A0A060VY17_ONCMY Loading...

Tax1-binding protein 3

AlphaFold DB , UniProt , Accession A0A060VY17, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110502506, Length 123 aa.

						>A0A060VY17_ONCMY|A0A060VY17|LOC110502506
MSFIPGQPVTAVVQRIEICKLRQGEHLILGFSIGGGIDQDPGQNPFSEDKSDKGIYVTRVTPGGPAEVAGLMMGDKVMQVNGWDMTMVTHDQARKRLTKKNEDIVRLLVTRKSLEQAVRHSMM
					

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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	43.1	Very low	53.1	Low	251 Å²	251	119 Å²	119	100%	1.236	70%	0.703	S	S	*	*				0	124.7	0	-73.4	176.7	178.4	0	0	107.6
2	S	46.6	Very low	55.7	Low	110 Å²	110	111.5 Å²	111.5	77%	0.769	66%	0.659	S	S	*	*			trans	-85.6	123.4	-175.2	45.2	0	0	0	0	111.1	I4	S2-I4 PolarHBondContact O-N 3.03Å
3	F	49.4	Very low	58.4	Low	167 Å²	167	108.7 Å²	108.7	73%	0.732	64%	0.643	S	S	*	*			trans	-63.2	126.5	172.3	174.3	-99.5	0	0	0	110.6	P5	F3-P5 HydrophobicContact CD1-CG 4.42Å; F3-P5 HydrophobicContact CE1-CB 4.44Å; F3-P5 HydrophobicContact CE1-CG 4.21Å
4	I	52.6	Low	61	Low	101 Å²	101	104.8 Å²	104.8	52%	0.518	62%	0.615	S	S	.	*			trans	-102.5	115.1	173.8	-57.8	175.7	0	0	0	107.9	S2 G6 Q7	S2-I4 PolarHBondContact O-N 3.03Å; I4-G6 PolarHBondContact O-N 2.71Å; I4-Q7 PolarHBondContact O-N 3.38Å
5	P	42.6	Very low	63.4	Low	105 Å²	105	112.5 Å²	112.5	68%	0.682	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	131.5	176.1	-22.7	32.8	0	0	0	111.5	F3	F3-P5 HydrophobicContact CD1-CG 4.42Å; F3-P5 HydrophobicContact CE1-CB 4.44Å; F3-P5 HydrophobicContact CE1-CG 4.21Å
6	G	57.9	Low	65.6	Low	79 Å²	79	105.8 Å²	105.8	81%	0.814	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.3	-5.3	177.7	0	0	0	0	0	115.4	I4 P8	I4-G6 PolarHBondContact O-N 2.71Å; G6-P8 WeakPolarHBondContact O-CD 3.31Å
7	Q	51.1	Low	67.5	Low	131 Å²	131	105.3 Å²	105.3	61%	0.612	58%	0.584	S	S	*	*			trans	-75.2	121	170	-156.2	165.1	9.7	0	0	108.9	I4 V9	I4-Q7 PolarHBondContact O-N 3.38Å; Q7-V9 PolarHBondContact O-N 3.43Å; Q7-V9 VanDerWaalsContact O-N 3.08Å
8	P	53.1	Low	69.2	Low	107 Å²	107	99.4 Å²	99.4	70%	0.695	55%	0.552	S	S	*	*			trans	-60.2	119.2	178.7	22.3	-30.8	0	0	0	108.8	G6 T10	G6-P8 WeakPolarHBondContact O-CD 3.31Å; P8-T10 VanDerWaalsContact C-N 3.28Å; P8-T10 PolarHBondContact O-N 3.31Å
9	V	56.3	Low	70.8	Confident	121 Å²	121	98.3 Å²	98.3	73%	0.733	55%	0.55	S	S	*	*			trans	-75.5	91.2	171.4	-174.9	0	0	0	0	106.4	Q7 A11	Q7-V9 PolarHBondContact O-N 3.43Å; Q7-V9 VanDerWaalsContact O-N 3.08Å; V9-A11 PolarHBondContact O-N 2.72Å
10	T	63.3	Low	72.1	Confident	90 Å²	90	94.4 Å²	94.4	55%	0.552	53%	0.527	S	S	*	.			trans	-73.6	81.2	173.3	-41.8	0	0	0	0	108.2	P8 V12	P8-T10 VanDerWaalsContact C-N 3.28Å; P8-T10 PolarHBondContact O-N 3.31Å; T10-V12 PolarHBondContact O-N 2.75Å
11	A	68.6	Low	73.2	Confident	47 Å²	47	94.4 Å²	94.4	39%	0.388	53%	0.525	S	S	.	.			trans	-73.9	117	170.1	0	0	0	0	0	108	V9 V13 T110	V9-A11 PolarHBondContact O-N 2.72Å; A11-V13 PolarHBondContact O-N 2.76Å; A11-T110 HydrophobicContact CB-CG2 4.08Å
12	V	84.3	Confident	75.7	Confident	29 Å²	29	89.7 Å²	89.7	18%	0.176	49%	0.494	C	S	.	.			trans	-77.7	111.8	174.8	-176.3	0	0	0	0	107.6	T10 L114 E115 V118	T10-V12 PolarHBondContact O-N 2.75Å; V12-L114 HydrophobicContact CB-CB 4.15Å; V12-L114 HydrophobicContact CG1-CB 3.75Å; V12-E115 HydrophobicContact CB-CG 4.1Å; V12-E115 HydrophobicContact CG2-CG 4.21Å; V12-V118 HydrophobicContact CB-CG2 4.44Å; V12-V118 HydrophobicContact CG1-CG2 4.04Å; V12-V118 HydrophobicContact CG2-CB 3.7Å; V12-V118 HydrophobicContact CG2-CG1 4.08Å; V12-V118 HydrophobicContact CG2-CG2 3.56Å
13	V	89.8	Confident	77.8	Confident	75 Å²	75	90.5 Å²	90.5	46%	0.455	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	138.1	-179.7	-66.3	0	0	0	0	111.2	A11 L108 V109 T110	A11-V13 PolarHBondContact O-N 2.76Å; V13-L108 HydrophobicContact CB-CD1 3.75Å; V13-L108 HydrophobicContact CB-CD2 4.46Å; V13-L108 HydrophobicContact CB-CG 4.02Å; V13-L108 HydrophobicContact CG1-CD1 4.44Å; V13-L108 HydrophobicContact CG1-CD2 4.28Å; V13-L108 HydrophobicContact CG1-CG 4.2Å; V13-L108 HydrophobicContact CG2-CD1 3.94Å; V13-V109 CarbonylContact C-O 3.48Å; V13-V109 VanDerWaalsContact CA-O 3.26Å; V13-V109 WeakPolarHBondContact CA-O 3.31Å; V13-T110 HydrophobicContact CG1-CG2 3.8Å
14	Q	94.9	Very high	79.8	Confident	54 Å²	54	85.4 Å²	85.4	25%	0.252	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135.1	170.3	-173	177.9	-9.7	0	0	109.2	I16 V109 R111 L114	Q14-I16 HydrophobicContact CG-CD1 4.44Å; Q14-I16 HydrophobicContact CG-CG1 4.02Å; Q14-V109 HydrophobicContact CB-CG2 3.97Å; Q14-V109 PolarHBondContact N-O 2.77Å; Q14-V109 PolarHBondContact O-N 2.87Å; Q14-R111 VanDerWaalsContact OE1-NH1 3.08Å; Q14-L114 HydrophobicContact CB-CD1 3.93Å
15	R	97.6	Very high	81.5	Confident	221 Å²	221	88.7 Å²	88.7	83%	0.834	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.5	169.9	-69.4	177.5	-179.6	141.3	-0	108.8	L107 L108	R15-L107 WeakPolarHBondContact CA-O 3.33Å; R15-L108 HydrophobicContact CG-CD1 3.71Å
16	I	98.2	Very high	83.8	Confident	5 Å²	5	90 Å²	90	3%	0.026	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.4	-179.3	-62.2	179.3	0	0	0	108	Q14 I18 A69 L71 R106 L107 V109	Q14-I16 HydrophobicContact CG-CD1 4.44Å; Q14-I16 HydrophobicContact CG-CG1 4.02Å; I16-I18 HydrophobicContact CG2-CD1 4.28Å; I16-I18 HydrophobicContact CG2-CG1 3.85Å; I16-A69 HydrophobicContact CG2-CB 3.73Å; I16-L71 HydrophobicContact CD1-CB 4.21Å; I16-L71 HydrophobicContact CD1-CD1 3.7Å; I16-L71 HydrophobicContact CG2-CB 4.48Å; I16-R106 CarbonylContact O-C 3.57Å; I16-R106 WeakPolarHBondContact O-CA 3.49Å; I16-L107 HydrophobicContact CB-CB 4.38Å; I16-L107 PolarHBondContact N-O 2.9Å; I16-L107 PolarHBondContact O-N 2.82Å; I16-V109 HydrophobicContact CD1-CG2 3.74Å; I16-V109 HydrophobicContact CG1-CG2 4.38Å
17	E	98.6	Very high	85.5	Confident	97 Å²	97	88.2 Å²	88.2	45%	0.453	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	119.3	175.9	-174	166.2	131.2	0	0	109.3	A69 I104 R106	E17-A69 WeakPolarHBondContact O-CB 3.39Å; E17-I104 HydrophobicContact CG-CG2 3.41Å; E17-I104 VanDerWaalsContact CG-CG2 3.41Å; E17-R106 HydrophobicContact CB-CG 4.46Å; E17-R106 HydrophobicContact CG-CG 4.06Å; E17-R106 IonicContact OE1-NH2 2.67Å; E17-R106 PolarHBondContact OE1-NH2 2.8Å; E17-R106 IonicContact OE2-CZ 3.43Å; E17-R106 VanDerWaalsContact OE2-CZ 3.27Å; E17-R106 IonicContact OE2-NE 2.72Å; E17-R106 PolarHBondContact OE2-NE 2.87Å; E17-R106 IonicContact OE2-NH2 3.63Å; E17-R106 PolarHBondContact OE2-NH2 2.88Å
18	I	98.6	Very high	87.6	Confident	0 Å²	0	84.5 Å²	84.5	0%	0	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.9	-177.4	-50.1	177.6	0	0	0	108.7	I16 L29 F31 P65 A66 A69 L71 I104 V105 L107	I16-I18 HydrophobicContact CG2-CD1 4.28Å; I16-I18 HydrophobicContact CG2-CG1 3.85Å; I18-L29 HydrophobicContact CB-CD2 4.08Å; I18-L29 HydrophobicContact CG2-CD2 3.74Å; I18-F31 HydrophobicContact CD1-CD1 4.44Å; I18-F31 HydrophobicContact CD1-CE1 4.06Å; I18-P65 HydrophobicContact CG2-CB 3.71Å; I18-A66 HydrophobicContact CD1-CB 4.05Å; I18-A69 HydrophobicContact CB-CB 4.49Å; I18-A69 HydrophobicContact CG1-CB 3.8Å; I18-L71 HydrophobicContact CD1-CD2 4.14Å; I18-I104 WeakPolarHBondContact O-CA 3Å; I18-V105 PolarHBondContact N-O 2.84Å; I18-V105 PolarHBondContact O-N 3.33Å; I18-L107 HydrophobicContact CD1-CD1 3.7Å; I18-L107 HydrophobicContact CD1-CG 4.42Å
19	C	97.9	Very high	89.8	Confident	78 Å²	78	80.2 Å²	80.2	53%	0.527	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	120.3	166.5	-63.1	0	0	0	0	109	P65	C19-P65 VanDerWaalsContact O-CB 3.29Å; C19-P65 WeakPolarHBondContact O-CB 3.17Å
20	K	97.3	Very high	91.7	Very high	20 Å²	20	75 Å²	75	9%	0.087	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-63.1	137.8	177.4	-70.4	178.4	-179.1	154.6	0	110.3	L27 I28 L29 L97 K99 E102 D103 V105	K20-L27 HydrophobicContact CB-CB 3.93Å; K20-L27 HydrophobicContact CB-CD2 4.18Å; K20-L27 HydrophobicContact CB-CG 4.49Å; K20-L27 HydrophobicContact CD-CB 3.77Å; K20-L27 HydrophobicContact CD-CD1 4.26Å; K20-L27 HydrophobicContact CG-CB 4.4Å; K20-I28 WeakPolarHBondContact CA-O 3.3Å; K20-L29 HydrophobicContact CD-CD2 4.34Å; K20-L29 HydrophobicContact CG-CD2 3.5Å; K20-L29 HydrophobicContact CG-CG 4.03Å; K20-L97 WeakPolarHBondContact CE-O 3.44Å; K20-L97 PolarHBondContact NZ-O 2.93Å; K20-K99 PolarHBondContact NZ-O 3.08Å; K20-E102 VanDerWaalsContact CD-O 3.31Å; K20-E102 WeakPolarHBondContact CD-O 3.26Å; K20-E102 VanDerWaalsContact CE-O 3.31Å; K20-E102 WeakPolarHBondContact CE-O 3.49Å; K20-E102 PolarHBondContact NZ-O 3.23Å; K20-D103 WeakPolarHBondContact CB-O 3.12Å; K20-D103 WeakPolarHBondContact CG-O 3.34Å; K20-D103 PolarHBondContact N-O 3.4Å; K20-V105 VanDerWaalsContact CE-CG2 3.46Å
21	L	96.3	Very high	93.4	Very high	94 Å²	94	72 Å²	72	49%	0.492	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	133.5	173.5	177.6	65.7	0	0	0	109.7	L27 I28 P65	L21-L27 WeakPolarHBondContact O-CA 3.36Å; L21-I28 HydrophobicContact CB-CG1 4.04Å; L21-I28 HydrophobicContact CD2-CD1 4.4Å; L21-I28 PolarHBondContact N-O 2.98Å; L21-I28 WeakPolarHBondContact O-CG1 3.43Å; L21-I28 PolarHBondContact O-N 3.2Å; L21-P65 HydrophobicContact CB-CG 3.52Å; L21-P65 HydrophobicContact CD2-CG 4.49Å
22	R	94.9	Very high	94.9	Very high	153 Å²	153	72.4 Å²	72.4	58%	0.577	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	121.9	172.8	-169.7	162.4	-66.8	-97.7	-0.9	110.1	G24 H26 L27	R22-G24 WeakPolarHBondContact CG-O 3.47Å; R22-H26 WeakPolarHBondContact CA-O 3.29Å; R22-L27 HydrophobicContact CB-CD2 4.05Å; R22-L27 HydrophobicContact CG-CD2 4.46Å
23	Q	91.1	Very high	95.5	Very high	127 Å²	127	72.3 Å²	72.3	59%	0.593	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.9	96.4	175.6	-167.7	177.5	30.5	0	0	108.4	E25 H26 I28	Q23-E25 PolarHBondContact O-N 2.79Å; Q23-H26 PolarHBondContact N-O 2.79Å; Q23-H26 PolarHBondContact O-N 2.91Å; Q23-H26 VanDerWaalsContact O-N 3.17Å; Q23-I28 HydrophobicContact CB-CD1 4.38Å; Q23-I28 HydrophobicContact CB-CG1 4.42Å
24	G	90.8	Very high	95.9	Very high	60 Å²	60	69.5 Å²	69.5	62%	0.619	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	-129.4	-167.7	0	0	0	0	0	111.5	R22 H26	R22-G24 WeakPolarHBondContact CG-O 3.47Å; G24-H26 PolarHBondContact O-N 2.86Å
25	E	89.1	Confident	96.1	Very high	170 Å²	170	67.9 Å²	67.9	79%	0.794	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-3.6	177.9	-63.7	-57.2	125.9	0	0	113.9	Q23	Q23-E25 PolarHBondContact O-N 2.79Å
26	H	89.5	Confident	96.1	Very high	132 Å²	132	57.4 Å²	57.4	61%	0.611	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	147.5	-173.4	-60.5	-77.1	0	0	0	112.6	R22 Q23 G24	R22-H26 WeakPolarHBondContact CA-O 3.29Å; Q23-H26 PolarHBondContact N-O 2.79Å; Q23-H26 PolarHBondContact O-N 2.91Å; Q23-H26 VanDerWaalsContact O-N 3.17Å; G24-H26 PolarHBondContact O-N 2.86Å
27	L	94	Very high	96.1	Very high	41 Å²	41	60 Å²	60	22%	0.215	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.7	166.6	-70.6	174.7	0	0	0	108.8	K20 L21 R22 D103	K20-L27 HydrophobicContact CB-CB 3.93Å; K20-L27 HydrophobicContact CB-CD2 4.18Å; K20-L27 HydrophobicContact CB-CG 4.49Å; K20-L27 HydrophobicContact CD-CB 3.77Å; K20-L27 HydrophobicContact CD-CD1 4.26Å; K20-L27 HydrophobicContact CG-CB 4.4Å; L21-L27 WeakPolarHBondContact O-CA 3.36Å; R22-L27 HydrophobicContact CB-CD2 4.05Å; R22-L27 HydrophobicContact CG-CD2 4.46Å; L27-D103 WeakPolarHBondContact CD1-OD1 3.37Å
28	I	96.4	Very high	96.1	Very high	53 Å²	53	59.2 Å²	59.2	27%	0.272	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	147	-176.2	62.6	159.5	0	0	0	111.4	K20 L21 Q23	K20-I28 WeakPolarHBondContact CA-O 3.3Å; L21-I28 HydrophobicContact CB-CG1 4.04Å; L21-I28 HydrophobicContact CD2-CD1 4.4Å; L21-I28 PolarHBondContact N-O 2.98Å; L21-I28 WeakPolarHBondContact O-CG1 3.43Å; L21-I28 PolarHBondContact O-N 3.2Å; Q23-I28 HydrophobicContact CB-CD1 4.38Å; Q23-I28 HydrophobicContact CB-CG1 4.42Å
29	L	97.8	Very high	96.1	Very high	18 Å²	18	63.3 Å²	63.3	9%	0.094	34%	0.34	C	S	.	.			trans	-97.3	-22	175	-67.2	162.6	0	0	0	112.6	I18 K20 F31 A66 L97 V105	I18-L29 HydrophobicContact CB-CD2 4.08Å; I18-L29 HydrophobicContact CG2-CD2 3.74Å; K20-L29 HydrophobicContact CD-CD2 4.34Å; K20-L29 HydrophobicContact CG-CD2 3.5Å; K20-L29 HydrophobicContact CG-CG 4.03Å; L29-F31 HydrophobicContact CB-CD1 3.52Å; L29-F31 HydrophobicContact CB-CE1 3.44Å; L29-F31 VanDerWaalsContact CB-CE1 3.44Å; L29-F31 HydrophobicContact CD1-CD1 4.48Å; L29-F31 HydrophobicContact CD1-CE1 3.6Å; L29-F31 HydrophobicContact CD1-CZ 4.14Å; L29-F31 HydrophobicContact CD2-CE1 4.49Å; L29-F31 HydrophobicContact CG-CE1 4.02Å; L29-A66 VanDerWaalsContact O-CB 3.23Å; L29-A66 WeakPolarHBondContact O-CB 3.44Å; L29-A66 PolarHBondContact O-N 3.25Å; L29-L97 HydrophobicContact CD1-CB 3.93Å; L29-L97 HydrophobicContact CD1-CD2 4.12Å; L29-V105 HydrophobicContact CD1-CG2 4.43Å; L29-V105 HydrophobicContact CD2-CB 3.94Å; L29-V105 HydrophobicContact CD2-CG2 3.93Å
30	G	97.8	Very high	96	Very high	10 Å²	10	64.2 Å²	64.2	10%	0.103	34%	0.34	C	S	.	.	S	Bend	trans	77.1	32.2	-178.8	0	0	0	0	0	114.5	T61	G30-T61 WeakPolarHBondContact O-CB 3.16Å; G30-T61 PolarHBondContact O-N 2.83Å; G30-T61 PolarHBondContact O-OG1 3.37Å
31	F	98.6	Very high	95.9	Very high	29 Å²	29	64.3 Å²	64.3	13%	0.127	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	167.8	170.8	74.7	-83.4	0	0	0	111.4	I18 L29 I33 V57 R59 V60 A66 L71 L97 L107	I18-F31 HydrophobicContact CD1-CD1 4.44Å; I18-F31 HydrophobicContact CD1-CE1 4.06Å; L29-F31 HydrophobicContact CB-CD1 3.52Å; L29-F31 HydrophobicContact CB-CE1 3.44Å; L29-F31 VanDerWaalsContact CB-CE1 3.44Å; L29-F31 HydrophobicContact CD1-CD1 4.48Å; L29-F31 HydrophobicContact CD1-CE1 3.6Å; L29-F31 HydrophobicContact CD1-CZ 4.14Å; L29-F31 HydrophobicContact CD2-CE1 4.49Å; L29-F31 HydrophobicContact CG-CE1 4.02Å; F31-I33 HydrophobicContact CD2-CG2 3.99Å; F31-I33 HydrophobicContact CE2-CG2 3.46Å; F31-I33 VanDerWaalsContact CE2-CG2 3.46Å; F31-V57 HydrophobicContact CB-CG1 4.32Å; F31-V57 HydrophobicContact CD2-CG1 4.13Å; F31-V57 HydrophobicContact CD2-CG2 4.14Å; F31-V57 HydrophobicContact CE2-CG2 4.31Å; F31-R59 CarbonylContact C-O 3.51Å; F31-R59 WeakPolarHBondContact CA-O 3.39Å; F31-R59 VanDerWaalsContact CB-O 3.25Å; F31-R59 WeakPolarHBondContact CB-O 3.46Å; F31-V60 HydrophobicContact CB-CG2 4.36Å; F31-A66 HydrophobicContact CB-CB 3.91Å; F31-A66 HydrophobicContact CD1-CB 3.77Å; F31-A66 HydrophobicContact CG-CB 4.23Å; F31-L71 HydrophobicContact CB-CD2 4.02Å; F31-L71 HydrophobicContact CD1-CD2 3.77Å; F31-L71 HydrophobicContact CD2-CD2 3.79Å; F31-L71 HydrophobicContact CE1-CD2 4.05Å; F31-L71 HydrophobicContact CE2-CD2 4.08Å; F31-L71 HydrophobicContact CG-CD2 3.61Å; F31-L71 HydrophobicContact CZ-CD2 4.21Å; F31-L97 HydrophobicContact CE2-CD1 4.21Å; F31-L97 HydrophobicContact CZ-CD1 3.99Å; F31-L97 HydrophobicContact CZ-CD2 3.82Å; F31-L107 HydrophobicContact CZ-CD1 4.19Å
32	S	98.6	Very high	95.8	Very high	54 Å²	54	61.5 Å²	61.5	38%	0.378	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	150.9	175.7	-54.9	0	0	0	0	110.5	V57 T58 R59	S32-V57 WeakPolarHBondContact O-CA 3.33Å; S32-T58 WeakPolarHBondContact CB-OG1 3.39Å; S32-T58 PolarHBondContact O-N 3.32Å; S32-T58 PolarHBondContact O-OG1 3.43Å; S32-R59 PolarHBondContact N-O 3.48Å
33	I	98.5	Very high	95.7	Very high	28 Å²	28	61.4 Å²	61.4	14%	0.144	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	157.3	176.4	58.9	163.5	0	0	0	111.8	F31 I55 Y56 A93 L97	F31-I33 HydrophobicContact CD2-CG2 3.99Å; F31-I33 HydrophobicContact CE2-CG2 3.46Å; F31-I33 VanDerWaalsContact CE2-CG2 3.46Å; I33-I55 HydrophobicContact CB-CG2 3.93Å; I33-I55 HydrophobicContact CD1-CG2 4.09Å; I33-I55 HydrophobicContact CG2-CG2 3.94Å; I33-Y56 CarbonylContact C-O 3.5Å; I33-Y56 WeakPolarHBondContact CA-O 3.43Å; I33-A93 HydrophobicContact CD1-CB 3.79Å; I33-L97 HydrophobicContact CD1-CD1 3.97Å; I33-L97 HydrophobicContact CG2-CD1 3.85Å
34	G	98.2	Very high	95.8	Very high	15 Å²	15	56.1 Å²	56.1	16%	0.155	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	167.7	169.9	0	0	0	0	0	110.5	I55 Y56	G34-I55 WeakPolarHBondContact O-CA 3.37Å; G34-Y56 PolarHBondContact N-O 3.31Å; G34-Y56 PolarHBondContact O-N 3.07Å
35	G	97.9	Very high	96	Very high	20 Å²	20	57.8 Å²	57.8	21%	0.206	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	86.6	-166.2	-175.6	0	0	0	0	0	113.4	Q39 H90	G35-Q39 WeakPolarHBondContact O-CG 3.36Å; G35-H90 WeakPolarHBondContact O-CB 3.44Å; G35-H90 PolarHBondContact O-ND1 3.38Å
36	G	98.3	Very high	96.2	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.01	29%	0.29	C	S	.	.			trans	119.5	150.6	-167.2	0	0	0	0	0	111.2	D38 Q39 K53 V88	G36-D38 PolarHBondContact O-N 3.17Å; G36-D38 VanDerWaalsContact O-N 3.12Å; G36-Q39 PolarHBondContact O-N 3.33Å; G36-K53 CarbonylContact C-O 3.55Å; G36-K53 VanDerWaalsContact C-O 3.23Å; G36-K53 VanDerWaalsContact CA-O 3.26Å; G36-K53 WeakPolarHBondContact CA-O 3.46Å; G36-K53 PolarHBondContact N-O 3.08Å; G36-V88 WeakPolarHBondContact CA-O 3.47Å
37	I	98.1	Very high	96.2	Very high	59 Å²	59	45.8 Å²	45.8	30%	0.303	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.1	-175.4	65.2	178.8	0	0	0	113.8	K53 M87 V88 T89	I37-K53 HydrophobicContact CB-CD 4.48Å; I37-K53 HydrophobicContact CG2-CB 4.2Å; I37-K53 PolarHBondContact O-NZ 3.18Å; I37-M87 HydrophobicContact CG2-CB 4.49Å; I37-M87 HydrophobicContact CG2-CE 4.18Å; I37-M87 HydrophobicContact CG2-SD 4.13Å; I37-V88 PolarHBondContact N-O 2.93Å; I37-T89 HydrophobicContact CD1-CG2 4.23Å; I37-T89 HydrophobicContact CG1-CG2 3.97Å
38	D	98.2	Very high	95.9	Very high	82 Å²	82	51.1 Å²	51.1	44%	0.439	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-2.1	178.6	62.7	-44.6	0	0	0	113.9	G36 T89 H90	G36-D38 PolarHBondContact O-N 3.17Å; G36-D38 VanDerWaalsContact O-N 3.12Å; D38-T89 HydrophobicContact CB-CG2 4.19Å; D38-T89 WeakPolarHBondContact OD1-CA 3.01Å; D38-T89 WeakPolarHBondContact OD1-CB 3.43Å; D38-H90 PolarHBondContact OD1-N 3.16Å
39	Q	97.8	Very high	95.6	Very high	86 Å²	86	52.9 Å²	52.9	40%	0.402	30%	0.296	S	S	.	.	S	Bend	trans	-104	162.2	178.8	-55.3	-59.3	-56.8	0	0	111.4	G35 G36 P41 K53 H90	G35-Q39 WeakPolarHBondContact O-CG 3.36Å; G36-Q39 PolarHBondContact O-N 3.33Å; Q39-P41 WeakPolarHBondContact O-CD 3.37Å; Q39-K53 PolarHBondContact O-NZ 3.18Å; Q39-H90 HydrophobicContact CG-CB 3.95Å
40	D	97.2	Very high	95.4	Very high	97 Å²	97	57 Å²	57	52%	0.519	31%	0.313	S	S	.	.			trans	-75.7	109.1	172	178.2	10.8	0	0	0	110.1	G42 Q43	D40-G42 PolarHBondContact O-N 2.92Å; D40-G42 PolarHBondContact OD1-N 2.93Å; D40-Q43 HydrophobicContact CB-CG 4.2Å; D40-Q43 PolarHBondContact O-N 2.94Å; D40-Q43 WeakPolarHBondContact OD2-CG 3.44Å; D40-Q43 PolarHBondContact OD2-NE2 2.81Å
41	P	95.1	Very high	95.2	Very high	21 Å²	21	60.3 Å²	60.3	14%	0.136	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-69	-19.7	179.8	31	-36.4	0	0	0	112.9	Q39 Q43 N44 K50 D52 K53	Q39-P41 WeakPolarHBondContact O-CD 3.37Å; P41-Q43 PolarHBondContact O-N 3.39Å; P41-N44 WeakPolarHBondContact O-CB 3.46Å; P41-N44 PolarHBondContact O-N 2.89Å; P41-N44 VanDerWaalsContact O-N 3.1Å; P41-K50 WeakPolarHBondContact CB-O 3.41Å; P41-K50 VanDerWaalsContact CG-O 3.28Å; P41-K50 WeakPolarHBondContact CG-O 3.46Å; P41-D52 VanDerWaalsContact CB-O 3.26Å; P41-D52 WeakPolarHBondContact CB-O 3.47Å; P41-K53 HydrophobicContact CB-CG 4.13Å; P41-K53 HydrophobicContact CG-CG 4.14Å
42	G	94.7	Very high	95	Very high	36 Å²	36	60.2 Å²	60.2	37%	0.371	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-62.2	-26.6	177.7	0	0	0	0	0	113.3	D40 N44	D40-G42 PolarHBondContact O-N 2.92Å; D40-G42 PolarHBondContact OD1-N 2.93Å; G42-N44 VanDerWaalsContact C-N 3.34Å
43	Q	92.4	Very high	94.9	Very high	151 Å²	151	61.4 Å²	61.4	71%	0.706	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-81.5	-9.5	178.4	-56.2	-53.8	-45.7	0	0	113.7	D40 P41 P45	D40-Q43 HydrophobicContact CB-CG 4.2Å; D40-Q43 PolarHBondContact O-N 2.94Å; D40-Q43 WeakPolarHBondContact OD2-CG 3.44Å; D40-Q43 PolarHBondContact OD2-NE2 2.81Å; P41-Q43 PolarHBondContact O-N 3.39Å; Q43-P45 WeakPolarHBondContact O-CD 3.46Å
44	N	93.1	Very high	94.9	Very high	15 Å²	15	60.1 Å²	60.1	8%	0.08	33%	0.328	C	S	.	.			trans	-78	113	-177.6	-178	-2	0	0	0	110.6	P41 G42 F46 K50 Y56	P41-N44 WeakPolarHBondContact O-CB 3.46Å; P41-N44 PolarHBondContact O-N 2.89Å; P41-N44 VanDerWaalsContact O-N 3.1Å; G42-N44 VanDerWaalsContact C-N 3.34Å; N44-F46 VanDerWaalsContact C-N 3.29Å; N44-F46 PolarHBondContact O-N 3.28Å; N44-F46 WeakPolarHBondContact OD1-CB 3.45Å; N44-F46 WeakPolarHBondContact OD1-CD2 3.42Å; N44-F46 PolarHBondContact OD1-N 3.28Å; N44-K50 PolarHBondContact O-NZ 2.78Å; N44-Y56 WeakPolarHBondContact ND2-CD2 3.27Å; N44-Y56 VanDerWaalsContact ND2-CE2 3.28Å; N44-Y56 WeakPolarHBondContact ND2-CE2 3.4Å
45	P	93.8	Very high	94.9	Very high	96 Å²	96	59.5 Å²	59.5	62%	0.623	32%	0.321	S	S	*	.	S	Bend	trans	-77.4	-15.1	-179.2	33.3	-35.4	0	0	0	113	Q43	Q43-P45 WeakPolarHBondContact O-CD 3.46Å
46	F	93.3	Very high	94.9	Very high	45 Å²	45	59.2 Å²	59.2	20%	0.197	31%	0.314	C	S	.	.	S	Bend	trans	-88.4	-26	-172.6	-54.2	-70.7	0	0	0	113.1	N44 Y56 T58 M73 K112	N44-F46 VanDerWaalsContact C-N 3.29Å; N44-F46 PolarHBondContact O-N 3.28Å; N44-F46 WeakPolarHBondContact OD1-CB 3.45Å; N44-F46 WeakPolarHBondContact OD1-CD2 3.42Å; N44-F46 PolarHBondContact OD1-N 3.28Å; F46-Y56 HydrophobicContact CB-CD1 3.68Å; F46-Y56 HydrophobicContact CB-CE1 4.11Å; F46-Y56 HydrophobicContact CB-CG 4.32Å; F46-T58 HydrophobicContact CD2-CG2 4.46Å; F46-T58 HydrophobicContact CE2-CG2 3.88Å; F46-M73 HydrophobicContact CE1-CE 4.46Å; F46-M73 HydrophobicContact CE1-CG 3.56Å; F46-M73 HydrophobicContact CE1-SD 4.02Å; F46-M73 HydrophobicContact CZ-CG 3.73Å; F46-M73 HydrophobicContact CZ-SD 4.02Å; F46-K112 WeakPolarHBondContact O-CE 3.4Å; F46-K112 PolarHBondContact O-NZ 2.55Å
47	S	90.1	Very high	94.9	Very high	5 Å²	5	59.1 Å²	59.1	4%	0.035	31%	0.313	C	S	.	.			trans	-85	135.5	174.9	-172.3	0	0	0	0	112.1	D49 K50 D52	S47-D49 WeakPolarHBondContact CB-O 3.34Å; S47-D49 PolarHBondContact OG-N 3.07Å; S47-D49 VanDerWaalsContact OG-N 3.12Å; S47-D49 PolarHBondContact OG-O 3.39Å; S47-K50 PolarHBondContact O-NZ 3.08Å; S47-D52 VanDerWaalsContact OG-CB 3.3Å; S47-D52 WeakPolarHBondContact OG-CB 3.35Å
48	E	87.4	Confident	94.9	Very high	153 Å²	153	58.7 Å²	58.7	72%	0.715	31%	0.313	S	S	*	.	S	Bend	trans	-77.1	-33	166.3	-89.8	159.2	-133.7	0	0	111.7	K50 K112	E48-K50 PolarHBondContact O-N 3.02Å; E48-K112 VanDerWaalsContact CD-NZ 3.3Å; E48-K112 VanDerWaalsContact CG-NZ 3.3Å; E48-K112 WeakPolarHBondContact OE1-CE 3.25Å; E48-K112 IonicContact OE1-NZ 2.74Å; E48-K112 PolarHBondContact OE1-NZ 3.11Å
49	D	91.6	Very high	94.9	Very high	90 Å²	90	62.3 Å²	62.3	48%	0.481	32%	0.321	S	S	.	.	S	Bend	trans	-86.3	107.2	172.8	-178.3	-4.6	0	0	0	109	S47 S51 D52	S47-D49 WeakPolarHBondContact CB-O 3.34Å; S47-D49 PolarHBondContact OG-N 3.07Å; S47-D49 VanDerWaalsContact OG-N 3.12Å; S47-D49 PolarHBondContact OG-O 3.39Å; D49-S51 VanDerWaalsContact CG-OG 3.24Å; D49-S51 PolarHBondContact O-N 2.98Å; D49-S51 WeakPolarHBondContact OD1-CA 3.46Å; D49-S51 WeakPolarHBondContact OD1-CB 3.16Å; D49-S51 PolarHBondContact OD1-N 3.19Å; D49-S51 PolarHBondContact OD1-OG 2.97Å; D49-S51 PolarHBondContact OD2-OG 2.88Å; D49-D52 HydrophobicContact CB-CB 4.21Å; D49-D52 WeakPolarHBondContact O-CB 3.23Å; D49-D52 PolarHBondContact O-N 3.17Å
50	K	92.1	Very high	95	Very high	104 Å²	104	59.5 Å²	59.5	45%	0.452	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	1.6	179.1	-61.2	-51	-172.9	-163.5	0	114	P41 N44 S47 E48	P41-K50 WeakPolarHBondContact CB-O 3.41Å; P41-K50 VanDerWaalsContact CG-O 3.28Å; P41-K50 WeakPolarHBondContact CG-O 3.46Å; N44-K50 PolarHBondContact O-NZ 2.78Å; S47-K50 PolarHBondContact O-NZ 3.08Å; E48-K50 PolarHBondContact O-N 3.02Å
51	S	94.1	Very high	95	Very high	79 Å²	79	57.8 Å²	57.8	55%	0.552	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-8.5	165.9	75.8	0	0	0	0	113.1	D49 K53	D49-S51 VanDerWaalsContact CG-OG 3.24Å; D49-S51 PolarHBondContact O-N 2.98Å; D49-S51 WeakPolarHBondContact OD1-CA 3.46Å; D49-S51 WeakPolarHBondContact OD1-CB 3.16Å; D49-S51 PolarHBondContact OD1-N 3.19Å; D49-S51 PolarHBondContact OD1-OG 2.97Å; D49-S51 PolarHBondContact OD2-OG 2.88Å; S51-K53 PolarHBondContact O-N 3.25Å
52	D	95.1	Very high	95.2	Very high	27 Å²	27	61.6 Å²	61.6	14%	0.144	33%	0.327	C	S	.	.			trans	-70.5	115	-177.8	-173.7	2.3	0	0	0	112.2	P41 S47 D49 G54 Y56 K76	P41-D52 VanDerWaalsContact CB-O 3.26Å; P41-D52 WeakPolarHBondContact CB-O 3.47Å; S47-D52 VanDerWaalsContact OG-CB 3.3Å; S47-D52 WeakPolarHBondContact OG-CB 3.35Å; D49-D52 HydrophobicContact CB-CB 4.21Å; D49-D52 WeakPolarHBondContact O-CB 3.23Å; D49-D52 PolarHBondContact O-N 3.17Å; D52-G54 PolarHBondContact OD1-N 2.95Å; D52-Y56 PolarHBondContact OD2-OH 3.42Å; D52-K76 IonicContact OD1-NZ 2.76Å; D52-K76 PolarHBondContact OD1-NZ 2.81Å; D52-K76 WeakPolarHBondContact OD2-CE 3.43Å; D52-K76 IonicContact OD2-NZ 3.51Å; D52-K76 PolarHBondContact OD2-NZ 2.62Å
53	K	96.8	Very high	95.3	Very high	79 Å²	79	62.9 Å²	62.9	34%	0.343	34%	0.34	S	S	.	.			trans	-96.4	8.7	-178	-77.4	169.5	174.2	-70.3	0	114.1	G36 I37 Q39 P41 S51	G36-K53 CarbonylContact C-O 3.55Å; G36-K53 VanDerWaalsContact C-O 3.23Å; G36-K53 VanDerWaalsContact CA-O 3.26Å; G36-K53 WeakPolarHBondContact CA-O 3.46Å; G36-K53 PolarHBondContact N-O 3.08Å; I37-K53 HydrophobicContact CB-CD 4.48Å; I37-K53 HydrophobicContact CG2-CB 4.2Å; I37-K53 PolarHBondContact O-NZ 3.18Å; Q39-K53 PolarHBondContact O-NZ 3.18Å; P41-K53 HydrophobicContact CB-CG 4.13Å; P41-K53 HydrophobicContact CG-CG 4.14Å; S51-K53 PolarHBondContact O-N 3.25Å
54	G	97.2	Very high	95.5	Very high	1 Å²	1	56 Å²	56	1%	0.01	31%	0.31	C	S	.	.			trans	-63.4	170.7	-178.9	0	0	0	0	0	114.3	D52 Y56	D52-G54 PolarHBondContact OD1-N 2.95Å; G54-Y56 WeakPolarHBondContact O-CD2 3.44Å
55	I	98.6	Very high	95.8	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	127.6	176.5	-56.8	-61.3	0	0	0	109.7	I33 G34 V77 V88 A93	I33-I55 HydrophobicContact CB-CG2 3.93Å; I33-I55 HydrophobicContact CD1-CG2 4.09Å; I33-I55 HydrophobicContact CG2-CG2 3.94Å; G34-I55 WeakPolarHBondContact O-CA 3.37Å; I55-V77 HydrophobicContact CB-CB 4.31Å; I55-V77 HydrophobicContact CG2-CB 4.22Å; I55-V77 HydrophobicContact CG2-CG2 4.34Å; I55-V77 PolarHBondContact O-N 3Å; I55-V88 HydrophobicContact CD1-CG2 4.1Å; I55-V88 HydrophobicContact CG1-CG2 3.8Å; I55-A93 HydrophobicContact CD1-CB 3.57Å; I55-A93 HydrophobicContact CG1-CB 3.71Å; I55-A93 HydrophobicContact CG2-CB 4.28Å
56	Y	98.4	Very high	96	Very high	14 Å²	14	51.8 Å²	51.8	6%	0.055	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145	-178.2	-77.5	-97.4	0	0	0	111.8	I33 G34 N44 F46 D52 G54 T58 D75 K76	I33-Y56 CarbonylContact C-O 3.5Å; I33-Y56 WeakPolarHBondContact CA-O 3.43Å; G34-Y56 PolarHBondContact N-O 3.31Å; G34-Y56 PolarHBondContact O-N 3.07Å; N44-Y56 WeakPolarHBondContact ND2-CD2 3.27Å; N44-Y56 VanDerWaalsContact ND2-CE2 3.28Å; N44-Y56 WeakPolarHBondContact ND2-CE2 3.4Å; F46-Y56 HydrophobicContact CB-CD1 3.68Å; F46-Y56 HydrophobicContact CB-CE1 4.11Å; F46-Y56 HydrophobicContact CB-CG 4.32Å; D52-Y56 PolarHBondContact OD2-OH 3.42Å; G54-Y56 WeakPolarHBondContact O-CD2 3.44Å; Y56-T58 PolarHBondContact O-N 2.9Å; Y56-D75 WeakPolarHBondContact CA-O 3.42Å; Y56-K76 HydrophobicContact CD1-CB 4.07Å; Y56-K76 HydrophobicContact CD1-CG 4.48Å; Y56-K76 HydrophobicContact CD2-CG 4.44Å; Y56-K76 HydrophobicContact CE1-CB 3.69Å; Y56-K76 HydrophobicContact CE1-CD 4.39Å; Y56-K76 HydrophobicContact CE1-CG 4.04Å; Y56-K76 HydrophobicContact CE2-CD 4.16Å; Y56-K76 HydrophobicContact CE2-CG 3.97Å
57	V	98.4	Very high	96.3	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	114.5	170.7	-178.9	0	0	0	0	109.1	F31 S32 V60 L71 M72 G74 D75 V77	F31-V57 HydrophobicContact CB-CG1 4.32Å; F31-V57 HydrophobicContact CD2-CG1 4.13Å; F31-V57 HydrophobicContact CD2-CG2 4.14Å; F31-V57 HydrophobicContact CE2-CG2 4.31Å; S32-V57 WeakPolarHBondContact O-CA 3.33Å; V57-V60 HydrophobicContact CG1-CG2 3.64Å; V57-L71 HydrophobicContact CG1-CD2 4.23Å; V57-L71 HydrophobicContact CG1-CG 4.48Å; V57-L71 HydrophobicContact CG2-CD1 4.04Å; V57-L71 HydrophobicContact CG2-CD2 3.83Å; V57-L71 HydrophobicContact CG2-CG 4.02Å; V57-M72 WeakPolarHBondContact CB-O 3.34Å; V57-M72 WeakPolarHBondContact CG1-O 3.48Å; V57-G74 PolarHBondContact O-N 3.46Å; V57-D75 HydrophobicContact CB-CB 4.41Å; V57-D75 HydrophobicContact CG2-CB 4.03Å; V57-D75 PolarHBondContact N-O 2.81Å; V57-V77 HydrophobicContact CG2-CG2 4.12Å
58	T	98.2	Very high	96.6	Very high	50 Å²	50	59.6 Å²	59.6	31%	0.307	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-20.6	-176	55.5	0	0	0	0	113.1	S32 F46 Y56	S32-T58 WeakPolarHBondContact CB-OG1 3.39Å; S32-T58 PolarHBondContact O-N 3.32Å; S32-T58 PolarHBondContact O-OG1 3.43Å; F46-T58 HydrophobicContact CD2-CG2 4.46Å; F46-T58 HydrophobicContact CE2-CG2 3.88Å; Y56-T58 PolarHBondContact O-N 2.9Å
59	R	98.4	Very high	97.1	Very high	158 Å²	158	53.8 Å²	53.8	60%	0.596	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.2	145.1	177.7	-176.2	176.8	175.6	-178.8	-0.2	109.7	F31 S32	F31-R59 CarbonylContact C-O 3.51Å; F31-R59 WeakPolarHBondContact CA-O 3.39Å; F31-R59 VanDerWaalsContact CB-O 3.25Å; F31-R59 WeakPolarHBondContact CB-O 3.46Å; S32-R59 PolarHBondContact N-O 3.48Å
60	V	98.6	Very high	97.4	Very high	26 Å²	26	50.7 Å²	50.7	16%	0.158	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.9	167.8	-177.8	0	0	0	0	107.8	F31 V57 P62 A66 E67	F31-V60 HydrophobicContact CB-CG2 4.36Å; V57-V60 HydrophobicContact CG1-CG2 3.64Å; V60-P62 WeakPolarHBondContact O-CD 3.38Å; V60-A66 HydrophobicContact CG1-CB 4.19Å; V60-E67 HydrophobicContact CG1-CB 3.73Å; V60-E67 HydrophobicContact CG1-CG 4.43Å
61	T	98.2	Very high	97.7	Very high	62 Å²	62	45.9 Å²	45.9	38%	0.38	28%	0.275	S	S	.	.			trans	-80.1	123.4	178	-62.5	0	0	0	0	109.4	G30 G63 G64	G30-T61 WeakPolarHBondContact O-CB 3.16Å; G30-T61 PolarHBondContact O-N 2.83Å; G30-T61 PolarHBondContact O-OG1 3.37Å; T61-G63 PolarHBondContact O-N 2.98Å; T61-G64 WeakPolarHBondContact O-CA 3.26Å; T61-G64 PolarHBondContact O-N 3.05Å
62	P	97.8	Very high	97.9	Very high	101 Å²	101	46.8 Å²	46.8	66%	0.656	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	135.6	176.2	-25.2	35	0	0	0	112.2	V60 G64	V60-P62 WeakPolarHBondContact O-CD 3.38Å; P62-G64 PolarHBondContact O-N 2.75Å; P62-G64 VanDerWaalsContact O-N 3.17Å
63	G	97.2	Very high	98	Very high	62 Å²	62	51.2 Å²	51.2	64%	0.639	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	2.5	-173.7	0	0	0	0	0	114.7	T61 E67	T61-G63 PolarHBondContact O-N 2.98Å; G63-E67 PolarHBondContact N-OE2 2.76Å
64	G	98	Very high	98	Very high	8 Å²	8	48.6 Å²	48.6	8%	0.082	29%	0.288	C	S	.	.	S	Bend	trans	-79	168.1	-177.8	0	0	0	0	0	113.3	T61 P62 A66 E67 V68	T61-G64 WeakPolarHBondContact O-CA 3.26Å; T61-G64 PolarHBondContact O-N 3.05Å; P62-G64 PolarHBondContact O-N 2.75Å; P62-G64 VanDerWaalsContact O-N 3.17Å; G64-A66 VanDerWaalsContact C-N 3.3Å; G64-A66 PolarHBondContact O-N 2.88Å; G64-E67 PolarHBondContact O-N 3.38Å; G64-E67 VanDerWaalsContact O-N 3.11Å; G64-V68 WeakPolarHBondContact O-CG2 3.23Å; G64-V68 PolarHBondContact O-N 3.43Å; G64-V68 VanDerWaalsContact O-N 3.07Å
65	P	98.2	Very high	98.1	Very high	21 Å²	21	48.6 Å²	48.6	14%	0.136	29%	0.288	C	S	.	.	H	α-helix	trans	-58.2	-39.2	-176.9	-25.4	34.7	0	0	0	113.9	I18 C19 L21 A69	I18-P65 HydrophobicContact CG2-CB 3.71Å; C19-P65 VanDerWaalsContact O-CB 3.29Å; C19-P65 WeakPolarHBondContact O-CB 3.17Å; L21-P65 HydrophobicContact CB-CG 3.52Å; L21-P65 HydrophobicContact CD2-CG 4.49Å; P65-A69 WeakPolarHBondContact O-CB 3.4Å; P65-A69 PolarHBondContact O-N 2.89Å
66	A	98.6	Very high	98	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-41.8	176.8	0	0	0	0	0	113.1	I18 L29 F31 V60 G64 A69 G70 L71	I18-A66 HydrophobicContact CD1-CB 4.05Å; L29-A66 VanDerWaalsContact O-CB 3.23Å; L29-A66 WeakPolarHBondContact O-CB 3.44Å; L29-A66 PolarHBondContact O-N 3.25Å; F31-A66 HydrophobicContact CB-CB 3.91Å; F31-A66 HydrophobicContact CD1-CB 3.77Å; F31-A66 HydrophobicContact CG-CB 4.23Å; V60-A66 HydrophobicContact CG1-CB 4.19Å; G64-A66 VanDerWaalsContact C-N 3.3Å; G64-A66 PolarHBondContact O-N 2.88Å; A66-A69 PolarHBondContact O-N 3.31Å; A66-G70 PolarHBondContact O-N 2.94Å; A66-L71 HydrophobicContact CB-CB 4.11Å; A66-L71 HydrophobicContact CB-CD2 3.9Å; A66-L71 VanDerWaalsContact O-CB 3.25Å; A66-L71 WeakPolarHBondContact O-CB 3.44Å; A66-L71 PolarHBondContact O-N 3.5Å
67	E	98.4	Very high	98	Very high	93 Å²	93	49.7 Å²	49.7	44%	0.435	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-45.9	177.7	-169.5	-178.9	-109.7	0	0	110.8	V60 G63 G64 A69 G70	V60-E67 HydrophobicContact CG1-CB 3.73Å; V60-E67 HydrophobicContact CG1-CG 4.43Å; G63-E67 PolarHBondContact N-OE2 2.76Å; G64-E67 PolarHBondContact O-N 3.38Å; G64-E67 VanDerWaalsContact O-N 3.11Å; E67-A69 PolarHBondContact O-N 2.72Å; E67-G70 WeakPolarHBondContact O-CA 3.12Å; E67-G70 PolarHBondContact O-N 2.9Å
68	V	98.2	Very high	98	Very high	121 Å²	121	51.7 Å²	51.7	73%	0.733	30%	0.303	S	S	*	.	H	α-helix	trans	-59.5	-35.7	177.6	173.6	0	0	0	0	111.5	G64 G70	G64-V68 WeakPolarHBondContact O-CG2 3.23Å; G64-V68 PolarHBondContact O-N 3.43Å; G64-V68 VanDerWaalsContact O-N 3.07Å; V68-G70 PolarHBondContact O-N 3.25Å
69	A	98.2	Very high	98	Very high	32 Å²	32	52.8 Å²	52.8	26%	0.264	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-6.5	175.5	0	0	0	0	0	113.9	I16 E17 I18 P65 A66 E67	I16-A69 HydrophobicContact CG2-CB 3.73Å; E17-A69 WeakPolarHBondContact O-CB 3.39Å; I18-A69 HydrophobicContact CB-CB 4.49Å; I18-A69 HydrophobicContact CG1-CB 3.8Å; P65-A69 WeakPolarHBondContact O-CB 3.4Å; P65-A69 PolarHBondContact O-N 2.89Å; A66-A69 PolarHBondContact O-N 3.31Å; E67-A69 PolarHBondContact O-N 2.72Å
70	G	97.8	Very high	98	Very high	24 Å²	24	45.3 Å²	45.3	25%	0.247	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	18.1	178.6	0	0	0	0	0	115	A66 E67 V68 R111	A66-G70 PolarHBondContact O-N 2.94Å; E67-G70 WeakPolarHBondContact O-CA 3.12Å; E67-G70 PolarHBondContact O-N 2.9Å; V68-G70 PolarHBondContact O-N 3.25Å; G70-R111 PolarHBondContact O-NH2 3.5Å
71	L	98.4	Very high	98	Very high	4 Å²	4	46 Å²	46	2%	0.021	28%	0.279	C	S	.	.			trans	-71.5	136.9	169.8	-167.1	71.4	0	0	0	109.5	I16 I18 F31 V57 A66 D75 L107 V109	I16-L71 HydrophobicContact CD1-CB 4.21Å; I16-L71 HydrophobicContact CD1-CD1 3.7Å; I16-L71 HydrophobicContact CG2-CB 4.48Å; I18-L71 HydrophobicContact CD1-CD2 4.14Å; F31-L71 HydrophobicContact CB-CD2 4.02Å; F31-L71 HydrophobicContact CD1-CD2 3.77Å; F31-L71 HydrophobicContact CD2-CD2 3.79Å; F31-L71 HydrophobicContact CE1-CD2 4.05Å; F31-L71 HydrophobicContact CE2-CD2 4.08Å; F31-L71 HydrophobicContact CG-CD2 3.61Å; F31-L71 HydrophobicContact CZ-CD2 4.21Å; V57-L71 HydrophobicContact CG1-CD2 4.23Å; V57-L71 HydrophobicContact CG1-CG 4.48Å; V57-L71 HydrophobicContact CG2-CD1 4.04Å; V57-L71 HydrophobicContact CG2-CD2 3.83Å; V57-L71 HydrophobicContact CG2-CG 4.02Å; A66-L71 HydrophobicContact CB-CB 4.11Å; A66-L71 HydrophobicContact CB-CD2 3.9Å; A66-L71 VanDerWaalsContact O-CB 3.25Å; A66-L71 WeakPolarHBondContact O-CB 3.44Å; A66-L71 PolarHBondContact O-N 3.5Å; L71-D75 HydrophobicContact CD1-CB 4.26Å; L71-L107 HydrophobicContact CD1-CD1 3.9Å; L71-L107 HydrophobicContact CD2-CD1 4.16Å; L71-V109 HydrophobicContact CD1-CG1 3.99Å
72	M	97.9	Very high	97.9	Very high	97 Å²	97	45.9 Å²	45.9	48%	0.478	29%	0.29	S	S	.	.			trans	-122.2	153.4	-178	-64.5	-177	-172.3	0	0	111.4	V57 G74 D75 R111	V57-M72 WeakPolarHBondContact CB-O 3.34Å; V57-M72 WeakPolarHBondContact CG1-O 3.48Å; M72-G74 PolarHBondContact O-N 2.7Å; M72-D75 PolarHBondContact N-OD2 2.84Å; M72-D75 WeakPolarHBondContact O-CB 3.5Å; M72-D75 VanDerWaalsContact O-CG 3.3Å; M72-D75 PolarHBondContact O-N 3.47Å; M72-R111 PolarHBondContact SD-NH1 2.81Å
73	M	97.6	Very high	97.9	Very high	121 Å²	121	47.2 Å²	47.2	60%	0.596	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	137	168.9	-176.8	177.6	65.3	0	0	109.9	F46 D75	F46-M73 HydrophobicContact CE1-CE 4.46Å; F46-M73 HydrophobicContact CE1-CG 3.56Å; F46-M73 HydrophobicContact CE1-SD 4.02Å; F46-M73 HydrophobicContact CZ-CG 3.73Å; F46-M73 HydrophobicContact CZ-SD 4.02Å; M73-D75 VanDerWaalsContact C-N 3.34Å
74	G	96.9	Very high	97.9	Very high	24 Å²	24	48.1 Å²	48.1	25%	0.247	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	-6	-176.3	0	0	0	0	0	115	V57 M72 K76	V57-G74 PolarHBondContact O-N 3.46Å; M72-G74 PolarHBondContact O-N 2.7Å; G74-K76 PolarHBondContact O-N 3.44Å
75	D	97.7	Very high	98	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.269	C	S	.	.			trans	-60.1	132	170.6	-76.1	-13.4	0	0	0	110.3	Y56 V57 L71 M72 M73 V109 R111	Y56-D75 WeakPolarHBondContact CA-O 3.42Å; V57-D75 HydrophobicContact CB-CB 4.41Å; V57-D75 HydrophobicContact CG2-CB 4.03Å; V57-D75 PolarHBondContact N-O 2.81Å; L71-D75 HydrophobicContact CD1-CB 4.26Å; M72-D75 PolarHBondContact N-OD2 2.84Å; M72-D75 WeakPolarHBondContact O-CB 3.5Å; M72-D75 VanDerWaalsContact O-CG 3.3Å; M72-D75 PolarHBondContact O-N 3.47Å; M73-D75 VanDerWaalsContact C-N 3.34Å; D75-V109 HydrophobicContact CB-CB 4.14Å; D75-V109 HydrophobicContact CB-CG1 4.39Å; D75-V109 HydrophobicContact CB-CG2 4.34Å; D75-R111 WeakPolarHBondContact OD1-CB 3.44Å; D75-R111 WeakPolarHBondContact OD1-CG 3.4Å; D75-R111 IonicContact OD1-CZ 3.03Å; D75-R111 IonicContact OD1-NE 3.63Å; D75-R111 PolarHBondContact OD1-NE 2.86Å; D75-R111 IonicContact OD1-NH2 3.38Å; D75-R111 PolarHBondContact OD1-NH2 3.06Å; D75-R111 IonicContact OD2-CZ 3.27Å; D75-R111 IonicContact OD2-NE 2.75Å; D75-R111 IonicContact OD2-NH2 2.71Å; D75-R111 PolarHBondContact OD2-NH2 3.21Å
76	K	97.6	Very high	97.9	Very high	38 Å²	38	49.2 Å²	49.2	17%	0.165	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.6	171.8	-172.8	-179	-173.8	164	0	108.9	D52 Y56 G74 M78 V109 T110	D52-K76 IonicContact OD1-NZ 2.76Å; D52-K76 PolarHBondContact OD1-NZ 2.81Å; D52-K76 WeakPolarHBondContact OD2-CE 3.43Å; D52-K76 IonicContact OD2-NZ 3.51Å; D52-K76 PolarHBondContact OD2-NZ 2.62Å; Y56-K76 HydrophobicContact CD1-CB 4.07Å; Y56-K76 HydrophobicContact CD1-CG 4.48Å; Y56-K76 HydrophobicContact CD2-CG 4.44Å; Y56-K76 HydrophobicContact CE1-CB 3.69Å; Y56-K76 HydrophobicContact CE1-CD 4.39Å; Y56-K76 HydrophobicContact CE1-CG 4.04Å; Y56-K76 HydrophobicContact CE2-CD 4.16Å; Y56-K76 HydrophobicContact CE2-CG 3.97Å; G74-K76 PolarHBondContact O-N 3.44Å; K76-M78 HydrophobicContact CD-SD 3.83Å; K76-M78 HydrophobicContact CG-SD 3.93Å; K76-M78 PolarHBondContact O-N 3.17Å; K76-V109 CarbonylContact O-C 3.47Å; K76-V109 WeakPolarHBondContact O-CA 3.3Å; K76-V109 WeakPolarHBondContact O-CB 3.2Å; K76-T110 PolarHBondContact N-O 2.95Å; K76-T110 PolarHBondContact O-N 3.32Å
77	V	98.3	Very high	97.8	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.012	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	114.6	180	-173.7	0	0	0	0	109.3	I55 V57 V80 M85 L107 V109	I55-V77 HydrophobicContact CB-CB 4.31Å; I55-V77 HydrophobicContact CG2-CB 4.22Å; I55-V77 HydrophobicContact CG2-CG2 4.34Å; I55-V77 PolarHBondContact O-N 3Å; V57-V77 HydrophobicContact CG2-CG2 4.12Å; V77-V80 HydrophobicContact CG1-CG2 3.86Å; V77-M85 HydrophobicContact CG1-CB 4.39Å; V77-M85 HydrophobicContact CG1-CG 4.09Å; V77-M85 WeakPolarHBondContact O-CB 3.25Å; V77-L107 HydrophobicContact CG1-CD2 4.27Å; V77-V109 HydrophobicContact CG2-CG1 4.42Å
78	M	97.8	Very high	97.8	Very high	42 Å²	42	52 Å²	52	21%	0.207	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-38.2	179.2	-54.8	-54.3	-68.5	0	0	111.5	K76 M85 T86 L108 T110	K76-M78 HydrophobicContact CD-SD 3.83Å; K76-M78 HydrophobicContact CG-SD 3.93Å; K76-M78 PolarHBondContact O-N 3.17Å; M78-M85 PolarHBondContact O-N 3.34Å; M78-T86 HydrophobicContact CE-CG2 3.63Å; M78-L108 WeakPolarHBondContact CA-O 3.37Å; M78-L108 HydrophobicContact CB-CB 4.42Å; M78-L108 HydrophobicContact CB-CD2 4.4Å; M78-L108 HydrophobicContact CB-CG 4.47Å; M78-L108 WeakPolarHBondContact CB-O 3.43Å; M78-L108 PolarHBondContact N-O 2.91Å; M78-T110 HydrophobicContact CG-CG2 3.87Å; M78-T110 HydrophobicContact SD-CG2 4.24Å
79	Q	98.4	Very high	97.8	Very high	73 Å²	73	47.9 Å²	47.9	34%	0.341	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	151.1	178.4	-61.1	-176.2	-28.7	0	0	112.9	W83 L107 L108	Q79-W83 CarbonylContact C-O 3.23Å; Q79-W83 WeakPolarHBondContact CA-O 3.19Å; Q79-L107 WeakPolarHBondContact O-CA 3.35Å; Q79-L108 HydrophobicContact CB-CB 3.84Å; Q79-L108 HydrophobicContact CG-CB 4.25Å; Q79-L108 HydrophobicContact CG-CD2 4.25Å; Q79-L108 PolarHBondContact N-O 3.03Å; Q79-L108 PolarHBondContact O-N 3.03Å; Q79-L108 VanDerWaalsContact O-N 3.08Å
80	V	98.6	Very high	97.8	Very high	1 Å²	1	49 Å²	49	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	113	171	174.4	0	0	0	0	108.5	V77 G82 W83 M85 R96 L97 V105 L107	V77-V80 HydrophobicContact CG1-CG2 3.86Å; V80-G82 PolarHBondContact O-N 3.45Å; V80-W83 PolarHBondContact N-O 3.2Å; V80-W83 VanDerWaalsContact O-CB 3.3Å; V80-W83 WeakPolarHBondContact O-CB 3.4Å; V80-W83 PolarHBondContact O-N 3.29Å; V80-M85 HydrophobicContact CB-CE 4.14Å; V80-M85 HydrophobicContact CB-CG 4.21Å; V80-M85 HydrophobicContact CB-SD 4.26Å; V80-M85 HydrophobicContact CG2-CE 4.41Å; V80-M85 HydrophobicContact CG2-CG 3.66Å; V80-M85 HydrophobicContact CG2-SD 3.87Å; V80-R96 HydrophobicContact CB-CB 4.49Å; V80-R96 HydrophobicContact CG1-CB 4.14Å; V80-L97 HydrophobicContact CG1-CD2 3.94Å; V80-L97 HydrophobicContact CG2-CD2 3.66Å; V80-L97 HydrophobicContact CG2-CG 4.23Å; V80-V105 HydrophobicContact CG1-CG1 4Å; V80-L107 HydrophobicContact CB-CD2 4.34Å; V80-L107 HydrophobicContact CG1-CD2 4.46Å; V80-L107 HydrophobicContact CG2-CD2 3.65Å
81	N	97.6	Very high	97.8	Very high	41 Å²	41	50.5 Å²	50.5	22%	0.219	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	42	-178.4	-72.4	-20.2	0	0	0	112.6	W83 E102 I104 R106	N81-W83 VanDerWaalsContact C-N 3.25Å; N81-W83 PolarHBondContact O-N 3.48Å; N81-E102 PolarHBondContact ND2-OE2 2.96Å; N81-I104 PolarHBondContact ND2-O 2.67Å; N81-R106 PolarHBondContact N-O 3.38Å; N81-R106 PolarHBondContact OD1-N 2.9Å
82	G	96.9	Very high	97.9	Very high	59 Å²	59	54.8 Å²	54.8	61%	0.608	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	-5.8	-178.4	0	0	0	0	0	115.4	V80	V80-G82 PolarHBondContact O-N 3.45Å
83	W	97.8	Very high	97.9	Very high	129 Å²	129	50.1 Å²	50.1	49%	0.489	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	129.8	173.7	-65.2	83.7	0	0	0	110.4	Q79 V80 N81 M85 R96	Q79-W83 CarbonylContact C-O 3.23Å; Q79-W83 WeakPolarHBondContact CA-O 3.19Å; V80-W83 PolarHBondContact N-O 3.2Å; V80-W83 VanDerWaalsContact O-CB 3.3Å; V80-W83 WeakPolarHBondContact O-CB 3.4Å; V80-W83 PolarHBondContact O-N 3.29Å; N81-W83 VanDerWaalsContact C-N 3.25Å; N81-W83 PolarHBondContact O-N 3.48Å; W83-M85 HydrophobicContact CB-CE 3.64Å; W83-M85 WeakPolarHBondContact O-CE 3.46Å; W83-R96 VanDerWaalsContact CD2-NH1 3.34Å; W83-R96 VanDerWaalsContact CZ2-NH1 3.28Å
84	D	98.1	Very high	97.9	Very high	80 Å²	80	49.6 Å²	49.6	43%	0.428	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	133	174.9	-173	-99.7	0	0	0	111.9	T86 V88	D84-T86 WeakPolarHBondContact OD1-CB 3.47Å; D84-T86 PolarHBondContact OD1-N 2.67Å; D84-T86 PolarHBondContact OD1-OG1 2.7Å; D84-T86 WeakPolarHBondContact OD2-CG2 3.24Å; D84-V88 WeakPolarHBondContact O-CG1 3.5Å
85	M	98.2	Very high	98	Very high	3 Å²	3	54 Å²	54	2%	0.015	27%	0.271	C	S	.	.			trans	-113.2	8	-180	-65.2	-63.9	113.8	0	0	112.7	V77 M78 V80 W83 V88 A93 R96	V77-M85 HydrophobicContact CG1-CB 4.39Å; V77-M85 HydrophobicContact CG1-CG 4.09Å; V77-M85 WeakPolarHBondContact O-CB 3.25Å; M78-M85 PolarHBondContact O-N 3.34Å; V80-M85 HydrophobicContact CB-CE 4.14Å; V80-M85 HydrophobicContact CB-CG 4.21Å; V80-M85 HydrophobicContact CB-SD 4.26Å; V80-M85 HydrophobicContact CG2-CE 4.41Å; V80-M85 HydrophobicContact CG2-CG 3.66Å; V80-M85 HydrophobicContact CG2-SD 3.87Å; W83-M85 HydrophobicContact CB-CE 3.64Å; W83-M85 WeakPolarHBondContact O-CE 3.46Å; M85-V88 HydrophobicContact CB-CG2 4.41Å; M85-V88 HydrophobicContact CE-CG1 4.49Å; M85-V88 HydrophobicContact SD-CG2 4.06Å; M85-A93 HydrophobicContact SD-CB 4.23Å; M85-R96 HydrophobicContact CE-CB 4.14Å; M85-R96 HydrophobicContact CE-CG 3.86Å
86	T	96.1	Very high	98	Very high	49 Å²	49	57.6 Å²	57.6	30%	0.301	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-32	-172.9	65.7	0	0	0	0	112.9	M78 D84	M78-T86 HydrophobicContact CE-CG2 3.63Å; D84-T86 WeakPolarHBondContact OD1-CB 3.47Å; D84-T86 PolarHBondContact OD1-N 2.67Å; D84-T86 PolarHBondContact OD1-OG1 2.7Å; D84-T86 WeakPolarHBondContact OD2-CG2 3.24Å
87	M	96.8	Very high	98	Very high	134 Å²	134	56.3 Å²	56.3	66%	0.66	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.3	49.9	-175.1	-68	-64.5	-68.2	0	0	111.7	I37	I37-M87 HydrophobicContact CG2-CB 4.49Å; I37-M87 HydrophobicContact CG2-CE 4.18Å; I37-M87 HydrophobicContact CG2-SD 4.13Å
88	V	98.4	Very high	97.9	Very high	18 Å²	18	59.8 Å²	59.8	11%	0.109	30%	0.3	C	S	.	.			trans	-113	155.6	179.9	-58.9	0	0	0	0	111.6	G36 I37 I55 D84 M85 Q92 A93	G36-V88 WeakPolarHBondContact CA-O 3.47Å; I37-V88 PolarHBondContact N-O 2.93Å; I55-V88 HydrophobicContact CD1-CG2 4.1Å; I55-V88 HydrophobicContact CG1-CG2 3.8Å; D84-V88 WeakPolarHBondContact O-CG1 3.5Å; M85-V88 HydrophobicContact CB-CG2 4.41Å; M85-V88 HydrophobicContact CE-CG1 4.49Å; M85-V88 HydrophobicContact SD-CG2 4.06Å; V88-Q92 HydrophobicContact CB-CB 4.08Å; V88-A93 HydrophobicContact CG2-CB 3.95Å
89	T	98.8	Very high	97.7	Very high	35 Å²	35	60.6 Å²	60.6	22%	0.215	30%	0.303	C	S	.	.			trans	-72.5	159.9	167.7	70.5	0	0	0	0	110.9	I37 D38 D91 Q92 A93	I37-T89 HydrophobicContact CD1-CG2 4.23Å; I37-T89 HydrophobicContact CG1-CG2 3.97Å; D38-T89 HydrophobicContact CB-CG2 4.19Å; D38-T89 WeakPolarHBondContact OD1-CA 3.01Å; D38-T89 WeakPolarHBondContact OD1-CB 3.43Å; T89-D91 VanDerWaalsContact C-N 3.29Å; T89-D91 PolarHBondContact O-N 3.46Å; T89-Q92 WeakPolarHBondContact O-CB 3.32Å; T89-Q92 PolarHBondContact O-N 3.38Å; T89-Q92 WeakPolarHBondContact OG1-CB 3.36Å; T89-Q92 VanDerWaalsContact OG1-CG 3.24Å; T89-Q92 WeakPolarHBondContact OG1-CG 3.38Å; T89-Q92 PolarHBondContact OG1-N 3.23Å; T89-A93 PolarHBondContact O-N 3.45Å
90	H	98.6	Very high	97.3	Very high	55 Å²	55	65.9 Å²	65.9	26%	0.255	32%	0.324	S	S	.	.	H	α-helix	trans	-55	-46.2	176.3	-171.2	85.7	0	0	0	111.8	G35 D38 Q39 Q92 A93 R94	G35-H90 WeakPolarHBondContact O-CB 3.44Å; G35-H90 PolarHBondContact O-ND1 3.38Å; D38-H90 PolarHBondContact OD1-N 3.16Å; Q39-H90 HydrophobicContact CG-CB 3.95Å; H90-Q92 PolarHBondContact O-N 2.99Å; H90-A93 PolarHBondContact O-N 3.48Å; H90-R94 PolarHBondContact O-N 2.98Å
91	D	98.5	Very high	97	Very high	55 Å²	55	72.3 Å²	72.3	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-67.9	-34.4	-180	-175.5	63.7	0	0	0	112.7	T89 R94 K95	T89-D91 VanDerWaalsContact C-N 3.29Å; T89-D91 PolarHBondContact O-N 3.46Å; D91-R94 PolarHBondContact O-N 3.42Å; D91-R94 IonicContact OD1-CZ 2.93Å; D91-R94 VanDerWaalsContact OD1-CZ 3.24Å; D91-R94 IonicContact OD1-NE 2.84Å; D91-R94 PolarHBondContact OD1-NE 2.92Å; D91-R94 IonicContact OD1-NH2 2.67Å; D91-R94 PolarHBondContact OD1-NH2 3.36Å; D91-K95 WeakPolarHBondContact O-CB 3.48Å; D91-K95 WeakPolarHBondContact O-CG 3.44Å; D91-K95 PolarHBondContact O-N 2.96Å; D91-K95 WeakPolarHBondContact OD2-CD 3.28Å; D91-K95 WeakPolarHBondContact OD2-CE 3.26Å; D91-K95 IonicContact OD2-NZ 2.7Å; D91-K95 PolarHBondContact OD2-NZ 3.31Å
92	Q	98.6	Very high	96.9	Very high	94 Å²	94	72.4 Å²	72.4	44%	0.439	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-47.3	172.4	-77.2	171.6	-16.1	0	0	111	V88 T89 H90 R94 K95 R96	V88-Q92 HydrophobicContact CB-CB 4.08Å; T89-Q92 WeakPolarHBondContact O-CB 3.32Å; T89-Q92 PolarHBondContact O-N 3.38Å; T89-Q92 WeakPolarHBondContact OG1-CB 3.36Å; T89-Q92 VanDerWaalsContact OG1-CG 3.24Å; T89-Q92 WeakPolarHBondContact OG1-CG 3.38Å; T89-Q92 PolarHBondContact OG1-N 3.23Å; H90-Q92 PolarHBondContact O-N 2.99Å; Q92-R94 PolarHBondContact O-N 2.99Å; Q92-K95 PolarHBondContact O-N 3.49Å; Q92-R96 VanDerWaalsContact O-CG 3.27Å; Q92-R96 WeakPolarHBondContact O-CG 3.05Å; Q92-R96 PolarHBondContact O-N 3.25Å; Q92-R96 VanDerWaalsContact O-N 3.07Å
93	A	98.4	Very high	96.8	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-58.8	-48.2	176.3	0	0	0	0	0	111.5	I33 I55 M85 V88 T89 H90 K95 R96 L97	I33-A93 HydrophobicContact CD1-CB 3.79Å; I55-A93 HydrophobicContact CD1-CB 3.57Å; I55-A93 HydrophobicContact CG1-CB 3.71Å; I55-A93 HydrophobicContact CG2-CB 4.28Å; M85-A93 HydrophobicContact SD-CB 4.23Å; V88-A93 HydrophobicContact CG2-CB 3.95Å; T89-A93 PolarHBondContact O-N 3.45Å; H90-A93 PolarHBondContact O-N 3.48Å; A93-K95 PolarHBondContact O-N 2.93Å; A93-R96 PolarHBondContact O-N 3.13Å; A93-L97 WeakPolarHBondContact O-CG 3.42Å; A93-L97 PolarHBondContact O-N 3.02Å; A93-L97 VanDerWaalsContact O-N 3.08Å
94	R	98.3	Very high	96.8	Very high	110 Å²	110	70.4 Å²	70.4	42%	0.415	34%	0.343	S	S	.	.	H	α-helix	trans	-54.5	-51.5	175.7	-175	-167.2	67.5	80.5	-3.9	111.6	H90 D91 Q92 R96 L97 T98	H90-R94 PolarHBondContact O-N 2.98Å; D91-R94 PolarHBondContact O-N 3.42Å; D91-R94 IonicContact OD1-CZ 2.93Å; D91-R94 VanDerWaalsContact OD1-CZ 3.24Å; D91-R94 IonicContact OD1-NE 2.84Å; D91-R94 PolarHBondContact OD1-NE 2.92Å; D91-R94 IonicContact OD1-NH2 2.67Å; D91-R94 PolarHBondContact OD1-NH2 3.36Å; Q92-R94 PolarHBondContact O-N 2.99Å; R94-R96 VanDerWaalsContact C-N 3.28Å; R94-R96 PolarHBondContact O-N 3.42Å; R94-L97 PolarHBondContact O-N 3.38Å; R94-T98 HydrophobicContact CG-CG2 4.45Å; R94-T98 WeakPolarHBondContact O-CG2 3.42Å; R94-T98 PolarHBondContact O-N 3.39Å; R94-T98 PolarHBondContact O-OG1 3.37Å; R94-T98 VanDerWaalsContact O-OG1 3.05Å
95	K	97.9	Very high	96.8	Very high	116 Å²	116	66.6 Å²	66.6	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-58.2	-38.4	179.7	-80.1	170.6	171.4	157.3	0	112.5	D91 Q92 A93	D91-K95 WeakPolarHBondContact O-CB 3.48Å; D91-K95 WeakPolarHBondContact O-CG 3.44Å; D91-K95 PolarHBondContact O-N 2.96Å; D91-K95 WeakPolarHBondContact OD2-CD 3.28Å; D91-K95 WeakPolarHBondContact OD2-CE 3.26Å; D91-K95 IonicContact OD2-NZ 2.7Å; D91-K95 PolarHBondContact OD2-NZ 3.31Å; Q92-K95 PolarHBondContact O-N 3.49Å; A93-K95 PolarHBondContact O-N 2.93Å
96	R	97.7	Very high	96.9	Very high	76 Å²	76	72.5 Å²	72.5	29%	0.287	34%	0.344	S	S	.	.	H	α-helix	trans	-68.3	-40.1	178.3	-64.6	-68.6	173.5	175.4	-0.7	111.9	V80 W83 M85 Q92 A93 R94	V80-R96 HydrophobicContact CB-CB 4.49Å; V80-R96 HydrophobicContact CG1-CB 4.14Å; W83-R96 VanDerWaalsContact CD2-NH1 3.34Å; W83-R96 VanDerWaalsContact CZ2-NH1 3.28Å; M85-R96 HydrophobicContact CE-CB 4.14Å; M85-R96 HydrophobicContact CE-CG 3.86Å; Q92-R96 VanDerWaalsContact O-CG 3.27Å; Q92-R96 WeakPolarHBondContact O-CG 3.05Å; Q92-R96 PolarHBondContact O-N 3.25Å; Q92-R96 VanDerWaalsContact O-N 3.07Å; A93-R96 PolarHBondContact O-N 3.13Å; R94-R96 VanDerWaalsContact C-N 3.28Å; R94-R96 PolarHBondContact O-N 3.42Å
97	L	97.7	Very high	97	Very high	10 Å²	10	70.4 Å²	70.4	5%	0.052	33%	0.331	C	S	.	.	H	α-helix	trans	-70.1	-36.4	177.9	-68.8	168.6	0	0	0	112.7	K20 L29 F31 I33 V80 A93 R94 V105 L107	K20-L97 WeakPolarHBondContact CE-O 3.44Å; K20-L97 PolarHBondContact NZ-O 2.93Å; L29-L97 HydrophobicContact CD1-CB 3.93Å; L29-L97 HydrophobicContact CD1-CD2 4.12Å; F31-L97 HydrophobicContact CE2-CD1 4.21Å; F31-L97 HydrophobicContact CZ-CD1 3.99Å; F31-L97 HydrophobicContact CZ-CD2 3.82Å; I33-L97 HydrophobicContact CD1-CD1 3.97Å; I33-L97 HydrophobicContact CG2-CD1 3.85Å; V80-L97 HydrophobicContact CG1-CD2 3.94Å; V80-L97 HydrophobicContact CG2-CD2 3.66Å; V80-L97 HydrophobicContact CG2-CG 4.23Å; A93-L97 WeakPolarHBondContact O-CG 3.42Å; A93-L97 PolarHBondContact O-N 3.02Å; A93-L97 VanDerWaalsContact O-N 3.08Å; R94-L97 PolarHBondContact O-N 3.38Å; L97-V105 HydrophobicContact CD2-CG1 4.04Å; L97-L107 HydrophobicContact CD2-CD2 3.95Å
98	T	96.1	Very high	97	Very high	76 Å²	76	65.5 Å²	65.5	47%	0.466	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	20	-170.2	66.9	0	0	0	0	114.9	R94 K100	R94-T98 HydrophobicContact CG-CG2 4.45Å; R94-T98 WeakPolarHBondContact O-CG2 3.42Å; R94-T98 PolarHBondContact O-N 3.39Å; R94-T98 PolarHBondContact O-OG1 3.37Å; R94-T98 VanDerWaalsContact O-OG1 3.05Å; T98-K100 PolarHBondContact O-N 2.97Å
99	K	94.9	Very high	97	Very high	58 Å²	58	64.7 Å²	64.7	25%	0.252	30%	0.302	S	S	.	.			trans	-58.6	130	173.7	-77	178.5	169.4	179.6	0	111	K20 E102	K20-K99 PolarHBondContact NZ-O 3.08Å; K99-E102 HydrophobicContact CB-CB 4.2Å; K99-E102 HydrophobicContact CB-CG 4.17Å; K99-E102 HydrophobicContact CD-CG 4.21Å; K99-E102 WeakPolarHBondContact CD-OE1 3.2Å; K99-E102 WeakPolarHBondContact CD-OE2 3.41Å; K99-E102 IonicContact NZ-OE1 3.24Å; K99-E102 PolarHBondContact NZ-OE1 3.01Å
100	K	90.4	Very high	96.8	Very high	184 Å²	184	63.7 Å²	63.7	80%	0.8	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-23.5	-174.4	-66.4	-172.2	177.5	-173.1	0	113.8	T98	T98-K100 PolarHBondContact O-N 2.97Å
101	N	92.2	Very high	96.5	Very high	137 Å²	137	62.2 Å²	62.2	73%	0.733	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	11.7	-178.7	65.8	-33.7	0	0	0	113.3
102	E	94.3	Very high	96	Very high	42 Å²	42	63.5 Å²	63.5	20%	0.196	29%	0.291	C	S	.	.			trans	-123.6	91.9	178.7	-69.5	179.2	-167.8	0	0	108.3	K20 N81 K99 I104	K20-E102 VanDerWaalsContact CD-O 3.31Å; K20-E102 WeakPolarHBondContact CD-O 3.26Å; K20-E102 VanDerWaalsContact CE-O 3.31Å; K20-E102 WeakPolarHBondContact CE-O 3.49Å; K20-E102 PolarHBondContact NZ-O 3.23Å; N81-E102 PolarHBondContact ND2-OE2 2.96Å; K99-E102 HydrophobicContact CB-CB 4.2Å; K99-E102 HydrophobicContact CB-CG 4.17Å; K99-E102 HydrophobicContact CD-CG 4.21Å; K99-E102 WeakPolarHBondContact CD-OE1 3.2Å; K99-E102 WeakPolarHBondContact CD-OE2 3.41Å; K99-E102 IonicContact NZ-OE1 3.24Å; K99-E102 PolarHBondContact NZ-OE1 3.01Å; E102-I104 PolarHBondContact O-N 2.85Å
103	D	96.1	Very high	95.3	Very high	88 Å²	88	62.1 Å²	62.1	47%	0.471	29%	0.292	S	S	.	.	S	Bend	trans	-69.3	-24.8	179.1	-68.2	-28	0	0	0	112.2	K20 L27	K20-D103 WeakPolarHBondContact CB-O 3.12Å; K20-D103 WeakPolarHBondContact CG-O 3.34Å; K20-D103 PolarHBondContact N-O 3.4Å; L27-D103 WeakPolarHBondContact CD1-OD1 3.37Å
104	I	97.6	Very high	94.6	Very high	59 Å²	59	64.5 Å²	64.5	30%	0.303	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.2	179.3	-58.1	176.1	0	0	0	109.6	E17 I18 N81 E102 R106	E17-I104 HydrophobicContact CG-CG2 3.41Å; E17-I104 VanDerWaalsContact CG-CG2 3.41Å; I18-I104 WeakPolarHBondContact O-CA 3Å; N81-I104 PolarHBondContact ND2-O 2.67Å; E102-I104 PolarHBondContact O-N 2.85Å; I104-R106 HydrophobicContact CG2-CG 4.39Å
105	V	98.3	Very high	93.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118	174	173.9	0	0	0	0	109.5	I18 K20 L29 V80 L97 L107	I18-V105 PolarHBondContact N-O 2.84Å; I18-V105 PolarHBondContact O-N 3.33Å; K20-V105 VanDerWaalsContact CE-CG2 3.46Å; L29-V105 HydrophobicContact CD1-CG2 4.43Å; L29-V105 HydrophobicContact CD2-CB 3.94Å; L29-V105 HydrophobicContact CD2-CG2 3.93Å; V80-V105 HydrophobicContact CG1-CG1 4Å; L97-V105 HydrophobicContact CD2-CG1 4.04Å; V105-L107 HydrophobicContact CG1-CD2 3.54Å; V105-L107 HydrophobicContact CG1-CG 4.12Å
106	R	98.6	Very high	93.1	Very high	127 Å²	127	60.9 Å²	60.9	48%	0.479	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117.4	175.6	-64.6	178.5	178.9	86.6	13.1	109.3	I16 E17 N81 I104	I16-R106 CarbonylContact O-C 3.57Å; I16-R106 WeakPolarHBondContact O-CA 3.49Å; E17-R106 HydrophobicContact CB-CG 4.46Å; E17-R106 HydrophobicContact CG-CG 4.06Å; E17-R106 IonicContact OE1-NH2 2.67Å; E17-R106 PolarHBondContact OE1-NH2 2.8Å; E17-R106 IonicContact OE2-CZ 3.43Å; E17-R106 VanDerWaalsContact OE2-CZ 3.27Å; E17-R106 IonicContact OE2-NE 2.72Å; E17-R106 PolarHBondContact OE2-NE 2.87Å; E17-R106 IonicContact OE2-NH2 3.63Å; E17-R106 PolarHBondContact OE2-NH2 2.88Å; N81-R106 PolarHBondContact N-O 3.38Å; N81-R106 PolarHBondContact OD1-N 2.9Å; I104-R106 HydrophobicContact CG2-CG 4.39Å
107	L	98.6	Very high	92.4	Very high	5 Å²	5	60 Å²	60	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	140.3	177.9	-54.8	-178	0	0	0	110	R15 I16 I18 F31 L71 V77 Q79 V80 L97 V105 V109	R15-L107 WeakPolarHBondContact CA-O 3.33Å; I16-L107 HydrophobicContact CB-CB 4.38Å; I16-L107 PolarHBondContact N-O 2.9Å; I16-L107 PolarHBondContact O-N 2.82Å; I18-L107 HydrophobicContact CD1-CD1 3.7Å; I18-L107 HydrophobicContact CD1-CG 4.42Å; F31-L107 HydrophobicContact CZ-CD1 4.19Å; L71-L107 HydrophobicContact CD1-CD1 3.9Å; L71-L107 HydrophobicContact CD2-CD1 4.16Å; V77-L107 HydrophobicContact CG1-CD2 4.27Å; Q79-L107 WeakPolarHBondContact O-CA 3.35Å; V80-L107 HydrophobicContact CB-CD2 4.34Å; V80-L107 HydrophobicContact CG1-CD2 4.46Å; V80-L107 HydrophobicContact CG2-CD2 3.65Å; L97-L107 HydrophobicContact CD2-CD2 3.95Å; V105-L107 HydrophobicContact CG1-CD2 3.54Å; V105-L107 HydrophobicContact CG1-CG 4.12Å; L107-V109 HydrophobicContact CB-CG1 3.99Å
108	L	98.1	Very high	91.6	Very high	31 Å²	31	61.5 Å²	61.5	16%	0.162	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.7	158	-167.9	70.8	0	0	0	106.9	V13 R15 M78 Q79	V13-L108 HydrophobicContact CB-CD1 3.75Å; V13-L108 HydrophobicContact CB-CD2 4.46Å; V13-L108 HydrophobicContact CB-CG 4.02Å; V13-L108 HydrophobicContact CG1-CD1 4.44Å; V13-L108 HydrophobicContact CG1-CD2 4.28Å; V13-L108 HydrophobicContact CG1-CG 4.2Å; V13-L108 HydrophobicContact CG2-CD1 3.94Å; R15-L108 HydrophobicContact CG-CD1 3.71Å; M78-L108 WeakPolarHBondContact CA-O 3.37Å; M78-L108 HydrophobicContact CB-CB 4.42Å; M78-L108 HydrophobicContact CB-CD2 4.4Å; M78-L108 HydrophobicContact CB-CG 4.47Å; M78-L108 WeakPolarHBondContact CB-O 3.43Å; M78-L108 PolarHBondContact N-O 2.91Å; Q79-L108 HydrophobicContact CB-CB 3.84Å; Q79-L108 HydrophobicContact CG-CB 4.25Å; Q79-L108 HydrophobicContact CG-CD2 4.25Å; Q79-L108 PolarHBondContact N-O 3.03Å; Q79-L108 PolarHBondContact O-N 3.03Å; Q79-L108 VanDerWaalsContact O-N 3.08Å
109	V	97.6	Very high	90.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.9	-178.2	-55	0	0	0	0	111.7	V13 Q14 I16 L71 D75 K76 V77 L107	V13-V109 CarbonylContact C-O 3.48Å; V13-V109 VanDerWaalsContact CA-O 3.26Å; V13-V109 WeakPolarHBondContact CA-O 3.31Å; Q14-V109 HydrophobicContact CB-CG2 3.97Å; Q14-V109 PolarHBondContact N-O 2.77Å; Q14-V109 PolarHBondContact O-N 2.87Å; I16-V109 HydrophobicContact CD1-CG2 3.74Å; I16-V109 HydrophobicContact CG1-CG2 4.38Å; L71-V109 HydrophobicContact CD1-CG1 3.99Å; D75-V109 HydrophobicContact CB-CB 4.14Å; D75-V109 HydrophobicContact CB-CG1 4.39Å; D75-V109 HydrophobicContact CB-CG2 4.34Å; K76-V109 CarbonylContact O-C 3.47Å; K76-V109 WeakPolarHBondContact O-CA 3.3Å; K76-V109 WeakPolarHBondContact O-CB 3.2Å; V77-V109 HydrophobicContact CG2-CG1 4.42Å; L107-V109 HydrophobicContact CB-CG1 3.99Å
110	T	94.7	Very high	89.9	Confident	15 Å²	15	69 Å²	69	9%	0.092	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	146.9	163.3	63.9	0	0	0	0	109.9	A11 V13 K76 M78	A11-T110 HydrophobicContact CB-CG2 4.08Å; V13-T110 HydrophobicContact CG1-CG2 3.8Å; K76-T110 PolarHBondContact N-O 2.95Å; K76-T110 PolarHBondContact O-N 3.32Å; M78-T110 HydrophobicContact CG-CG2 3.87Å; M78-T110 HydrophobicContact SD-CG2 4.24Å
111	R	92.8	Very high	89.2	Confident	24 Å²	24	64.5 Å²	64.5	9%	0.091	33%	0.329	C	S	.	.			trans	-137.2	126	-178.5	-173.2	-178	-64.2	158.2	-0	109.6	Q14 G70 M72 D75 S113 L114 E115	Q14-R111 VanDerWaalsContact OE1-NH1 3.08Å; G70-R111 PolarHBondContact O-NH2 3.5Å; M72-R111 PolarHBondContact SD-NH1 2.81Å; D75-R111 WeakPolarHBondContact OD1-CB 3.44Å; D75-R111 WeakPolarHBondContact OD1-CG 3.4Å; D75-R111 IonicContact OD1-CZ 3.03Å; D75-R111 IonicContact OD1-NE 3.63Å; D75-R111 PolarHBondContact OD1-NE 2.86Å; D75-R111 IonicContact OD1-NH2 3.38Å; D75-R111 PolarHBondContact OD1-NH2 3.06Å; D75-R111 IonicContact OD2-CZ 3.27Å; D75-R111 IonicContact OD2-NE 2.75Å; D75-R111 IonicContact OD2-NH2 2.71Å; D75-R111 PolarHBondContact OD2-NH2 3.21Å; R111-S113 VanDerWaalsContact C-N 3.28Å; R111-S113 VanDerWaalsContact CD-OG 3.23Å; R111-S113 WeakPolarHBondContact CD-OG 3.26Å; R111-S113 WeakPolarHBondContact CG-OG 3.46Å; R111-S113 PolarHBondContact O-N 2.9Å; R111-L114 HydrophobicContact CB-CB 4.35Å; R111-L114 HydrophobicContact CB-CD1 3.93Å; R111-L114 HydrophobicContact CB-CG 4.01Å; R111-L114 HydrophobicContact CG-CG 4.45Å; R111-L114 WeakPolarHBondContact O-CB 3.2Å; R111-L114 PolarHBondContact O-N 2.99Å; R111-E115 PolarHBondContact O-N 2.95Å; R111-E115 VanDerWaalsContact O-N 3.13Å
112	K	86.3	Confident	88.3	Confident	81 Å²	81	64.8 Å²	64.8	35%	0.352	33%	0.327	S	S	.	.	H	α-helix	trans	-55.5	-40.3	-178	-68.7	-174.9	179	179.8	0	113.4	F46 E48 L114 E115 Q116	F46-K112 WeakPolarHBondContact O-CE 3.4Å; F46-K112 PolarHBondContact O-NZ 2.55Å; E48-K112 VanDerWaalsContact CD-NZ 3.3Å; E48-K112 VanDerWaalsContact CG-NZ 3.3Å; E48-K112 WeakPolarHBondContact OE1-CE 3.25Å; E48-K112 IonicContact OE1-NZ 2.74Å; E48-K112 PolarHBondContact OE1-NZ 3.11Å; K112-L114 VanDerWaalsContact C-N 3.3Å; K112-L114 PolarHBondContact O-N 2.69Å; K112-E115 PolarHBondContact O-N 3.43Å; K112-Q116 WeakPolarHBondContact O-CG 3.4Å; K112-Q116 PolarHBondContact O-N 3.24Å
113	S	85.5	Confident	86.6	Confident	65 Å²	65	72.7 Å²	72.7	46%	0.455	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-33.2	179.2	56.2	0	0	0	0	112.7	R111 A117	R111-S113 VanDerWaalsContact C-N 3.28Å; R111-S113 VanDerWaalsContact CD-OG 3.23Å; R111-S113 WeakPolarHBondContact CD-OG 3.26Å; R111-S113 WeakPolarHBondContact CG-OG 3.46Å; R111-S113 PolarHBondContact O-N 2.9Å; S113-A117 WeakPolarHBondContact O-CB 3.34Å; S113-A117 PolarHBondContact O-N 2.99Å
114	L	83.7	Confident	86.1	Confident	51 Å²	51	71.9 Å²	71.9	27%	0.267	36%	0.361	S	S	.	.	H	α-helix	trans	-69.7	-41.2	173.9	-65	178	0	0	0	111.1	V12 Q14 R111 K112 Q116 A117 V118	V12-L114 HydrophobicContact CB-CB 4.15Å; V12-L114 HydrophobicContact CG1-CB 3.75Å; Q14-L114 HydrophobicContact CB-CD1 3.93Å; R111-L114 HydrophobicContact CB-CB 4.35Å; R111-L114 HydrophobicContact CB-CD1 3.93Å; R111-L114 HydrophobicContact CB-CG 4.01Å; R111-L114 HydrophobicContact CG-CG 4.45Å; R111-L114 WeakPolarHBondContact O-CB 3.2Å; R111-L114 PolarHBondContact O-N 2.99Å; K112-L114 VanDerWaalsContact C-N 3.3Å; K112-L114 PolarHBondContact O-N 2.69Å; L114-Q116 VanDerWaalsContact C-N 3.35Å; L114-Q116 PolarHBondContact O-N 3.32Å; L114-A117 PolarHBondContact O-N 3.12Å; L114-V118 WeakPolarHBondContact O-CG2 3.48Å; L114-V118 PolarHBondContact O-N 2.74Å
115	E	82.2	Confident	85.5	Confident	41 Å²	41	72.6 Å²	72.6	19%	0.192	36%	0.364	C	S	.	.	H	α-helix	trans	-60.8	-43.8	174.9	-66.2	176.5	-168.7	0	0	111.8	V12 R111 K112 R119	V12-E115 HydrophobicContact CB-CG 4.1Å; V12-E115 HydrophobicContact CG2-CG 4.21Å; R111-E115 PolarHBondContact O-N 2.95Å; R111-E115 VanDerWaalsContact O-N 3.13Å; K112-E115 PolarHBondContact O-N 3.43Å; E115-R119 WeakPolarHBondContact O-CB 3.22Å; E115-R119 VanDerWaalsContact O-CG 3.26Å; E115-R119 WeakPolarHBondContact O-CG 3.28Å; E115-R119 PolarHBondContact O-N 3.46Å
116	Q	82.8	Confident	84.8	Confident	109 Å²	109	76.6 Å²	76.6	51%	0.509	39%	0.385	S	S	.	.	H	α-helix	trans	-64.9	-44	176.4	-71.7	174.6	-0.5	0	0	112.1	K112 L114 V118 R119 H120	K112-Q116 WeakPolarHBondContact O-CG 3.4Å; K112-Q116 PolarHBondContact O-N 3.24Å; L114-Q116 VanDerWaalsContact C-N 3.35Å; L114-Q116 PolarHBondContact O-N 3.32Å; Q116-V118 PolarHBondContact O-N 3.12Å; Q116-R119 PolarHBondContact O-N 2.62Å; Q116-H120 PolarHBondContact O-CD2 2.95Å; Q116-H120 PolarHBondContact O-N 2.85Å
117	A	81.8	Confident	84	Confident	58 Å²	58	73.6 Å²	73.6	48%	0.479	38%	0.379	S	S	.	.	H	α-helix	trans	-61	-44.7	178.1	0	0	0	0	0	112	S113 L114 H120 S121	S113-A117 WeakPolarHBondContact O-CB 3.34Å; S113-A117 PolarHBondContact O-N 2.99Å; L114-A117 PolarHBondContact O-N 3.12Å; A117-H120 PolarHBondContact O-N 3.18Å; A117-S121 PolarHBondContact O-N 2.74Å
118	V	81.4	Confident	83	Confident	41 Å²	41	77.9 Å²	77.9	25%	0.248	40%	0.401	C	S	.	.	H	α-helix	trans	-65.2	-43.8	177	172.7	0	0	0	0	110.9	V12 L114 Q116 H120 S121 M122	V12-V118 HydrophobicContact CB-CG2 4.44Å; V12-V118 HydrophobicContact CG1-CG2 4.04Å; V12-V118 HydrophobicContact CG2-CB 3.7Å; V12-V118 HydrophobicContact CG2-CG1 4.08Å; V12-V118 HydrophobicContact CG2-CG2 3.56Å; L114-V118 WeakPolarHBondContact O-CG2 3.48Å; L114-V118 PolarHBondContact O-N 2.74Å; Q116-V118 PolarHBondContact O-N 3.12Å; V118-H120 VanDerWaalsContact C-N 3.31Å; V118-H120 PolarHBondContact O-N 2.86Å; V118-S121 WeakPolarHBondContact CA-OG 3.35Å; V118-S121 PolarHBondContact O-N 2.91Å; V118-S121 VanDerWaalsContact O-N 3.16Å; V118-S121 PolarHBondContact O-OG 3.32Å; V118-M122 HydrophobicContact CG1-CE 3.55Å; V118-M122 HydrophobicContact CG1-SD 3.95Å; V118-M122 WeakPolarHBondContact O-CG 3.45Å; V118-M122 PolarHBondContact O-N 3.1Å
119	R	79.9	Confident	82	Confident	153 Å²	153	81.1 Å²	81.1	58%	0.577	42%	0.417	S	S	*	.	H	α-helix	trans	-57.6	-43.1	175.4	-76.8	175.7	-175	162.4	7.7	112.3	E115 Q116 M122	E115-R119 WeakPolarHBondContact O-CB 3.22Å; E115-R119 VanDerWaalsContact O-CG 3.26Å; E115-R119 WeakPolarHBondContact O-CG 3.28Å; E115-R119 PolarHBondContact O-N 3.46Å; Q116-R119 PolarHBondContact O-N 2.62Å; R119-M122 PolarHBondContact O-N 3.23Å
120	H	75.3	Confident	80.9	Confident	138 Å²	138	86.9 Å²	86.9	64%	0.639	45%	0.447	S	S	*	.	H	α-helix	trans	-68	-35.1	177.4	-77	-157.9	0	0	0	112.5	Q116 A117 V118 M122 M123	Q116-H120 PolarHBondContact O-CD2 2.95Å; Q116-H120 PolarHBondContact O-N 2.85Å; A117-H120 PolarHBondContact O-N 3.18Å; V118-H120 VanDerWaalsContact C-N 3.31Å; V118-H120 PolarHBondContact O-N 2.86Å; H120-M122 PolarHBondContact O-N 3.4Å; H120-M123 PolarHBondContact O-N 3.21Å
121	S	76	Confident	79.9	Confident	90 Å²	90	92.4 Å²	92.4	63%	0.629	47%	0.474	S	S	*	.	H	α-helix	trans	-72.3	-15.8	179	69.9	0	0	0	0	114.7	A117 V118	A117-S121 PolarHBondContact O-N 2.74Å; V118-S121 WeakPolarHBondContact CA-OG 3.35Å; V118-S121 PolarHBondContact O-N 2.91Å; V118-S121 VanDerWaalsContact O-N 3.16Å; V118-S121 PolarHBondContact O-OG 3.32Å
122	M	73.5	Confident	78.8	Confident	142 Å²	142	98.1 Å²	98.1	70%	0.7	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-0.2	-179.8	-69.2	178.1	173.1	0	0	113.2	V118 R119 H120	V118-M122 HydrophobicContact CG1-CE 3.55Å; V118-M122 HydrophobicContact CG1-SD 3.95Å; V118-M122 WeakPolarHBondContact O-CG 3.45Å; V118-M122 PolarHBondContact O-N 3.1Å; R119-M122 PolarHBondContact O-N 3.23Å; H120-M122 PolarHBondContact O-N 3.4Å
123	M	57	Low	78.1	Confident	208 Å²	208	99.6 Å²	99.6	100%	1.025	52%	0.52	S	S	*	.			trans	-97.3	0	172.7	-65.2	-179	-172.3	0	0	110.1	H120	H120-M123 PolarHBondContact O-N 3.21Å

Retrieved 123 of 123 residues in 385.5 ms (Link to these results)

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