28-K43 CarbonylContact C-O 3.56Å; G28-K43 VanDerWaalsContact CA-O 3.3Å; G28-K43 WeakPolarHBondContact CA-O 3.38Å; E29-K43 HydrophobicContact CB-CB 4.44Å; E29-K43 PolarHBondContact N-O 3.38Å; E29-K43 PolarHBondContact O-N 3.29Å; E29-K43 IonicContact OE1-NZ 3.95Å; E29-K43 WeakPolarHBondContact OE2-CE 3.39Å; E29-K43 IonicContact OE2-NZ 3.04Å; E29-K43 PolarHBondContact OE2-NZ 3.14Å; V31-K43 HydrophobicContact CG2-CB 3.52Å; K43-N54 HydrophobicContact CD-CB 4.09Å; K43-N54 HydrophobicContact CG-CB 3.6Å; K43-D55 WeakPolarHBondContact CA-O 3.47Å
44	C	93.8	Very high	91.6	Very high	17 Å²	17	78 Å²	78	12%	0.115	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	162.7	-178	-58.9	0	0	0	0	110.3	Q27 N54 D55 I57	Q27-C44 PolarHBondContact O-SG 2.83Å; C44-N54 WeakPolarHBondContact O-CB 3.26Å; C44-D55 HydrophobicContact CB-CB 4.24Å; C44-D55 PolarHBondContact N-O 2.91Å; C44-D55 PolarHBondContact O-N 3.35Å; C44-I57 HydrophobicContact CB-CD1 4.3Å; C44-I57 VanDerWaalsContact SG-CD1 3.56Å
45	A	90.8	Very high	91.8	Very high	88 Å²	88	76.6 Å²	76.6	73%	0.727	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.8	143.9	171	0	0	0	0	0	110.8	S47	A45-S47 PolarHBondContact O-N 3.12Å
46	S	92.6	Very high	92.3	Very high	23 Å²	23	75.4 Å²	75.4	16%	0.161	44%	0.44	C	S	.	.			trans	-62.4	117.6	-178.9	177.5	0	0	0	0	112.2	S48 G49 K50 L53	S46-S48 PolarHBondContact O-N 2.98Å; S46-S48 PolarHBondContact OG-N 3.32Å; S46-S48 PolarHBondContact OG-OG 3.46Å; S46-G49 PolarHBondContact O-N 3.3Å; S46-K50 WeakPolarHBondContact CB-O 3.3Å; S46-K50 PolarHBondContact OG-O 3.2Å; S46-L53 WeakPolarHBondContact CB-O 3.18Å
47	S	90.2	Very high	92.6	Very high	102 Å²	102	69.2 Å²	69.2	71%	0.713	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-23.1	169.9	52	0	0	0	0	113.1	A45 G49 D55	A45-S47 PolarHBondContact O-N 3.12Å; S47-G49 VanDerWaalsContact C-N 3.27Å; S47-G49 PolarHBondContact O-N 3.35Å; S47-D55 WeakPolarHBondContact CB-OD2 3.46Å; S47-D55 PolarHBondContact N-OD1 2.88Å; S47-D55 PolarHBondContact N-OD2 3.28Å; S47-D55 PolarHBondContact OG-OD1 3.1Å; S47-D55 PolarHBondContact OG-OD2 2.57Å
48	S	90.1	Very high	92.9	Very high	68 Å²	68	71.7 Å²	71.7	48%	0.476	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-5.8	177.1	74.2	0	0	0	0	114.4	S46 K50	S46-S48 PolarHBondContact O-N 2.98Å; S46-S48 PolarHBondContact OG-N 3.32Å; S46-S48 PolarHBondContact OG-OG 3.46Å; S48-K50 PolarHBondContact O-N 3.14Å; S48-K50 VanDerWaalsContact O-N 3.12Å
49	G	88.1	Confident	93.1	Very high	66 Å²	66	66.4 Å²	66.4	68%	0.68	40%	0.398	S	S	*	.			trans	70.8	-2.5	-176.1	0	0	0	0	0	114.9	S46 S47	S46-G49 PolarHBondContact O-N 3.3Å; S47-G49 VanDerWaalsContact C-N 3.27Å; S47-G49 PolarHBondContact O-N 3.35Å
50	K	90.4	Very high	93.1	Very high	130 Å²	130	66.9 Å²	66.9	57%	0.565	40%	0.401	S	S	*	.			trans	-74.5	122.3	177.1	-67.1	177.9	-179	173.6	0	109.9	S46 S48 N52 L53	S46-K50 WeakPolarHBondContact CB-O 3.3Å; S46-K50 PolarHBondContact OG-O 3.2Å; S48-K50 PolarHBondContact O-N 3.14Å; S48-K50 VanDerWaalsContact O-N 3.12Å; K50-N52 VanDerWaalsContact C-N 3.27Å; K50-N52 PolarHBondContact O-N 2.85Å; K50-L53 HydrophobicContact CB-CB 4.32Å; K50-L53 HydrophobicContact CB-CD1 3.96Å; K50-L53 HydrophobicContact CB-CG 4.03Å; K50-L53 HydrophobicContact CD-CD1 3.65Å; K50-L53 HydrophobicContact CD-CG 4.48Å; K50-L53 HydrophobicContact CG-CD1 4.41Å; K50-L53 PolarHBondContact O-N 3.41Å
51	P	86.1	Confident	93.1	Very high	121 Å²	121	68.4 Å²	68.4	79%	0.786	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-22.6	-170.9	26.5	-35.5	0	0	0	114
52	N	89.8	Confident	93	Very high	152 Å²	152	70.9 Å²	70.9	81%	0.813	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	6.1	-178.9	-63.1	-30.1	0	0	0	113.3	K50	K50-N52 VanDerWaalsContact C-N 3.27Å; K50-N52 PolarHBondContact O-N 2.85Å
53	L	93.5	Very high	92.9	Very high	88 Å²	88	78.1 Å²	78.1	46%	0.461	46%	0.461	S	S	.	.			trans	-113.4	159.5	176.6	-60.3	-175.4	0	0	0	109.3	S46 K50	S46-L53 WeakPolarHBondContact CB-O 3.18Å; K50-L53 HydrophobicContact CB-CB 4.32Å; K50-L53 HydrophobicContact CB-CD1 3.96Å; K50-L53 HydrophobicContact CB-CG 4.03Å; K50-L53 HydrophobicContact CD-CD1 3.65Å; K50-L53 HydrophobicContact CD-CG 4.48Å; K50-L53 HydrophobicContact CG-CD1 4.41Å; K50-L53 PolarHBondContact O-N 3.41Å
54	N	93.8	Very high	93	Very high	87 Å²	87	76 Å²	76	47%	0.465	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	150.8	172.1	-63.3	-86	0	0	0	108	K43 C44	K43-N54 HydrophobicContact CD-CB 4.09Å; K43-N54 HydrophobicContact CG-CB 3.6Å; C44-N54 WeakPolarHBondContact O-CB 3.26Å
55	D	95.3	Very high	93	Very high	47 Å²	47	78.9 Å²	78.9	25%	0.251	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	132.4	170.5	-68.2	-1.9	0	0	0	107.9	K43 C44 S47	K43-D55 WeakPolarHBondContact CA-O 3.47Å; C44-D55 HydrophobicContact CB-CB 4.24Å; C44-D55 PolarHBondContact N-O 2.91Å; C44-D55 PolarHBondContact O-N 3.35Å; S47-D55 WeakPolarHBondContact CB-OD2 3.46Å; S47-D55 PolarHBondContact N-OD1 2.88Å; S47-D55 PolarHBondContact N-OD2 3.28Å; S47-D55 PolarHBondContact OG-OD1 3.1Å; S47-D55 PolarHBondContact OG-OD2 2.57Å
56	V	96.4	Very high	93.2	Very high	92 Å²	92	79.8 Å²	79.8	56%	0.558	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	116.7	176.3	-179.3	0	0	0	0	108	T41 L42 L58	T41-V56 HydrophobicContact CG2-CG1 3.57Å; L42-V56 CarbonylContact O-C 3.59Å; L42-V56 WeakPolarHBondContact O-CA 3.24Å; V56-L58 HydrophobicContact CG1-CD1 4.33Å
57	I	95.3	Very high	93.2	Very high	53 Å²	53	81 Å²	81	27%	0.272	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.7	-174.4	-51.5	-178.3	0	0	0	108.8	L26 T41 L42 C44 I59	L26-I57 HydrophobicContact CD2-CD1 4.49Å; T41-I57 CarbonylContact C-O 3.52Å; T41-I57 WeakPolarHBondContact CA-O 3.33Å; L42-I57 PolarHBondContact N-O 3.33Å; L42-I57 PolarHBondContact O-N 3.22Å; C44-I57 HydrophobicContact CB-CD1 4.3Å; C44-I57 VanDerWaalsContact SG-CD1 3.56Å; I57-I59 HydrophobicContact CG2-CD1 4.46Å; I57-I59 HydrophobicContact CG2-CG1 3.86Å
58	L	96.3	Very high	93.4	Very high	112 Å²	112	79.4 Å²	79.4	59%	0.586	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	118.8	172.3	-78.6	73.9	0	0	0	108.7	M39 T41 V56	M39-L58 HydrophobicContact CE-CB 3.84Å; T41-L58 HydrophobicContact CG2-CD1 4.3Å; V56-L58 HydrophobicContact CG1-CD1 4.33Å
59	I	95.4	Very high	93.5	Very high	10 Å²	10	80.5 Å²	80.5	5%	0.051	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	119	-174.6	-54.4	177.4	0	0	0	108.9	C18 L26 M39 L40 L42 I57 L61 V64	C18-I59 HydrophobicContact CB-CD1 4.23Å; L26-I59 HydrophobicContact CB-CD1 4.16Å; L26-I59 HydrophobicContact CD1-CD1 3.79Å; L26-I59 HydrophobicContact CD1-CG1 4.14Å; M39-I59 CarbonylContact C-O 3.54Å; M39-I59 WeakPolarHBondContact CA-O 3.47Å; L40-I59 HydrophobicContact CB-CB 4.41Å; L40-I59 PolarHBondContact N-O 3.47Å; L40-I59 PolarHBondContact O-N 2.94Å; L42-I59 HydrophobicContact CD1-CD1 3.48Å; L42-I59 VanDerWaalsContact CD1-CD1 3.48Å; L42-I59 HydrophobicContact CG-CD1 3.89Å; I57-I59 HydrophobicContact CG2-CD1 4.46Å; I57-I59 HydrophobicContact CG2-CG1 3.86Å; I59-L61 HydrophobicContact CG2-CD2 4.43Å; I59-L61 PolarHBondContact O-N 2.97Å; I59-V64 HydrophobicContact CG2-CG2 3.37Å
60	N	95.2	Very high	93.8	Very high	55 Å²	55	81.6 Å²	81.6	29%	0.294	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	113.4	168.2	-176.5	-17.4	0	0	0	109	M39 A62 Y63	M39-N60 HydrophobicContact CE-CB 4.3Å; M39-N60 WeakPolarHBondContact SD-CA 3.43Å; M39-N60 HydrophobicContact SD-CB 3.45Å; M39-N60 WeakPolarHBondContact SD-CB 3.32Å; N60-A62 PolarHBondContact O-N 3.06Å; N60-A62 VanDerWaalsContact O-N 3.11Å; N60-A62 WeakPolarHBondContact OD1-CB 3.4Å; N60-A62 PolarHBondContact OD1-N 3.11Å; N60-Y63 HydrophobicContact CB-CD2 3.97Å; N60-Y63 HydrophobicContact CB-CE2 4.44Å; N60-Y63 PolarHBondContact O-N 2.97Å
61	L	93.9	Very high	93.8	Very high	32 Å²	32	80.7 Å²	80.7	17%	0.168	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-65.8	-14.5	-176.8	-63.9	-177.8	0	0	0	113.7	F10 F33 K38 L40 I59 Y63 V64 V67	F10-L61 HydrophobicContact CE2-CD1 3.61Å; F10-L61 HydrophobicContact CZ-CD1 4.11Å; F33-L61 HydrophobicContact CD2-CD1 4.36Å; F33-L61 HydrophobicContact CE2-CD1 3.43Å; F33-L61 VanDerWaalsContact CE2-CD1 3.43Å; F33-L61 HydrophobicContact CE2-CG 4.37Å; F33-L61 HydrophobicContact CZ-CD1 3.98Å; K38-L61 HydrophobicContact CB-CB 4.3Å; K38-L61 WeakPolarHBondContact O-CB 3.21Å; K38-L61 WeakPolarHBondContact O-CG 3.31Å; K38-L61 PolarHBondContact O-N 3.31Å; L40-L61 HydrophobicContact CB-CD2 3.98Å; L40-L61 HydrophobicContact CB-CG 4.24Å; L40-L61 HydrophobicContact CD2-CD2 4.06Å; I59-L61 HydrophobicContact CG2-CD2 4.43Å; I59-L61 PolarHBondContact O-N 2.97Å; L61-Y63 PolarHBondContact O-N 3.15Å; L61-V64 HydrophobicContact CD2-CB 4.26Å; L61-V64 HydrophobicContact CD2-CG2 4.01Å; L61-V64 PolarHBondContact O-N 3.33Å; L61-V64 VanDerWaalsContact O-N 3.17Å; L61-V67 HydrophobicContact CD2-CG2 4.16Å
62	A	93.9	Very high	93.9	Very high	77 Å²	77	78.7 Å²	78.7	64%	0.636	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-61.8	-24.4	171	0	0	0	0	0	112.9	N60	N60-A62 PolarHBondContact O-N 3.06Å; N60-A62 VanDerWaalsContact O-N 3.11Å; N60-A62 WeakPolarHBondContact OD1-CB 3.4Å; N60-A62 PolarHBondContact OD1-N 3.11Å
63	Y	95.6	Very high	93.7	Very high	153 Å²	153	74.5 Å²	74.5	60%	0.6	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-105.4	19.7	178.1	-56.2	-63.6	0	0	0	112.7	T20 C21 N60 L61	T20-Y63 CarbonylContact C-O 3.6Å; T20-Y63 WeakPolarHBondContact CA-O 3.41Å; C21-Y63 PolarHBondContact N-O 3.39Å; N60-Y63 HydrophobicContact CB-CD2 3.97Å; N60-Y63 HydrophobicContact CB-CE2 4.44Å; N60-Y63 PolarHBondContact O-N 2.97Å; L61-Y63 PolarHBondContact O-N 3.15Å
64	V	95.6	Very high	93.1	Very high	23 Å²	23	76.8 Å²	76.8	14%	0.139	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.2	177.9	178.1	0	0	0	0	108.5	C18 L19 I59 L61 K66 V67	C18-V64 HydrophobicContact CB-CG1 4.07Å; L19-V64 CarbonylContact O-C 3.59Å; L19-V64 WeakPolarHBondContact O-CA 3.46Å; L19-V64 WeakPolarHBondContact O-CG1 3.36Å; I59-V64 HydrophobicContact CG2-CG2 3.37Å; L61-V64 HydrophobicContact CD2-CB 4.26Å; L61-V64 HydrophobicContact CD2-CG2 4.01Å; L61-V64 PolarHBondContact O-N 3.33Å; L61-V64 VanDerWaalsContact O-N 3.17Å; V64-K66 WeakPolarHBondContact CG1-O 3.45Å; V64-V67 HydrophobicContact CG1-CG2 3.5Å
65	S	95.7	Very high	92.7	Very high	78 Å²	78	79.3 Å²	79.3	55%	0.545	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-27.8	179	56.1	0	0	0	0	112.3	L19 T20	L19-S65 WeakPolarHBondContact CG-OG 3.49Å; L19-S65 PolarHBondContact O-N 3.48Å; L19-S65 PolarHBondContact O-OG 2.99Å; T20-S65 PolarHBondContact O-OG 3.39Å
66	K	94	Very high	91.9	Very high	107 Å²	107	83.4 Å²	83.4	47%	0.465	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	141.2	-180	-164.9	-174.6	-176.6	-143.3	0	111.6	C18 L19 V64 D68	C18-K66 WeakPolarHBondContact CA-O 3.45Å; L19-K66 HydrophobicContact CB-CB 4.09Å; L19-K66 PolarHBondContact N-O 3.33Å; L19-K66 PolarHBondContact O-N 3.04Å; V64-K66 WeakPolarHBondContact CG1-O 3.45Å; K66-D68 WeakPolarHBondContact CE-OD1 3.45Å; K66-D68 VanDerWaalsContact CE-OD2 3.27Å; K66-D68 WeakPolarHBondContact CE-OD2 3.37Å; K66-D68 IonicContact NZ-OD1 3.86Å; K66-D68 PolarHBondContact NZ-OD1 3.46Å; K66-D68 IonicContact NZ-OD2 2.64Å; K66-D68 PolarHBondContact NZ-OD2 3.31Å
67	V	93	Very high	91	Very high	47 Å²	47	81.4 Å²	81.4	29%	0.285	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.9	167.9	-170.5	0	0	0	0	109.4	F10 V16 S17 L61 V64	F10-V67 HydrophobicContact CD1-CG1 4.46Å; F10-V67 HydrophobicContact CE1-CB 4.22Å; F10-V67 HydrophobicContact CE1-CG1 3.43Å; F10-V67 VanDerWaalsContact CE1-CG1 3.43Å; F10-V67 HydrophobicContact CZ-CB 4.3Å; F10-V67 HydrophobicContact CZ-CG1 3.86Å; F10-V67 HydrophobicContact CZ-CG2 4.29Å; V16-V67 HydrophobicContact CB-CG1 4.3Å; S17-V67 CarbonylContact O-C 3.54Å; S17-V67 VanDerWaalsContact O-CA 3.32Å; S17-V67 WeakPolarHBondContact O-CA 3.48Å; L61-V67 HydrophobicContact CD2-CG2 4.16Å; V64-V67 HydrophobicContact CG1-CG2 3.5Å
68	D	93.4	Very high	90.4	Very high	70 Å²	70	83.3 Å²	83.3	37%	0.374	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.2	175.2	-65.8	-56.6	0	0	0	109.8	V16 S17 K66	V16-D68 CarbonylContact C-O 3.57Å; V16-D68 VanDerWaalsContact CA-O 3.27Å; V16-D68 WeakPolarHBondContact CA-O 3.46Å; S17-D68 PolarHBondContact N-O 3.13Å; S17-D68 PolarHBondContact O-N 3.07Å; K66-D68 WeakPolarHBondContact CE-OD1 3.45Å; K66-D68 VanDerWaalsContact CE-OD2 3.27Å; K66-D68 WeakPolarHBondContact CE-OD2 3.37Å; K66-D68 IonicContact NZ-OD1 3.86Å; K66-D68 PolarHBondContact NZ-OD1 3.46Å; K66-D68 IonicContact NZ-OD2 2.64Å; K66-D68 PolarHBondContact NZ-OD2 3.31Å
69	I	92.5	Very high	89.8	Confident	90 Å²	90	83.9 Å²	83.9	46%	0.462	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	116.5	171	-58.5	171.9	0	0	0	107.7	V16 D72	V16-I69 HydrophobicContact CG1-CG1 4.21Å; I69-D72 HydrophobicContact CG2-CB 4.06Å
70	I	93.8	Very high	89.1	Confident	89 Å²	89	91.5 Å²	91.5	46%	0.456	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-44.1	-178.2	-53	174.6	0	0	0	110	H15 Q27	H15-I70 HydrophobicContact CB-CB 4.46Å; H15-I70 PolarHBondContact O-N 3.08Å; Q27-I70 HydrophobicContact CG-CD1 3.57Å
71	H	91.6	Very high	88.7	Confident	112 Å²	112	93.3 Å²	93.3	52%	0.519	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	119.2	176.9	175.8	71.4	0	0	0	108.4	S14 H15	S14-H71 CarbonylContact C-O 3.48Å; S14-H71 VanDerWaalsContact CA-O 3.29Å; S14-H71 WeakPolarHBondContact CA-O 3.49Å; S14-H71 WeakPolarHBondContact CB-O 3.49Å; H15-H71 HydrophobicContact CB-CB 4.17Å; H15-H71 PolarHBondContact N-O 3.33Å; H15-H71 PolarHBondContact O-N 3.5Å; H15-H71 VanDerWaalsContact O-N 3.15Å
72	D	88.8	Confident	88.5	Confident	79 Å²	79	97.5 Å²	97.5	42%	0.422	56%	0.556	S	S	.	*			trans	-87.1	130.1	175.2	-155.9	5.6	0	0	0	110.1	S14 I69 T74	S14-D72 PolarHBondContact OG-OD1 3.45Å; I69-D72 HydrophobicContact CG2-CB 4.06Å; D72-T74 PolarHBondContact O-N 3.14Å
73	R	84.9	Confident	88.3	Confident	64 Å²	64	100.4 Å²	100.4	24%	0.242	56%	0.56	C	S	.	*			trans	-81.3	119.5	177.2	-176.5	177.1	-176.9	154.6	14.1	109.2	V12 S14 E75	V12-R73 WeakPolarHBondContact O-CD 3.31Å; S14-R73 PolarHBondContact OG-N 2.97Å; R73-E75 WeakPolarHBondContact CG-O 3.44Å; R73-E75 PolarHBondContact NE-O 3.35Å; R73-E75 VanDerWaalsContact NE-O 3.09Å
74	T	81.6	Confident	88.3	Confident	135 Å²	135	97.3 Å²	97.3	83%	0.828	55%	0.554	S	S	*	*			trans	-94.1	-15.4	178.8	54.5	0	0	0	0	113.3	D72	D72-T74 PolarHBondContact O-N 3.14Å
75	E	83.6	Confident	88.3	Confident	141 Å²	141	101.3 Å²	101.3	66%	0.659	58%	0.578	S	S	*	*	S	Bend	trans	-95	145.6	-178.8	-63.9	-178.5	-179.6	0	0	112.1	R73 P77	R73-E75 WeakPolarHBondContact CG-O 3.44Å; R73-E75 PolarHBondContact NE-O 3.35Å; R73-E75 VanDerWaalsContact NE-O 3.09Å; E75-P77 WeakPolarHBondContact O-CD 3.39Å
76	T	80.3	Confident	88.3	Confident	133 Å²	133	99.5 Å²	99.5	82%	0.816	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-62.5	128.7	174.3	-52.4	0	0	0	0	110
77	P	77.6	Confident	88.4	Confident	50 Å²	50	101.6 Å²	101.6	33%	0.325	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-55.8	148.4	174.4	-26.4	35.2	0	0	0	112.3	V12 E75	V12-P77 HydrophobicContact CB-CG 4.23Å; V12-P77 HydrophobicContact CG1-CB 4.49Å; V12-P77 HydrophobicContact CG1-CG 4.09Å; E75-P77 WeakPolarHBondContact O-CD 3.39Å
78	P	80.9	Confident	88.5	Confident	92 Å²	92	102.2 Å²	102.2	60%	0.597	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-57.4	146.3	174.4	25.4	-33.9	0	0	0	110.1	L80	P78-L80 PolarHBondContact O-N 3.15Å
79	P	83.8	Confident	88.7	Confident	125 Å²	125	101.2 Å²	101.2	81%	0.812	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-59.2	143.3	177.2	25.9	-33.8	0	0	0	109.9
80	L	82.6	Confident	88.8	Confident	170 Å²	170	100.8 Å²	100.8	89%	0.89	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-60.6	141.9	176.2	-63.6	176.4	0	0	0	110.1	P78 S82	P78-L80 PolarHBondContact O-N 3.15Å; L80-S82 PolarHBondContact O-N 3.5Å
81	A	85.6	Confident	88.9	Confident	92 Å²	92	104.1 Å²	104.1	76%	0.76	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-59.8	135	173.3	0	0	0	0	0	109.9	L83	A81-L83 PolarHBondContact O-N 3.05Å
82	S	89.2	Confident	89.2	Confident	121 Å²	121	101.7 Å²	101.7	85%	0.846	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-66.7	132	176.3	57.9	0	0	0	0	110.3	L80	L80-S82 PolarHBondContact O-N 3.5Å
83	L	90.7	Very high	89.5	Confident	137 Å²	137	103.7 Å²	103.7	72%	0.717	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-83.6	135.2	176.3	-67.2	175.7	0	0	0	109.8	A81 V85 L88	A81-L83 PolarHBondContact O-N 3.05Å; L83-V85 PolarHBondContact O-N 3.47Å; L83-V85 VanDerWaalsContact O-N 3.13Å; L83-L88 HydrophobicContact CB-CD1 4.14Å; L83-L88 HydrophobicContact CD1-CD1 4.38Å
84	N	94.4	Very high	90	Very high	89 Å²	89	103.5 Å²	103.5	48%	0.476	60%	0.596	S	S	.	*			trans	-82.5	91.2	169.9	-171.4	-45	0	0	0	109.6	G86 K87 L88	N84-G86 PolarHBondContact O-N 3.42Å; N84-G86 PolarHBondContact OD1-N 2.95Å; N84-K87 HydrophobicContact CB-CB 4.11Å; N84-K87 HydrophobicContact CB-CD 4.09Å; N84-K87 HydrophobicContact CB-CG 4.17Å; N84-K87 PolarHBondContact O-N 3.13Å; N84-K87 VanDerWaalsContact O-N 3.16Å; N84-K87 PolarHBondContact OD1-N 2.93Å; N84-L88 WeakPolarHBondContact O-CG 3.41Å; N84-L88 PolarHBondContact O-N 3.31Å; N84-L88 VanDerWaalsContact O-N 3.07Å
85	V	95.7	Very high	90.6	Very high	107 Å²	107	102 Å²	102	65%	0.648	58%	0.58	S	S	*	*	H	α-helix	trans	-59.4	-34.6	-177	-172.5	0	0	0	0	112	L83 L88 A89	L83-V85 PolarHBondContact O-N 3.47Å; L83-V85 VanDerWaalsContact O-N 3.13Å; V85-L88 PolarHBondContact O-N 3.36Å; V85-A89 WeakPolarHBondContact O-CB 3.32Å; V85-A89 PolarHBondContact O-N 3.49Å
86	G	96.8	Very high	91.3	Very high	40 Å²	40	102.1 Å²	102.1	41%	0.412	58%	0.578	S	S	.	*	H	α-helix	trans	-63.3	-45.2	175.8	0	0	0	0	0	112.9	N84 L88 A89 N90	N84-G86 PolarHBondContact O-N 3.42Å; N84-G86 PolarHBondContact OD1-N 2.95Å; G86-L88 VanDerWaalsContact C-N 3.33Å; G86-L88 PolarHBondContact O-N 2.88Å; G86-A89 PolarHBondContact O-N 3.38Å; G86-N90 WeakPolarHBondContact O-CB 3.49Å; G86-N90 VanDerWaalsContact O-CG 3.29Å; G86-N90 PolarHBondContact O-N 2.9Å; G86-N90 PolarHBondContact O-ND2 3.36Å
87	K	95.6	Very high	92	Very high	150 Å²	150	100.8 Å²	100.8	65%	0.652	56%	0.563	S	S	*	*	H	α-helix	trans	-62.6	-40.5	174.1	-73.9	-176.9	-178.9	-176.5	0	111.6	N84 N90 R91	N84-K87 HydrophobicContact CB-CB 4.11Å; N84-K87 HydrophobicContact CB-CD 4.09Å; N84-K87 HydrophobicContact CB-CG 4.17Å; N84-K87 PolarHBondContact O-N 3.13Å; N84-K87 VanDerWaalsContact O-N 3.16Å; N84-K87 PolarHBondContact OD1-N 2.93Å; K87-N90 PolarHBondContact O-N 2.95Å; K87-R91 WeakPolarHBondContact O-CB 3.4Å; K87-R91 PolarHBondContact O-N 3.13Å
88	L	95.6	Very high	92.7	Very high	61 Å²	61	100.8 Å²	100.8	32%	0.319	56%	0.56	S	S	.	*	H	α-helix	trans	-64.2	-45.6	177.4	-67.6	174.1	0	0	0	111.9	L83 N84 V85 G86 N90 R91 A92	L83-L88 HydrophobicContact CB-CD1 4.14Å; L83-L88 HydrophobicContact CD1-CD1 4.38Å; N84-L88 WeakPolarHBondContact O-CG 3.41Å; N84-L88 PolarHBondContact O-N 3.31Å; N84-L88 VanDerWaalsContact O-N 3.07Å; V85-L88 PolarHBondContact O-N 3.36Å; G86-L88 VanDerWaalsContact C-N 3.33Å; G86-L88 PolarHBondContact O-N 2.88Å; L88-N90 PolarHBondContact O-N 3.37Å; L88-R91 VanDerWaalsContact CD2-NH2 3.34Å; L88-R91 PolarHBondContact O-N 3.5Å; L88-A92 WeakPolarHBondContact O-CB 3.39Å; L88-A92 PolarHBondContact O-N 2.97Å
89	A	96.8	Very high	93.5	Very high	48 Å²	48	102.4 Å²	102.4	40%	0.397	56%	0.558	S	S	.	*	H	α-helix	trans	-63.1	-41.2	177.4	0	0	0	0	0	112	V85 G86 A92 R93	V85-A89 WeakPolarHBondContact O-CB 3.32Å; V85-A89 PolarHBondContact O-N 3.49Å; G86-A89 PolarHBondContact O-N 3.38Å; A89-A92 PolarHBondContact O-N 3.5Å; A89-R93 WeakPolarHBondContact O-CB 3.3Å; A89-R93 PolarHBondContact O-N 3.49Å
90	N	96.1	Very high	94.1	Very high	82 Å²	82	101.5 Å²	101.5	44%	0.439	55%	0.545	S	S	.	.	H	α-helix	trans	-63	-45.9	175.1	-72.9	-15.3	0	0	0	111.6	G86 K87 L88 A92 R93 T94	G86-N90 WeakPolarHBondContact O-CB 3.49Å; G86-N90 VanDerWaalsContact O-CG 3.29Å; G86-N90 PolarHBondContact O-N 2.9Å; G86-N90 PolarHBondContact O-ND2 3.36Å; K87-N90 PolarHBondContact O-N 2.95Å; L88-N90 PolarHBondContact O-N 3.37Å; N90-A92 VanDerWaalsContact C-N 3.34Å; N90-A92 PolarHBondContact O-N 3.39Å; N90-R93 PolarHBondContact O-N 2.83Å; N90-R93 PolarHBondContact OD1-NH1 3.44Å; N90-R93 PolarHBondContact OD1-NH2 3.03Å; N90-R93 VanDerWaalsContact OD1-NH2 3.09Å; N90-T94 PolarHBondContact O-N 2.84Å; N90-T94 PolarHBondContact O-OG1 2.88Å; N90-T94 VanDerWaalsContact O-OG1 3.13Å
91	R	95.5	Very high	94.7	Very high	158 Å²	158	94.8 Å²	94.8	60%	0.596	51%	0.513	S	S	*	.	H	α-helix	trans	-58.2	-46.3	175	-173.8	177.1	66.3	-176.4	2.5	111.4	K87 L88 R93 T94 E95	K87-R91 WeakPolarHBondContact O-CB 3.4Å; K87-R91 PolarHBondContact O-N 3.13Å; L88-R91 VanDerWaalsContact CD2-NH2 3.34Å; L88-R91 PolarHBondContact O-N 3.5Å; R91-R93 VanDerWaalsContact C-N 3.32Å; R91-R93 PolarHBondContact O-N 2.83Å; R91-T94 PolarHBondContact O-N 2.9Å; R91-E95 HydrophobicContact CG-CG 4.45Å; R91-E95 VanDerWaalsContact O-CG 3.32Å; R91-E95 WeakPolarHBondContact O-CG 3.47Å; R91-E95 PolarHBondContact O-N 3.1Å
92	A	96.9	Very high	95.2	Very high	62 Å²	62	93.7 Å²	93.7	51%	0.512	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-39.9	178.3	0	0	0	0	0	112.6	L88 A89 N90 K96	L88-A92 WeakPolarHBondContact O-CB 3.39Å; L88-A92 PolarHBondContact O-N 2.97Å; A89-A92 PolarHBondContact O-N 3.5Å; N90-A92 VanDerWaalsContact C-N 3.34Å; N90-A92 PolarHBondContact O-N 3.39Å; A92-K96 WeakPolarHBondContact O-CB 3.34Å; A92-K96 PolarHBondContact O-N 3.22Å; A92-K96 VanDerWaalsContact O-N 3.11Å
93	R	96.4	Very high	95.5	Very high	121 Å²	121	90.8 Å²	90.8	46%	0.457	48%	0.475	S	S	.	.	H	α-helix	trans	-65.4	-48.4	176.8	-165.6	-171.7	-47.7	103.5	7.6	111.6	A89 N90 R91 E95 K96 E97	A89-R93 WeakPolarHBondContact O-CB 3.3Å; A89-R93 PolarHBondContact O-N 3.49Å; N90-R93 PolarHBondContact O-N 2.83Å; N90-R93 PolarHBondContact OD1-NH1 3.44Å; N90-R93 PolarHBondContact OD1-NH2 3.03Å; N90-R93 VanDerWaalsContact OD1-NH2 3.09Å; R91-R93 VanDerWaalsContact C-N 3.32Å; R91-R93 PolarHBondContact O-N 2.83Å; R93-E95 PolarHBondContact O-N 2.78Å; R93-K96 WeakPolarHBondContact O-CB 3.38Å; R93-K96 PolarHBondContact O-N 3.43Å; R93-E97 WeakPolarHBondContact CG-OE1 3.39Å; R93-E97 WeakPolarHBondContact O-CG 3.38Å; R93-E97 PolarHBondContact O-N 3.28Å
94	T	93.9	Very high	95.8	Very high	59 Å²	59	88.8 Å²	88.8	36%	0.362	46%	0.459	S	S	.	.	H	α-helix	trans	-60.2	-46.4	178.4	-59.9	0	0	0	0	111.6	N90 R91 K96 E97 D98	N90-T94 PolarHBondContact O-N 2.84Å; N90-T94 PolarHBondContact O-OG1 2.88Å; N90-T94 VanDerWaalsContact O-OG1 3.13Å; R91-T94 PolarHBondContact O-N 2.9Å; T94-K96 VanDerWaalsContact C-N 3.28Å; T94-K96 PolarHBondContact O-N 3.45Å; T94-E97 PolarHBondContact O-N 3.47Å; T94-D98 WeakPolarHBondContact O-CB 3.29Å; T94-D98 PolarHBondContact O-N 2.86Å
95	E	95.3	Very high	95.9	Very high	105 Å²	105	84.6 Å²	84.6	49%	0.491	44%	0.437	S	S	.	.	H	α-helix	trans	-61.7	-37	177.3	-69.4	-62.6	149	0	0	112.3	R91 R93 K99	R91-E95 HydrophobicContact CG-CG 4.45Å; R91-E95 VanDerWaalsContact O-CG 3.32Å; R91-E95 WeakPolarHBondContact O-CG 3.47Å; R91-E95 PolarHBondContact O-N 3.1Å; R93-E95 PolarHBondContact O-N 2.78Å; E95-K99 WeakPolarHBondContact O-CB 3.42Å; E95-K99 VanDerWaalsContact O-CG 3.29Å; E95-K99 WeakPolarHBondContact O-CG 3.48Å; E95-K99 PolarHBondContact O-N 3.49Å
96	K	97	Very high	96	Very high	143 Å²	143	84.3 Å²	84.3	62%	0.622	43%	0.43	S	S	*	.	H	α-helix	trans	-64.1	-48	174.5	-178.7	-175	176.2	-175.8	0	111.2	A92 R93 T94 K99 L100	A92-K96 WeakPolarHBondContact O-CB 3.34Å; A92-K96 PolarHBondContact O-N 3.22Å; A92-K96 VanDerWaalsContact O-N 3.11Å; R93-K96 WeakPolarHBondContact O-CB 3.38Å; R93-K96 PolarHBondContact O-N 3.43Å; T94-K96 VanDerWaalsContact C-N 3.28Å; T94-K96 PolarHBondContact O-N 3.45Å; K96-K99 PolarHBondContact O-N 3.18Å; K96-L100 HydrophobicContact CG-CD1 4.07Å; K96-L100 WeakPolarHBondContact O-CB 3.43Å; K96-L100 VanDerWaalsContact O-CG 3.29Å; K96-L100 WeakPolarHBondContact O-CG 3.39Å; K96-L100 PolarHBondContact O-N 2.86Å
97	E	95	Very high	95.9	Very high	104 Å²	104	87 Å²	87	49%	0.486	44%	0.442	S	S	.	.	H	α-helix	trans	-61.4	-43.9	178.7	-73.2	167.2	-175.3	0	0	111.3	R93 T94 K99 L100 S101	R93-E97 WeakPolarHBondContact CG-OE1 3.39Å; R93-E97 WeakPolarHBondContact O-CG 3.38Å; R93-E97 PolarHBondContact O-N 3.28Å; T94-E97 PolarHBondContact O-N 3.47Å; E97-K99 PolarHBondContact O-N 2.94Å; E97-L100 PolarHBondContact O-N 3.42Å; E97-S101 WeakPolarHBondContact O-CB 3.5Å; E97-S101 PolarHBondContact O-N 3.19Å
98	D	94	Very high	96	Very high	50 Å²	50	81.2 Å²	81.2	27%	0.267	42%	0.423	S	S	.	.	H	α-helix	trans	-61	-43	177	-75.2	4.3	0	0	0	111.7	T94 S101 Q102 H122	T94-D98 WeakPolarHBondContact O-CB 3.29Å; T94-D98 PolarHBondContact O-N 2.86Å; D98-S101 PolarHBondContact O-N 3.4Å; D98-Q102 PolarHBondContact O-N 2.98Å; D98-H122 IonicContact OD1-CE1 3.53Å; D98-H122 PolarHBondContact OD1-CE1 3.38Å; D98-H122 IonicContact OD1-ND1 2.72Å; D98-H122 IonicContact OD1-NE2 2.91Å; D98-H122 IonicContact OD2-CE1 2.95Å; D98-H122 IonicContact OD2-ND1 3.77Å
99	K	95.9	Very high	96	Very high	127 Å²	127	80.7 Å²	80.7	55%	0.552	43%	0.432	S	S	*	.	H	α-helix	trans	-68.4	-39.3	177	-73.9	-69.8	173.2	-167.9	0	112.9	E95 K96 E97 Q102 A103	E95-K99 WeakPolarHBondContact O-CB 3.42Å; E95-K99 VanDerWaalsContact O-CG 3.29Å; E95-K99 WeakPolarHBondContact O-CG 3.48Å; E95-K99 PolarHBondContact O-N 3.49Å; K96-K99 PolarHBondContact O-N 3.18Å; E97-K99 PolarHBondContact O-N 2.94Å; K99-Q102 PolarHBondContact O-N 3.21Å; K99-A103 WeakPolarHBondContact O-CB 2.98Å; K99-A103 PolarHBondContact O-N 3.36Å
100	L	96.6	Very high	96.1	Very high	105 Å²	105	78.7 Å²	78.7	55%	0.55	42%	0.415	S	S	.	.	H	α-helix	trans	-64	-42.3	174.5	-73.3	172	0	0	0	111.2	K96 E97 A103 Y104	K96-L100 HydrophobicContact CG-CD1 4.07Å; K96-L100 WeakPolarHBondContact O-CB 3.43Å; K96-L100 VanDerWaalsContact O-CG 3.29Å; K96-L100 WeakPolarHBondContact O-CG 3.39Å; K96-L100 PolarHBondContact O-N 2.86Å; E97-L100 PolarHBondContact O-N 3.42Å; L100-A103 PolarHBondContact O-N 3.46Å; L100-Y104 WeakPolarHBondContact O-CB 3.45Å; L100-Y104 PolarHBondContact O-N 2.92Å
101	S	95.3	Very high	96.1	Very high	30 Å²	30	77 Å²	77	21%	0.21	41%	0.41	C	S	.	.	H	α-helix	trans	-60.4	-43.6	174.3	-179.5	0	0	0	0	111.9	E97 D98 Y104 A105 W130	E97-S101 WeakPolarHBondContact O-CB 3.5Å; E97-S101 PolarHBondContact O-N 3.19Å; D98-S101 PolarHBondContact O-N 3.4Å; S101-Y104 WeakPolarHBondContact O-CB 3.29Å; S101-Y104 PolarHBondContact O-N 3.47Å; S101-A105 PolarHBondContact O-N 3.44Å; S101-A105 VanDerWaalsContact O-N 3.1Å; S101-W130 PolarHBondContact OG-NE1 3.49Å
102	Q	95.9	Very high	96.1	Very high	69 Å²	69	73.6 Å²	73.6	32%	0.322	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-45.2	175.2	-173.4	174	26.7	0	0	112.1	D98 K99 Y104 A105 I106	D98-Q102 PolarHBondContact O-N 2.98Å; K99-Q102 PolarHBondContact O-N 3.21Å; Q102-Y104 VanDerWaalsContact C-N 3.34Å; Q102-Y104 PolarHBondContact O-N 2.93Å; Q102-A105 PolarHBondContact O-N 2.87Å; Q102-I106 HydrophobicContact CG-CD1 4.33Å; Q102-I106 WeakPolarHBondContact O-CG1 3.41Å; Q102-I106 PolarHBondContact O-N 2.75Å
103	A	97.1	Very high	96.1	Very high	59 Å²	59	75.2 Å²	75.2	49%	0.488	40%	0.403	S	S	.	.	H	α-helix	trans	-63.3	-40.2	177.7	0	0	0	0	0	112	K99 L100 I106 S107	K99-A103 WeakPolarHBondContact O-CB 2.98Å; K99-A103 PolarHBondContact O-N 3.36Å; L100-A103 PolarHBondContact O-N 3.46Å; A103-I106 PolarHBondContact O-N 3.37Å; A103-S107 PolarHBondContact O-N 3Å; A103-S107 PolarHBondContact O-OG 3.1Å
104	Y	97.1	Very high	96.1	Very high	96 Å²	96	69.5 Å²	69.5	38%	0.376	38%	0.382	S	S	.	.	H	α-helix	trans	-56.6	-52.1	173.9	174.8	-90.4	0	0	0	111.2	L100 S101 Q102 I106 S107 A108 W130 E132	L100-Y104 WeakPolarHBondContact O-CB 3.45Å; L100-Y104 PolarHBondContact O-N 2.92Å; S101-Y104 WeakPolarHBondContact O-CB 3.29Å; S101-Y104 PolarHBondContact O-N 3.47Å; Q102-Y104 VanDerWaalsContact C-N 3.34Å; Q102-Y104 PolarHBondContact O-N 2.93Å; Y104-I106 VanDerWaalsContact C-N 3.28Å; Y104-I106 PolarHBondContact O-N 3.3Å; Y104-S107 PolarHBondContact O-N 3.28Å; Y104-S107 PolarHBondContact O-OG 2.82Å; Y104-A108 HydrophobicContact CE1-CB 4.24Å; Y104-A108 WeakPolarHBondContact O-CB 3.09Å; Y104-A108 PolarHBondContact O-N 2.94Å; Y104-W130 HydrophobicContact CD1-CB 3.58Å; Y104-W130 AromaticContact CD1-CG 3.9Å; Y104-W130 HydrophobicContact CD1-CG 3.9Å; Y104-W130 HydrophobicContact CE1-CB 3.44Å; Y104-W130 VanDerWaalsContact CE1-CB 3.44Å; Y104-W130 HydrophobicContact CE1-CG 4.16Å; Y104-E132 WeakPolarHBondContact CE1-O 3.2Å; Y104-E132 VanDerWaalsContact OH-CA 3.26Å; Y104-E132 WeakPolarHBondContact OH-CA 3.3Å; Y104-E132 PolarHBondContact OH-N 3.35Å; Y104-E132 VanDerWaalsContact OH-N 3.14Å
105	A	96.3	Very high	96.3	Very high	1 Å²	1	68.3 Å²	68.3	1%	0.008	37%	0.372	C	S	.	.	H	α-helix	trans	-58.3	-40.9	-178.5	0	0	0	0	0	112.5	S101 Q102 A108 G109 V110 Q115 W130	S101-A105 PolarHBondContact O-N 3.44Å; S101-A105 VanDerWaalsContact O-N 3.1Å; Q102-A105 PolarHBondContact O-N 2.87Å; A105-A108 PolarHBondContact O-N 3.28Å; A105-G109 PolarHBondContact O-N 2.88Å; A105-V110 HydrophobicContact CB-CB 4.22Å; A105-V110 HydrophobicContact CB-CG2 4.27Å; A105-V110 VanDerWaalsContact O-CB 3.31Å; A105-V110 WeakPolarHBondContact O-CB 3.25Å; A105-V110 WeakPolarHBondContact O-CG2 3.27Å; A105-V110 PolarHBondContact O-N 3.43Å; A105-Q115 HydrophobicContact CB-CG 4.1Å; A105-W130 HydrophobicContact CB-CD2 4.27Å; A105-W130 HydrophobicContact CB-CZ2 3.79Å
106	I	96.2	Very high	96.4	Very high	100 Å²	100	67.1 Å²	67.1	51%	0.513	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-49.8	174.7	-65.2	166.4	0	0	0	110.2	Q102 A103 Y104 A108 G109	Q102-I106 HydrophobicContact CG-CD1 4.33Å; Q102-I106 WeakPolarHBondContact O-CG1 3.41Å; Q102-I106 PolarHBondContact O-N 2.75Å; A103-I106 PolarHBondContact O-N 3.37Å; Y104-I106 VanDerWaalsContact C-N 3.28Å; Y104-I106 PolarHBondContact O-N 3.3Å; I106-A108 VanDerWaalsContact C-N 3.28Å; I106-A108 PolarHBondContact O-N 3.36Å; I106-G109 PolarHBondContact O-N 3.43Å
107	S	96.3	Very high	96.4	Very high	96 Å²	96	60.3 Å²	60.3	67%	0.671	34%	0.337	S	S	*	.	H	α-helix	trans	-63.7	-32.5	-179.3	72.5	0	0	0	0	113.4	A103 Y104 G109	A103-S107 PolarHBondContact O-N 3Å; A103-S107 PolarHBondContact O-OG 3.1Å; Y104-S107 PolarHBondContact O-N 3.28Å; Y104-S107 PolarHBondContact O-OG 2.82Å; S107-G109 PolarHBondContact O-N 3.12Å
108	A	96.6	Very high	96.6	Very high	29 Å²	29	56.1 Å²	56.1	24%	0.24	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-6.6	176.3	0	0	0	0	0	112.8	Y104 A105 I106 V110 K133	Y104-A108 HydrophobicContact CE1-CB 4.24Å; Y104-A108 WeakPolarHBondContact O-CB 3.09Å; Y104-A108 PolarHBondContact O-N 2.94Å; A105-A108 PolarHBondContact O-N 3.28Å; I106-A108 VanDerWaalsContact C-N 3.28Å; I106-A108 PolarHBondContact O-N 3.36Å; A108-V110 HydrophobicContact CB-CG2 4.31Å; A108-K133 WeakPolarHBondContact O-CE 3.46Å
109	G	96.6	Very high	96.7	Very high	50 Å²	50	57.4 Å²	57.4	52%	0.515	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	35.8	-178.4	0	0	0	0	0	113.1	A105 I106 S107	A105-G109 PolarHBondContact O-N 2.88Å; I106-G109 PolarHBondContact O-N 3.43Å; S107-G109 PolarHBondContact O-N 3.12Å
110	V	97.9	Very high	96.8	Very high	7 Å²	7	53.4 Å²	53.4	4%	0.042	31%	0.308	C	S	.	.			trans	-71.9	138	171.8	175.2	0	0	0	0	109.7	A105 A108 Q115 W130 K133 Y147	A105-V110 HydrophobicContact CB-CB 4.22Å; A105-V110 HydrophobicContact CB-CG2 4.27Å; A105-V110 VanDerWaalsContact O-CB 3.31Å; A105-V110 WeakPolarHBondContact O-CB 3.25Å; A105-V110 WeakPolarHBondContact O-CG2 3.27Å; A105-V110 PolarHBondContact O-N 3.43Å; A108-V110 HydrophobicContact CB-CG2 4.31Å; V110-Q115 HydrophobicContact CB-CG 4.32Å; V110-Q115 HydrophobicContact CG1-CG 3.96Å; V110-Q115 PolarHBondContact O-NE2 2.65Å; V110-W130 HydrophobicContact CG1-CH2 3.7Å; V110-W130 HydrophobicContact CG1-CZ2 4.49Å; V110-W130 HydrophobicContact CG1-CZ3 3.91Å; V110-W130 HydrophobicContact CG2-CE3 4.38Å; V110-W130 HydrophobicContact CG2-CZ3 4.11Å; V110-K133 HydrophobicContact CG2-CB 4.28Å; V110-K133 HydrophobicContact CG2-CG 4.17Å; V110-Y147 HydrophobicContact CG1-CE2 4.3Å; V110-Y147 WeakPolarHBondContact CG1-OH 3.34Å
111	S	97.1	Very high	96.8	Very high	47 Å²	47	48.4 Å²	48.4	33%	0.329	28%	0.281	S	S	.	.			trans	-64.4	157.6	179.4	87.1	0	0	0	0	112.1	E113 G114 Q115	S111-E113 WeakPolarHBondContact CB-OE2 3.43Å; S111-E113 PolarHBondContact O-N 2.95Å; S111-E113 PolarHBondContact OG-N 2.88Å; S111-E113 PolarHBondContact OG-OE2 3.06Å; S111-G114 PolarHBondContact O-N 3.03Å; S111-G114 VanDerWaalsContact O-N 3.14Å; S111-G114 PolarHBondContact OG-N 2.83Å; S111-Q115 WeakPolarHBondContact O-CG 3.48Å; S111-Q115 PolarHBondContact O-N 3.24Å
112	V	95.9	Very high	96.8	Very high	85 Å²	85	48.4 Å²	48.4	52%	0.515	28%	0.278	S	S	.	.	H	α-helix	trans	-59.8	-37.6	178.9	176.8	0	0	0	0	110.7	Q115 Q116	V112-Q115 PolarHBondContact O-N 3.26Å; V112-Q116 HydrophobicContact CG1-CG 4.36Å; V112-Q116 WeakPolarHBondContact O-CB 3.35Å; V112-Q116 VanDerWaalsContact O-CG 3.26Å; V112-Q116 WeakPolarHBondContact O-CG 3.45Å; V112-Q116 PolarHBondContact O-N 2.84Å
113	E	95.5	Very high	96.8	Very high	97 Å²	97	52.7 Å²	52.7	45%	0.453	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-45.9	176.3	-56.9	73.1	-157.8	0	0	111.2	S111 Q115 Q116 L117	S111-E113 WeakPolarHBondContact CB-OE2 3.43Å; S111-E113 PolarHBondContact O-N 2.95Å; S111-E113 PolarHBondContact OG-N 2.88Å; S111-E113 PolarHBondContact OG-OE2 3.06Å; E113-Q115 VanDerWaalsContact C-N 3.35Å; E113-Q115 PolarHBondContact O-N 3.42Å; E113-Q116 PolarHBondContact O-N 3.12Å; E113-L117 WeakPolarHBondContact O-CB 3.27Å; E113-L117 PolarHBondContact O-N 3.4Å
114	G	97.4	Very high	96.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-43	175.6	0	0	0	0	0	112.3	S111 Q116 L117 F118 Y147	S111-G114 PolarHBondContact O-N 3.03Å; S111-G114 VanDerWaalsContact O-N 3.14Å; S111-G114 PolarHBondContact OG-N 2.83Å; G114-Q116 PolarHBondContact O-N 2.77Å; G114-L117 PolarHBondContact O-N 3.35Å; G114-F118 PolarHBondContact O-N 2.96Å; G114-Y147 VanDerWaalsContact CA-CD2 3.45Å
115	Q	97.8	Very high	96.5	Very high	34 Å²	34	50.4 Å²	50.4	16%	0.159	29%	0.285	C	S	.	.	H	α-helix	trans	-62	-42.7	176.2	-66.3	174.6	40.3	0	0	111.9	A105 V110 S111 V112 E113 F118 Q119	A105-Q115 HydrophobicContact CB-CG 4.1Å; V110-Q115 HydrophobicContact CB-CG 4.32Å; V110-Q115 HydrophobicContact CG1-CG 3.96Å; V110-Q115 PolarHBondContact O-NE2 2.65Å; S111-Q115 WeakPolarHBondContact O-CG 3.48Å; S111-Q115 PolarHBondContact O-N 3.24Å; V112-Q115 PolarHBondContact O-N 3.26Å; E113-Q115 VanDerWaalsContact C-N 3.35Å; E113-Q115 PolarHBondContact O-N 3.42Å; Q115-F118 PolarHBondContact O-N 3.09Å; Q115-Q119 WeakPolarHBondContact O-CG 3.35Å; Q115-Q119 PolarHBondContact O-N 3.38Å; Q115-Q119 VanDerWaalsContact O-N 3.13Å
116	Q	97	Very high	96.3	Very high	81 Å²	81	56.8 Å²	56.8	38%	0.379	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-43.3	177.3	-73.4	174.9	-3.2	0	0	111.7	V112 E113 G114 F118 Q119 T120	V112-Q116 HydrophobicContact CG1-CG 4.36Å; V112-Q116 WeakPolarHBondContact O-CB 3.35Å; V112-Q116 VanDerWaalsContact O-CG 3.26Å; V112-Q116 WeakPolarHBondContact O-CG 3.45Å; V112-Q116 PolarHBondContact O-N 2.84Å; E113-Q116 PolarHBondContact O-N 3.12Å; G114-Q116 PolarHBondContact O-N 2.77Å; Q116-F118 PolarHBondContact O-N 3.33Å; Q116-Q119 PolarHBondContact O-N 2.95Å; Q116-T120 PolarHBondContact O-N 2.91Å; Q116-T120 PolarHBondContact O-OG1 3.1Å
117	L	98.1	Very high	96.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.3	-45.7	176.8	178.6	64.2	0	0	0	111.2	E113 G114 Q119 T120 I121 I135 I143 V167 H170	E113-L117 WeakPolarHBondContact O-CB 3.27Å; E113-L117 PolarHBondContact O-N 3.4Å; G114-L117 PolarHBondContact O-N 3.35Å; L117-Q119 VanDerWaalsContact C-N 3.29Å; L117-Q119 PolarHBondContact O-N 3.41Å; L117-T120 WeakPolarHBondContact O-CB 3.33Å; L117-T120 PolarHBondContact O-N 3.48Å; L117-T120 VanDerWaalsContact O-N 3.1Å; L117-I121 HydrophobicContact CD1-CD1 4.12Å; L117-I121 HydrophobicContact CD1-CG1 4.31Å; L117-I121 HydrophobicContact CD2-CD1 4.4Å; L117-I121 HydrophobicContact CG-CD1 3.87Å; L117-I121 HydrophobicContact CG-CG1 4.45Å; L117-I121 WeakPolarHBondContact O-CG1 3.42Å; L117-I121 PolarHBondContact O-N 3.49Å; L117-I135 HydrophobicContact CB-CD1 4.46Å; L117-I135 HydrophobicContact CD2-CD1 4.12Å; L117-I135 HydrophobicContact CG-CD1 4.23Å; L117-I143 HydrophobicContact CD2-CD1 4.48Å; L117-I143 HydrophobicContact CD2-CG2 4.3Å; L117-V167 HydrophobicContact CD1-CB 4.34Å; L117-V167 HydrophobicContact CD1-CG1 4.32Å; L117-V167 HydrophobicContact CD1-CG2 4.03Å; L117-V167 HydrophobicContact CD2-CG1 4.26Å; L117-V167 HydrophobicContact CD2-CG2 4.18Å; L117-H170 HydrophobicContact CD1-CB 3.77Å
118	F	98	Very high	96.2	Very high	15 Å²	15	54 Å²	54	7%	0.066	29%	0.289	C	S	.	.	H	α-helix	trans	-56	-44.7	175.5	-179.3	-89.5	0	0	0	111.5	G114 Q115 Q116 T120 I121 H122 C128 W130 I135	G114-F118 PolarHBondContact O-N 2.96Å; Q115-F118 PolarHBondContact O-N 3.09Å; Q116-F118 PolarHBondContact O-N 3.33Å; F118-T120 VanDerWaalsContact C-N 3.33Å; F118-T120 PolarHBondContact O-N 2.98Å; F118-I121 PolarHBondContact O-N 3.05Å; F118-H122 HydrophobicContact CD1-CB 4.4Å; F118-H122 HydrophobicContact CE1-CB 4.12Å; F118-H122 VanDerWaalsContact O-CB 3.25Å; F118-H122 WeakPolarHBondContact O-CB 3.32Å; F118-H122 PolarHBondContact O-N 2.8Å; F118-C128 HydrophobicContact CE2-CB 4.31Å; F118-W130 HydrophobicContact CB-CH2 3.6Å; F118-W130 HydrophobicContact CB-CZ2 3.21Å; F118-W130 AromaticContact CD1-CZ2 3.98Å; F118-W130 HydrophobicContact CD1-CZ2 3.98Å; F118-W130 AromaticContact CD1-NE1 3.75Å; F118-W130 HydrophobicContact CD2-CD2 4.04Å; F118-W130 AromaticContact CD2-CE2 3.53Å; F118-W130 HydrophobicContact CD2-CH2 4.18Å; F118-W130 AromaticContact CD2-CZ2 3.64Å; F118-W130 HydrophobicContact CD2-CZ2 3.64Å; F118-W130 AromaticContact CD2-NE1 3.77Å; F118-W130 AromaticContact CE1-NE1 3.8Å; F118-W130 HydrophobicContact CE2-CD2 4.31Å; F118-W130 AromaticContact CE2-CE2 4Å; F118-W130 HydrophobicContact CE2-CG 4.38Å; F118-W130 AromaticContact CE2-NE1 3.82Å; F118-W130 HydrophobicContact CG-CD2 4.49Å; F118-W130 AromaticContact CG-CE2 3.56Å; F118-W130 HydrophobicContact CG-CH2 4.06Å; F118-W130 AromaticContact CG-CZ2 3.32Å; F118-W130 HydrophobicContact CG-CZ2 3.32Å; F118-W130 AromaticContact CG-NE1 3.75Å; F118-W130 AromaticContact CZ-NE1 3.85Å; F118-I135 HydrophobicContact CB-CD1 3.94Å; F118-I135 HydrophobicContact CB-CG1 4.33Å; F118-I135 HydrophobicContact CD2-CB 4.44Å; F118-I135 HydrophobicContact CD2-CD1 4.46Å; F118-I135 HydrophobicContact CD2-CG1 4.07Å; F118-I135 HydrophobicContact CD2-CG2 3.76Å; F118-I135 HydrophobicContact CE2-CG2 4.3Å
119	Q	96.6	Very high	96.2	Very high	78 Å²	78	57.4 Å²	57.4	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-62.2	-39.2	177	-70	174.4	19.6	0	0	112.4	Q115 Q116 L117 K123	Q115-Q119 WeakPolarHBondContact O-CG 3.35Å; Q115-Q119 PolarHBondContact O-N 3.38Å; Q115-Q119 VanDerWaalsContact O-N 3.13Å; Q116-Q119 PolarHBondContact O-N 2.95Å; L117-Q119 VanDerWaalsContact C-N 3.29Å; L117-Q119 PolarHBondContact O-N 3.41Å; Q119-K123 VanDerWaalsContact O-CG 3.27Å; Q119-K123 WeakPolarHBondContact O-CG 3.42Å; Q119-K123 PolarHBondContact O-N 3.07Å
120	T	97.1	Very high	96.3	Very high	42 Å²	42	56.4 Å²	56.4	26%	0.258	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-43.9	175.2	-68.1	0	0	0	0	111.7	Q116 L117 F118 K123 T124 I166 H170	Q116-T120 PolarHBondContact O-N 2.91Å; Q116-T120 PolarHBondContact O-OG1 3.1Å; L117-T120 WeakPolarHBondContact O-CB 3.33Å; L117-T120 PolarHBondContact O-N 3.48Å; L117-T120 VanDerWaalsContact O-N 3.1Å; F118-T120 VanDerWaalsContact C-N 3.33Å; F118-T120 PolarHBondContact O-N 2.98Å; T120-K123 PolarHBondContact O-N 2.97Å; T120-T124 PolarHBondContact O-N 3.19Å; T120-T124 PolarHBondContact O-OG1 3.4Å; T120-T124 VanDerWaalsContact O-OG1 3.1Å; T120-I166 HydrophobicContact CG2-CG2 4.17Å; T120-H170 HydrophobicContact CG2-CB 4.1Å; T120-H170 PolarHBondContact OG1-ND1 3.14Å
121	I	97.2	Very high	96.2	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-50.1	175.6	-65.2	167.9	0	0	0	109.7	L117 F118 K123 T124 I125 C128 I135 V137 I143 I166	L117-I121 HydrophobicContact CD1-CD1 4.12Å; L117-I121 HydrophobicContact CD1-CG1 4.31Å; L117-I121 HydrophobicContact CD2-CD1 4.4Å; L117-I121 HydrophobicContact CG-CD1 3.87Å; L117-I121 HydrophobicContact CG-CG1 4.45Å; L117-I121 WeakPolarHBondContact O-CG1 3.42Å; L117-I121 PolarHBondContact O-N 3.49Å; F118-I121 PolarHBondContact O-N 3.05Å; I121-K123 PolarHBondContact O-N 3.24Å; I121-T124 CarbonylContact O-C 3.47Å; I121-T124 WeakPolarHBondContact O-CA 3.43Å; I121-T124 PolarHBondContact O-N 3.41Å; I121-I125 HydrophobicContact CG2-CB 4.45Å; I121-I125 PolarHBondContact O-N 3.44Å; I121-C128 HydrophobicContact CG2-CB 4.14Å; I121-I135 HydrophobicContact CD1-CD1 4.36Å; I121-I135 HydrophobicContact CD1-CG2 4.22Å; I121-V137 HydrophobicContact CD1-CG2 4.44Å; I121-V137 HydrophobicContact CG2-CG1 4.19Å; I121-V137 HydrophobicContact CG2-CG2 3.88Å; I121-I143 HydrophobicContact CD1-CD1 3.39Å; I121-I166 HydrophobicContact CG1-CG2 3.91Å
122	H	96	Very high	96.1	Very high	30 Å²	30	65.7 Å²	65.7	14%	0.139	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-25.8	-178	-172.2	-111.4	0	0	0	114.2	D98 F118 T124 I125 K126	D98-H122 IonicContact OD1-CE1 3.53Å; D98-H122 PolarHBondContact OD1-CE1 3.38Å; D98-H122 IonicContact OD1-ND1 2.72Å; D98-H122 IonicContact OD1-NE2 2.91Å; D98-H122 IonicContact OD2-CE1 2.95Å; D98-H122 IonicContact OD2-ND1 3.77Å; F118-H122 HydrophobicContact CD1-CB 4.4Å; F118-H122 HydrophobicContact CE1-CB 4.12Å; F118-H122 VanDerWaalsContact O-CB 3.25Å; F118-H122 WeakPolarHBondContact O-CB 3.32Å; F118-H122 PolarHBondContact O-N 2.8Å; H122-T124 VanDerWaalsContact C-N 3.34Å; H122-I125 WeakPolarHBondContact CA-O 3.37Å; H122-K126 WeakPolarHBondContact O-CE 3.44Å; H122-K126 PolarHBondContact O-NZ 3.11Å
123	K	94.4	Very high	96.2	Very high	159 Å²	159	66.3 Å²	66.3	69%	0.691	31%	0.312	S	S	*	.	H	α-helix	trans	-70.9	-30.1	170.9	-77	171.4	-176.6	175.5	0	112.7	Q119 T120 I121	Q119-K123 VanDerWaalsContact O-CG 3.27Å; Q119-K123 WeakPolarHBondContact O-CG 3.42Å; Q119-K123 PolarHBondContact O-N 3.07Å; T120-K123 PolarHBondContact O-N 2.97Å; I121-K123 PolarHBondContact O-N 3.24Å
124	T	94.4	Very high	96.3	Very high	89 Å²	89	63.5 Å²	63.5	55%	0.546	30%	0.3	S	S	.	.	H	α-helix	trans	-96.6	-40.6	-176	-46.8	0	0	0	0	111.8	T120 I121 H122 I166	T120-T124 PolarHBondContact O-N 3.19Å; T120-T124 PolarHBondContact O-OG1 3.4Å; T120-T124 VanDerWaalsContact O-OG1 3.1Å; I121-T124 CarbonylContact O-C 3.47Å; I121-T124 WeakPolarHBondContact O-CA 3.43Å; I121-T124 PolarHBondContact O-N 3.41Å; H122-T124 VanDerWaalsContact C-N 3.34Å; T124-I166 HydrophobicContact CG2-CD1 4.03Å
125	I	95.1	Very high	96.3	Very high	19 Å²	19	63.5 Å²	63.5	10%	0.097	30%	0.3	C	S	.	.			trans	-130.4	108.5	-175.2	-56.4	174.4	0	0	0	107.5	I121 H122 E127 C128 V137 M138 I166	I121-I125 HydrophobicContact CG2-CB 4.45Å; I121-I125 PolarHBondContact O-N 3.44Å; H122-I125 WeakPolarHBondContact CA-O 3.37Å; I125-E127 VanDerWaalsContact C-N 3.28Å; I125-E127 PolarHBondContact O-N 3.33Å; I125-C128 PolarHBondContact O-SG 2.93Å; I125-C128 VanDerWaalsContact O-SG 3.4Å; I125-V137 HydrophobicContact CB-CG1 4.45Å; I125-V137 HydrophobicContact CD1-CG1 3.88Å; I125-V137 HydrophobicContact CG2-CG1 3.95Å; I125-M138 HydrophobicContact CD1-CE 4.41Å; I125-M138 HydrophobicContact CG2-CG 3.91Å; I125-M138 HydrophobicContact CG2-SD 4.22Å; I125-I166 HydrophobicContact CD1-CD1 3.63Å; I125-I166 HydrophobicContact CG1-CD1 4.22Å
126	K	91.6	Very high	96.4	Very high	135 Å²	135	62.3 Å²	62.3	59%	0.587	30%	0.295	S	S	*	.	S	Bend	trans	-70.1	-27.2	-178.4	-66.8	-67.4	168.9	-160	0	113.2	H122 C128	H122-K126 WeakPolarHBondContact O-CE 3.44Å; H122-K126 PolarHBondContact O-NZ 3.11Å; K126-C128 VanDerWaalsContact C-N 3.29Å; K126-C128 PolarHBondContact O-N 3.2Å
127	E	94.7	Very high	96.4	Very high	121 Å²	121	58.5 Å²	58.5	57%	0.565	28%	0.277	S	S	*	.			trans	-82.7	74.6	176	-166.1	175.2	-166.1	0	0	110.7	I125 M138	I125-E127 VanDerWaalsContact C-N 3.28Å; I125-E127 PolarHBondContact O-N 3.33Å; E127-M138 HydrophobicContact CB-CG 4.35Å; E127-M138 PolarHBondContact O-N 3.2Å
128	C	95.9	Very high	96.2	Very high	17 Å²	17	61 Å²	61	12%	0.115	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	149	166.7	60.9	0	0	0	0	111.1	F118 I121 I125 K126 I136 V137	F118-C128 HydrophobicContact CE2-CB 4.31Å; I121-C128 HydrophobicContact CG2-CB 4.14Å; I125-C128 PolarHBondContact O-SG 2.93Å; I125-C128 VanDerWaalsContact O-SG 3.4Å; K126-C128 VanDerWaalsContact C-N 3.29Å; K126-C128 PolarHBondContact O-N 3.2Å; C128-I136 CarbonylContact C-O 3.56Å; C128-I136 WeakPolarHBondContact CA-O 3.43Å; C128-I136 VanDerWaalsContact CB-O 3.3Å; C128-I136 WeakPolarHBondContact CB-O 3.47Å; C128-V137 HydrophobicContact CB-CB 4.49Å; C128-V137 HydrophobicContact CB-CG1 4.47Å; C128-V137 HydrophobicContact CB-CG2 4.2Å
129	K	96.1	Very high	96	Very high	100 Å²	100	65.1 Å²	65.1	44%	0.435	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	160.2	-175.8	63.5	-169.3	176.3	-155.5	0	111.2	I136 D139	K129-I136 HydrophobicContact CG-CB 3.99Å; K129-I136 PolarHBondContact N-O 3.18Å; K129-I136 PolarHBondContact O-N 2.95Å; K129-D139 WeakPolarHBondContact CE-OD1 3.45Å; K129-D139 IonicContact NZ-OD1 3.88Å; K129-D139 PolarHBondContact NZ-OD1 2.86Å; K129-D139 IonicContact NZ-OD2 2.65Å; K129-D139 PolarHBondContact NZ-OD2 3.19Å
130	W	97.5	Very high	96	Very high	28 Å²	28	65.7 Å²	65.7	11%	0.106	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	139.3	169.3	-65.3	107	0	0	0	110.8	S101 Y104 A105 V110 F118 N134 I135 Y147	S101-W130 PolarHBondContact OG-NE1 3.49Å; Y104-W130 HydrophobicContact CD1-CB 3.58Å; Y104-W130 AromaticContact CD1-CG 3.9Å; Y104-W130 HydrophobicContact CD1-CG 3.9Å; Y104-W130 HydrophobicContact CE1-CB 3.44Å; Y104-W130 VanDerWaalsContact CE1-CB 3.44Å; Y104-W130 HydrophobicContact CE1-CG 4.16Å; A105-W130 HydrophobicContact CB-CD2 4.27Å; A105-W130 HydrophobicContact CB-CZ2 3.79Å; V110-W130 HydrophobicContact CG1-CH2 3.7Å; V110-W130 HydrophobicContact CG1-CZ2 4.49Å; V110-W130 HydrophobicContact CG1-CZ3 3.91Å; V110-W130 HydrophobicContact CG2-CE3 4.38Å; V110-W130 HydrophobicContact CG2-CZ3 4.11Å; F118-W130 HydrophobicContact CB-CH2 3.6Å; F118-W130 HydrophobicContact CB-CZ2 3.21Å; F118-W130 AromaticContact CD1-CZ2 3.98Å; F118-W130 HydrophobicContact CD1-CZ2 3.98Å; F118-W130 AromaticContact CD1-NE1 3.75Å; F118-W130 HydrophobicContact CD2-CD2 4.04Å; F118-W130 AromaticContact CD2-CE2 3.53Å; F118-W130 HydrophobicContact CD2-CH2 4.18Å; F118-W130 AromaticContact CD2-CZ2 3.64Å; F118-W130 HydrophobicContact CD2-CZ2 3.64Å; F118-W130 AromaticContact CD2-NE1 3.77Å; F118-W130 AromaticContact CE1-NE1 3.8Å; F118-W130 HydrophobicContact CE2-CD2 4.31Å; F118-W130 AromaticContact CE2-CE2 4Å; F118-W130 HydrophobicContact CE2-CG 4.38Å; F118-W130 AromaticContact CE2-NE1 3.82Å; F118-W130 HydrophobicContact CG-CD2 4.49Å; F118-W130 AromaticContact CG-CE2 3.56Å; F118-W130 HydrophobicContact CG-CH2 4.06Å; F118-W130 AromaticContact CG-CZ2 3.32Å; F118-W130 HydrophobicContact CG-CZ2 3.32Å; F118-W130 AromaticContact CG-NE1 3.75Å; F118-W130 AromaticContact CZ-NE1 3.85Å; W130-N134 WeakPolarHBondContact CA-O 3.44Å; W130-I135 HydrophobicContact CE3-CG1 3.98Å; W130-I135 HydrophobicContact CH2-CD1 4.07Å; W130-I135 HydrophobicContact CH2-CG1 3.7Å; W130-I135 HydrophobicContact CZ3-CD1 4.18Å; W130-I135 HydrophobicContact CZ3-CG1 3.36Å; W130-Y147 HydrophobicContact CZ3-CE1 4.47Å
131	Q	96.6	Very high	96	Very high	110 Å²	110	63.7 Å²	63.7	51%	0.514	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	104.6	163.8	-179.1	179.1	61	0	0	107.5	K133 N134 I136	Q131-K133 PolarHBondContact O-N 3.04Å; Q131-K133 VanDerWaalsContact O-N 3.12Å; Q131-N134 PolarHBondContact N-O 2.97Å; Q131-N134 WeakPolarHBondContact O-CA 3.26Å; Q131-N134 WeakPolarHBondContact O-CB 3.41Å; Q131-N134 PolarHBondContact O-N 2.87Å; Q131-I136 HydrophobicContact CB-CD1 3.94Å; Q131-I136 HydrophobicContact CB-CG1 3.54Å
132	E	95.2	Very high	96.1	Very high	139 Å²	139	66.1 Å²	66.1	65%	0.65	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	-114.5	-167.3	-54.5	178.2	171	0	0	110.3	Y104	Y104-E132 WeakPolarHBondContact CE1-O 3.2Å; Y104-E132 VanDerWaalsContact OH-CA 3.26Å; Y104-E132 WeakPolarHBondContact OH-CA 3.3Å; Y104-E132 PolarHBondContact OH-N 3.35Å; Y104-E132 VanDerWaalsContact OH-N 3.14Å
133	K	97.6	Very high	96.2	Very high	99 Å²	99	64.7 Å²	64.7	43%	0.43	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-1.9	174.7	-65.4	-178.3	174	-178.7	0	113.1	A108 V110 Q131 P145 Y147	A108-K133 WeakPolarHBondContact O-CE 3.46Å; V110-K133 HydrophobicContact CG2-CB 4.28Å; V110-K133 HydrophobicContact CG2-CG 4.17Å; Q131-K133 PolarHBondContact O-N 3.04Å; Q131-K133 VanDerWaalsContact O-N 3.12Å; K133-P145 HydrophobicContact CB-CG 4.06Å; K133-Y147 VanDerWaalsContact O-CE1 3.24Å; K133-Y147 WeakPolarHBondContact O-CE1 3.48Å; K133-Y147 VanDerWaalsContact O-CZ 3.31Å; K133-Y147 PolarHBondContact O-OH 3.02Å
134	N	98.1	Very high	96.4	Very high	37 Å²	37	58.4 Å²	58.4	20%	0.198	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	147.5	-176.7	-56.9	-41.5	0	0	0	111.5	W130 Q131 I136 V142 I143 S144	W130-N134 WeakPolarHBondContact CA-O 3.44Å; Q131-N134 PolarHBondContact N-O 2.97Å; Q131-N134 WeakPolarHBondContact O-CA 3.26Å; Q131-N134 WeakPolarHBondContact O-CB 3.41Å; Q131-N134 PolarHBondContact O-N 2.87Å; N134-I136 HydrophobicContact CB-CD1 4.29Å; N134-V142 HydrophobicContact CB-CG1 3.93Å; N134-I143 WeakPolarHBondContact CA-O 3.01Å; N134-S144 WeakPolarHBondContact OD1-CA 3.49Å; N134-S144 WeakPolarHBondContact OD1-CB 3.48Å
135	I	98.3	Very high	96.5	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.2	168.5	-54.6	170.2	0	0	0	107.6	L117 F118 I121 W130 V137 V142 I143 Y147	L117-I135 HydrophobicContact CB-CD1 4.46Å; L117-I135 HydrophobicContact CD2-CD1 4.12Å; L117-I135 HydrophobicContact CG-CD1 4.23Å; F118-I135 HydrophobicContact CB-CD1 3.94Å; F118-I135 HydrophobicContact CB-CG1 4.33Å; F118-I135 HydrophobicContact CD2-CB 4.44Å; F118-I135 HydrophobicContact CD2-CD1 4.46Å; F118-I135 HydrophobicContact CD2-CG1 4.07Å; F118-I135 HydrophobicContact CD2-CG2 3.76Å; F118-I135 HydrophobicContact CE2-CG2 4.3Å; I121-I135 HydrophobicContact CD1-CD1 4.36Å; I121-I135 HydrophobicContact CD1-CG2 4.22Å; W130-I135 HydrophobicContact CE3-CG1 3.98Å; W130-I135 HydrophobicContact CH2-CD1 4.07Å; W130-I135 HydrophobicContact CH2-CG1 3.7Å; W130-I135 HydrophobicContact CZ3-CD1 4.18Å; W130-I135 HydrophobicContact CZ3-CG1 3.36Å; I135-V137 HydrophobicContact CG2-CG2 3.88Å; I135-V142 CarbonylContact O-C 3.59Å; I135-V142 WeakPolarHBondContact O-CA 3.2Å; I135-I143 HydrophobicContact CB-CB 4.15Å; I135-I143 HydrophobicContact CB-CD1 4.44Å; I135-I143 HydrophobicContact CB-CG1 4.49Å; I135-I143 HydrophobicContact CG2-CD1 4.47Å; I135-I143 PolarHBondContact N-O 2.86Å; I135-I143 PolarHBondContact O-N 3.45Å; I135-Y147 HydrophobicContact CD1-CD1 4.13Å; I135-Y147 HydrophobicContact CD1-CE1 4.38Å; I135-Y147 HydrophobicContact CG1-CD1 4.47Å; I135-Y147 HydrophobicContact CG1-CE1 4.31Å
136	I	98	Very high	96.6	Very high	10 Å²	10	60 Å²	60	5%	0.051	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.2	174.5	-47.9	-59.1	0	0	0	107.9	C128 K129 Q131 N134 D139 V141 V142	C128-I136 CarbonylContact C-O 3.56Å; C128-I136 WeakPolarHBondContact CA-O 3.43Å; C128-I136 VanDerWaalsContact CB-O 3.3Å; C128-I136 WeakPolarHBondContact CB-O 3.47Å; K129-I136 HydrophobicContact CG-CB 3.99Å; K129-I136 PolarHBondContact N-O 3.18Å; K129-I136 PolarHBondContact O-N 2.95Å; Q131-I136 HydrophobicContact CB-CD1 3.94Å; Q131-I136 HydrophobicContact CB-CG1 3.54Å; N134-I136 HydrophobicContact CB-CD1 4.29Å; I136-D139 WeakPolarHBondContact CG2-OD1 3.47Å; I136-V141 CarbonylContact C-O 3.51Å; I136-V141 WeakPolarHBondContact CA-O 3.45Å; I136-V142 HydrophobicContact CD1-CB 4.16Å; I136-V142 HydrophobicContact CD1-CG1 3.83Å; I136-V142 HydrophobicContact CD1-CG2 3.7Å
137	V	97.7	Very high	96.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	122.3	-178.5	-170.6	0	0	0	0	108.8	I121 I125 C128 I135 D139 D140 V141 I143 V163	I121-V137 HydrophobicContact CD1-CG2 4.44Å; I121-V137 HydrophobicContact CG2-CG1 4.19Å; I121-V137 HydrophobicContact CG2-CG2 3.88Å; I125-V137 HydrophobicContact CB-CG1 4.45Å; I125-V137 HydrophobicContact CD1-CG1 3.88Å; I125-V137 HydrophobicContact CG2-CG1 3.95Å; C128-V137 HydrophobicContact CB-CB 4.49Å; C128-V137 HydrophobicContact CB-CG1 4.47Å; C128-V137 HydrophobicContact CB-CG2 4.2Å; I135-V137 HydrophobicContact CG2-CG2 3.88Å; V137-D139 PolarHBondContact O-N 3.06Å; V137-D140 PolarHBondContact O-N 2.73Å; V137-D140 VanDerWaalsContact O-N 3.12Å; V137-V141 HydrophobicContact CB-CB 4.4Å; V137-V141 PolarHBondContact N-O 3.49Å; V137-V141 PolarHBondContact O-N 3.33Å; V137-V141 VanDerWaalsContact O-N 3.09Å; V137-I143 HydrophobicContact CG2-CD1 4.35Å; V137-V163 HydrophobicContact CB-CG2 4.16Å; V137-V163 HydrophobicContact CG1-CG2 3.89Å; V137-V163 HydrophobicContact CG2-CG2 4.49Å
138	M	94.8	Very high	97	Very high	54 Å²	54	51 Å²	51	27%	0.266	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	26.2	-178.6	-58.3	174.1	-64.9	0	0	113.8	I125 E127 D140 A159	I125-M138 HydrophobicContact CD1-CE 4.41Å; I125-M138 HydrophobicContact CG2-CG 3.91Å; I125-M138 HydrophobicContact CG2-SD 4.22Å; E127-M138 HydrophobicContact CB-CG 4.35Å; E127-M138 PolarHBondContact O-N 3.2Å; M138-D140 PolarHBondContact O-N 3.06Å; M138-A159 HydrophobicContact CE-CB 4.03Å
139	D	94.1	Very high	97.1	Very high	100 Å²	100	51.5 Å²	51.5	54%	0.535	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	7.8	-172.3	-74.3	-43.5	0	0	0	116.2	K129 I136 V137	K129-D139 WeakPolarHBondContact CE-OD1 3.45Å; K129-D139 IonicContact NZ-OD1 3.88Å; K129-D139 PolarHBondContact NZ-OD1 2.86Å; K129-D139 IonicContact NZ-OD2 2.65Å; K129-D139 PolarHBondContact NZ-OD2 3.19Å; I136-D139 WeakPolarHBondContact CG2-OD1 3.47Å; V137-D139 PolarHBondContact O-N 3.06Å
140	D	95	Very high	97.2	Very high	90 Å²	90	53 Å²	53	48%	0.481	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-27.9	-174.7	-82.3	-18.5	0	0	0	112.9	V137 M138 G154	V137-D140 PolarHBondContact O-N 2.73Å; V137-D140 VanDerWaalsContact O-N 3.12Å; M138-D140 PolarHBondContact O-N 3.06Å; D140-G154 VanDerWaalsContact O-CA 3.31Å; D140-G154 WeakPolarHBondContact O-CA 3.35Å
141	V	98.1	Very high	97.2	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.9	-175.1	-175.8	0	0	0	0	110.5	I136 V137 R153 A159 L160 V163	I136-V141 CarbonylContact C-O 3.51Å; I136-V141 WeakPolarHBondContact CA-O 3.45Å; V137-V141 HydrophobicContact CB-CB 4.4Å; V137-V141 PolarHBondContact N-O 3.49Å; V137-V141 PolarHBondContact O-N 3.33Å; V137-V141 VanDerWaalsContact O-N 3.09Å; V141-R153 CarbonylContact C-O 3.56Å; V141-R153 WeakPolarHBondContact CA-O 3.18Å; V141-A159 HydrophobicContact CG2-CB 4.31Å; V141-L160 HydrophobicContact CG1-CD1 3.8Å; V141-L160 HydrophobicContact CG2-CB 4.3Å; V141-L160 HydrophobicContact CG2-CD1 4.35Å; V141-V163 HydrophobicContact CB-CG2 4.17Å; V141-V163 HydrophobicContact CG1-CB 4.05Å; V141-V163 HydrophobicContact CG1-CG1 3.82Å; V141-V163 HydrophobicContact CG1-CG2 4.18Å; V141-V163 HydrophobicContact CG2-CG2 4.11Å
142	V	98.5	Very high	97.2	Very high	51 Å²	51	47.7 Å²	47.7	31%	0.309	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.6	176.7	-175.6	0	0	0	0	108.9	N134 I135 I136 R153	N134-V142 HydrophobicContact CB-CG1 3.93Å; I135-V142 CarbonylContact O-C 3.59Å; I135-V142 WeakPolarHBondContact O-CA 3.2Å; I136-V142 HydrophobicContact CD1-CB 4.16Å; I136-V142 HydrophobicContact CD1-CG1 3.83Å; I136-V142 HydrophobicContact CD1-CG2 3.7Å; V142-R153 PolarHBondContact N-O 2.83Å; V142-R153 PolarHBondContact O-N 3.49Å
143	I	98.6	Very high	97.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115.7	172	-42.4	174.2	0	0	0	107.7	L117 I121 N134 I135 V137 Y147 V163 V167	L117-I143 HydrophobicContact CD2-CD1 4.48Å; L117-I143 HydrophobicContact CD2-CG2 4.3Å; I121-I143 HydrophobicContact CD1-CD1 3.39Å; N134-I143 WeakPolarHBondContact CA-O 3.01Å; I135-I143 HydrophobicContact CB-CB 4.15Å; I135-I143 HydrophobicContact CB-CD1 4.44Å; I135-I143 HydrophobicContact CB-CG1 4.49Å; I135-I143 HydrophobicContact CG2-CD1 4.47Å; I135-I143 PolarHBondContact N-O 2.86Å; I135-I143 PolarHBondContact O-N 3.45Å; V137-I143 HydrophobicContact CG2-CD1 4.35Å; I143-Y147 HydrophobicContact CG2-CD1 4.26Å; I143-V163 HydrophobicContact CD1-CG1 3.6Å; I143-V163 HydrophobicContact CG1-CG1 4.09Å; I143-V167 HydrophobicContact CD1-CG2 3.93Å
144	S	98.3	Very high	97.3	Very high	27 Å²	27	46 Å²	46	19%	0.189	25%	0.247	C	C	.	.			trans	-101.8	156.7	-178.9	49.5	0	0	0	0	111.4	N134 Y147 N151	N134-S144 WeakPolarHBondContact OD1-CA 3.49Å; N134-S144 WeakPolarHBondContact OD1-CB 3.48Å; S144-Y147 VanDerWaalsContact O-CA 3.3Å; S144-Y147 WeakPolarHBondContact O-CA 3.36Å; S144-Y147 PolarHBondContact O-N 3.36Å; S144-N151 PolarHBondContact N-O 3.36Å; S144-N151 WeakPolarHBondContact O-CB 3.49Å; S144-N151 PolarHBondContact OG-O 2.92Å
145	P	97.8	Very high	97.2	Very high	58 Å²	58	52.7 Å²	52.7	38%	0.377	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	143.7	168.4	-21.5	27.3	0	0	0	111.8	K133 Y147	K133-P145 HydrophobicContact CB-CG 4.06Å; P145-Y147 VanDerWaalsContact C-N 3.29Å; P145-Y147 VanDerWaalsContact CA-N 3.33Å; P145-Y147 HydrophobicContact CB-CD2 4.49Å; P145-Y147 HydrophobicContact CB-CE2 4.04Å; P145-Y147 HydrophobicContact CG-CE1 4.14Å; P145-Y147 HydrophobicContact CG-CE2 4.02Å; P145-Y147 WeakPolarHBondContact CG-OH 3.35Å
146	P	96.9	Very high	97	Very high	84 Å²	84	60 Å²	60	55%	0.545	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	cis	-82.7	26	2.2	34.2	-38.3	0	0	0	115.5	Q148 N151	P146-Q148 VanDerWaalsContact C-N 3.3Å; P146-Q148 HydrophobicContact CG-CG 4.15Å; P146-Q148 PolarHBondContact O-N 2.82Å; P146-Q148 PolarHBondContact O-NE2 2.49Å; P146-N151 VanDerWaalsContact CD-OD1 3.24Å; P146-N151 WeakPolarHBondContact CD-OD1 3.22Å; P146-N151 WeakPolarHBondContact CG-OD1 3.4Å
147	Y	97.6	Very high	96.8	Very high	4 Å²	4	61.3 Å²	61.3	2%	0.016	32%	0.324	C	S	.	.			trans	64.2	27.7	172.2	-49	-75.2	0	0	0	115.2	V110 G114 W130 K133 I135 I143 S144 P145 N151 F171	V110-Y147 HydrophobicContact CG1-CE2 4.3Å; V110-Y147 WeakPolarHBondContact CG1-OH 3.34Å; G114-Y147 VanDerWaalsContact CA-CD2 3.45Å; W130-Y147 HydrophobicContact CZ3-CE1 4.47Å; K133-Y147 VanDerWaalsContact O-CE1 3.24Å; K133-Y147 WeakPolarHBondContact O-CE1 3.48Å; K133-Y147 VanDerWaalsContact O-CZ 3.31Å; K133-Y147 PolarHBondContact O-OH 3.02Å; I135-Y147 HydrophobicContact CD1-CD1 4.13Å; I135-Y147 HydrophobicContact CD1-CE1 4.38Å; I135-Y147 HydrophobicContact CG1-CD1 4.47Å; I135-Y147 HydrophobicContact CG1-CE1 4.31Å; I143-Y147 HydrophobicContact CG2-CD1 4.26Å; S144-Y147 VanDerWaalsContact O-CA 3.3Å; S144-Y147 WeakPolarHBondContact O-CA 3.36Å; S144-Y147 PolarHBondContact O-N 3.36Å; P145-Y147 VanDerWaalsContact C-N 3.29Å; P145-Y147 VanDerWaalsContact CA-N 3.33Å; P145-Y147 HydrophobicContact CB-CD2 4.49Å; P145-Y147 HydrophobicContact CB-CE2 4.04Å; P145-Y147 HydrophobicContact CG-CE1 4.14Å; P145-Y147 HydrophobicContact CG-CE2 4.02Å; P145-Y147 WeakPolarHBondContact CG-OH 3.35Å; Y147-N151 PolarHBondContact N-OD1 3.13Å; Y147-F171 WeakPolarHBondContact O-CE2 3.47Å; Y147-F171 WeakPolarHBondContact O-CZ 3.46Å
148	Q	97.4	Very high	96.6	Very high	61 Å²	61	66.3 Å²	66.3	29%	0.285	36%	0.359	S	S	.	.			trans	-84.1	170.7	174.6	-56.2	-58.4	-46.6	0	0	111.4	P146 E150 N151 F171	P146-Q148 VanDerWaalsContact C-N 3.3Å; P146-Q148 HydrophobicContact CG-CG 4.15Å; P146-Q148 PolarHBondContact O-N 2.82Å; P146-Q148 PolarHBondContact O-NE2 2.49Å; Q148-E150 HydrophobicContact CB-CG 4.05Å; Q148-E150 WeakPolarHBondContact CB-OE1 3.45Å; Q148-E150 VanDerWaalsContact CB-OE2 3.31Å; Q148-E150 WeakPolarHBondContact CB-OE2 3.43Å; Q148-E150 PolarHBondContact O-N 3.22Å; Q148-N151 WeakPolarHBondContact CB-OD1 3.47Å; Q148-N151 PolarHBondContact N-OD1 2.94Å; Q148-N151 WeakPolarHBondContact O-CB 3.35Å; Q148-N151 PolarHBondContact O-N 3.41Å; Q148-F171 VanDerWaalsContact NE2-CZ 3.35Å
149	V	97.3	Very high	96.6	Very high	29 Å²	29	64.9 Å²	64.9	18%	0.176	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-59.2	-39.4	-178.9	-175.4	0	0	0	0	110.9	N151 C152 R164 V167 E168	V149-N151 PolarHBondContact O-N 3.43Å; V149-C152 VanDerWaalsContact O-CB 3.32Å; V149-C152 WeakPolarHBondContact O-CB 3.42Å; V149-C152 PolarHBondContact O-N 3.37Å; V149-C152 PolarHBondContact O-SG 2.95Å; V149-R164 HydrophobicContact CG1-CB 3.89Å; V149-R164 HydrophobicContact CG1-CG 3.83Å; V149-V167 HydrophobicContact CG2-CB 4.36Å; V149-V167 HydrophobicContact CG2-CG1 3.91Å; V149-E168 HydrophobicContact CB-CG 4.42Å; V149-E168 HydrophobicContact CG1-CG 4.08Å; V149-E168 HydrophobicContact CG2-CB 4.41Å; V149-E168 HydrophobicContact CG2-CG 3.45Å; V149-E168 VanDerWaalsContact CG2-CG 3.45Å
150	E	97.3	Very high	96.8	Very high	131 Å²	131	60.1 Å²	60.1	61%	0.612	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-66.5	-19.8	175.2	60.6	-89.6	-159	0	0	113.8	Q148 C152	Q148-E150 HydrophobicContact CB-CG 4.05Å; Q148-E150 WeakPolarHBondContact CB-OE1 3.45Å; Q148-E150 VanDerWaalsContact CB-OE2 3.31Å; Q148-E150 WeakPolarHBondContact CB-OE2 3.43Å; Q148-E150 PolarHBondContact O-N 3.22Å; E150-C152 VanDerWaalsContact C-N 3.31Å
151	N	97.8	Very high	96.9	Very high	25 Å²	25	58.5 Å²	58.5	13%	0.134	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-87.6	-0.1	176.9	-53	122.4	0	0	0	113.3	S144 P146 Y147 Q148 V149	S144-N151 PolarHBondContact N-O 3.36Å; S144-N151 WeakPolarHBondContact O-CB 3.49Å; S144-N151 PolarHBondContact OG-O 2.92Å; P146-N151 VanDerWaalsContact CD-OD1 3.24Å; P146-N151 WeakPolarHBondContact CD-OD1 3.22Å; P146-N151 WeakPolarHBondContact CG-OD1 3.4Å; Y147-N151 PolarHBondContact N-OD1 3.13Å; Q148-N151 WeakPolarHBondContact CB-OD1 3.47Å; Q148-N151 PolarHBondContact N-OD1 2.94Å; Q148-N151 WeakPolarHBondContact O-CB 3.35Å; Q148-N151 PolarHBondContact O-N 3.41Å; V149-N151 PolarHBondContact O-N 3.43Å
152	C	97.9	Very high	96.8	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.007	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	115.9	172.8	-59.1	0	0	0	0	110.1	V149 E150 L160 R164	V149-C152 VanDerWaalsContact O-CB 3.32Å; V149-C152 WeakPolarHBondContact O-CB 3.42Å; V149-C152 PolarHBondContact O-N 3.37Å; V149-C152 PolarHBondContact O-SG 2.95Å; E150-C152 VanDerWaalsContact C-N 3.31Å; C152-L160 HydrophobicContact CB-CD1 3.98Å; C152-R164 HydrophobicContact CB-CG 3.88Å; C152-R164 PolarHBondContact O-NH2 2.64Å
153	R	97.9	Very high	96.8	Very high	170 Å²	170	60.4 Å²	60.4	64%	0.642	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	142.2	177.5	-58.1	-170.9	-171.7	-83.6	0.2	110.2	V141 V142	V141-R153 CarbonylContact C-O 3.56Å; V141-R153 WeakPolarHBondContact CA-O 3.18Å; V142-R153 PolarHBondContact N-O 2.83Å; V142-R153 PolarHBondContact O-N 3.49Å
154	G	96.2	Very high	96.7	Very high	34 Å²	34	64 Å²	64	35%	0.351	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	175.4	-179.3	179.5	0	0	0	0	0	109.6	D140	D140-G154 VanDerWaalsContact O-CA 3.31Å; D140-G154 WeakPolarHBondContact O-CA 3.35Å
155	K	95	Very high	96.7	Very high	177 Å²	177	69.3 Å²	69.3	77%	0.77	37%	0.365	S	S	*	.			trans	-65.1	137.5	171.2	-68.7	177.6	-177.6	168.7	0	109.6	G157	K155-G157 PolarHBondContact O-N 2.8Å
156	E	94.2	Very high	96.7	Very high	153 Å²	153	67.3 Å²	67.3	72%	0.715	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	132.1	174.1	-70.7	-59.7	151.9	0	0	110.1
157	G	94.1	Very high	96.8	Very high	38 Å²	38	63.3 Å²	63.3	39%	0.392	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	154.5	-167.3	-174.8	0	0	0	0	0	114.4	K155 S161	K155-G157 PolarHBondContact O-N 2.8Å; G157-S161 WeakPolarHBondContact O-CB 3.36Å; G157-S161 PolarHBondContact O-N 3.41Å; G157-S161 VanDerWaalsContact O-N 3.14Å; G157-S161 PolarHBondContact O-OG 3.26Å
158	S	94.5	Very high	96.8	Very high	104 Å²	104	67.5 Å²	67.5	73%	0.727	34%	0.344	S	S	*	.	H	α-helix	trans	-65.5	-40	-175.8	55.4	0	0	0	0	112.8	S161 H162	S158-S161 PolarHBondContact O-N 3.03Å; S158-H162 VanDerWaalsContact O-CB 3.26Å; S158-H162 WeakPolarHBondContact O-CB 3.45Å; S158-H162 PolarHBondContact O-N 3.03Å
159	A	94.3	Very high	96.8	Very high	24 Å²	24	70.8 Å²	70.8	20%	0.198	36%	0.357	C	S	.	.	H	α-helix	trans	-60.7	-54.4	-179.6	0	0	0	0	0	111.7	M138 V141 S161 H162 V163	M138-A159 HydrophobicContact CE-CB 4.03Å; V141-A159 HydrophobicContact CG2-CB 4.31Å; A159-S161 VanDerWaalsContact C-N 3.33Å; A159-S161 PolarHBondContact O-N 3.11Å; A159-H162 PolarHBondContact O-N 2.95Å; A159-V163 WeakPolarHBondContact O-CG2 3.47Å; A159-V163 PolarHBondContact O-N 2.81Å
160	L	97.4	Very high	96.8	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-60	-43.4	177.5	-177.8	60.8	0	0	0	111.8	V141 C152 H162 V163 R164	V141-L160 HydrophobicContact CG1-CD1 3.8Å; V141-L160 HydrophobicContact CG2-CB 4.3Å; V141-L160 HydrophobicContact CG2-CD1 4.35Å; C152-L160 HydrophobicContact CB-CD1 3.98Å; L160-H162 VanDerWaalsContact C-N 3.33Å; L160-H162 PolarHBondContact O-N 3.17Å; L160-V163 PolarHBondContact O-N 2.87Å; L160-R164 WeakPolarHBondContact O-CG 3.44Å; L160-R164 PolarHBondContact O-N 2.91Å
161	S	97.4	Very high	96.7	Very high	55 Å²	55	65.7 Å²	65.7	39%	0.385	33%	0.331	S	S	.	.	H	α-helix	trans	-62.6	-38.7	177.4	-61	0	0	0	0	112.5	G157 S158 A159 K165	G157-S161 WeakPolarHBondContact O-CB 3.36Å; G157-S161 PolarHBondContact O-N 3.41Å; G157-S161 VanDerWaalsContact O-N 3.14Å; G157-S161 PolarHBondContact O-OG 3.26Å; S158-S161 PolarHBondContact O-N 3.03Å; A159-S161 VanDerWaalsContact C-N 3.33Å; A159-S161 PolarHBondContact O-N 3.11Å; S161-K165 WeakPolarHBondContact O-CG 2.93Å; S161-K165 PolarHBondContact O-N 3.38Å
162	H	96.6	Very high	96.6	Very high	92 Å²	92	72.4 Å²	72.4	43%	0.426	35%	0.354	S	S	.	.	H	α-helix	trans	-69.9	-44.8	178.1	-172.8	63.2	0	0	0	111.4	S158 A159 L160 R164 K165 I166	S158-H162 VanDerWaalsContact O-CB 3.26Å; S158-H162 WeakPolarHBondContact O-CB 3.45Å; S158-H162 PolarHBondContact O-N 3.03Å; A159-H162 PolarHBondContact O-N 2.95Å; L160-H162 VanDerWaalsContact C-N 3.33Å; L160-H162 PolarHBondContact O-N 3.17Å; H162-R164 PolarHBondContact O-N 3.46Å; H162-K165 WeakPolarHBondContact O-CB 3.4Å; H162-K165 PolarHBondContact O-N 3.42Å; H162-I166 WeakPolarHBondContact O-CG1 3.32Å; H162-I166 PolarHBondContact O-N 3.09Å
163	V	97.6	Very high	96.5	Very high	1 Å²	1	75.6 Å²	75.6	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-46.5	176.2	173.4	0	0	0	0	110.9	V137 V141 I143 A159 L160 K165 I166 V167	V137-V163 HydrophobicContact CB-CG2 4.16Å; V137-V163 HydrophobicContact CG1-CG2 3.89Å; V137-V163 HydrophobicContact CG2-CG2 4.49Å; V141-V163 HydrophobicContact CB-CG2 4.17Å; V141-V163 HydrophobicContact CG1-CB 4.05Å; V141-V163 HydrophobicContact CG1-CG1 3.82Å; V141-V163 HydrophobicContact CG1-CG2 4.18Å; V141-V163 HydrophobicContact CG2-CG2 4.11Å; I143-V163 HydrophobicContact CD1-CG1 3.6Å; I143-V163 HydrophobicContact CG1-CG1 4.09Å; A159-V163 WeakPolarHBondContact O-CG2 3.47Å; A159-V163 PolarHBondContact O-N 2.81Å; L160-V163 PolarHBondContact O-N 2.87Å; V163-K165 VanDerWaalsContact C-N 3.32Å; V163-K165 PolarHBondContact O-N 2.77Å; V163-I166 WeakPolarHBondContact O-CB 3.39Å; V163-I166 PolarHBondContact O-N 3.39Å; V163-V167 HydrophobicContact CG1-CG2 4.33Å; V163-V167 WeakPolarHBondContact O-CG2 3.37Å; V163-V167 PolarHBondContact O-N 3.02Å
164	R	98.1	Very high	96.2	Very high	74 Å²	74	68.7 Å²	68.7	28%	0.279	35%	0.348	S	S	.	.	H	α-helix	trans	-55.8	-44	175.7	-77.2	-177.6	176.7	153.1	6.4	112.5	V149 C152 L160 H162 I166 V167 E168	V149-R164 HydrophobicContact CG1-CB 3.89Å; V149-R164 HydrophobicContact CG1-CG 3.83Å; C152-R164 HydrophobicContact CB-CG 3.88Å; C152-R164 PolarHBondContact O-NH2 2.64Å; L160-R164 WeakPolarHBondContact O-CG 3.44Å; L160-R164 PolarHBondContact O-N 2.91Å; H162-R164 PolarHBondContact O-N 3.46Å; R164-I166 VanDerWaalsContact C-N 3.33Å; R164-I166 PolarHBondContact O-N 2.85Å; R164-V167 PolarHBondContact O-N 3.11Å; R164-E168 WeakPolarHBondContact O-CG 3.03Å; R164-E168 PolarHBondContact O-N 2.91Å
165	K	97.9	Very high	96	Very high	140 Å²	140	73.6 Å²	73.6	61%	0.609	36%	0.362	S	S	*	.	H	α-helix	trans	-61.3	-38.1	175.5	-73.5	174.1	-176.6	178.5	0	113	S161 H162 V163 K169	S161-K165 WeakPolarHBondContact O-CG 2.93Å; S161-K165 PolarHBondContact O-N 3.38Å; H162-K165 WeakPolarHBondContact O-CB 3.4Å; H162-K165 PolarHBondContact O-N 3.42Å; V163-K165 VanDerWaalsContact C-N 3.32Å; V163-K165 PolarHBondContact O-N 2.77Å; K165-K169 VanDerWaalsContact O-CB 3.27Å; K165-K169 WeakPolarHBondContact O-CB 3.42Å; K165-K169 PolarHBondContact O-N 3.44Å
166	I	97.8	Very high	95.9	Very high	16 Å²	16	67.7 Å²	67.7	8%	0.082	34%	0.343	C	S	.	.	H	α-helix	trans	-65.2	-44.1	175.7	-65.6	167.9	0	0	0	110.1	T120 I121 T124 I125 H162 V163 R164 K169 H170	T120-I166 HydrophobicContact CG2-CG2 4.17Å; I121-I166 HydrophobicContact CG1-CG2 3.91Å; T124-I166 HydrophobicContact CG2-CD1 4.03Å; I125-I166 HydrophobicContact CD1-CD1 3.63Å; I125-I166 HydrophobicContact CG1-CD1 4.22Å; H162-I166 WeakPolarHBondContact O-CG1 3.32Å; H162-I166 PolarHBondContact O-N 3.09Å; V163-I166 WeakPolarHBondContact O-CB 3.39Å; V163-I166 PolarHBondContact O-N 3.39Å; R164-I166 VanDerWaalsContact C-N 3.33Å; R164-I166 PolarHBondContact O-N 2.85Å; I166-K169 PolarHBondContact O-N 2.92Å; I166-H170 WeakPolarHBondContact O-CB 3.27Å; I166-H170 PolarHBondContact O-N 3.32Å
167	V	97.9	Very high	95.7	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-47.7	178.2	179.9	0	0	0	0	110.9	L117 I143 V149 V163 R164 K169 H170 F171	L117-V167 HydrophobicContact CD1-CB 4.34Å; L117-V167 HydrophobicContact CD1-CG1 4.32Å; L117-V167 HydrophobicContact CD1-CG2 4.03Å; L117-V167 HydrophobicContact CD2-CG1 4.26Å; L117-V167 HydrophobicContact CD2-CG2 4.18Å; I143-V167 HydrophobicContact CD1-CG2 3.93Å; V149-V167 HydrophobicContact CG2-CB 4.36Å; V149-V167 HydrophobicContact CG2-CG1 3.91Å; V163-V167 HydrophobicContact CG1-CG2 4.33Å; V163-V167 WeakPolarHBondContact O-CG2 3.37Å; V163-V167 PolarHBondContact O-N 3.02Å; R164-V167 PolarHBondContact O-N 3.11Å; V167-K169 VanDerWaalsContact C-N 3.35Å; V167-K169 PolarHBondContact O-N 3.21Å; V167-H170 WeakPolarHBondContact O-CB 3.1Å; V167-H170 PolarHBondContact O-N 2.96Å; V167-F171 HydrophobicContact CG1-CD2 3.95Å; V167-F171 HydrophobicContact CG1-CE2 3.61Å; V167-F171 WeakPolarHBondContact O-CD2 3.27Å; V167-F171 PolarHBondContact O-N 2.87Å
168	E	97.8	Very high	95.5	Very high	91 Å²	91	70.9 Å²	70.9	43%	0.425	35%	0.345	S	S	.	.	H	α-helix	trans	-56.7	-47.4	174.7	-75.2	171.9	-165.4	0	0	112.1	V149 R164 H170 F171 R172	V149-E168 HydrophobicContact CB-CG 4.42Å; V149-E168 HydrophobicContact CG1-CG 4.08Å; V149-E168 HydrophobicContact CG2-CB 4.41Å; V149-E168 HydrophobicContact CG2-CG 3.45Å; V149-E168 VanDerWaalsContact CG2-CG 3.45Å; R164-E168 WeakPolarHBondContact O-CG 3.03Å; R164-E168 PolarHBondContact O-N 2.91Å; E168-H170 VanDerWaalsContact C-N 3.34Å; E168-H170 PolarHBondContact O-N 3.5Å; E168-F171 PolarHBondContact O-N 3.48Å; E168-R172 PolarHBondContact O-N 3.07Å; E168-R172 VanDerWaalsContact O-N 3.12Å
169	K	97.4	Very high	95.2	Very high	130 Å²	130	69 Å²	69	57%	0.565	33%	0.333	S	S	*	.	H	α-helix	trans	-62.3	-42.8	178.1	-177.8	-177.9	174.6	-174.7	0	111.2	K165 I166 V167 F171 R172 D173	K165-K169 VanDerWaalsContact O-CB 3.27Å; K165-K169 WeakPolarHBondContact O-CB 3.42Å; K165-K169 PolarHBondContact O-N 3.44Å; I166-K169 PolarHBondContact O-N 2.92Å; V167-K169 VanDerWaalsContact C-N 3.35Å; V167-K169 PolarHBondContact O-N 3.21Å; K169-F171 PolarHBondContact O-N 3.3Å; K169-R172 PolarHBondContact O-N 3.5Å; K169-D173 WeakPolarHBondContact CE-OD2 3.36Å; K169-D173 WeakPolarHBondContact O-CB 3.34Å; K169-D173 VanDerWaalsContact O-CG 3.28Å; K169-D173 PolarHBondContact O-N 3.33Å
170	H	97.1	Very high	94.8	Very high	10 Å²	10	73.9 Å²	73.9	5%	0.046	35%	0.353	C	S	.	.	H	α-helix	trans	-54.7	-51.5	178.4	173.4	79.4	0	0	0	111.4	L117 T120 I166 V167 E168 R172 D173 V174	L117-H170 HydrophobicContact CD1-CB 3.77Å; T120-H170 HydrophobicContact CG2-CB 4.1Å; T120-H170 PolarHBondContact OG1-ND1 3.14Å; I166-H170 WeakPolarHBondContact O-CB 3.27Å; I166-H170 PolarHBondContact O-N 3.32Å; V167-H170 WeakPolarHBondContact O-CB 3.1Å; V167-H170 PolarHBondContact O-N 2.96Å; E168-H170 VanDerWaalsContact C-N 3.34Å; E168-H170 PolarHBondContact O-N 3.5Å; H170-R172 PolarHBondContact O-N 2.97Å; H170-D173 PolarHBondContact O-N 3.47Å; H170-V174 VanDerWaalsContact O-CG2 3.3Å; H170-V174 WeakPolarHBondContact O-CG2 3.3Å; H170-V174 PolarHBondContact O-N 3.41Å
171	F	96	Very high	94.1	Very high	43 Å²	43	80 Å²	80	19%	0.189	38%	0.381	C	S	.	.	H	α-helix	trans	-64.9	-40.7	-179.7	-73.3	-67.8	0	0	0	112.4	Y147 Q148 V167 E168 K169 D173 V174 E175	Y147-F171 WeakPolarHBondContact O-CE2 3.47Å; Y147-F171 WeakPolarHBondContact O-CZ 3.46Å; Q148-F171 VanDerWaalsContact NE2-CZ 3.35Å; V167-F171 HydrophobicContact CG1-CD2 3.95Å; V167-F171 HydrophobicContact CG1-CE2 3.61Å; V167-F171 WeakPolarHBondContact O-CD2 3.27Å; V167-F171 PolarHBondContact O-N 2.87Å; E168-F171 PolarHBondContact O-N 3.48Å; K169-F171 PolarHBondContact O-N 3.3Å; F171-D173 VanDerWaalsContact C-N 3.34Å; F171-D173 PolarHBondContact O-N 2.84Å; F171-V174 PolarHBondContact O-N 2.77Å; F171-E175 WeakPolarHBondContact O-CG 3.49Å; F171-E175 PolarHBondContact O-N 2.86Å
172	R	96.1	Very high	93.5	Very high	166 Å²	166	86 Å²	86	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-59.9	-43.2	174.6	-171.4	-174.9	-57.5	-171.5	2.3	112.5	E168 K169 H170 S176	E168-R172 PolarHBondContact O-N 3.07Å; E168-R172 VanDerWaalsContact O-N 3.12Å; K169-R172 PolarHBondContact O-N 3.5Å; H170-R172 PolarHBondContact O-N 2.97Å; R172-S176 WeakPolarHBondContact O-CB 3.41Å; R172-S176 PolarHBondContact O-N 2.82Å; R172-S176 PolarHBondContact O-OG 2.84Å
173	D	94.5	Very high	92.9	Very high	68 Å²	68	85 Å²	85	36%	0.364	40%	0.399	S	S	.	.	H	α-helix	trans	-67.3	-41	179.3	-71.5	-11.5	0	0	0	110.6	K169 H170 F171 S176 Q177	K169-D173 WeakPolarHBondContact CE-OD2 3.36Å; K169-D173 WeakPolarHBondContact O-CB 3.34Å; K169-D173 VanDerWaalsContact O-CG 3.28Å; K169-D173 PolarHBondContact O-N 3.33Å; H170-D173 PolarHBondContact O-N 3.47Å; F171-D173 VanDerWaalsContact C-N 3.34Å; F171-D173 PolarHBondContact O-N 2.84Å; D173-S176 PolarHBondContact O-N 2.83Å; D173-Q177 WeakPolarHBondContact O-CG 3.35Å; D173-Q177 PolarHBondContact O-N 2.79Å
174	V	92.9	Very high	91.9	Very high	26 Å²	26	91.1 Å²	91.1	16%	0.158	43%	0.428	C	S	.	.	H	α-helix	trans	-63.9	-44	176.4	169.5	0	0	0	0	111.7	H170 F171 S176 Q177 K178	H170-V174 VanDerWaalsContact O-CG2 3.3Å; H170-V174 WeakPolarHBondContact O-CG2 3.3Å; H170-V174 PolarHBondContact O-N 3.41Å; F171-V174 PolarHBondContact O-N 2.77Å; V174-S176 VanDerWaalsContact C-N 3.35Å; V174-Q177 PolarHBondContact O-N 2.94Å; V174-K178 HydrophobicContact CG1-CD 4.3Å; V174-K178 WeakPolarHBondContact O-CG 3.45Å; V174-K178 PolarHBondContact O-N 3.27Å
175	E	92.3	Very high	90.9	Very high	137 Å²	137	90.2 Å²	90.2	64%	0.64	44%	0.436	S	S	*	.	H	α-helix	trans	-62.8	-41.9	175.1	-74.1	-176.8	154.3	0	0	112	F171 Q177 K178 S179	F171-E175 WeakPolarHBondContact O-CG 3.49Å; F171-E175 PolarHBondContact O-N 2.86Å; E175-Q177 VanDerWaalsContact C-N 3.35Å; E175-Q177 PolarHBondContact O-N 3.37Å; E175-K178 PolarHBondContact O-N 3.42Å; E175-S179 PolarHBondContact O-N 3.12Å; E175-S179 PolarHBondContact O-OG 3.12Å
176	S	92.7	Very high	89.7	Confident	52 Å²	52	88.9 Å²	88.9	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-62.3	-42.3	176.9	-58.5	0	0	0	0	111.3	R172 D173 V174 S179 M180	R172-S176 WeakPolarHBondContact O-CB 3.41Å; R172-S176 PolarHBondContact O-N 2.82Å; R172-S176 PolarHBondContact O-OG 2.84Å; D173-S176 PolarHBondContact O-N 2.83Å; V174-S176 VanDerWaalsContact C-N 3.35Å; S176-S179 PolarHBondContact O-N 2.75Å; S176-S179 PolarHBondContact O-OG 3.16Å; S176-M180 WeakPolarHBondContact O-CG 3.31Å; S176-M180 PolarHBondContact O-N 3.27Å; S176-M180 VanDerWaalsContact O-N 3.1Å
177	Q	89.9	Confident	88.4	Confident	120 Å²	120	94.1 Å²	94.1	56%	0.561	46%	0.456	S	S	*	.	H	α-helix	trans	-66.5	-42.1	176.1	-74	177.2	-0.5	0	0	112.6	D173 V174 E175 S179 M180 Q181	D173-Q177 WeakPolarHBondContact O-CG 3.35Å; D173-Q177 PolarHBondContact O-N 2.79Å; V174-Q177 PolarHBondContact O-N 2.94Å; E175-Q177 VanDerWaalsContact C-N 3.35Å; E175-Q177 PolarHBondContact O-N 3.37Å; Q177-S179 VanDerWaalsContact C-N 3.33Å; Q177-S179 PolarHBondContact O-N 3.03Å; Q177-M180 PolarHBondContact O-N 3.27Å; Q177-Q181 WeakPolarHBondContact O-CG 3.33Å; Q177-Q181 PolarHBondContact O-N 3.18Å
178	K	89.1	Confident	87.1	Confident	138 Å²	138	98.9 Å²	98.9	60%	0.6	49%	0.485	S	S	*	.	H	α-helix	trans	-61.4	-41.2	176.4	-76.9	178.3	-179.8	178	0	111.8	V174 E175 R182	V174-K178 HydrophobicContact CG1-CD 4.3Å; V174-K178 WeakPolarHBondContact O-CG 3.45Å; V174-K178 PolarHBondContact O-N 3.27Å; E175-K178 PolarHBondContact O-N 3.42Å; K178-R182 WeakPolarHBondContact O-CB 3.29Å; K178-R182 PolarHBondContact O-N 2.89Å; K178-R182 VanDerWaalsContact O-N 3.08Å
179	S	88.4	Confident	85.5	Confident	66 Å²	66	101 Å²	101	46%	0.462	50%	0.495	S	S	.	.	H	α-helix	trans	-66.4	-42.8	177.5	64.1	0	0	0	0	112.1	E175 S176 Q177 Q181 R182 S183	E175-S179 PolarHBondContact O-N 3.12Å; E175-S179 PolarHBondContact O-OG 3.12Å; S176-S179 PolarHBondContact O-N 2.75Å; S176-S179 PolarHBondContact O-OG 3.16Å; Q177-S179 VanDerWaalsContact C-N 3.33Å; Q177-S179 PolarHBondContact O-N 3.03Å; S179-Q181 PolarHBondContact O-N 3.29Å; S179-R182 PolarHBondContact O-N 3.27Å; S179-S183 PolarHBondContact O-N 3.26Å; S179-S183 PolarHBondContact O-OG 3.13Å; S179-S183 VanDerWaalsContact O-OG 3.14Å
180	M	86.2	Confident	83.9	Confident	125 Å²	125	101.5 Å²	101.5	62%	0.616	50%	0.497	S	S	*	.	H	α-helix	trans	-61.3	-44.3	175.2	-72.2	-179.8	-176.4	0	0	112.7	S176 Q177 R182 S183 Q184	S176-M180 WeakPolarHBondContact O-CG 3.31Å; S176-M180 PolarHBondContact O-N 3.27Å; S176-M180 VanDerWaalsContact O-N 3.1Å; Q177-M180 PolarHBondContact O-N 3.27Å; M180-R182 VanDerWaalsContact C-N 3.33Å; M180-R182 PolarHBondContact O-N 2.85Å; M180-S183 PolarHBondContact O-N 2.72Å; M180-Q184 WeakPolarHBondContact O-CG 3.41Å; M180-Q184 PolarHBondContact O-N 2.91Å
181	Q	83	Confident	82.2	Confident	130 Å²	130	105.3 Å²	105.3	61%	0.607	52%	0.518	S	S	*	.	H	α-helix	trans	-62.4	-40.5	177.3	-77.3	178.6	0.5	0	0	112	Q177 S179 Q184 A185	Q177-Q181 WeakPolarHBondContact O-CG 3.33Å; Q177-Q181 PolarHBondContact O-N 3.18Å; S179-Q181 PolarHBondContact O-N 3.29Å; Q181-Q184 PolarHBondContact O-N 2.8Å; Q181-A185 WeakPolarHBondContact O-CB 3.47Å; Q181-A185 PolarHBondContact O-N 2.9Å
182	R	84.9	Confident	80.6	Confident	181 Å²	181	106.4 Å²	106.4	68%	0.683	53%	0.531	S	S	*	.	H	α-helix	trans	-63.6	-42.4	177.5	-166.4	178	-174.4	-166.5	1.4	111.8	K178 S179 M180 A185 Q186	K178-R182 WeakPolarHBondContact O-CB 3.29Å; K178-R182 PolarHBondContact O-N 2.89Å; K178-R182 VanDerWaalsContact O-N 3.08Å; S179-R182 PolarHBondContact O-N 3.27Å; M180-R182 VanDerWaalsContact C-N 3.33Å; M180-R182 PolarHBondContact O-N 2.85Å; R182-A185 PolarHBondContact O-N 2.81Å; R182-Q186 WeakPolarHBondContact O-CG 3.05Å; R182-Q186 PolarHBondContact O-N 2.85Å; R182-Q186 VanDerWaalsContact O-N 3.13Å
183	S	83.4	Confident	79	Confident	71 Å²	71	103 Å²	103	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-63.9	-42.3	176.8	-60.2	0	0	0	0	112.3	S179 M180 Q186 Q187	S179-S183 PolarHBondContact O-N 3.26Å; S179-S183 PolarHBondContact O-OG 3.13Å; S179-S183 VanDerWaalsContact O-OG 3.14Å; M180-S183 PolarHBondContact O-N 2.72Å; S183-Q186 PolarHBondContact O-N 3.22Å; S183-Q187 PolarHBondContact O-N 3.25Å; S183-Q187 VanDerWaalsContact O-N 3.13Å
184	Q	77	Confident	77.2	Confident	130 Å²	130	105.9 Å²	105.9	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-65.1	-44.4	176.9	-73.7	-179.6	1.7	0	0	112.1	M180 Q181 Q186 Q187 T188	M180-Q184 WeakPolarHBondContact O-CG 3.41Å; M180-Q184 PolarHBondContact O-N 2.91Å; Q181-Q184 PolarHBondContact O-N 2.8Å; Q184-Q186 VanDerWaalsContact C-N 3.32Å; Q184-Q186 PolarHBondContact O-N 2.86Å; Q184-Q187 PolarHBondContact O-N 3.05Å; Q184-Q187 VanDerWaalsContact O-N 3.15Å; Q184-T188 PolarHBondContact O-N 3.23Å; Q184-T188 PolarHBondContact O-OG1 2.91Å; Q184-T188 VanDerWaalsContact O-OG1 3.06Å
185	A	75.8	Confident	75.5	Confident	55 Å²	55	109.7 Å²	109.7	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-62	-38.5	178.7	0	0	0	0	0	112.7	Q181 R182 Q187 Q189	Q181-A185 WeakPolarHBondContact O-CB 3.47Å; Q181-A185 PolarHBondContact O-N 2.9Å; R182-A185 PolarHBondContact O-N 2.81Å; A185-Q187 VanDerWaalsContact C-N 3.35Å; A185-Q189 PolarHBondContact O-N 2.9Å; A185-Q189 VanDerWaalsContact O-N 3.11Å
186	Q	73.9	Confident	73.4	Confident	111 Å²	111	110.9 Å²	110.9	52%	0.519	59%	0.594	S	S	.	*	H	α-helix	trans	-67.4	-35.1	175.4	-74.1	176.9	-15.6	0	0	112.4	R182 S183 Q184 K190	R182-Q186 WeakPolarHBondContact O-CG 3.05Å; R182-Q186 PolarHBondContact O-N 2.85Å; R182-Q186 VanDerWaalsContact O-N 3.13Å; S183-Q186 PolarHBondContact O-N 3.22Å; Q184-Q186 VanDerWaalsContact C-N 3.32Å; Q184-Q186 PolarHBondContact O-N 2.86Å; Q186-K190 PolarHBondContact O-N 2.8Å; Q186-K190 VanDerWaalsContact O-N 3.14Å
187	Q	70.7	Confident	72.5	Confident	127 Å²	127	113.8 Å²	113.8	59%	0.593	61%	0.606	S	S	*	*	H	α-helix	trans	-70.7	-43.7	177.5	-163.8	161.8	8.5	0	0	111.6	S183 Q184 A185 Q189 K190 D191	S183-Q187 PolarHBondContact O-N 3.25Å; S183-Q187 VanDerWaalsContact O-N 3.13Å; Q184-Q187 PolarHBondContact O-N 3.05Å; Q184-Q187 VanDerWaalsContact O-N 3.15Å; A185-Q187 VanDerWaalsContact C-N 3.35Å; Q187-Q189 VanDerWaalsContact C-N 3.34Å; Q187-Q189 PolarHBondContact O-N 3.23Å; Q187-K190 PolarHBondContact O-N 3.32Å; Q187-D191 PolarHBondContact O-N 3.07Å
188	T	69.3	Low	71.5	Confident	99 Å²	99	113.5 Å²	113.5	61%	0.607	61%	0.608	S	S	*	*	H	α-helix	trans	-62.6	-38.2	175.6	-49.6	0	0	0	0	112.5	Q184 S192	Q184-T188 PolarHBondContact O-N 3.23Å; Q184-T188 PolarHBondContact O-OG1 2.91Å; Q184-T188 VanDerWaalsContact O-OG1 3.06Å; T188-S192 PolarHBondContact O-N 3.32Å; T188-S192 VanDerWaalsContact O-N 3.15Å; T188-S192 PolarHBondContact O-OG 3.15Å
189	Q	64.9	Low	70.6	Confident	135 Å²	135	112.1 Å²	112.1	63%	0.631	61%	0.609	S	S	*	*	H	α-helix	trans	-64.7	-42	173.8	-82.3	-177.1	-17.6	0	0	112	A185 Q187 D191 S192 T193	A185-Q189 PolarHBondContact O-N 2.9Å; A185-Q189 VanDerWaalsContact O-N 3.11Å; Q187-Q189 VanDerWaalsContact C-N 3.34Å; Q187-Q189 PolarHBondContact O-N 3.23Å; Q189-D191 PolarHBondContact O-N 3.18Å; Q189-S192 PolarHBondContact O-N 3.41Å; Q189-S192 PolarHBondContact O-OG 2.82Å; Q189-T193 PolarHBondContact O-N 2.79Å; Q189-T193 VanDerWaalsContact O-N 3.11Å; Q189-T193 PolarHBondContact O-OG1 3.41Å
190	K	63.3	Low	69.5	Low	141 Å²	141	114.8 Å²	114.8	61%	0.613	62%	0.617	S	S	*	*	H	α-helix	trans	-63.8	-42	179.6	-162.1	176.6	-178.7	-177.1	0	112.4	Q186 Q187 S192 T193 L194	Q186-K190 PolarHBondContact O-N 2.8Å; Q186-K190 VanDerWaalsContact O-N 3.14Å; Q187-K190 PolarHBondContact O-N 3.32Å; K190-S192 VanDerWaalsContact C-N 3.34Å; K190-S192 PolarHBondContact O-N 2.76Å; K190-T193 WeakPolarHBondContact CA-OG1 3.41Å; K190-T193 PolarHBondContact O-N 2.64Å; K190-T193 PolarHBondContact O-OG1 3.29Å; K190-L194 HydrophobicContact CG-CD1 4.2Å; K190-L194 WeakPolarHBondContact O-CD1 3.38Å; K190-L194 PolarHBondContact O-N 3.49Å
191	D	61.4	Low	68.5	Low	91 Å²	91	114.2 Å²	114.2	49%	0.487	62%	0.618	S	S	.	*	H	α-helix	trans	-68	-33.9	177.9	-68.4	-22	0	0	0	112.3	Q187 Q189 L194 S195	Q187-D191 PolarHBondContact O-N 3.07Å; Q189-D191 PolarHBondContact O-N 3.18Å; D191-L194 PolarHBondContact O-N 2.87Å; D191-S195 PolarHBondContact O-N 2.71Å; D191-S195 PolarHBondContact O-OG 3.48Å
192	S	62.2	Low	67.5	Low	65 Å²	65	113.1 Å²	113.1	46%	0.455	62%	0.618	S	S	.	*	H	α-helix	trans	-68.4	-35.2	174.9	70.3	0	0	0	0	113.2	T188 Q189 K190 S196	T188-S192 PolarHBondContact O-N 3.32Å; T188-S192 VanDerWaalsContact O-N 3.15Å; T188-S192 PolarHBondContact O-OG 3.15Å; Q189-S192 PolarHBondContact O-N 3.41Å; Q189-S192 PolarHBondContact O-OG 2.82Å; K190-S192 VanDerWaalsContact C-N 3.34Å; K190-S192 PolarHBondContact O-N 2.76Å; S192-S196 PolarHBondContact O-OG 3.09Å
193	T	62.4	Low	66.3	Low	96 Å²	96	108.3 Å²	108.3	59%	0.589	61%	0.614	S	S	*	*	H	α-helix	trans	-76.5	-21	177.1	49.5	0	0	0	0	114.1	Q189 K190	Q189-T193 PolarHBondContact O-N 2.79Å; Q189-T193 VanDerWaalsContact O-N 3.11Å; Q189-T193 PolarHBondContact O-OG1 3.41Å; K190-T193 WeakPolarHBondContact CA-OG1 3.41Å; K190-T193 PolarHBondContact O-N 2.64Å; K190-T193 PolarHBondContact O-OG1 3.29Å
194	L	58	Low	65	Low	127 Å²	127	111.2 Å²	111.2	67%	0.665	62%	0.623	S	S	*	*	H	α-helix	trans	-86.9	-14.8	176.8	-78.5	157.6	0	0	0	113	K190 D191	K190-L194 HydrophobicContact CG-CD1 4.2Å; K190-L194 WeakPolarHBondContact O-CD1 3.38Å; K190-L194 PolarHBondContact O-N 3.49Å; D191-L194 PolarHBondContact O-N 2.87Å
195	S	57.5	Low	64	Low	107 Å²	107	109.6 Å²	109.6	75%	0.748	62%	0.624	S	S	*	*			trans	-102.4	6	-178.9	-53	0	0	0	0	113.5	D191	D191-S195 PolarHBondContact O-N 2.71Å; D191-S195 PolarHBondContact O-OG 3.48Å
196	S	48.2	Very low	62.9	Low	161 Å²	161	114.5 Å²	114.5	100%	1.126	64%	0.639	S	S	*	*			trans	-111	0	174.8	-55.3	0	0	0	0	110.1	S192	S192-S196 PolarHBondContact O-OG 3.09Å

Retrieved 196 of 196 residues in 104.2 ms (Link to these results)

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