A0A087X0V4_HUMAN Loading...

Protein archease

Component of the tRNA-splicing ligase complex required to facilitate the enzymatic turnover of catalytic subunit RTCB. Together with DDX1, acts by facilitating the guanylylation of RTCB, a key intermediate step in tRNA ligation.

AlphaFold DB , UniProt , Accession A0A087X0V4, Species HUMAN (Homo sapiens, Human), Gene ZBTB8OS, Length 160 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	34.4	Very low	50.1	Low	240 Å²	240	147.2 Å²	147.2	100%	1.182	74%	0.741	S	S	*	*				0	97.5	0	-77.6	172.4	43.5	0	0	106.3	Q3	M1-Q3 PolarHBondContact O-N 3.46Å
2	A	40	Very low	52.2	Low	102 Å²	102	149.5 Å²	149.5	84%	0.843	76%	0.757	S	S	*	*			trans	-67.9	129.3	173.5	0	0	0	0	0	107.3	E4	A2-E4 PolarHBondContact O-N 3.09Å
3	Q	38.1	Very low	54.2	Low	188 Å²	188	142.9 Å²	142.9	88%	0.879	73%	0.725	S	S	*	*			trans	-58.3	126.3	170.3	-78	164.3	-53.6	0	0	107.5	M1 E5	M1-Q3 PolarHBondContact O-N 3.46Å; Q3-E5 VanDerWaalsContact C-N 3.3Å; Q3-E5 PolarHBondContact O-N 2.76Å
4	E	43.5	Very low	56.2	Low	191 Å²	191	138.1 Å²	138.1	89%	0.893	71%	0.706	S	S	*	*			trans	-65.1	94.7	168.1	-70.2	177.8	158.2	0	0	106.6	A2 E6	A2-E4 PolarHBondContact O-N 3.09Å; E4-E6 PolarHBondContact O-N 2.84Å
5	E	49	Very low	57.5	Low	188 Å²	188	138.2 Å²	138.2	88%	0.879	70%	0.702	S	S	*	*			trans	-60.9	118.1	162.5	-80.1	-179.5	161	0	0	106.9	Q3 D7	Q3-E5 VanDerWaalsContact C-N 3.3Å; Q3-E5 PolarHBondContact O-N 2.76Å; E5-D7 PolarHBondContact O-N 3.12Å
6	E	49.3	Very low	58.6	Low	176 Å²	176	139.8 Å²	139.8	82%	0.822	71%	0.706	S	S	*	*			trans	-56.6	132.9	179.5	-76.8	-178.9	144.3	0	0	110	E4 V8	E4-E6 PolarHBondContact O-N 2.84Å; E6-V8 VanDerWaalsContact C-N 3.32Å; E6-V8 VanDerWaalsContact O-CG2 3.3Å; E6-V8 WeakPolarHBondContact O-CG2 3.48Å; E6-V8 PolarHBondContact O-N 2.93Å
7	D	52.9	Low	59.5	Low	64 Å²	64	136.8 Å²	136.8	34%	0.342	69%	0.689	S	S	.	*			trans	-66.9	85.1	176.3	-174.1	1.5	0	0	0	109.4	E5 R9	E5-D7 PolarHBondContact O-N 3.12Å; D7-R9 PolarHBondContact O-N 2.9Å; D7-R9 IonicContact OD1-CZ 2.8Å; D7-R9 IonicContact OD1-NE 2.75Å; D7-R9 PolarHBondContact OD1-NE 2.88Å; D7-R9 IonicContact OD1-NH2 2.75Å; D7-R9 PolarHBondContact OD1-NH2 2.97Å; D7-R9 IonicContact OD2-CZ 3.58Å; D7-R9 IonicContact OD2-NE 3.55Å; D7-R9 IonicContact OD2-NH2 3.93Å; D7-R9 PolarHBondContact OD2-NH2 3.23Å
8	V	54.7	Low	60.1	Low	126 Å²	126	135.3 Å²	135.3	76%	0.764	68%	0.678	S	S	*	*			trans	-80.9	50.9	179.8	-161	0	0	0	0	111.1	E6 D10	E6-V8 VanDerWaalsContact C-N 3.32Å; E6-V8 VanDerWaalsContact O-CG2 3.3Å; E6-V8 WeakPolarHBondContact O-CG2 3.48Å; E6-V8 PolarHBondContact O-N 2.93Å; V8-D10 PolarHBondContact O-N 2.75Å
9	R	59	Low	60.6	Low	67 Å²	67	132.6 Å²	132.6	25%	0.253	68%	0.678	S	S	.	*			trans	-89.4	87.2	161.1	-70.9	179.4	-71	173.5	-5.4	107.9	D7 Y11 Y24	D7-R9 PolarHBondContact O-N 2.9Å; D7-R9 IonicContact OD1-CZ 2.8Å; D7-R9 IonicContact OD1-NE 2.75Å; D7-R9 PolarHBondContact OD1-NE 2.88Å; D7-R9 IonicContact OD1-NH2 2.75Å; D7-R9 PolarHBondContact OD1-NH2 2.97Å; D7-R9 IonicContact OD2-CZ 3.58Å; D7-R9 IonicContact OD2-NE 3.55Å; D7-R9 IonicContact OD2-NH2 3.93Å; D7-R9 PolarHBondContact OD2-NH2 3.23Å; R9-Y11 VanDerWaalsContact C-N 3.29Å; R9-Y11 HydrophobicContact CB-CD2 3.98Å; R9-Y11 HydrophobicContact CB-CE2 3.46Å; R9-Y11 VanDerWaalsContact CB-CE2 3.46Å; R9-Y11 HydrophobicContact CG-CE2 4.38Å; R9-Y11 VanDerWaalsContact O-CD2 3.31Å; R9-Y11 WeakPolarHBondContact O-CD2 3.43Å; R9-Y11 PolarHBondContact O-N 2.93Å; R9-Y24 PolarHBondContact NH1-OH 3.1Å
10	D	62.5	Low	61.1	Low	146 Å²	146	132.8 Å²	132.8	78%	0.781	68%	0.679	S	S	*	*			trans	-76.9	84.4	175.1	-165.6	10.7	0	0	0	109.3	V8	V8-D10 PolarHBondContact O-N 2.75Å
11	Y	67.9	Low	61.1	Low	131 Å²	131	134.9 Å²	134.9	51%	0.514	68%	0.684	S	S	.	*			trans	-75.8	148.7	166.6	-61.7	-80.5	0	0	0	108.2	R9 L13	R9-Y11 VanDerWaalsContact C-N 3.29Å; R9-Y11 HydrophobicContact CB-CD2 3.98Å; R9-Y11 HydrophobicContact CB-CE2 3.46Å; R9-Y11 VanDerWaalsContact CB-CE2 3.46Å; R9-Y11 HydrophobicContact CG-CE2 4.38Å; R9-Y11 VanDerWaalsContact O-CD2 3.31Å; R9-Y11 WeakPolarHBondContact O-CD2 3.43Å; R9-Y11 PolarHBondContact O-N 2.93Å; Y11-L13 VanDerWaalsContact CB-CD2 3.49Å; Y11-L13 HydrophobicContact CG-CD2 4.32Å; Y11-L13 PolarHBondContact O-N 2.79Å
12	N	75.6	Confident	62.6	Low	175 Å²	175	126 Å²	126	94%	0.936	65%	0.648	S	S	*	*			trans	-67.4	67.7	167.5	-80.1	-28.9	0	0	0	110.4
13	L	78.1	Confident	64.1	Low	64 Å²	64	130.7 Å²	130.7	34%	0.335	65%	0.65	S	S	.	*			trans	-83.4	140.5	-176	-61.4	-178.4	0	0	0	110.4	Y11 Q17 K18	Y11-L13 VanDerWaalsContact CB-CD2 3.49Å; Y11-L13 HydrophobicContact CG-CD2 4.32Å; Y11-L13 PolarHBondContact O-N 2.79Å; L13-Q17 HydrophobicContact CB-CB 3.98Å; L13-Q17 HydrophobicContact CD2-CB 4.07Å; L13-Q17 HydrophobicContact CG-CB 4.4Å; L13-K18 HydrophobicContact CB-CG 3.87Å; L13-K18 HydrophobicContact CD1-CG 4.26Å
14	T	81.7	Confident	65.7	Low	75 Å²	75	127.9 Å²	127.9	46%	0.46	63%	0.632	S	S	.	*			trans	-68	160.9	163.3	68.8	0	0	0	0	110.4	E16 Q17 K18	T14-E16 PolarHBondContact O-N 2.86Å; T14-Q17 WeakPolarHBondContact O-CB 3.5Å; T14-Q17 PolarHBondContact O-N 3.25Å; T14-Q17 WeakPolarHBondContact OG1-CG 3.13Å; T14-Q17 PolarHBondContact OG1-OE1 2.86Å; T14-K18 PolarHBondContact O-N 2.9Å; T14-K18 VanDerWaalsContact O-N 3.12Å
15	E	75.4	Confident	66.9	Low	140 Å²	140	123.8 Å²	123.8	65%	0.654	62%	0.622	S	S	*	*	H	α-helix	trans	-57.5	-33.5	179.2	-64.7	-58.8	119.3	0	0	112.9	K18	E15-K18 IonicContact OE1-NZ 2.94Å; E15-K18 PolarHBondContact OE1-NZ 3.1Å
16	E	76.4	Confident	67.7	Low	164 Å²	164	118.5 Å²	118.5	77%	0.766	60%	0.604	S	S	*	*	H	α-helix	trans	-69.5	-32.5	176.1	-64.3	-179.9	175.1	0	0	112.6	T14 A19	T14-E16 PolarHBondContact O-N 2.86Å; E16-A19 WeakPolarHBondContact O-CB 3.37Å
17	Q	72.5	Confident	68.8	Low	88 Å²	88	115.3 Å²	115.3	41%	0.411	60%	0.596	S	S	.	*	H	α-helix	trans	-78	-33	180	-69.5	167	-22.8	0	0	111.9	L13 T14 A19 I20	L13-Q17 HydrophobicContact CB-CB 3.98Å; L13-Q17 HydrophobicContact CD2-CB 4.07Å; L13-Q17 HydrophobicContact CG-CB 4.4Å; T14-Q17 WeakPolarHBondContact O-CB 3.5Å; T14-Q17 PolarHBondContact O-N 3.25Å; T14-Q17 WeakPolarHBondContact OG1-CG 3.13Å; T14-Q17 PolarHBondContact OG1-OE1 2.86Å; Q17-A19 PolarHBondContact O-N 2.88Å; Q17-I20 PolarHBondContact O-N 3.37Å
18	K	70.8	Confident	69.4	Low	111 Å²	111	119.7 Å²	119.7	48%	0.483	62%	0.62	S	S	.	*	H	α-helix	trans	-60.6	-27.6	173.1	-68	176.9	-175.5	169.4	0	112.8	L13 T14 E15 I20	L13-K18 HydrophobicContact CB-CG 3.87Å; L13-K18 HydrophobicContact CD1-CG 4.26Å; T14-K18 PolarHBondContact O-N 2.9Å; T14-K18 VanDerWaalsContact O-N 3.12Å; E15-K18 IonicContact OE1-NZ 2.94Å; E15-K18 PolarHBondContact OE1-NZ 3.1Å; K18-I20 PolarHBondContact O-N 2.8Å
19	A	70.2	Confident	70.3	Confident	83 Å²	83	121.9 Å²	121.9	69%	0.686	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-18.6	175.7	0	0	0	0	0	112.9	E16 Q17	E16-A19 WeakPolarHBondContact O-CB 3.37Å; Q17-A19 PolarHBondContact O-N 2.88Å
20	I	70.6	Confident	71	Confident	137 Å²	137	126.1 Å²	126.1	70%	0.703	63%	0.634	S	S	*	*	S	Bend	trans	-95.4	97.5	178.8	-55.2	176.5	0	0	0	108.6	Q17 K18	Q17-I20 PolarHBondContact O-N 3.37Å; K18-I20 PolarHBondContact O-N 2.8Å
21	K	61.5	Low	72.1	Confident	177 Å²	177	125.2 Å²	125.2	77%	0.77	62%	0.621	S	S	*	*			trans	-78	122.8	177.1	-67.8	-169.2	175.9	-167.6	0	111.5
22	A	64.4	Low	73.1	Confident	54 Å²	54	124.2 Å²	124.2	45%	0.446	62%	0.621	S	S	.	*			trans	-64.5	133.8	160.8	0	0	0	0	0	109.1	Y24	A22-Y24 HydrophobicContact CB-CD1 4.19Å; A22-Y24 HydrophobicContact CB-CE1 3.78Å
23	K	71.9	Confident	73.7	Confident	200 Å²	200	117.1 Å²	117.1	87%	0.87	59%	0.585	S	S	*	*			trans	-116.4	56.6	-178.8	-65.6	-175.5	-179.3	-179.2	0	111.2
24	Y	70.9	Confident	74.6	Confident	129 Å²	129	119.2 Å²	119.2	51%	0.506	59%	0.593	S	S	.	*	S	Bend	trans	-152.2	149.4	175	63.6	-92.2	0	0	0	110.2	R9 A22	R9-Y24 PolarHBondContact NH1-OH 3.1Å; A22-Y24 HydrophobicContact CB-CD1 4.19Å; A22-Y24 HydrophobicContact CB-CE1 3.78Å
25	P	68.8	Low	75.2	Confident	104 Å²	104	116.1 Å²	116.1	68%	0.675	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-68.9	144.2	178.4	28.1	-34.1	0	0	0	111.2	V27	P25-V27 PolarHBondContact O-N 2.79Å
26	P	66.8	Low	76.3	Confident	78 Å²	78	113.1 Å²	113.1	51%	0.506	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-54.5	134.1	171.9	-23	32.8	0	0	0	111.2
27	V	71.4	Confident	77.3	Confident	109 Å²	109	105.5 Å²	105.5	66%	0.661	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-90.9	120.8	175.3	179.8	0	0	0	0	108.1	P25 R29	P25-V27 PolarHBondContact O-N 2.79Å; V27-R29 HydrophobicContact CG1-CG 4.39Å; V27-R29 PolarHBondContact O-N 3.26Å
28	N	67.2	Low	78.5	Confident	156 Å²	156	109 Å²	109	83%	0.834	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-71.4	120.1	169.5	-163.9	0.4	0	0	0	108.7
29	R	72.3	Confident	79.7	Confident	171 Å²	171	104 Å²	104	65%	0.645	51%	0.514	S	S	*	.			trans	-107.3	127.4	-179	-66.4	-179	-177.2	176.8	1.3	108.5	V27 Y31	V27-R29 HydrophobicContact CG1-CG 4.39Å; V27-R29 PolarHBondContact O-N 3.26Å; R29-Y31 HydrophobicContact CB-CE2 3.85Å; R29-Y31 VanDerWaalsContact CD-OH 3.26Å; R29-Y31 WeakPolarHBondContact CD-OH 3.21Å
30	K	74.9	Confident	81	Confident	157 Å²	157	106.4 Å²	106.4	68%	0.683	52%	0.515	S	S	*	.			trans	-90.1	139.3	166.2	-66.9	-169.6	170.8	-157.1	0	108.8
31	Y	85.9	Confident	82.2	Confident	126 Å²	126	102.8 Å²	102.8	49%	0.494	50%	0.5	S	S	.	.			trans	-119.7	131.9	174.7	-62	-80.1	0	0	0	107	R29 I160	R29-Y31 HydrophobicContact CB-CE2 3.85Å; R29-Y31 VanDerWaalsContact CD-OH 3.26Å; R29-Y31 WeakPolarHBondContact CD-OH 3.21Å; Y31-I160 WeakPolarHBondContact O-CG1 3.33Å; Y31-I160 PolarHBondContact O-N 3.29Å
32	E	86.9	Confident	83.9	Confident	111 Å²	111	94.6 Å²	94.6	52%	0.519	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	142.4	-177.3	-70.7	175.3	171.9	0	0	108.2	I157 I158	E32-I157 HydrophobicContact CB-CG2 3.77Å; E32-I157 HydrophobicContact CG-CG2 4.13Å; E32-I158 CarbonylContact C-O 3.56Å; E32-I158 VanDerWaalsContact CA-O 3.27Å; E32-I158 WeakPolarHBondContact CA-O 3.48Å
33	C	90.1	Very high	85.5	Confident	25 Å²	25	94.2 Å²	94.2	17%	0.169	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.8	174.6	-174.2	0	0	0	0	109.3	I157 I158 I160	C33-I157 CarbonylContact O-C 3.52Å; C33-I157 WeakPolarHBondContact O-CA 3.31Å; C33-I158 HydrophobicContact CB-CD1 4.4Å; C33-I158 HydrophobicContact CB-CG1 3.98Å; C33-I158 PolarHBondContact N-O 3Å; C33-I158 WeakPolarHBondContact O-CG1 3.5Å; C33-I158 PolarHBondContact O-N 3.12Å; C33-I160 HydrophobicContact CB-CD1 4.43Å
34	E	95.3	Very high	86.7	Confident	109 Å²	109	87.3 Å²	87.3	51%	0.509	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.3	172.2	-173.1	178.8	78.8	0	0	109.3	V156 I157	E34-V156 CarbonylContact C-O 3.55Å; E34-V156 WeakPolarHBondContact CA-O 3.26Å; E34-I157 HydrophobicContact CB-CG1 4.19Å; E34-I157 HydrophobicContact CG-CG1 4.25Å
35	L	95.8	Very high	88	Confident	10 Å²	10	81.2 Å²	81.2	5%	0.052	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	128.1	169	-56.1	-178.2	0	0	0	108.5	A52 M53 F155 V156 I158	L35-A52 HydrophobicContact CD1-CB 4.48Å; L35-A52 HydrophobicContact CD2-CB 4.19Å; L35-M53 HydrophobicContact CD1-CB 3.84Å; L35-F155 CarbonylContact O-C 3.6Å; L35-F155 WeakPolarHBondContact O-CA 3.46Å; L35-V156 PolarHBondContact N-O 3.01Å; L35-V156 PolarHBondContact O-N 3.34Å; L35-I158 HydrophobicContact CD1-CD1 4.08Å; L35-I158 HydrophobicContact CD1-CG1 4.49Å; L35-I158 HydrophobicContact CD1-CG2 3.94Å; L35-I158 HydrophobicContact CD2-CD1 4.05Å; L35-I158 HydrophobicContact CG-CD1 4.11Å; L35-I158 HydrophobicContact CG-CG1 4.28Å; L35-I158 HydrophobicContact CG-CG2 4.38Å
36	H	97.6	Very high	89.4	Confident	76 Å²	76	76.2 Å²	76.2	35%	0.352	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.8	170.5	173	-142	0	0	0	108.7	W38 E153 V154 F155	H36-W38 AromaticContact CE1-CE3 3.73Å; H36-W38 AromaticContact ND1-CZ3 3.98Å; H36-W38 AromaticContact NE2-CE3 3.92Å; H36-E153 IonicContact NE2-OE2 3.59Å; H36-V154 WeakPolarHBondContact CA-O 3.44Å; H36-F155 HydrophobicContact CB-CD1 3.94Å; H36-F155 HydrophobicContact CB-CE1 3.91Å; H36-F155 AromaticContact CD2-CD1 3.79Å; H36-F155 AromaticContact CD2-CE1 3.27Å; H36-F155 WeakPolarHBondContact CD2-CE1 3.26Å; H36-F155 AromaticContact CD2-CE2 3.86Å; H36-F155 AromaticContact CD2-CZ 3.31Å; H36-F155 WeakPolarHBondContact CD2-CZ 3.36Å; H36-F155 AromaticContact CE1-CZ 4Å; H36-F155 AromaticContact CG-CD1 3.93Å; H36-F155 AromaticContact CG-CE1 3.44Å; H36-F155 VanDerWaalsContact CG-CE1 3.44Å; H36-F155 AromaticContact CG-CZ 3.93Å; H36-F155 AromaticContact ND1-CE1 3.96Å; H36-F155 AromaticContact NE2-CE1 3.76Å; H36-F155 AromaticContact NE2-CZ 3.4Å; H36-F155 WeakPolarHBondContact NE2-CZ 3.3Å
37	A	97.7	Very high	90.9	Very high	4 Å²	4	73.1 Å²	73.1	3%	0.033	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151	-179.8	0	0	0	0	0	111	Q48 C49 E153 V154	A37-Q48 HydrophobicContact CB-CB 3.92Å; A37-C49 HydrophobicContact CB-CB 3.86Å; A37-E153 CarbonylContact O-C 3.6Å; A37-E153 VanDerWaalsContact O-CA 3.28Å; A37-E153 WeakPolarHBondContact O-CA 3.25Å; A37-V154 HydrophobicContact CB-CG2 4.02Å; A37-V154 PolarHBondContact N-O 2.93Å; A37-V154 PolarHBondContact O-N 2.98Å
38	W	98.1	Very high	92.2	Very high	161 Å²	161	71.8 Å²	71.8	61%	0.61	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.7	167.3	-177.1	63	89.3	0	0	0	110.6	H36 P152 E153	H36-W38 AromaticContact CE1-CE3 3.73Å; H36-W38 AromaticContact ND1-CZ3 3.98Å; H36-W38 AromaticContact NE2-CE3 3.92Å; W38-P152 VanDerWaalsContact CA-O 3.25Å; W38-P152 WeakPolarHBondContact CA-O 3.23Å; W38-E153 HydrophobicContact CB-CB 3.99Å
39	G	96.1	Very high	93.6	Very high	7 Å²	7	64.4 Å²	64.4	7%	0.072	29%	0.294	C	S	.	.			trans	-167.3	178.9	175	0	0	0	0	0	112.6	T41 P152	G39-T41 PolarHBondContact O-N 3.06Å; G39-P152 PolarHBondContact N-O 3.33Å; G39-P152 VanDerWaalsContact N-O 3.1Å; G39-P152 WeakPolarHBondContact O-CD 3.4Å
40	D	96.3	Very high	94.8	Very high	133 Å²	133	56.2 Å²	56.2	71%	0.711	26%	0.263	S	S	*	.	S	Bend	trans	-73.4	-17	173.8	-66.1	-22.9	0	0	0	111.5	E44	D40-E44 WeakPolarHBondContact CB-OE2 3.13Å; D40-E44 PolarHBondContact N-OE2 2.94Å
41	T	97	Very high	95.9	Very high	62 Å²	62	50 Å²	50	38%	0.38	24%	0.237	S	C	.	.	S	Bend	trans	-138.5	160	179.9	58.7	0	0	0	0	111	G39 E43 E44 A45	G39-T41 PolarHBondContact O-N 3.06Å; T41-E43 PolarHBondContact O-N 2.88Å; T41-E44 PolarHBondContact O-N 3.07Å; T41-E44 VanDerWaalsContact O-N 3.13Å; T41-E44 WeakPolarHBondContact OG1-CB 3.4Å; T41-E44 PolarHBondContact OG1-N 2.86Å; T41-A45 PolarHBondContact O-N 3.4Å
42	L	96.7	Very high	96.5	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-62.5	-37.5	176.5	-173.9	66.6	0	0	0	111.1	E44 A45 F46 L78 I109 Q111 V146 N148 P152	L42-E44 VanDerWaalsContact C-N 3.32Å; L42-E44 PolarHBondContact O-N 2.85Å; L42-A45 PolarHBondContact O-N 3.3Å; L42-F46 HydrophobicContact CD1-CD2 4.04Å; L42-F46 HydrophobicContact CD1-CE2 3.63Å; L42-F46 HydrophobicContact CG-CD2 4.15Å; L42-F46 HydrophobicContact CG-CE2 3.95Å; L42-F46 VanDerWaalsContact O-CD2 3.24Å; L42-F46 WeakPolarHBondContact O-CD2 3.31Å; L42-F46 PolarHBondContact O-N 2.98Å; L42-L78 HydrophobicContact CD2-CD1 4.34Å; L42-L78 HydrophobicContact CD2-CD2 3.95Å; L42-I109 HydrophobicContact CD2-CD1 4.28Å; L42-I109 HydrophobicContact CD2-CG2 4.28Å; L42-I109 HydrophobicContact CG-CD1 4.06Å; L42-Q111 HydrophobicContact CD2-CG 4.3Å; L42-V146 HydrophobicContact CD1-CG1 4Å; L42-N148 HydrophobicContact CD1-CB 4.23Å; L42-P152 HydrophobicContact CB-CB 4.4Å; L42-P152 HydrophobicContact CD1-CB 4.21Å
43	E	97.8	Very high	96.9	Very high	46 Å²	46	40.4 Å²	40.4	22%	0.215	20%	0.202	C	C	.	.	H	α-helix	trans	-56.1	-46.6	172.5	-70	81.4	176.6	0	0	111.6	T41 F46 E47 V106 I109	T41-E43 PolarHBondContact O-N 2.88Å; E43-F46 PolarHBondContact O-N 3.43Å; E43-E47 PolarHBondContact O-N 2.75Å; E43-V106 HydrophobicContact CB-CB 4Å; E43-V106 HydrophobicContact CB-CG1 3.87Å; E43-V106 HydrophobicContact CG-CB 4.43Å; E43-V106 HydrophobicContact CG-CG1 3.77Å; E43-I109 HydrophobicContact CG-CB 4.39Å; E43-I109 HydrophobicContact CG-CD1 4.07Å; E43-I109 HydrophobicContact CG-CG1 4.02Å; E43-I109 PolarHBondContact OE1-N 3.14Å
44	E	97.7	Very high	97.3	Very high	56 Å²	56	39.2 Å²	39.2	26%	0.262	19%	0.194	S	C	.	.	H	α-helix	trans	-67.2	-42.3	178	-173.2	173.9	-157.2	0	0	111.9	D40 T41 L42 F46 E47 Q48	D40-E44 WeakPolarHBondContact CB-OE2 3.13Å; D40-E44 PolarHBondContact N-OE2 2.94Å; T41-E44 PolarHBondContact O-N 3.07Å; T41-E44 VanDerWaalsContact O-N 3.13Å; T41-E44 WeakPolarHBondContact OG1-CB 3.4Å; T41-E44 PolarHBondContact OG1-N 2.86Å; L42-E44 VanDerWaalsContact C-N 3.32Å; L42-E44 PolarHBondContact O-N 2.85Å; E44-F46 VanDerWaalsContact C-N 3.27Å; E44-F46 PolarHBondContact O-N 3.02Å; E44-E47 WeakPolarHBondContact O-CG 3.48Å; E44-E47 PolarHBondContact O-N 3.43Å; E44-Q48 HydrophobicContact CG-CG 4.09Å; E44-Q48 VanDerWaalsContact O-CB 3.3Å; E44-Q48 WeakPolarHBondContact O-CB 3.48Å; E44-Q48 WeakPolarHBondContact O-CG 3.4Å; E44-Q48 PolarHBondContact O-N 3Å
45	A	98	Very high	97.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-40	175.3	0	0	0	0	0	112.1	T41 L42 C49 P152 V154	T41-A45 PolarHBondContact O-N 3.4Å; L42-A45 PolarHBondContact O-N 3.3Å; A45-C49 WeakPolarHBondContact O-CB 3.4Å; A45-C49 PolarHBondContact O-N 2.95Å; A45-P152 HydrophobicContact CB-CB 4.11Å; A45-V154 HydrophobicContact CB-CG1 4.34Å
46	F	98.1	Very high	97.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-68.1	-48.3	176.8	-85	-132.3	0	0	0	111.5	L42 E43 E44 Q48 C49 A50 L81 L82 F85 V106 I109 L116 V146 V154	L42-F46 HydrophobicContact CD1-CD2 4.04Å; L42-F46 HydrophobicContact CD1-CE2 3.63Å; L42-F46 HydrophobicContact CG-CD2 4.15Å; L42-F46 HydrophobicContact CG-CE2 3.95Å; L42-F46 VanDerWaalsContact O-CD2 3.24Å; L42-F46 WeakPolarHBondContact O-CD2 3.31Å; L42-F46 PolarHBondContact O-N 2.98Å; E43-F46 PolarHBondContact O-N 3.43Å; E44-F46 VanDerWaalsContact C-N 3.27Å; E44-F46 PolarHBondContact O-N 3.02Å; F46-Q48 VanDerWaalsContact C-N 3.32Å; F46-Q48 PolarHBondContact O-N 2.7Å; F46-C49 WeakPolarHBondContact O-CB 3.41Å; F46-C49 PolarHBondContact O-N 3.45Å; F46-C49 VanDerWaalsContact O-N 3.12Å; F46-A50 PolarHBondContact O-N 3.2Å; F46-A50 VanDerWaalsContact O-N 3.13Å; F46-L81 HydrophobicContact CE1-CG 4.33Å; F46-L82 HydrophobicContact CD1-CB 4.35Å; F46-L82 HydrophobicContact CD1-CD1 3.7Å; F46-L82 HydrophobicContact CD2-CD1 4.16Å; F46-L82 HydrophobicContact CE1-CB 3.62Å; F46-L82 HydrophobicContact CE1-CD1 3.83Å; F46-L82 HydrophobicContact CE1-CG 4.29Å; F46-L82 HydrophobicContact CE2-CB 4.46Å; F46-L82 HydrophobicContact CE2-CD1 4.26Å; F46-L82 HydrophobicContact CG-CD1 3.88Å; F46-L82 HydrophobicContact CZ-CB 3.68Å; F46-L82 HydrophobicContact CZ-CD1 4.11Å; F46-L82 HydrophobicContact CZ-CG 4.33Å; F46-F85 HydrophobicContact CB-CE1 4.27Å; F46-F85 HydrophobicContact CD1-CD1 4.29Å; F46-F85 VanDerWaalsContact O-CE1 3.23Å; F46-F85 WeakPolarHBondContact O-CE1 3.33Å; F46-V106 HydrophobicContact CB-CG2 4.11Å; F46-I109 HydrophobicContact CB-CD1 4.35Å; F46-I109 HydrophobicContact CD1-CD1 3.97Å; F46-I109 HydrophobicContact CD2-CD1 4.31Å; F46-I109 HydrophobicContact CE1-CD1 4.32Å; F46-I109 HydrophobicContact CG-CD1 3.95Å; F46-L116 HydrophobicContact CD1-CD1 3.6Å; F46-L116 HydrophobicContact CE1-CD1 4.24Å; F46-L116 HydrophobicContact CG-CD1 4.5Å; F46-V146 HydrophobicContact CE2-CG1 4.13Å; F46-V154 HydrophobicContact CD2-CG1 4.07Å; F46-V154 HydrophobicContact CE2-CG1 3.91Å
47	E	97.9	Very high	97.1	Very high	12 Å²	12	36.3 Å²	36.3	6%	0.056	19%	0.189	C	C	.	.	H	α-helix	trans	-64.4	-38.4	-179.2	88.7	-164.1	-173.5	0	0	111.7	E43 E44 C49 A50 M51 V104 K105 V106	E43-E47 PolarHBondContact O-N 2.75Å; E44-E47 WeakPolarHBondContact O-CG 3.48Å; E44-E47 PolarHBondContact O-N 3.43Å; E47-C49 VanDerWaalsContact C-N 3.31Å; E47-C49 PolarHBondContact O-N 3.27Å; E47-A50 PolarHBondContact O-N 3.38Å; E47-M51 WeakPolarHBondContact O-CG 3.47Å; E47-M51 PolarHBondContact O-N 2.94Å; E47-V104 HydrophobicContact CB-CG1 4.42Å; E47-V104 WeakPolarHBondContact CB-O 3.35Å; E47-K105 IonicContact OE1-NZ 3.43Å; E47-K105 PolarHBondContact OE1-NZ 3.11Å; E47-K105 VanDerWaalsContact OE2-CA 3.31Å; E47-K105 WeakPolarHBondContact OE2-CA 3.47Å; E47-K105 VanDerWaalsContact OE2-CD 3.22Å; E47-K105 WeakPolarHBondContact OE2-CD 3.24Å; E47-K105 VanDerWaalsContact OE2-CE 3.23Å; E47-K105 WeakPolarHBondContact OE2-CE 3.48Å; E47-K105 IonicContact OE2-NZ 3.7Å; E47-K105 PolarHBondContact OE2-NZ 3.28Å; E47-V106 HydrophobicContact CB-CB 4.25Å; E47-V106 HydrophobicContact CB-CG2 3.73Å; E47-V106 PolarHBondContact OE2-N 3.26Å
48	Q	98.2	Very high	96.9	Very high	82 Å²	82	36.4 Å²	36.4	38%	0.383	19%	0.189	S	C	.	.	H	α-helix	trans	-65.7	-32.8	173.6	-68.3	-57.7	-32.9	0	0	112.3	A37 E44 F46 M51 A52	A37-Q48 HydrophobicContact CB-CB 3.92Å; E44-Q48 HydrophobicContact CG-CG 4.09Å; E44-Q48 VanDerWaalsContact O-CB 3.3Å; E44-Q48 WeakPolarHBondContact O-CB 3.48Å; E44-Q48 WeakPolarHBondContact O-CG 3.4Å; E44-Q48 PolarHBondContact O-N 3Å; F46-Q48 VanDerWaalsContact C-N 3.32Å; F46-Q48 PolarHBondContact O-N 2.7Å; Q48-M51 PolarHBondContact O-N 3.39Å; Q48-A52 WeakPolarHBondContact O-CB 3.48Å; Q48-A52 PolarHBondContact O-N 3.16Å
49	C	97.9	Very high	96.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-42.1	174.7	-164.1	0	0	0	0	111.8	A37 A45 F46 E47 M51 A52 M53 L86 V154	A37-C49 HydrophobicContact CB-CB 3.86Å; A45-C49 WeakPolarHBondContact O-CB 3.4Å; A45-C49 PolarHBondContact O-N 2.95Å; F46-C49 WeakPolarHBondContact O-CB 3.41Å; F46-C49 PolarHBondContact O-N 3.45Å; F46-C49 VanDerWaalsContact O-N 3.12Å; E47-C49 VanDerWaalsContact C-N 3.31Å; E47-C49 PolarHBondContact O-N 3.27Å; C49-M51 VanDerWaalsContact C-N 3.33Å; C49-M51 PolarHBondContact O-N 3Å; C49-A52 PolarHBondContact O-N 2.89Å; C49-M53 PolarHBondContact O-N 2.95Å; C49-M53 VanDerWaalsContact O-N 3.07Å; C49-L86 HydrophobicContact CB-CD2 4.48Å; C49-V154 HydrophobicContact CB-CG2 3.68Å
50	A	97.5	Very high	96.7	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-41.5	171.7	0	0	0	0	0	111.5	F46 E47 A52 M53 F54 F85 L86 V104	F46-A50 PolarHBondContact O-N 3.2Å; F46-A50 VanDerWaalsContact O-N 3.13Å; E47-A50 PolarHBondContact O-N 3.38Å; A50-A52 VanDerWaalsContact C-N 3.33Å; A50-A52 PolarHBondContact O-N 2.95Å; A50-M53 WeakPolarHBondContact O-CB 3.3Å; A50-M53 PolarHBondContact O-N 3.12Å; A50-F54 WeakPolarHBondContact O-CD2 3.36Å; A50-F54 PolarHBondContact O-N 2.94Å; A50-F85 HydrophobicContact CB-CE1 3.71Å; A50-F85 HydrophobicContact CB-CZ 3.68Å; A50-L86 HydrophobicContact CB-CD2 3.97Å; A50-V104 HydrophobicContact CB-CB 4.38Å; A50-V104 HydrophobicContact CB-CG1 4.3Å; A50-V104 HydrophobicContact CB-CG2 4.29Å
51	M	97.9	Very high	96.6	Very high	27 Å²	27	29.6 Å²	29.6	13%	0.133	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-38.1	175.1	-70.4	-46.8	-56	0	0	113.1	E47 Q48 C49 M53 F54 G55 T60 R102 E103 V104	E47-M51 WeakPolarHBondContact O-CG 3.47Å; E47-M51 PolarHBondContact O-N 2.94Å; Q48-M51 PolarHBondContact O-N 3.39Å; C49-M51 VanDerWaalsContact C-N 3.33Å; C49-M51 PolarHBondContact O-N 3Å; M51-M53 VanDerWaalsContact C-N 3.34Å; M51-F54 PolarHBondContact O-N 3.39Å; M51-G55 PolarHBondContact O-N 3.33Å; M51-T60 HydrophobicContact CE-CG2 4.04Å; M51-R102 WeakPolarHBondContact CE-O 3.45Å; M51-E103 VanDerWaalsContact SD-CA 3.51Å; M51-V104 HydrophobicContact SD-CB 4.04Å; M51-V104 HydrophobicContact SD-CG2 3.91Å; M51-V104 PolarHBondContact SD-N 2.8Å
52	A	97.3	Very high	96.5	Very high	35 Å²	35	28.8 Å²	28.8	29%	0.289	17%	0.169	S	C	.	.	H	α-helix	trans	-63.6	-40.2	175	0	0	0	0	0	111.6	L35 Q48 C49 A50 Y56	L35-A52 HydrophobicContact CD1-CB 4.48Å; L35-A52 HydrophobicContact CD2-CB 4.19Å; Q48-A52 WeakPolarHBondContact O-CB 3.48Å; Q48-A52 PolarHBondContact O-N 3.16Å; C49-A52 PolarHBondContact O-N 2.89Å; A50-A52 VanDerWaalsContact C-N 3.33Å; A50-A52 PolarHBondContact O-N 2.95Å; A52-Y56 PolarHBondContact O-N 3.29Å; A52-Y56 VanDerWaalsContact O-N 3.15Å
53	M	96.9	Very high	96.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-51.9	174.7	-177.2	-175.9	66.1	0	0	111.7	L35 C49 A50 M51 G55 Y56 M57 W89 L90 V136 I139	L35-M53 HydrophobicContact CD1-CB 3.84Å; C49-M53 PolarHBondContact O-N 2.95Å; C49-M53 VanDerWaalsContact O-N 3.07Å; A50-M53 WeakPolarHBondContact O-CB 3.3Å; A50-M53 PolarHBondContact O-N 3.12Å; M51-M53 VanDerWaalsContact C-N 3.34Å; M53-G55 PolarHBondContact O-N 2.79Å; M53-Y56 VanDerWaalsContact O-CB 3.3Å; M53-Y56 WeakPolarHBondContact O-CB 3.33Å; M53-Y56 PolarHBondContact O-N 2.75Å; M53-Y56 VanDerWaalsContact O-N 3.15Å; M53-M57 HydrophobicContact CG-CE 4.17Å; M53-M57 PolarHBondContact O-N 2.85Å; M53-W89 HydrophobicContact CE-CB 4.17Å; M53-L90 HydrophobicContact CE-CB 4.25Å; M53-L90 HydrophobicContact SD-CB 4.2Å; M53-L90 HydrophobicContact SD-CD1 4.47Å; M53-V136 HydrophobicContact CG-CG1 4.42Å; M53-V136 HydrophobicContact CG-CG2 4.16Å; M53-I139 HydrophobicContact SD-CD1 3.65Å
54	F	96.7	Very high	96.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.8	-33.4	179.8	-71.1	-62.6	0	0	0	113.1	A50 M51 Y56 M57 T58 T60 W89 F93 I100 P101 V104	A50-F54 WeakPolarHBondContact O-CD2 3.36Å; A50-F54 PolarHBondContact O-N 2.94Å; M51-F54 PolarHBondContact O-N 3.39Å; F54-Y56 PolarHBondContact O-N 3.2Å; F54-M57 HydrophobicContact CD1-CE 4.46Å; F54-M57 HydrophobicContact CD1-SD 3.79Å; F54-M57 HydrophobicContact CE1-SD 4.2Å; F54-M57 WeakPolarHBondContact O-CB 3.43Å; F54-M57 PolarHBondContact O-N 2.81Å; F54-T58 PolarHBondContact O-N 3.46Å; F54-T60 HydrophobicContact CB-CG2 3.94Å; F54-W89 HydrophobicContact CE2-CB 4.01Å; F54-W89 HydrophobicContact CE2-CD2 4.44Å; F54-W89 HydrophobicContact CE2-CE3 4.28Å; F54-W89 HydrophobicContact CE2-CG 4.36Å; F54-W89 HydrophobicContact CZ-CB 3.98Å; F54-W89 HydrophobicContact CZ-CE3 4.32Å; F54-F93 HydrophobicContact CE1-CB 3.94Å; F54-F93 HydrophobicContact CE1-CG 4.38Å; F54-I100 HydrophobicContact CD1-CD1 4.1Å; F54-I100 HydrophobicContact CD1-CG1 4.13Å; F54-P101 HydrophobicContact CD1-CG 4.36Å; F54-P101 HydrophobicContact CD2-CG 3.3Å; F54-P101 HydrophobicContact CE1-CG 4.34Å; F54-P101 HydrophobicContact CE2-CG 3.27Å; F54-P101 HydrophobicContact CG-CG 3.88Å; F54-P101 HydrophobicContact CZ-CG 3.82Å; F54-V104 HydrophobicContact CE2-CG2 4.49Å
55	G	95.9	Very high	96.3	Very high	43 Å²	43	32 Å²	32	44%	0.443	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-23.4	172.3	0	0	0	0	0	113.5	M51 M53 T58	M51-G55 PolarHBondContact O-N 3.33Å; M53-G55 PolarHBondContact O-N 2.79Å; G55-T58 CarbonylContact C-O 3.01Å; G55-T58 WeakPolarHBondContact CA-O 3.33Å
56	Y	94.3	Very high	96.2	Very high	84 Å²	84	37.6 Å²	37.6	33%	0.329	22%	0.22	S	C	.	.	H	α-helix	trans	-76	-31.6	172.8	-150.2	-100.9	0	0	0	112.4	A52 M53 F54 T134 I160	A52-Y56 PolarHBondContact O-N 3.29Å; A52-Y56 VanDerWaalsContact O-N 3.15Å; M53-Y56 VanDerWaalsContact O-CB 3.3Å; M53-Y56 WeakPolarHBondContact O-CB 3.33Å; M53-Y56 PolarHBondContact O-N 2.75Å; M53-Y56 VanDerWaalsContact O-N 3.15Å; F54-Y56 PolarHBondContact O-N 3.2Å; Y56-T134 HydrophobicContact CE1-CG2 4.18Å; Y56-T134 PolarHBondContact O-N 3.07Å; Y56-I160 HydrophobicContact CD1-CG2 4.22Å; Y56-I160 HydrophobicContact CE1-CD1 3.75Å; Y56-I160 HydrophobicContact CE1-CG2 3.96Å
57	M	94.4	Very high	96.1	Very high	7 Å²	7	40.7 Å²	40.7	3%	0.034	23%	0.234	C	C	.	.	H	α-helix	trans	-79	-37.8	179.2	-61	175.4	-177.4	0	0	112.9	M53 F54 L90 F93 I100 G133 T134 V136	M53-M57 HydrophobicContact CG-CE 4.17Å; M53-M57 PolarHBondContact O-N 2.85Å; F54-M57 HydrophobicContact CD1-CE 4.46Å; F54-M57 HydrophobicContact CD1-SD 3.79Å; F54-M57 HydrophobicContact CE1-SD 4.2Å; F54-M57 WeakPolarHBondContact O-CB 3.43Å; F54-M57 PolarHBondContact O-N 2.81Å; M57-L90 HydrophobicContact CE-CD1 3.32Å; M57-F93 HydrophobicContact CE-CD1 4.07Å; M57-F93 HydrophobicContact CE-CE1 4.34Å; M57-F93 HydrophobicContact SD-CD1 3.81Å; M57-F93 HydrophobicContact SD-CD2 4.36Å; M57-F93 HydrophobicContact SD-CE1 3.76Å; M57-F93 HydrophobicContact SD-CE2 4.31Å; M57-F93 HydrophobicContact SD-CG 4.11Å; M57-F93 HydrophobicContact SD-CZ 4.02Å; M57-I100 HydrophobicContact CB-CD1 4.48Å; M57-G133 WeakPolarHBondContact O-CA 3.48Å; M57-G133 PolarHBondContact O-N 2.83Å; M57-T134 WeakPolarHBondContact CA-O 3.38Å; M57-V136 HydrophobicContact CE-CB 3.5Å; M57-V136 VanDerWaalsContact CE-CB 3.5Å; M57-V136 HydrophobicContact CE-CG2 3.6Å; M57-V136 HydrophobicContact CG-CG2 3.91Å
58	T	95.3	Very high	96	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.031	26%	0.261	C	S	.	.	S	Bend	trans	-160.5	168.6	179.5	-161.8	0	0	0	0	112.1	F54 G55 T60 V63 I100 F125 H130 P131	F54-T58 PolarHBondContact O-N 3.46Å; G55-T58 CarbonylContact C-O 3.01Å; G55-T58 WeakPolarHBondContact CA-O 3.33Å; T58-T60 PolarHBondContact O-N 2.89Å; T58-T60 VanDerWaalsContact O-N 3.07Å; T58-V63 HydrophobicContact CG2-CG2 4.42Å; T58-I100 HydrophobicContact CG2-CD1 3.39Å; T58-I100 HydrophobicContact CG2-CG1 4.14Å; T58-F125 HydrophobicContact CG2-CE2 4.26Å; T58-H130 HydrophobicContact CG2-CB 4.5Å; T58-H130 WeakPolarHBondContact OG1-CB 3.28Å; T58-P131 WeakPolarHBondContact CB-O 3.39Å; T58-P131 PolarHBondContact OG1-O 3.23Å
59	D	95.2	Very high	95.9	Very high	92 Å²	92	41.8 Å²	41.8	49%	0.492	25%	0.248	S	C	.	.			trans	-72.6	97.6	166.4	-177.4	-4.7	0	0	0	109.8	G61 T62 P131	D59-G61 PolarHBondContact O-N 2.88Å; D59-G61 VanDerWaalsContact O-N 3.11Å; D59-G61 WeakPolarHBondContact OD1-CA 3.2Å; D59-G61 PolarHBondContact OD1-N 3.25Å; D59-T62 HydrophobicContact CB-CG2 4.13Å; D59-T62 WeakPolarHBondContact O-CB 3.31Å; D59-T62 PolarHBondContact O-N 3.25Å; D59-T62 PolarHBondContact O-OG1 2.86Å; D59-P131 HydrophobicContact CB-CG 4.14Å
60	T	94.1	Very high	95.9	Very high	27 Å²	27	46.3 Å²	46.3	17%	0.166	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-61.3	-17.7	178.9	58.9	0	0	0	0	112.7	M51 F54 T58 T62 V63	M51-T60 HydrophobicContact CE-CG2 4.04Å; F54-T60 HydrophobicContact CB-CG2 3.94Å; T58-T60 PolarHBondContact O-N 2.89Å; T58-T60 VanDerWaalsContact O-N 3.07Å; T60-T62 PolarHBondContact O-N 3.34Å; T60-V63 WeakPolarHBondContact O-CB 3.34Å; T60-V63 PolarHBondContact O-N 3.25Å; T60-V63 VanDerWaalsContact O-N 3.16Å
61	G	94.4	Very high	95.8	Very high	40 Å²	40	46.6 Å²	46.6	41%	0.412	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-64.3	-22.6	172.5	0	0	0	0	0	113.7	D59 R102	D59-G61 PolarHBondContact O-N 2.88Å; D59-G61 VanDerWaalsContact O-N 3.11Å; D59-G61 WeakPolarHBondContact OD1-CA 3.2Å; D59-G61 PolarHBondContact OD1-N 3.25Å; G61-R102 PolarHBondContact O-NH1 3.11Å
62	T	94.7	Very high	95.8	Very high	45 Å²	45	51.8 Å²	51.8	28%	0.276	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-83.9	-13.2	176.4	67.3	0	0	0	0	113.9	D59 T60 K129 P131	D59-T62 HydrophobicContact CB-CG2 4.13Å; D59-T62 WeakPolarHBondContact O-CB 3.31Å; D59-T62 PolarHBondContact O-N 3.25Å; D59-T62 PolarHBondContact O-OG1 2.86Å; T60-T62 PolarHBondContact O-N 3.34Å; T62-K129 WeakPolarHBondContact O-CE 3.45Å; T62-P131 HydrophobicContact CG2-CG 4.3Å
63	V	96.5	Very high	95.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.285	C	S	.	.			trans	-80.6	131.5	-179.6	-178.8	0	0	0	0	109.6	T58 T60 I100 R102 E123	T58-V63 HydrophobicContact CG2-CG2 4.42Å; T60-V63 WeakPolarHBondContact O-CB 3.34Å; T60-V63 PolarHBondContact O-N 3.25Å; T60-V63 VanDerWaalsContact O-N 3.16Å; V63-I100 HydrophobicContact CG1-CG2 4.07Å; V63-I100 WeakPolarHBondContact CG1-O 3.42Å; V63-I100 HydrophobicContact CG2-CG1 4.39Å; V63-I100 HydrophobicContact CG2-CG2 3.82Å; V63-R102 HydrophobicContact CB-CB 4.01Å; V63-R102 HydrophobicContact CG1-CB 3.93Å; V63-R102 VanDerWaalsContact O-CD 3.26Å; V63-R102 WeakPolarHBondContact O-CD 3.24Å; V63-R102 WeakPolarHBondContact O-CG 3.26Å; V63-R102 PolarHBondContact O-NH1 3.27Å; V63-E123 HydrophobicContact CG1-CG 4.13Å
64	E	96	Very high	95.8	Very high	93 Å²	93	57 Å²	57	44%	0.435	31%	0.313	S	S	.	.			trans	-92.5	141.9	177.1	-73.2	174.7	-138.9	0	0	111.4	L66 G122 E123 K129	E64-L66 VanDerWaalsContact C-N 3.28Å; E64-L66 HydrophobicContact CB-CD1 4.31Å; E64-L66 HydrophobicContact CB-CD2 4.15Å; E64-L66 HydrophobicContact CB-CG 3.86Å; E64-L66 PolarHBondContact O-N 2.85Å; E64-G122 CarbonylContact O-C 3.59Å; E64-G122 VanDerWaalsContact O-CA 3.24Å; E64-G122 WeakPolarHBondContact O-CA 3.41Å; E64-G122 VanDerWaalsContact O-O 3.09Å; E64-E123 WeakPolarHBondContact CB-OE1 3.31Å; E64-E123 PolarHBondContact N-OE1 3.16Å; E64-K129 VanDerWaalsContact CG-NZ 3.34Å; E64-K129 WeakPolarHBondContact OE1-CE 3.43Å; E64-K129 IonicContact OE1-NZ 3.12Å; E64-K129 PolarHBondContact OE1-NZ 2.75Å; E64-K129 IonicContact OE2-NZ 3.9Å
65	P	96.1	Very high	95.8	Very high	79 Å²	79	57.6 Å²	57.6	51%	0.513	32%	0.32	S	S	.	.			trans	-80.9	67.6	-178.8	35.7	-38	0	0	0	111.7	W121	P65-W121 HydrophobicContact CB-CB 4.27Å; P65-W121 HydrophobicContact CB-CG 4.18Å
66	L	95.2	Very high	95.8	Very high	118 Å²	118	62.5 Å²	62.5	62%	0.618	34%	0.336	S	S	*	.			trans	-90	-33.6	-173.2	-60.2	-178.6	0	0	0	113.7	E64 G122 E123	E64-L66 VanDerWaalsContact C-N 3.28Å; E64-L66 HydrophobicContact CB-CD1 4.31Å; E64-L66 HydrophobicContact CB-CD2 4.15Å; E64-L66 HydrophobicContact CB-CG 3.86Å; E64-L66 PolarHBondContact O-N 2.85Å; L66-G122 PolarHBondContact N-O 2.82Å; L66-E123 HydrophobicContact CB-CB 4.33Å; L66-E123 HydrophobicContact CD1-CB 4.12Å; L66-E123 HydrophobicContact CG-CB 4.39Å
67	Q	94.8	Very high	95.9	Very high	65 Å²	65	62 Å²	62	30%	0.304	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	159.9	178.3	68.9	-167	-24.4	0	0	110.9	F99 W121 G122	Q67-F99 HydrophobicContact CG-CD2 3.79Å; Q67-F99 HydrophobicContact CG-CE2 3.44Å; Q67-F99 VanDerWaalsContact CG-CE2 3.44Å; Q67-W121 CarbonylContact O-C 3.53Å; Q67-W121 WeakPolarHBondContact O-CA 3.24Å; Q67-G122 WeakPolarHBondContact CG-O 3.32Å; Q67-G122 PolarHBondContact N-O 3.43Å; Q67-G122 PolarHBondContact O-N 3.05Å
68	T	96.7	Very high	95.9	Very high	100 Å²	100	63.2 Å²	63.2	61%	0.613	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	129	178.7	-54.9	0	0	0	0	109.5	I119 G120	T68-I119 HydrophobicContact CG2-CB 4.38Å; T68-G120 CarbonylContact C-O 3.59Å; T68-G120 VanDerWaalsContact CA-O 3.3Å; T68-G120 WeakPolarHBondContact CA-O 3.38Å
69	V	96.3	Very high	96	Very high	18 Å²	18	67 Å²	67	11%	0.109	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.3	177.6	177.5	0	0	0	0	108.5	V71 W89 K92 F99 I119 G120	V69-V71 HydrophobicContact CG1-CG2 4.41Å; V69-W89 HydrophobicContact CB-CH2 4.39Å; V69-W89 HydrophobicContact CB-CZ3 4.35Å; V69-W89 HydrophobicContact CG1-CH2 4.47Å; V69-W89 HydrophobicContact CG1-CZ3 4.31Å; V69-K92 HydrophobicContact CG1-CD 4.11Å; V69-K92 HydrophobicContact CG1-CG 4.3Å; V69-F99 HydrophobicContact CB-CD1 4.16Å; V69-F99 HydrophobicContact CB-CE1 3.93Å; V69-F99 HydrophobicContact CB-CZ 4.19Å; V69-F99 HydrophobicContact CG2-CD1 3.84Å; V69-F99 HydrophobicContact CG2-CD2 3.8Å; V69-F99 HydrophobicContact CG2-CE1 3.86Å; V69-F99 HydrophobicContact CG2-CE2 3.85Å; V69-F99 HydrophobicContact CG2-CG 3.8Å; V69-F99 HydrophobicContact CG2-CZ 3.86Å; V69-I119 CarbonylContact O-C 3.53Å; V69-I119 VanDerWaalsContact O-CA 3.31Å; V69-I119 WeakPolarHBondContact O-CA 3.17Å; V69-G120 PolarHBondContact N-O 2.99Å; V69-G120 PolarHBondContact O-N 2.8Å
70	E	96.8	Very high	96.1	Very high	95 Å²	95	63.1 Å²	63.1	44%	0.444	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.6	173.8	-173.3	165.2	-162.6	0	0	109.3	R117 S118 I119	E70-R117 HydrophobicContact CG-CG 4.46Å; E70-R117 WeakPolarHBondContact OE1-CD 3.42Å; E70-R117 WeakPolarHBondContact OE1-CG 3.46Å; E70-R117 IonicContact OE1-CZ 3.41Å; E70-R117 IonicContact OE1-NE 2.62Å; E70-R117 IonicContact OE1-NH1 2.77Å; E70-R117 PolarHBondContact OE1-NH1 3.37Å; E70-R117 VanDerWaalsContact OE1-NH1 3.12Å; E70-S118 WeakPolarHBondContact CA-O 3.44Å; E70-S118 WeakPolarHBondContact CG-O 3.47Å; E70-I119 HydrophobicContact CB-CG2 4.13Å; E70-I119 HydrophobicContact CG-CG2 3.99Å
71	V	96.8	Very high	96.3	Very high	6 Å²	6	61.8 Å²	61.8	4%	0.036	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.6	177.6	171.5	0	0	0	0	108.1	V69 T73 E88 W89 K92 S118	V69-V71 HydrophobicContact CG1-CG2 4.41Å; V71-T73 HydrophobicContact CG1-CG2 3.77Å; V71-E88 HydrophobicContact CG1-CB 3.74Å; V71-W89 HydrophobicContact CB-CD2 4.45Å; V71-W89 HydrophobicContact CB-CZ2 3.96Å; V71-W89 HydrophobicContact CG2-CD2 3.86Å; V71-W89 HydrophobicContact CG2-CE3 4.06Å; V71-W89 HydrophobicContact CG2-CG 4.45Å; V71-W89 HydrophobicContact CG2-CH2 3.92Å; V71-W89 HydrophobicContact CG2-CZ2 3.74Å; V71-W89 HydrophobicContact CG2-CZ3 4.06Å; V71-K92 HydrophobicContact CG2-CG 4.25Å; V71-S118 PolarHBondContact N-O 3.45Å; V71-S118 PolarHBondContact O-N 3.49Å; V71-S118 PolarHBondContact O-OG 2.94Å; V71-S118 VanDerWaalsContact O-OG 3.1Å
72	E	97.8	Very high	96.4	Very high	135 Å²	135	59.9 Å²	59.9	63%	0.631	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.9	174.8	-74.9	-172.2	178.3	0	0	109.6	L116 R117	E72-L116 WeakPolarHBondContact CA-O 3.44Å; E72-R117 HydrophobicContact CG-CB 4.18Å; E72-R117 HydrophobicContact CG-CG 3.71Å; E72-R117 WeakPolarHBondContact OE1-CD 3.18Å
73	T	97.4	Very high	96.6	Very high	15 Å²	15	59.3 Å²	59.3	9%	0.092	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	162.8	-178.9	71.7	0	0	0	0	111.7	V71 E88 K115 L116	V71-T73 HydrophobicContact CG1-CG2 3.77Å; T73-E88 HydrophobicContact CG2-CB 3.97Å; T73-E88 HydrophobicContact CG2-CG 3.72Å; T73-K115 WeakPolarHBondContact O-CA 3.24Å; T73-L116 PolarHBondContact N-O 3.28Å; T73-L116 PolarHBondContact O-N 3.15Å
74	Q	96.8	Very high	96.6	Very high	129 Å²	129	62.5 Å²	62.5	60%	0.603	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.1	151.5	173.8	62.8	179.5	27.3	0	0	110.3	H84 F114 K115	Q74-H84 PolarHBondContact O-ND1 3.3Å; Q74-F114 CarbonylContact C-O 3.6Å; Q74-F114 VanDerWaalsContact CA-O 3.26Å; Q74-F114 WeakPolarHBondContact CA-O 3.31Å; Q74-K115 HydrophobicContact CB-CG 4.18Å
75	G	96.1	Very high	96.7	Very high	13 Å²	13	58.1 Å²	58.1	13%	0.134	30%	0.303	C	S	.	.			trans	-136.1	-179.6	176.5	0	0	0	0	0	111.6	F114	G75-F114 PolarHBondContact N-O 3.13Å; G75-F114 WeakPolarHBondContact O-CB 3.23Å
76	D	95.9	Very high	96.8	Very high	147 Å²	147	54.3 Å²	54.3	79%	0.786	28%	0.279	S	S	*	.	S	Bend	trans	-96.9	-17.7	173	-64.5	-49.9	0	0	0	111.8	S80 F114	D76-S80 PolarHBondContact N-OG 3.3Å; D76-F114 VanDerWaalsContact O-CD2 3.23Å; D76-F114 WeakPolarHBondContact O-CD2 3.43Å; D76-F114 VanDerWaalsContact O-CE2 3.25Å; D76-F114 WeakPolarHBondContact O-CE2 3.26Å
77	D	96.3	Very high	96.9	Very high	72 Å²	72	51.9 Å²	51.9	39%	0.385	27%	0.266	S	S	.	.	S	Bend	trans	-156.5	-177.7	177.1	60	27.3	0	0	0	110.6	Q79 S80 L81 F114	D77-Q79 VanDerWaalsContact C-N 3.33Å; D77-Q79 PolarHBondContact O-N 2.92Å; D77-Q79 PolarHBondContact OD1-N 3.12Å; D77-Q79 VanDerWaalsContact OD1-N 3.11Å; D77-S80 PolarHBondContact N-OG 3.3Å; D77-S80 PolarHBondContact O-OG 3.37Å; D77-S80 WeakPolarHBondContact OD1-CB 3.35Å; D77-S80 PolarHBondContact OD1-N 3.01Å; D77-S80 PolarHBondContact OD1-OG 3.07Å; D77-L81 VanDerWaalsContact O-CB 3.24Å; D77-L81 WeakPolarHBondContact O-CB 3.22Å; D77-L81 PolarHBondContact O-N 3.34Å; D77-F114 VanDerWaalsContact C-CD1 3.45Å
78	L	95.8	Very high	97	Very high	33 Å²	33	52.8 Å²	52.8	17%	0.173	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-31.5	179.8	-69.1	179.6	0	0	0	113.7	L42 L82 F114 V146 N148	L42-L78 HydrophobicContact CD2-CD1 4.34Å; L42-L78 HydrophobicContact CD2-CD2 3.95Å; L78-L82 WeakPolarHBondContact O-CB 3.39Å; L78-L82 PolarHBondContact O-N 3.04Å; L78-F114 HydrophobicContact CD2-CD1 4.09Å; L78-F114 HydrophobicContact CD2-CE1 4.18Å; L78-F114 HydrophobicContact CG-CD1 4.38Å; L78-F114 HydrophobicContact CG-CE1 4.09Å; L78-V146 HydrophobicContact CB-CB 4.47Å; L78-V146 HydrophobicContact CB-CG1 4.12Å; L78-V146 HydrophobicContact CD1-CG1 4.11Å; L78-N148 HydrophobicContact CD1-CB 4.31Å
79	Q	96.8	Very high	97	Very high	85 Å²	85	48 Å²	48	40%	0.397	24%	0.241	S	C	.	.	H	α-helix	trans	-73.5	-48.1	-178.5	-68.7	179.8	7.7	0	0	110.5	D77 L81 L82 F83 M144 V146	D77-Q79 VanDerWaalsContact C-N 3.33Å; D77-Q79 PolarHBondContact O-N 2.92Å; D77-Q79 PolarHBondContact OD1-N 3.12Å; D77-Q79 VanDerWaalsContact OD1-N 3.11Å; Q79-L81 VanDerWaalsContact C-N 3.29Å; Q79-L81 PolarHBondContact O-N 3.48Å; Q79-L82 PolarHBondContact O-N 3.43Å; Q79-F83 WeakPolarHBondContact O-CB 3.34Å; Q79-F83 PolarHBondContact O-N 2.85Å; Q79-M144 HydrophobicContact CB-SD 3.84Å; Q79-M144 HydrophobicContact CG-CG 4.45Å; Q79-M144 HydrophobicContact CG-SD 4.38Å; Q79-V146 HydrophobicContact CG-CG2 4.18Å
80	S	97	Very high	97	Very high	10 Å²	10	47.5 Å²	47.5	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-36	173	56.3	0	0	0	0	112.4	D76 D77 F83 H84	D76-S80 PolarHBondContact N-OG 3.3Å; D77-S80 PolarHBondContact N-OG 3.3Å; D77-S80 PolarHBondContact O-OG 3.37Å; D77-S80 WeakPolarHBondContact OD1-CB 3.35Å; D77-S80 PolarHBondContact OD1-N 3.01Å; D77-S80 PolarHBondContact OD1-OG 3.07Å; S80-F83 PolarHBondContact O-N 3.3Å; S80-H84 PolarHBondContact O-N 2.71Å; S80-H84 PolarHBondContact O-ND1 2.62Å
81	L	97.7	Very high	96.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-45.6	173.4	-174.6	60.5	0	0	0	112	F46 D77 Q79 F85 I109 F114 L116	F46-L81 HydrophobicContact CE1-CG 4.33Å; D77-L81 VanDerWaalsContact O-CB 3.24Å; D77-L81 WeakPolarHBondContact O-CB 3.22Å; D77-L81 PolarHBondContact O-N 3.34Å; Q79-L81 VanDerWaalsContact C-N 3.29Å; Q79-L81 PolarHBondContact O-N 3.48Å; L81-F85 WeakPolarHBondContact O-CB 3.43Å; L81-F85 PolarHBondContact O-N 2.94Å; L81-I109 HydrophobicContact CD2-CG2 3.92Å; L81-F114 WeakPolarHBondContact CD1-O 3.35Å; L81-F114 HydrophobicContact CD2-CB 4.44Å; L81-L116 HydrophobicContact CD1-CB 3.72Å; L81-L116 HydrophobicContact CD2-CB 4.15Å; L81-L116 HydrophobicContact CG-CB 4.09Å
82	L	97.8	Very high	96.8	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-44	176.1	-179	58.9	0	0	0	111.5	F46 L78 Q79 F85 L86 M144 V146 V154 V156	F46-L82 HydrophobicContact CD1-CB 4.35Å; F46-L82 HydrophobicContact CD1-CD1 3.7Å; F46-L82 HydrophobicContact CD2-CD1 4.16Å; F46-L82 HydrophobicContact CE1-CB 3.62Å; F46-L82 HydrophobicContact CE1-CD1 3.83Å; F46-L82 HydrophobicContact CE1-CG 4.29Å; F46-L82 HydrophobicContact CE2-CB 4.46Å; F46-L82 HydrophobicContact CE2-CD1 4.26Å; F46-L82 HydrophobicContact CG-CD1 3.88Å; F46-L82 HydrophobicContact CZ-CB 3.68Å; F46-L82 HydrophobicContact CZ-CD1 4.11Å; F46-L82 HydrophobicContact CZ-CG 4.33Å; L78-L82 WeakPolarHBondContact O-CB 3.39Å; L78-L82 PolarHBondContact O-N 3.04Å; Q79-L82 PolarHBondContact O-N 3.43Å; L82-F85 HydrophobicContact CD1-CD1 4.17Å; L82-F85 PolarHBondContact O-N 3.47Å; L82-L86 HydrophobicContact CD1-CD1 4.1Å; L82-L86 HydrophobicContact CD1-CG 4.19Å; L82-L86 HydrophobicContact CG-CD1 4.23Å; L82-L86 WeakPolarHBondContact O-CG 3.31Å; L82-L86 PolarHBondContact O-N 2.77Å; L82-M144 HydrophobicContact CD2-SD 4.43Å; L82-V146 HydrophobicContact CD2-CG2 3.82Å; L82-V154 HydrophobicContact CD2-CB 3.88Å; L82-V154 HydrophobicContact CD2-CG1 4.01Å; L82-V154 HydrophobicContact CD2-CG2 4.36Å; L82-V156 HydrophobicContact CD2-CG2 3.48Å; L82-V156 VanDerWaalsContact CD2-CG2 3.48Å; L82-V156 HydrophobicContact CG-CG2 4.08Å
83	F	97.9	Very high	96.7	Very high	32 Å²	32	45.6 Å²	45.6	14%	0.14	22%	0.223	C	C	.	.	H	α-helix	trans	-57.7	-56.8	176.7	179.7	-86.2	0	0	0	111.3	Q79 S80 F85 L86 D87 I139 Y141 M144	Q79-F83 WeakPolarHBondContact O-CB 3.34Å; Q79-F83 PolarHBondContact O-N 2.85Å; S80-F83 PolarHBondContact O-N 3.3Å; F83-F85 VanDerWaalsContact C-N 3.27Å; F83-F85 PolarHBondContact O-N 2.77Å; F83-L86 PolarHBondContact O-N 3.41Å; F83-D87 HydrophobicContact CE1-CB 4.35Å; F83-D87 VanDerWaalsContact O-CB 3.28Å; F83-D87 WeakPolarHBondContact O-CB 3.18Å; F83-D87 PolarHBondContact O-N 3.25Å; F83-I139 HydrophobicContact CD2-CB 4.1Å; F83-I139 HydrophobicContact CD2-CG2 3.8Å; F83-I139 HydrophobicContact CE2-CB 3.94Å; F83-I139 HydrophobicContact CE2-CG2 4.14Å; F83-I139 VanDerWaalsContact CE2-O 3.32Å; F83-I139 WeakPolarHBondContact CE2-O 3.41Å; F83-Y141 HydrophobicContact CB-CE1 3.67Å; F83-Y141 HydrophobicContact CB-CE2 4.3Å; F83-Y141 WeakPolarHBondContact CB-OH 3.33Å; F83-Y141 AromaticContact CD1-CE2 3.92Å; F83-Y141 HydrophobicContact CD1-CE2 3.92Å; F83-Y141 AromaticContact CD1-CZ 3.77Å; F83-Y141 WeakPolarHBondContact CD1-OH 3.36Å; F83-Y141 HydrophobicContact CD2-CD1 4.36Å; F83-Y141 AromaticContact CD2-CD2 3.8Å; F83-Y141 HydrophobicContact CD2-CD2 3.8Å; F83-Y141 HydrophobicContact CD2-CE1 4.07Å; F83-Y141 AromaticContact CD2-CE2 3.46Å; F83-Y141 HydrophobicContact CD2-CE2 3.46Å; F83-Y141 VanDerWaalsContact CD2-CE2 3.46Å; F83-Y141 HydrophobicContact CD2-CG 4.24Å; F83-Y141 AromaticContact CD2-CZ 3.62Å; F83-Y141 HydrophobicContact CE1-CE2 4.13Å; F83-Y141 AromaticContact CE2-CD2 3.88Å; F83-Y141 HydrophobicContact CE2-CD2 3.88Å; F83-Y141 AromaticContact CE2-CE2 3.65Å; F83-Y141 HydrophobicContact CE2-CE2 3.65Å; F83-Y141 HydrophobicContact CG-CD2 4.37Å; F83-Y141 AromaticContact CG-CE1 3.91Å; F83-Y141 HydrophobicContact CG-CE1 3.91Å; F83-Y141 AromaticContact CG-CE2 3.61Å; F83-Y141 HydrophobicContact CG-CE2 3.61Å; F83-Y141 AromaticContact CG-CZ 3.34Å; F83-Y141 WeakPolarHBondContact CG-OH 3.47Å; F83-Y141 HydrophobicContact CZ-CE2 4.01Å; F83-M144 HydrophobicContact CB-CE 4.02Å; F83-M144 HydrophobicContact CD2-CE 4.18Å
84	H	97.8	Very high	96.3	Very high	68 Å²	68	47.5 Å²	47.5	32%	0.315	24%	0.237	S	C	.	.	H	α-helix	trans	-63.7	-35	-179.2	-65.8	152.2	0	0	0	111.8	Q74 S80 E88	Q74-H84 PolarHBondContact O-ND1 3.3Å; S80-H84 PolarHBondContact O-N 2.71Å; S80-H84 PolarHBondContact O-ND1 2.62Å; H84-E88 VanDerWaalsContact O-CB 3.31Å; H84-E88 WeakPolarHBondContact O-CB 3.28Å; H84-E88 WeakPolarHBondContact O-CG 3.27Å; H84-E88 PolarHBondContact O-N 2.68Å
85	F	98.1	Very high	95.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.7	-50.8	174.2	163	-104.8	0	0	0	112.2	F46 A50 L81 L82 F83 W89 V104 V106 L116 S118	F46-F85 HydrophobicContact CB-CE1 4.27Å; F46-F85 HydrophobicContact CD1-CD1 4.29Å; F46-F85 VanDerWaalsContact O-CE1 3.23Å; F46-F85 WeakPolarHBondContact O-CE1 3.33Å; A50-F85 HydrophobicContact CB-CE1 3.71Å; A50-F85 HydrophobicContact CB-CZ 3.68Å; L81-F85 WeakPolarHBondContact O-CB 3.43Å; L81-F85 PolarHBondContact O-N 2.94Å; L82-F85 HydrophobicContact CD1-CD1 4.17Å; L82-F85 PolarHBondContact O-N 3.47Å; F83-F85 VanDerWaalsContact C-N 3.27Å; F83-F85 PolarHBondContact O-N 2.77Å; F85-W89 AromaticContact CD2-CD1 3.59Å; F85-W89 AromaticContact CD2-NE1 3.66Å; F85-W89 AromaticContact CE2-CD1 3.31Å; F85-W89 AromaticContact CE2-NE1 3.09Å; F85-W89 AromaticContact CZ-CD1 3.71Å; F85-W89 AromaticContact CZ-NE1 3.74Å; F85-W89 PolarHBondContact O-N 2.97Å; F85-V104 HydrophobicContact CE2-CG1 4.46Å; F85-V104 HydrophobicContact CZ-CG1 4.18Å; F85-V106 HydrophobicContact CE2-CG2 3.93Å; F85-V106 HydrophobicContact CZ-CG2 3.91Å; F85-L116 HydrophobicContact CB-CD1 4.18Å; F85-L116 HydrophobicContact CB-CD2 4.47Å; F85-L116 HydrophobicContact CD2-CD1 3.81Å; F85-L116 HydrophobicContact CD2-CD2 3.36Å; F85-L116 HydrophobicContact CD2-CG 4.28Å; F85-L116 HydrophobicContact CE2-CD1 4.3Å; F85-L116 HydrophobicContact CE2-CD2 3.88Å; F85-L116 HydrophobicContact CG-CD1 3.96Å; F85-L116 HydrophobicContact CG-CD2 4.2Å; F85-S118 WeakPolarHBondContact CE2-OG 3.33Å
86	L	97.6	Very high	94.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-38.7	179	-66.5	175.1	0	0	0	112	C49 A50 L82 F83 W89 L90 I139 V156	C49-L86 HydrophobicContact CB-CD2 4.48Å; A50-L86 HydrophobicContact CB-CD2 3.97Å; L82-L86 HydrophobicContact CD1-CD1 4.1Å; L82-L86 HydrophobicContact CD1-CG 4.19Å; L82-L86 HydrophobicContact CG-CD1 4.23Å; L82-L86 WeakPolarHBondContact O-CG 3.31Å; L82-L86 PolarHBondContact O-N 2.77Å; F83-L86 PolarHBondContact O-N 3.41Å; L86-W89 PolarHBondContact O-N 3.13Å; L86-L90 WeakPolarHBondContact O-CB 3.49Å; L86-L90 PolarHBondContact O-N 3.44Å; L86-I139 HydrophobicContact CB-CD1 3.86Å; L86-I139 HydrophobicContact CB-CG1 3.81Å; L86-I139 HydrophobicContact CB-CG2 4.27Å; L86-I139 HydrophobicContact CD1-CG2 4.18Å; L86-V156 HydrophobicContact CD1-CB 4.3Å; L86-V156 HydrophobicContact CD1-CG1 3.87Å; L86-V156 HydrophobicContact CD1-CG2 4Å
87	D	96.8	Very high	93.9	Very high	66 Å²	66	45 Å²	45	35%	0.353	23%	0.229	S	C	.	.	H	α-helix	trans	-65.6	-41.8	-179.9	-166.1	48.2	0	0	0	111.9	F83 L90 Y91 I139	F83-D87 HydrophobicContact CE1-CB 4.35Å; F83-D87 VanDerWaalsContact O-CB 3.28Å; F83-D87 WeakPolarHBondContact O-CB 3.18Å; F83-D87 PolarHBondContact O-N 3.25Å; D87-L90 PolarHBondContact O-N 2.87Å; D87-Y91 WeakPolarHBondContact O-CB 3.47Å; D87-Y91 PolarHBondContact O-N 3.3Å; D87-I139 HydrophobicContact CB-CG1 4.4Å
88	E	96.8	Very high	93.8	Very high	85 Å²	85	46.7 Å²	46.7	40%	0.397	23%	0.233	S	C	.	.	H	α-helix	trans	-67	-38.9	175.6	-72.4	-75.9	175.4	0	0	112	V71 T73 H84 Y91 K92	V71-E88 HydrophobicContact CG1-CB 3.74Å; T73-E88 HydrophobicContact CG2-CB 3.97Å; T73-E88 HydrophobicContact CG2-CG 3.72Å; H84-E88 VanDerWaalsContact O-CB 3.31Å; H84-E88 WeakPolarHBondContact O-CB 3.28Å; H84-E88 WeakPolarHBondContact O-CG 3.27Å; H84-E88 PolarHBondContact O-N 2.68Å; E88-Y91 WeakPolarHBondContact O-CB 3.33Å; E88-Y91 PolarHBondContact O-N 2.75Å; E88-K92 WeakPolarHBondContact O-CG 3.4Å; E88-K92 PolarHBondContact O-N 2.91Å
89	W	97.3	Very high	93.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-42.9	171.7	-86	114	0	0	0	112.1	M53 F54 V69 V71 F85 L86 Y91 K92 F93 F99 P101 V104 S118	M53-W89 HydrophobicContact CE-CB 4.17Å; F54-W89 HydrophobicContact CE2-CB 4.01Å; F54-W89 HydrophobicContact CE2-CD2 4.44Å; F54-W89 HydrophobicContact CE2-CE3 4.28Å; F54-W89 HydrophobicContact CE2-CG 4.36Å; F54-W89 HydrophobicContact CZ-CB 3.98Å; F54-W89 HydrophobicContact CZ-CE3 4.32Å; V69-W89 HydrophobicContact CB-CH2 4.39Å; V69-W89 HydrophobicContact CB-CZ3 4.35Å; V69-W89 HydrophobicContact CG1-CH2 4.47Å; V69-W89 HydrophobicContact CG1-CZ3 4.31Å; V71-W89 HydrophobicContact CB-CD2 4.45Å; V71-W89 HydrophobicContact CB-CZ2 3.96Å; V71-W89 HydrophobicContact CG2-CD2 3.86Å; V71-W89 HydrophobicContact CG2-CE3 4.06Å; V71-W89 HydrophobicContact CG2-CG 4.45Å; V71-W89 HydrophobicContact CG2-CH2 3.92Å; V71-W89 HydrophobicContact CG2-CZ2 3.74Å; V71-W89 HydrophobicContact CG2-CZ3 4.06Å; F85-W89 AromaticContact CD2-CD1 3.59Å; F85-W89 AromaticContact CD2-NE1 3.66Å; F85-W89 AromaticContact CE2-CD1 3.31Å; F85-W89 AromaticContact CE2-NE1 3.09Å; F85-W89 AromaticContact CZ-CD1 3.71Å; F85-W89 AromaticContact CZ-NE1 3.74Å; F85-W89 PolarHBondContact O-N 2.97Å; L86-W89 PolarHBondContact O-N 3.13Å; W89-Y91 VanDerWaalsContact C-N 3.3Å; W89-Y91 PolarHBondContact O-N 3.4Å; W89-K92 PolarHBondContact O-N 3.48Å; W89-F93 PolarHBondContact O-N 3.01Å; W89-F99 HydrophobicContact CH2-CE1 4.44Å; W89-F99 HydrophobicContact CZ3-CD1 4.01Å; W89-F99 AromaticContact CZ3-CE1 3.7Å; W89-F99 HydrophobicContact CZ3-CE1 3.7Å; W89-P101 HydrophobicContact CE3-CG 4.46Å; W89-V104 HydrophobicContact CD2-CG2 4.49Å; W89-V104 HydrophobicContact CZ2-CG1 3.91Å; W89-V104 HydrophobicContact CZ2-CG2 4.31Å; W89-S118 PolarHBondContact NE1-OG 3.28Å; W89-S118 VanDerWaalsContact NE1-OG 3.16Å
90	L	96.1	Very high	93.7	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-37.2	175.3	-179.6	61.2	0	0	0	111.5	M53 M57 L86 D87 F93 S94 V136 I139	M53-L90 HydrophobicContact CE-CB 4.25Å; M53-L90 HydrophobicContact SD-CB 4.2Å; M53-L90 HydrophobicContact SD-CD1 4.47Å; M57-L90 HydrophobicContact CE-CD1 3.32Å; L86-L90 WeakPolarHBondContact O-CB 3.49Å; L86-L90 PolarHBondContact O-N 3.44Å; D87-L90 PolarHBondContact O-N 2.87Å; L90-F93 PolarHBondContact O-N 3.06Å; L90-S94 WeakPolarHBondContact O-CB 3.33Å; L90-S94 PolarHBondContact O-N 3.39Å; L90-S94 PolarHBondContact O-OG 3.34Å; L90-V136 HydrophobicContact CD1-CB 4.21Å; L90-V136 HydrophobicContact CD1-CG1 4.47Å; L90-V136 HydrophobicContact CD2-CG1 4.32Å; L90-I139 HydrophobicContact CD2-CD1 4.23Å; L90-I139 HydrophobicContact CD2-CG1 4.4Å
91	Y	95.3	Very high	93.7	Very high	125 Å²	125	40.7 Å²	40.7	49%	0.49	20%	0.203	S	C	.	.	H	α-helix	trans	-63.7	-41.3	175.3	-179.9	-94.1	0	0	0	111.7	D87 E88 W89 F93 S94 A95	D87-Y91 WeakPolarHBondContact O-CB 3.47Å; D87-Y91 PolarHBondContact O-N 3.3Å; E88-Y91 WeakPolarHBondContact O-CB 3.33Å; E88-Y91 PolarHBondContact O-N 2.75Å; W89-Y91 VanDerWaalsContact C-N 3.3Å; W89-Y91 PolarHBondContact O-N 3.4Å; Y91-F93 PolarHBondContact O-N 3.2Å; Y91-S94 PolarHBondContact O-N 3.13Å; Y91-A95 HydrophobicContact CD1-CB 4.45Å; Y91-A95 HydrophobicContact CD2-CB 3.68Å; Y91-A95 HydrophobicContact CE1-CB 4.13Å; Y91-A95 HydrophobicContact CE2-CB 3.31Å; Y91-A95 HydrophobicContact CG-CB 4.24Å; Y91-A95 PolarHBondContact O-N 2.78Å
92	K	94.6	Very high	93.7	Very high	49 Å²	49	44.5 Å²	44.5	21%	0.213	22%	0.218	C	C	.	.	I	π-helix	trans	-59.9	-34	174.7	-70.2	-67.6	171.5	-173.1	0	113	V69 V71 E88 W89 D96 F99	V69-K92 HydrophobicContact CG1-CD 4.11Å; V69-K92 HydrophobicContact CG1-CG 4.3Å; V71-K92 HydrophobicContact CG2-CG 4.25Å; E88-K92 WeakPolarHBondContact O-CG 3.4Å; E88-K92 PolarHBondContact O-N 2.91Å; W89-K92 PolarHBondContact O-N 3.48Å; K92-D96 HydrophobicContact CD-CB 4.41Å; K92-D96 IonicContact NZ-OD2 2.68Å; K92-D96 PolarHBondContact NZ-OD2 2.93Å; K92-F99 PolarHBondContact O-N 2.72Å
93	F	93.9	Very high	93.7	Very high	22 Å²	22	49 Å²	49	10%	0.096	24%	0.238	C	C	.	.	I	π-helix	trans	-76.8	-35.3	171.9	175.9	-98.2	0	0	0	113.3	F54 M57 W89 L90 Y91 F98 F99 I100 F125	F54-F93 HydrophobicContact CE1-CB 3.94Å; F54-F93 HydrophobicContact CE1-CG 4.38Å; M57-F93 HydrophobicContact CE-CD1 4.07Å; M57-F93 HydrophobicContact CE-CE1 4.34Å; M57-F93 HydrophobicContact SD-CD1 3.81Å; M57-F93 HydrophobicContact SD-CD2 4.36Å; M57-F93 HydrophobicContact SD-CE1 3.76Å; M57-F93 HydrophobicContact SD-CE2 4.31Å; M57-F93 HydrophobicContact SD-CG 4.11Å; M57-F93 HydrophobicContact SD-CZ 4.02Å; W89-F93 PolarHBondContact O-N 3.01Å; L90-F93 PolarHBondContact O-N 3.06Å; Y91-F93 PolarHBondContact O-N 3.2Å; F93-F98 VanDerWaalsContact O-CA 3.27Å; F93-F98 WeakPolarHBondContact O-CA 3.23Å; F93-F98 WeakPolarHBondContact O-CD1 3.24Å; F93-F99 WeakPolarHBondContact CA-O 3.41Å; F93-F99 WeakPolarHBondContact CB-O 3.35Å; F93-I100 HydrophobicContact CD2-CB 4.33Å; F93-I100 HydrophobicContact CD2-CD1 4.29Å; F93-I100 HydrophobicContact CE2-CD1 4.06Å; F93-F125 HydrophobicContact CE2-CB 3.85Å; F93-F125 HydrophobicContact CE2-CD1 4.43Å; F93-F125 HydrophobicContact CE2-CD2 4.27Å; F93-F125 AromaticContact CE2-CG 3.94Å; F93-F125 HydrophobicContact CE2-CG 3.94Å
94	S	89.7	Confident	93.7	Very high	56 Å²	56	47.7 Å²	47.7	39%	0.392	23%	0.233	S	C	.	.	I	π-helix	trans	-94	-28.5	-168.1	-54.5	0	0	0	0	114.5	L90 Y91	L90-S94 WeakPolarHBondContact O-CB 3.33Å; L90-S94 PolarHBondContact O-N 3.39Å; L90-S94 PolarHBondContact O-OG 3.34Å; Y91-S94 PolarHBondContact O-N 3.13Å
95	A	82.1	Confident	93.7	Very high	54 Å²	54	48.2 Å²	48.2	45%	0.446	24%	0.235	S	C	.	.	I	π-helix	trans	-125.9	-21.8	-165.4	0	0	0	0	0	115.4	Y91	Y91-A95 HydrophobicContact CD1-CB 4.45Å; Y91-A95 HydrophobicContact CD2-CB 3.68Å; Y91-A95 HydrophobicContact CE1-CB 4.13Å; Y91-A95 HydrophobicContact CE2-CB 3.31Å; Y91-A95 HydrophobicContact CG-CB 4.24Å; Y91-A95 PolarHBondContact O-N 2.78Å
96	D	75	Confident	93.7	Very high	88 Å²	88	48.4 Å²	48.4	47%	0.471	24%	0.236	S	C	.	.	I	π-helix	trans	-103.1	-84.7	-170.9	-137.5	6.5	0	0	0	111.4	K92	K92-D96 HydrophobicContact CD-CB 4.41Å; K92-D96 IonicContact NZ-OD2 2.68Å; K92-D96 PolarHBondContact NZ-OD2 2.93Å
97	E	82.2	Confident	93.7	Very high	95 Å²	95	51.9 Å²	51.9	44%	0.444	25%	0.254	S	S	.	.	S	Bend	trans	-118.3	12.7	-171.2	-63.1	-177.6	157.7	0	0	113	F99 E124	E97-F99 HydrophobicContact CB-CB 4.39Å; E97-F99 PolarHBondContact O-N 2.99Å; E97-F99 VanDerWaalsContact O-N 3.11Å; E97-E124 VanDerWaalsContact O-CG 3.31Å; E97-E124 WeakPolarHBondContact O-CG 3.18Å
98	F	92.7	Very high	93.7	Very high	107 Å²	107	51.1 Å²	51.1	47%	0.469	25%	0.254	S	S	.	.			trans	47.4	36.6	-163.9	-60.2	-76	0	0	0	112.5	F93 I100 E124 F125	F93-F98 VanDerWaalsContact O-CA 3.27Å; F93-F98 WeakPolarHBondContact O-CA 3.23Å; F93-F98 WeakPolarHBondContact O-CD1 3.24Å; F98-I100 PolarHBondContact O-N 2.91Å; F98-E124 HydrophobicContact CB-CG 4.3Å; F98-F125 HydrophobicContact CB-CB 4.35Å; F98-F125 WeakPolarHBondContact O-CB 3.37Å; F98-F125 PolarHBondContact O-N 2.81Å
99	F	95.6	Very high	93.7	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	123.9	-173.2	177.6	-101.7	0	0	0	109.9	Q67 V69 W89 K92 F93 E97 P101	Q67-F99 HydrophobicContact CG-CD2 3.79Å; Q67-F99 HydrophobicContact CG-CE2 3.44Å; Q67-F99 VanDerWaalsContact CG-CE2 3.44Å; V69-F99 HydrophobicContact CB-CD1 4.16Å; V69-F99 HydrophobicContact CB-CE1 3.93Å; V69-F99 HydrophobicContact CB-CZ 4.19Å; V69-F99 HydrophobicContact CG2-CD1 3.84Å; V69-F99 HydrophobicContact CG2-CD2 3.8Å; V69-F99 HydrophobicContact CG2-CE1 3.86Å; V69-F99 HydrophobicContact CG2-CE2 3.85Å; V69-F99 HydrophobicContact CG2-CG 3.8Å; V69-F99 HydrophobicContact CG2-CZ 3.86Å; W89-F99 HydrophobicContact CH2-CE1 4.44Å; W89-F99 HydrophobicContact CZ3-CD1 4.01Å; W89-F99 AromaticContact CZ3-CE1 3.7Å; W89-F99 HydrophobicContact CZ3-CE1 3.7Å; K92-F99 PolarHBondContact O-N 2.72Å; F93-F99 WeakPolarHBondContact CA-O 3.41Å; F93-F99 WeakPolarHBondContact CB-O 3.35Å; E97-F99 HydrophobicContact CB-CB 4.39Å; E97-F99 PolarHBondContact O-N 2.99Å; E97-F99 VanDerWaalsContact O-N 3.11Å; F99-P101 HydrophobicContact CE1-CB 3.83Å; F99-P101 HydrophobicContact CE1-CG 4.3Å; F99-P101 HydrophobicContact CZ-CB 4.26Å
100	I	95.9	Very high	93.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.8	171.6	-168.7	135.2	0	0	0	109.5	F54 M57 T58 V63 F93 F98 G122 E123 F125	F54-I100 HydrophobicContact CD1-CD1 4.1Å; F54-I100 HydrophobicContact CD1-CG1 4.13Å; M57-I100 HydrophobicContact CB-CD1 4.48Å; T58-I100 HydrophobicContact CG2-CD1 3.39Å; T58-I100 HydrophobicContact CG2-CG1 4.14Å; V63-I100 HydrophobicContact CG1-CG2 4.07Å; V63-I100 WeakPolarHBondContact CG1-O 3.42Å; V63-I100 HydrophobicContact CG2-CG1 4.39Å; V63-I100 HydrophobicContact CG2-CG2 3.82Å; F93-I100 HydrophobicContact CD2-CB 4.33Å; F93-I100 HydrophobicContact CD2-CD1 4.29Å; F93-I100 HydrophobicContact CE2-CD1 4.06Å; F98-I100 PolarHBondContact O-N 2.91Å; I100-G122 WeakPolarHBondContact O-CA 3.2Å; I100-E123 PolarHBondContact N-O 2.81Å; I100-E123 PolarHBondContact O-N 2.67Å; I100-F125 HydrophobicContact CB-CB 4.38Å; I100-F125 HydrophobicContact CD1-CD2 4.08Å; I100-F125 HydrophobicContact CG2-CB 4.03Å; I100-F125 HydrophobicContact CG2-CD2 4.24Å
101	P	97.1	Very high	93.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	136.9	175.3	27.6	-30.8	0	0	0	110.2	F54 W89 F99 V104	F54-P101 HydrophobicContact CD1-CG 4.36Å; F54-P101 HydrophobicContact CD2-CG 3.3Å; F54-P101 HydrophobicContact CE1-CG 4.34Å; F54-P101 HydrophobicContact CE2-CG 3.27Å; F54-P101 HydrophobicContact CG-CG 3.88Å; F54-P101 HydrophobicContact CZ-CG 3.82Å; W89-P101 HydrophobicContact CE3-CG 4.46Å; F99-P101 HydrophobicContact CE1-CB 3.83Å; F99-P101 HydrophobicContact CE1-CG 4.3Å; F99-P101 HydrophobicContact CZ-CB 4.26Å; P101-V104 HydrophobicContact CB-CG2 3.7Å; P101-V104 HydrophobicContact CG-CG2 3.57Å
102	R	97.1	Very high	93.4	Very high	80 Å²	80	59.3 Å²	59.3	30%	0.302	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	-44.6	162.4	-177.7	-170.7	176.6	78.1	9.1	110	M51 G61 V63 W121	M51-R102 WeakPolarHBondContact CE-O 3.45Å; G61-R102 PolarHBondContact O-NH1 3.11Å; V63-R102 HydrophobicContact CB-CB 4.01Å; V63-R102 HydrophobicContact CG1-CB 3.93Å; V63-R102 VanDerWaalsContact O-CD 3.26Å; V63-R102 WeakPolarHBondContact O-CD 3.24Å; V63-R102 WeakPolarHBondContact O-CG 3.26Å; V63-R102 PolarHBondContact O-NH1 3.27Å; R102-W121 WeakPolarHBondContact CB-O 3.46Å; R102-W121 PolarHBondContact N-O 3.28Å
103	E	97.4	Very high	93.4	Very high	93 Å²	93	61.7 Å²	61.7	44%	0.435	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.3	178.2	-74	168	-146	0	0	109.5	M51 G120 W121	M51-E103 VanDerWaalsContact SD-CA 3.51Å; E103-G120 VanDerWaalsContact O-CA 3.24Å; E103-G120 WeakPolarHBondContact O-CA 3.4Å; E103-W121 HydrophobicContact CB-CZ2 3.68Å; E103-W121 PolarHBondContact N-O 3.45Å; E103-W121 PolarHBondContact O-N 3.49Å; E103-W121 VanDerWaalsContact O-N 3.12Å; E103-W121 WeakPolarHBondContact OE2-CZ2 3.46Å
104	V	98.1	Very high	93.5	Very high	6 Å²	6	63.3 Å²	63.3	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	137.7	173.1	177.3	0	0	0	0	107.9	E47 A50 M51 F54 F85 W89 P101	E47-V104 HydrophobicContact CB-CG1 4.42Å; E47-V104 WeakPolarHBondContact CB-O 3.35Å; A50-V104 HydrophobicContact CB-CB 4.38Å; A50-V104 HydrophobicContact CB-CG1 4.3Å; A50-V104 HydrophobicContact CB-CG2 4.29Å; M51-V104 HydrophobicContact SD-CB 4.04Å; M51-V104 HydrophobicContact SD-CG2 3.91Å; M51-V104 PolarHBondContact SD-N 2.8Å; F54-V104 HydrophobicContact CE2-CG2 4.49Å; F85-V104 HydrophobicContact CE2-CG1 4.46Å; F85-V104 HydrophobicContact CZ-CG1 4.18Å; W89-V104 HydrophobicContact CD2-CG2 4.49Å; W89-V104 HydrophobicContact CZ2-CG1 3.91Å; W89-V104 HydrophobicContact CZ2-CG2 4.31Å; P101-V104 HydrophobicContact CB-CG2 3.7Å; P101-V104 HydrophobicContact CG-CG2 3.57Å
105	K	98.3	Very high	93.9	Very high	79 Å²	79	65.7 Å²	65.7	34%	0.343	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.4	174.5	-171.9	75.5	-153.3	153.1	0	109.9	E47 L107 S118 I119 W121	E47-K105 IonicContact OE1-NZ 3.43Å; E47-K105 PolarHBondContact OE1-NZ 3.11Å; E47-K105 VanDerWaalsContact OE2-CA 3.31Å; E47-K105 WeakPolarHBondContact OE2-CA 3.47Å; E47-K105 VanDerWaalsContact OE2-CD 3.22Å; E47-K105 WeakPolarHBondContact OE2-CD 3.24Å; E47-K105 VanDerWaalsContact OE2-CE 3.23Å; E47-K105 WeakPolarHBondContact OE2-CE 3.48Å; E47-K105 IonicContact OE2-NZ 3.7Å; E47-K105 PolarHBondContact OE2-NZ 3.28Å; K105-L107 HydrophobicContact CG-CD2 4.26Å; K105-S118 CarbonylContact O-C 3.53Å; K105-S118 VanDerWaalsContact O-CA 3.24Å; K105-S118 WeakPolarHBondContact O-CA 3.32Å; K105-S118 WeakPolarHBondContact O-CB 3.43Å; K105-I119 HydrophobicContact CB-CG1 4.09Å; K105-I119 PolarHBondContact N-O 2.98Å; K105-I119 PolarHBondContact O-N 2.82Å; K105-W121 HydrophobicContact CB-CH2 4.01Å; K105-W121 HydrophobicContact CB-CZ3 4.01Å
106	V	98.3	Very high	94.7	Very high	4 Å²	4	63.3 Å²	63.3	2%	0.024	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	119.5	168.7	176	0	0	0	0	108.1	E43 F46 E47 F85 I109 L116	E43-V106 HydrophobicContact CB-CB 4Å; E43-V106 HydrophobicContact CB-CG1 3.87Å; E43-V106 HydrophobicContact CG-CB 4.43Å; E43-V106 HydrophobicContact CG-CG1 3.77Å; F46-V106 HydrophobicContact CB-CG2 4.11Å; E47-V106 HydrophobicContact CB-CB 4.25Å; E47-V106 HydrophobicContact CB-CG2 3.73Å; E47-V106 PolarHBondContact OE2-N 3.26Å; F85-V106 HydrophobicContact CE2-CG2 3.93Å; F85-V106 HydrophobicContact CZ-CG2 3.91Å; V106-I109 HydrophobicContact CG1-CD1 4.05Å; V106-I109 HydrophobicContact CG1-CG1 3.76Å; V106-L116 HydrophobicContact CG1-CD1 4.02Å; V106-L116 HydrophobicContact CG1-CG 4.01Å; V106-L116 HydrophobicContact CG2-CD1 4.22Å
107	L	97.7	Very high	95.8	Very high	72 Å²	72	64 Å²	64	38%	0.377	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-34	-176.2	-62.5	-176.5	0	0	0	112.2	K105 R117 I119	K105-L107 HydrophobicContact CG-CD2 4.26Å; L107-R117 WeakPolarHBondContact CB-O 3.42Å; L107-R117 HydrophobicContact CD1-CG 4.41Å; L107-R117 PolarHBondContact N-O 3.23Å; L107-I119 HydrophobicContact CD1-CD1 4.47Å; L107-I119 HydrophobicContact CD1-CG1 4.33Å; L107-I119 HydrophobicContact CD1-CG2 3.78Å; L107-I119 HydrophobicContact CD2-CD1 3.95Å; L107-I119 HydrophobicContact CD2-CG1 3.95Å; L107-I119 HydrophobicContact CG-CG1 4.16Å; L107-I119 HydrophobicContact CG-CG2 4.38Å
108	S	96.8	Very high	96.5	Very high	51 Å²	51	59.4 Å²	59.4	36%	0.357	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	139.9	-179.5	56.1	0	0	0	0	111.7	L116 R117	S108-L116 WeakPolarHBondContact O-CA 3.47Å; S108-R117 PolarHBondContact N-O 3.07Å; S108-R117 PolarHBondContact O-N 3.48Å; S108-R117 VanDerWaalsContact O-N 3.1Å
109	I	97.1	Very high	96.8	Very high	15 Å²	15	56.2 Å²	56.2	8%	0.077	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	115.7	165.1	-65.9	171.6	0	0	0	109.5	L42 E43 F46 L81 V106 Q111 K115 L116	L42-I109 HydrophobicContact CD2-CD1 4.28Å; L42-I109 HydrophobicContact CD2-CG2 4.28Å; L42-I109 HydrophobicContact CG-CD1 4.06Å; E43-I109 HydrophobicContact CG-CB 4.39Å; E43-I109 HydrophobicContact CG-CD1 4.07Å; E43-I109 HydrophobicContact CG-CG1 4.02Å; E43-I109 PolarHBondContact OE1-N 3.14Å; F46-I109 HydrophobicContact CB-CD1 4.35Å; F46-I109 HydrophobicContact CD1-CD1 3.97Å; F46-I109 HydrophobicContact CD2-CD1 4.31Å; F46-I109 HydrophobicContact CE1-CD1 4.32Å; F46-I109 HydrophobicContact CG-CD1 3.95Å; L81-I109 HydrophobicContact CD2-CG2 3.92Å; V106-I109 HydrophobicContact CG1-CD1 4.05Å; V106-I109 HydrophobicContact CG1-CG1 3.76Å; I109-Q111 HydrophobicContact CG2-CG 4.01Å; I109-Q111 PolarHBondContact O-N 2.84Å; I109-K115 CarbonylContact C-O 3.53Å; I109-K115 WeakPolarHBondContact CA-O 3.39Å; I109-L116 HydrophobicContact CD1-CD1 4.07Å; I109-L116 HydrophobicContact CG1-CB 4.39Å; I109-L116 HydrophobicContact CG1-CD1 3.89Å; I109-L116 HydrophobicContact CG1-CG 4.14Å
110	D	95.8	Very high	96.9	Very high	59 Å²	59	56.1 Å²	56.1	32%	0.316	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	97	167.5	-176.2	-14.6	0	0	0	109.1	R112 N113 F114 K115	D110-R112 PolarHBondContact O-N 3.15Å; D110-R112 WeakPolarHBondContact OD1-CA 3.38Å; D110-R112 WeakPolarHBondContact OD1-CB 3.46Å; D110-R112 PolarHBondContact OD1-N 3.04Å; D110-N113 PolarHBondContact OD1-N 3.06Å; D110-N113 VanDerWaalsContact OD1-N 3.09Å; D110-N113 WeakPolarHBondContact OD2-CB 3.19Å; D110-N113 PolarHBondContact OD2-ND2 3.49Å; D110-F114 WeakPolarHBondContact O-CA 3.3Å; D110-F114 PolarHBondContact O-N 2.81Å; D110-K115 HydrophobicContact CB-CB 4.23Å; D110-K115 PolarHBondContact N-O 3.04Å; D110-K115 PolarHBondContact O-N 3.45Å
111	Q	92.6	Very high	97	Very high	92 Å²	92	59.3 Å²	59.3	43%	0.43	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.7	-179.9	-60.1	-177.7	34.2	0	0	113.9	L42 I109 F114 N148	L42-Q111 HydrophobicContact CD2-CG 4.3Å; I109-Q111 HydrophobicContact CG2-CG 4.01Å; I109-Q111 PolarHBondContact O-N 2.84Å; Q111-F114 WeakPolarHBondContact O-CE1 3.5Å; Q111-N148 PolarHBondContact OE1-ND2 3.05Å
112	R	93.6	Very high	97	Very high	221 Å²	221	59.3 Å²	59.3	83%	0.834	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-39.2	178.1	-66.9	-177.3	179.7	-179.2	1.1	112.2	D110	D110-R112 PolarHBondContact O-N 3.15Å; D110-R112 WeakPolarHBondContact OD1-CA 3.38Å; D110-R112 WeakPolarHBondContact OD1-CB 3.46Å; D110-R112 PolarHBondContact OD1-N 3.04Å
113	N	95.3	Very high	96.9	Very high	100 Å²	100	56.7 Å²	56.7	54%	0.535	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	2.7	-179.1	-58.3	-60.1	0	0	0	113.1	D110 K115	D110-N113 PolarHBondContact OD1-N 3.06Å; D110-N113 VanDerWaalsContact OD1-N 3.09Å; D110-N113 WeakPolarHBondContact OD2-CB 3.19Å; D110-N113 PolarHBondContact OD2-ND2 3.49Å; N113-K115 HydrophobicContact CB-CG 4.3Å; N113-K115 PolarHBondContact O-N 3.28Å
114	F	96.3	Very high	96.9	Very high	55 Å²	55	57.9 Å²	57.9	24%	0.241	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	58.3	-177.2	-54.8	-70	0	0	0	112.3	Q74 G75 D76 D77 L78 L81 D110 Q111	Q74-F114 CarbonylContact C-O 3.6Å; Q74-F114 VanDerWaalsContact CA-O 3.26Å; Q74-F114 WeakPolarHBondContact CA-O 3.31Å; G75-F114 PolarHBondContact N-O 3.13Å; G75-F114 WeakPolarHBondContact O-CB 3.23Å; D76-F114 VanDerWaalsContact O-CD2 3.23Å; D76-F114 WeakPolarHBondContact O-CD2 3.43Å; D76-F114 VanDerWaalsContact O-CE2 3.25Å; D76-F114 WeakPolarHBondContact O-CE2 3.26Å; D77-F114 VanDerWaalsContact C-CD1 3.45Å; L78-F114 HydrophobicContact CD2-CD1 4.09Å; L78-F114 HydrophobicContact CD2-CE1 4.18Å; L78-F114 HydrophobicContact CG-CD1 4.38Å; L78-F114 HydrophobicContact CG-CE1 4.09Å; L81-F114 WeakPolarHBondContact CD1-O 3.35Å; L81-F114 HydrophobicContact CD2-CB 4.44Å; D110-F114 WeakPolarHBondContact O-CA 3.3Å; D110-F114 PolarHBondContact O-N 2.81Å; Q111-F114 WeakPolarHBondContact O-CE1 3.5Å
115	K	97.3	Very high	96.7	Very high	106 Å²	106	59.6 Å²	59.6	46%	0.461	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.9	175.7	-61.6	-170.5	175.6	-170.6	0	110.4	T73 Q74 I109 D110 N113	T73-K115 WeakPolarHBondContact O-CA 3.24Å; Q74-K115 HydrophobicContact CB-CG 4.18Å; I109-K115 CarbonylContact C-O 3.53Å; I109-K115 WeakPolarHBondContact CA-O 3.39Å; D110-K115 HydrophobicContact CB-CB 4.23Å; D110-K115 PolarHBondContact N-O 3.04Å; D110-K115 PolarHBondContact O-N 3.45Å; N113-K115 HydrophobicContact CB-CG 4.3Å; N113-K115 PolarHBondContact O-N 3.28Å
116	L	97.9	Very high	96.5	Very high	4 Å²	4	58 Å²	58	2%	0.021	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	140.9	-180	176.6	154.8	0	0	0	109.5	F46 E72 T73 L81 F85 V106 S108 I109	F46-L116 HydrophobicContact CD1-CD1 3.6Å; F46-L116 HydrophobicContact CE1-CD1 4.24Å; F46-L116 HydrophobicContact CG-CD1 4.5Å; E72-L116 WeakPolarHBondContact CA-O 3.44Å; T73-L116 PolarHBondContact N-O 3.28Å; T73-L116 PolarHBondContact O-N 3.15Å; L81-L116 HydrophobicContact CD1-CB 3.72Å; L81-L116 HydrophobicContact CD2-CB 4.15Å; L81-L116 HydrophobicContact CG-CB 4.09Å; F85-L116 HydrophobicContact CB-CD1 4.18Å; F85-L116 HydrophobicContact CB-CD2 4.47Å; F85-L116 HydrophobicContact CD2-CD1 3.81Å; F85-L116 HydrophobicContact CD2-CD2 3.36Å; F85-L116 HydrophobicContact CD2-CG 4.28Å; F85-L116 HydrophobicContact CE2-CD1 4.3Å; F85-L116 HydrophobicContact CE2-CD2 3.88Å; F85-L116 HydrophobicContact CG-CD1 3.96Å; F85-L116 HydrophobicContact CG-CD2 4.2Å; V106-L116 HydrophobicContact CG1-CD1 4.02Å; V106-L116 HydrophobicContact CG1-CG 4.01Å; V106-L116 HydrophobicContact CG2-CD1 4.22Å; S108-L116 WeakPolarHBondContact O-CA 3.47Å; I109-L116 HydrophobicContact CD1-CD1 4.07Å; I109-L116 HydrophobicContact CG1-CB 4.39Å; I109-L116 HydrophobicContact CG1-CD1 3.89Å; I109-L116 HydrophobicContact CG1-CG 4.14Å
117	R	98.3	Very high	96.3	Very high	102 Å²	102	63.6 Å²	63.6	39%	0.385	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130	168.6	-172.3	168.2	74.7	117.2	0.8	109.5	E70 E72 L107 S108	E70-R117 HydrophobicContact CG-CG 4.46Å; E70-R117 WeakPolarHBondContact OE1-CD 3.42Å; E70-R117 WeakPolarHBondContact OE1-CG 3.46Å; E70-R117 IonicContact OE1-CZ 3.41Å; E70-R117 IonicContact OE1-NE 2.62Å; E70-R117 IonicContact OE1-NH1 2.77Å; E70-R117 PolarHBondContact OE1-NH1 3.37Å; E70-R117 VanDerWaalsContact OE1-NH1 3.12Å; E72-R117 HydrophobicContact CG-CB 4.18Å; E72-R117 HydrophobicContact CG-CG 3.71Å; E72-R117 WeakPolarHBondContact OE1-CD 3.18Å; L107-R117 WeakPolarHBondContact CB-O 3.42Å; L107-R117 HydrophobicContact CD1-CG 4.41Å; L107-R117 PolarHBondContact N-O 3.23Å; S108-R117 PolarHBondContact N-O 3.07Å; S108-R117 PolarHBondContact O-N 3.48Å; S108-R117 VanDerWaalsContact O-N 3.1Å
118	S	98.3	Very high	96.1	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	154.2	-177.7	62.4	0	0	0	0	111.3	E70 V71 F85 W89 K105	E70-S118 WeakPolarHBondContact CA-O 3.44Å; E70-S118 WeakPolarHBondContact CG-O 3.47Å; V71-S118 PolarHBondContact N-O 3.45Å; V71-S118 PolarHBondContact O-N 3.49Å; V71-S118 PolarHBondContact O-OG 2.94Å; V71-S118 VanDerWaalsContact O-OG 3.1Å; F85-S118 WeakPolarHBondContact CE2-OG 3.33Å; W89-S118 PolarHBondContact NE1-OG 3.28Å; W89-S118 VanDerWaalsContact NE1-OG 3.16Å; K105-S118 CarbonylContact O-C 3.53Å; K105-S118 VanDerWaalsContact O-CA 3.24Å; K105-S118 WeakPolarHBondContact O-CA 3.32Å; K105-S118 WeakPolarHBondContact O-CB 3.43Å
119	I	98.1	Very high	95.9	Very high	40 Å²	40	66.4 Å²	66.4	21%	0.205	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	150.3	173.6	59.3	170.2	0	0	0	109	T68 V69 E70 K105 L107 W121	T68-I119 HydrophobicContact CG2-CB 4.38Å; V69-I119 CarbonylContact O-C 3.53Å; V69-I119 VanDerWaalsContact O-CA 3.31Å; V69-I119 WeakPolarHBondContact O-CA 3.17Å; E70-I119 HydrophobicContact CB-CG2 4.13Å; E70-I119 HydrophobicContact CG-CG2 3.99Å; K105-I119 HydrophobicContact CB-CG1 4.09Å; K105-I119 PolarHBondContact N-O 2.98Å; K105-I119 PolarHBondContact O-N 2.82Å; L107-I119 HydrophobicContact CD1-CD1 4.47Å; L107-I119 HydrophobicContact CD1-CG1 4.33Å; L107-I119 HydrophobicContact CD1-CG2 3.78Å; L107-I119 HydrophobicContact CD2-CD1 3.95Å; L107-I119 HydrophobicContact CD2-CG1 3.95Å; L107-I119 HydrophobicContact CG-CG1 4.16Å; L107-I119 HydrophobicContact CG-CG2 4.38Å; I119-W121 HydrophobicContact CD1-CE3 4.46Å; I119-W121 HydrophobicContact CD1-CZ3 4.02Å; I119-W121 HydrophobicContact CG1-CZ3 4.16Å
120	G	97.6	Very high	95.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	144.4	173.7	0	0	0	0	0	109.6	T68 V69 E103	T68-G120 CarbonylContact C-O 3.59Å; T68-G120 VanDerWaalsContact CA-O 3.3Å; T68-G120 WeakPolarHBondContact CA-O 3.38Å; V69-G120 PolarHBondContact N-O 2.99Å; V69-G120 PolarHBondContact O-N 2.8Å; E103-G120 VanDerWaalsContact O-CA 3.24Å; E103-G120 WeakPolarHBondContact O-CA 3.4Å
121	W	97.8	Very high	95.7	Very high	67 Å²	67	66.2 Å²	66.2	25%	0.254	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.8	177.5	50.2	79.3	0	0	0	110.8	P65 Q67 R102 E103 K105 I119	P65-W121 HydrophobicContact CB-CB 4.27Å; P65-W121 HydrophobicContact CB-CG 4.18Å; Q67-W121 CarbonylContact O-C 3.53Å; Q67-W121 WeakPolarHBondContact O-CA 3.24Å; R102-W121 WeakPolarHBondContact CB-O 3.46Å; R102-W121 PolarHBondContact N-O 3.28Å; E103-W121 HydrophobicContact CB-CZ2 3.68Å; E103-W121 PolarHBondContact N-O 3.45Å; E103-W121 PolarHBondContact O-N 3.49Å; E103-W121 VanDerWaalsContact O-N 3.12Å; E103-W121 WeakPolarHBondContact OE2-CZ2 3.46Å; K105-W121 HydrophobicContact CB-CH2 4.01Å; K105-W121 HydrophobicContact CB-CZ3 4.01Å; I119-W121 HydrophobicContact CD1-CE3 4.46Å; I119-W121 HydrophobicContact CD1-CZ3 4.02Å; I119-W121 HydrophobicContact CG1-CZ3 4.16Å
122	G	97	Very high	95.7	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.1	-148	-170.9	0	0	0	0	0	111.6	E64 L66 Q67 I100	E64-G122 CarbonylContact O-C 3.59Å; E64-G122 VanDerWaalsContact O-CA 3.24Å; E64-G122 WeakPolarHBondContact O-CA 3.41Å; E64-G122 VanDerWaalsContact O-O 3.09Å; L66-G122 PolarHBondContact N-O 2.82Å; Q67-G122 WeakPolarHBondContact CG-O 3.32Å; Q67-G122 PolarHBondContact N-O 3.43Å; Q67-G122 PolarHBondContact O-N 3.05Å; I100-G122 WeakPolarHBondContact O-CA 3.2Å
123	E	96.3	Very high	95.6	Very high	24 Å²	24	60.7 Å²	60.7	11%	0.112	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	178.5	179.7	74.7	-166.5	114.4	0	0	110.9	V63 E64 L66 I100 K129 H130	V63-E123 HydrophobicContact CG1-CG 4.13Å; E64-E123 WeakPolarHBondContact CB-OE1 3.31Å; E64-E123 PolarHBondContact N-OE1 3.16Å; L66-E123 HydrophobicContact CB-CB 4.33Å; L66-E123 HydrophobicContact CD1-CB 4.12Å; L66-E123 HydrophobicContact CG-CB 4.39Å; I100-E123 PolarHBondContact N-O 2.81Å; I100-E123 PolarHBondContact O-N 2.67Å; E123-K129 VanDerWaalsContact OE1-CE 3.26Å; E123-K129 WeakPolarHBondContact OE1-CE 3.44Å; E123-K129 IonicContact OE1-NZ 2.77Å; E123-K129 PolarHBondContact OE1-NZ 2.93Å; E123-K129 IonicContact OE2-NZ 2.81Å; E123-K129 PolarHBondContact OE2-NZ 3.27Å; E123-H130 IonicContact OE1-NE2 3.81Å; E123-H130 PolarHBondContact OE1-NE2 3.11Å
124	E	96.3	Very high	95.5	Very high	119 Å²	119	58.8 Å²	58.8	56%	0.556	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	134.7	172	174.3	172.6	-174.2	0	0	110.8	E97 F98 S126 H130	E97-E124 VanDerWaalsContact O-CG 3.31Å; E97-E124 WeakPolarHBondContact O-CG 3.18Å; F98-E124 HydrophobicContact CB-CG 4.3Å; E124-S126 PolarHBondContact O-N 3.1Å; E124-H130 PolarHBondContact O-CE1 2.79Å
125	F	94.8	Very high	95.3	Very high	42 Å²	42	62.2 Å²	62.2	18%	0.184	32%	0.322	C	S	.	.			trans	-67.3	126.4	-178.9	179.4	-96.1	0	0	0	111.9	T58 F93 F98 I100 L127 H130	T58-F125 HydrophobicContact CG2-CE2 4.26Å; F93-F125 HydrophobicContact CE2-CB 3.85Å; F93-F125 HydrophobicContact CE2-CD1 4.43Å; F93-F125 HydrophobicContact CE2-CD2 4.27Å; F93-F125 AromaticContact CE2-CG 3.94Å; F93-F125 HydrophobicContact CE2-CG 3.94Å; F98-F125 HydrophobicContact CB-CB 4.35Å; F98-F125 WeakPolarHBondContact O-CB 3.37Å; F98-F125 PolarHBondContact O-N 2.81Å; I100-F125 HydrophobicContact CB-CB 4.38Å; I100-F125 HydrophobicContact CD1-CD2 4.08Å; I100-F125 HydrophobicContact CG2-CB 4.03Å; I100-F125 HydrophobicContact CG2-CD2 4.24Å; F125-L127 HydrophobicContact CE1-CD2 3.78Å; F125-L127 HydrophobicContact CE1-CG 4.19Å; F125-L127 HydrophobicContact CZ-CD2 4.05Å; F125-H130 HydrophobicContact CD2-CB 3.84Å; F125-H130 AromaticContact CD2-ND1 3.44Å; F125-H130 WeakPolarHBondContact CD2-ND1 3.47Å; F125-H130 HydrophobicContact CE2-CB 3.47Å; F125-H130 VanDerWaalsContact CE2-CB 3.47Å; F125-H130 HydrophobicContact CZ-CB 4.25Å
126	S	93.7	Very high	95.1	Very high	44 Å²	44	57.3 Å²	57.3	31%	0.308	30%	0.3	S	S	.	.			trans	-129.4	127.8	175.2	176.2	0	0	0	0	112	E124 S128 K129 H130	E124-S126 PolarHBondContact O-N 3.1Å; S126-S128 PolarHBondContact O-N 2.85Å; S126-S128 VanDerWaalsContact O-N 3.14Å; S126-S128 PolarHBondContact OG-N 2.86Å; S126-S128 PolarHBondContact OG-OG 2.96Å; S126-K129 PolarHBondContact O-N 3.04Å; S126-H130 PolarHBondContact N-ND1 2.76Å; S126-H130 VanDerWaalsContact N-ND1 3.15Å; S126-H130 PolarHBondContact O-N 2.94Å
127	L	92.9	Very high	94.8	Very high	122 Å²	122	62.9 Å²	62.9	64%	0.639	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-19.2	174.1	-67.5	172.5	0	0	0	113.7	F125 K129 Q132	F125-L127 HydrophobicContact CE1-CD2 3.78Å; F125-L127 HydrophobicContact CE1-CG 4.19Å; F125-L127 HydrophobicContact CZ-CD2 4.05Å; L127-K129 VanDerWaalsContact C-N 3.34Å; L127-Q132 HydrophobicContact CD2-CB 4.34Å; L127-Q132 HydrophobicContact CD2-CG 4.35Å
128	S	94.1	Very high	94.5	Very high	114 Å²	114	59.7 Å²	59.7	80%	0.797	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-20.6	176.5	65.1	0	0	0	0	113.2	S126	S126-S128 PolarHBondContact O-N 2.85Å; S126-S128 VanDerWaalsContact O-N 3.14Å; S126-S128 PolarHBondContact OG-N 2.86Å; S126-S128 PolarHBondContact OG-OG 2.96Å
129	K	93.1	Very high	94.3	Very high	69 Å²	69	60.2 Å²	60.2	30%	0.3	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-44.3	-174.6	-174	178	175.1	177	0	112	T62 E64 E123 S126 L127	T62-K129 WeakPolarHBondContact O-CE 3.45Å; E64-K129 VanDerWaalsContact CG-NZ 3.34Å; E64-K129 WeakPolarHBondContact OE1-CE 3.43Å; E64-K129 IonicContact OE1-NZ 3.12Å; E64-K129 PolarHBondContact OE1-NZ 2.75Å; E64-K129 IonicContact OE2-NZ 3.9Å; E123-K129 VanDerWaalsContact OE1-CE 3.26Å; E123-K129 WeakPolarHBondContact OE1-CE 3.44Å; E123-K129 IonicContact OE1-NZ 2.77Å; E123-K129 PolarHBondContact OE1-NZ 2.93Å; E123-K129 IonicContact OE2-NZ 2.81Å; E123-K129 PolarHBondContact OE2-NZ 3.27Å; S126-K129 PolarHBondContact O-N 3.04Å; L127-K129 VanDerWaalsContact C-N 3.34Å
130	H	95.6	Very high	94.1	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.019	32%	0.32	C	S	.	.	S	Bend	trans	-99.7	127.9	-171.2	-52.5	143.2	0	0	0	110.7	T58 E123 E124 F125 S126 Q132	T58-H130 HydrophobicContact CG2-CB 4.5Å; T58-H130 WeakPolarHBondContact OG1-CB 3.28Å; E123-H130 IonicContact OE1-NE2 3.81Å; E123-H130 PolarHBondContact OE1-NE2 3.11Å; E124-H130 PolarHBondContact O-CE1 2.79Å; F125-H130 HydrophobicContact CD2-CB 3.84Å; F125-H130 AromaticContact CD2-ND1 3.44Å; F125-H130 WeakPolarHBondContact CD2-ND1 3.47Å; F125-H130 HydrophobicContact CE2-CB 3.47Å; F125-H130 VanDerWaalsContact CE2-CB 3.47Å; F125-H130 HydrophobicContact CZ-CB 4.25Å; S126-H130 PolarHBondContact N-ND1 2.76Å; S126-H130 VanDerWaalsContact N-ND1 3.15Å; S126-H130 PolarHBondContact O-N 2.94Å; H130-Q132 PolarHBondContact O-N 3.45Å
131	P	93.8	Very high	93.9	Very high	66 Å²	66	64.7 Å²	64.7	43%	0.429	34%	0.34	S	S	.	.			trans	-58.7	134.3	175.4	-24	34.2	0	0	0	111.8	T58 D59 T62 G133	T58-P131 WeakPolarHBondContact CB-O 3.39Å; T58-P131 PolarHBondContact OG1-O 3.23Å; D59-P131 HydrophobicContact CB-CG 4.14Å; T62-P131 HydrophobicContact CG2-CG 4.3Å; P131-G133 PolarHBondContact O-N 2.57Å
132	Q	90.8	Very high	93.5	Very high	160 Å²	160	64.4 Å²	64.4	75%	0.748	35%	0.348	S	S	*	.			trans	-75.8	112.7	178.7	-170.1	176.5	-25.7	0	0	110.5	L127 H130	L127-Q132 HydrophobicContact CD2-CB 4.34Å; L127-Q132 HydrophobicContact CD2-CG 4.35Å; H130-Q132 PolarHBondContact O-N 3.45Å
133	G	93	Very high	93.2	Very high	36 Å²	36	67.1 Å²	67.1	37%	0.371	37%	0.371	S	S	.	.			trans	-90.7	-137.7	167.5	0	0	0	0	0	111.2	M57 P131	M57-G133 WeakPolarHBondContact O-CA 3.48Å; M57-G133 PolarHBondContact O-N 2.83Å; P131-G133 PolarHBondContact O-N 2.57Å
134	T	92.7	Very high	93.2	Very high	60 Å²	60	66.4 Å²	66.4	37%	0.368	37%	0.368	S	S	.	.			trans	-111.8	132.1	178.4	-47.4	0	0	0	0	110.5	Y56 M57 I160	Y56-T134 HydrophobicContact CE1-CG2 4.18Å; Y56-T134 PolarHBondContact O-N 3.07Å; M57-T134 WeakPolarHBondContact CA-O 3.38Å; T134-I160 HydrophobicContact CG2-CB 3.94Å; T134-I160 HydrophobicContact CG2-CD1 4.2Å; T134-I160 HydrophobicContact CG2-CG1 4.39Å
135	E	91.4	Very high	93.2	Very high	128 Å²	128	63.8 Å²	63.8	60%	0.598	36%	0.356	S	S	*	.			trans	-62.5	139.7	173.9	-174.1	-179.5	174.7	0	0	110.4	I160	E135-I160 WeakPolarHBondContact O-CA 2.95Å; E135-I160 WeakPolarHBondContact O-CB 3.25Å
136	V	93.2	Very high	93.3	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.012	36%	0.355	C	S	.	.			trans	-102.7	127.1	170.5	-176.8	0	0	0	0	107.5	M53 M57 L90 I158 I160	M53-V136 HydrophobicContact CG-CG1 4.42Å; M53-V136 HydrophobicContact CG-CG2 4.16Å; M57-V136 HydrophobicContact CE-CB 3.5Å; M57-V136 VanDerWaalsContact CE-CB 3.5Å; M57-V136 HydrophobicContact CE-CG2 3.6Å; M57-V136 HydrophobicContact CG-CG2 3.91Å; L90-V136 HydrophobicContact CD1-CB 4.21Å; L90-V136 HydrophobicContact CD1-CG1 4.47Å; L90-V136 HydrophobicContact CD2-CG1 4.32Å; V136-I158 HydrophobicContact CB-CD1 4.45Å; V136-I158 HydrophobicContact CG1-CB 3.88Å; V136-I158 HydrophobicContact CG1-CD1 3.87Å; V136-I158 HydrophobicContact CG1-CG1 4.38Å; V136-I158 HydrophobicContact CG1-CG2 4.32Å; V136-I158 HydrophobicContact CG2-CD1 3.73Å; V136-I160 HydrophobicContact CG2-CG2 4.37Å
137	K	91.7	Very high	93.5	Very high	122 Å²	122	65.8 Å²	65.8	53%	0.53	36%	0.359	S	S	.	.			trans	-94.4	-38.7	-175.3	-67.1	176.6	-177.1	130.2	0	113.1	D159 I160	K137-D159 PolarHBondContact N-O 3.15Å; K137-I160 WeakPolarHBondContact CE-OXT 3.2Å; K137-I160 PolarHBondContact NZ-O 2.69Å; K137-I160 PolarHBondContact NZ-OXT 3Å
138	A	92.1	Very high	93.5	Very high	35 Å²	35	63 Å²	63	29%	0.289	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	150.6	-175.5	0	0	0	0	0	112.1	I158 D159	A138-I158 WeakPolarHBondContact O-CA 3.45Å; A138-D159 HydrophobicContact CB-CB 4.35Å; A138-D159 PolarHBondContact N-O 3.48Å; A138-D159 PolarHBondContact O-N 3.37Å
139	I	95.2	Very high	93.4	Very high	10 Å²	10	65.3 Å²	65.3	5%	0.051	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	146.7	166	-45.5	-55.3	0	0	0	108.5	M53 F83 L86 D87 L90 M144 V156 I158	M53-I139 HydrophobicContact SD-CD1 3.65Å; F83-I139 HydrophobicContact CD2-CB 4.1Å; F83-I139 HydrophobicContact CD2-CG2 3.8Å; F83-I139 HydrophobicContact CE2-CB 3.94Å; F83-I139 HydrophobicContact CE2-CG2 4.14Å; F83-I139 VanDerWaalsContact CE2-O 3.32Å; F83-I139 WeakPolarHBondContact CE2-O 3.41Å; L86-I139 HydrophobicContact CB-CD1 3.86Å; L86-I139 HydrophobicContact CB-CG1 3.81Å; L86-I139 HydrophobicContact CB-CG2 4.27Å; L86-I139 HydrophobicContact CD1-CG2 4.18Å; D87-I139 HydrophobicContact CB-CG1 4.4Å; L90-I139 HydrophobicContact CD2-CD1 4.23Å; L90-I139 HydrophobicContact CD2-CG1 4.4Å; I139-M144 HydrophobicContact CG2-CE 4.43Å; I139-V156 HydrophobicContact CG2-CG1 3.76Å; I139-I158 HydrophobicContact CD1-CG2 3.76Å
140	T	93.8	Very high	93.1	Very high	24 Å²	24	70.5 Å²	70.5	15%	0.147	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	150.7	178.4	80.4	0	0	0	0	111.8	S142 M144 I157	T140-S142 PolarHBondContact OG1-N 3.23Å; T140-M144 WeakPolarHBondContact O-CE 3.38Å; T140-I157 WeakPolarHBondContact CB-O 3.27Å; T140-I157 PolarHBondContact N-O 3.26Å; T140-I157 WeakPolarHBondContact OG1-CB 3.36Å; T140-I157 PolarHBondContact OG1-O 3.21Å
141	Y	92.1	Very high	93	Very high	110 Å²	110	75.5 Å²	75.5	43%	0.431	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-2.8	168.8	-73.7	-77.3	0	0	0	113.1	F83 A143 M144	F83-Y141 HydrophobicContact CB-CE1 3.67Å; F83-Y141 HydrophobicContact CB-CE2 4.3Å; F83-Y141 WeakPolarHBondContact CB-OH 3.33Å; F83-Y141 AromaticContact CD1-CE2 3.92Å; F83-Y141 HydrophobicContact CD1-CE2 3.92Å; F83-Y141 AromaticContact CD1-CZ 3.77Å; F83-Y141 WeakPolarHBondContact CD1-OH 3.36Å; F83-Y141 HydrophobicContact CD2-CD1 4.36Å; F83-Y141 AromaticContact CD2-CD2 3.8Å; F83-Y141 HydrophobicContact CD2-CD2 3.8Å; F83-Y141 HydrophobicContact CD2-CE1 4.07Å; F83-Y141 AromaticContact CD2-CE2 3.46Å; F83-Y141 HydrophobicContact CD2-CE2 3.46Å; F83-Y141 VanDerWaalsContact CD2-CE2 3.46Å; F83-Y141 HydrophobicContact CD2-CG 4.24Å; F83-Y141 AromaticContact CD2-CZ 3.62Å; F83-Y141 HydrophobicContact CE1-CE2 4.13Å; F83-Y141 AromaticContact CE2-CD2 3.88Å; F83-Y141 HydrophobicContact CE2-CD2 3.88Å; F83-Y141 AromaticContact CE2-CE2 3.65Å; F83-Y141 HydrophobicContact CE2-CE2 3.65Å; F83-Y141 HydrophobicContact CG-CD2 4.37Å; F83-Y141 AromaticContact CG-CE1 3.91Å; F83-Y141 HydrophobicContact CG-CE1 3.91Å; F83-Y141 AromaticContact CG-CE2 3.61Å; F83-Y141 HydrophobicContact CG-CE2 3.61Å; F83-Y141 AromaticContact CG-CZ 3.34Å; F83-Y141 WeakPolarHBondContact CG-OH 3.47Å; F83-Y141 HydrophobicContact CZ-CE2 4.01Å; Y141-A143 PolarHBondContact O-N 3.32Å; Y141-A143 VanDerWaalsContact O-N 3.13Å; Y141-M144 HydrophobicContact CD1-CE 4.18Å; Y141-M144 HydrophobicContact CD1-SD 4.05Å; Y141-M144 HydrophobicContact CE1-SD 4.32Å; Y141-M144 PolarHBondContact O-N 2.96Å
142	S	90.8	Very high	93.1	Very high	61 Å²	61	72.6 Å²	72.6	43%	0.427	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	118.2	-177.7	-65.4	0	0	0	0	109.9	T140 M144 I157	T140-S142 PolarHBondContact OG1-N 3.23Å; S142-M144 PolarHBondContact O-N 3.39Å; S142-I157 WeakPolarHBondContact O-CD1 3.5Å; S142-I157 WeakPolarHBondContact O-CG1 3.3Å
143	A	91	Very high	93.4	Very high	57 Å²	57	68.2 Å²	68.2	47%	0.471	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.7	23.5	-178.5	0	0	0	0	0	115	Y141 Q145 I157	Y141-A143 PolarHBondContact O-N 3.32Å; Y141-A143 VanDerWaalsContact O-N 3.13Å; A143-Q145 WeakPolarHBondContact O-CG 3.34Å; A143-Q145 PolarHBondContact O-N 3.39Å; A143-Q145 PolarHBondContact O-NE2 2.87Å; A143-I157 HydrophobicContact CB-CD1 4Å
144	M	95.9	Very high	93.6	Very high	10 Å²	10	66.5 Å²	66.5	5%	0.049	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	127.9	179	-176.9	178.9	-69.8	0	0	110.7	Q79 L82 F83 I139 T140 Y141 S142 F155 V156	Q79-M144 HydrophobicContact CB-SD 3.84Å; Q79-M144 HydrophobicContact CG-CG 4.45Å; Q79-M144 HydrophobicContact CG-SD 4.38Å; L82-M144 HydrophobicContact CD2-SD 4.43Å; F83-M144 HydrophobicContact CB-CE 4.02Å; F83-M144 HydrophobicContact CD2-CE 4.18Å; I139-M144 HydrophobicContact CG2-CE 4.43Å; T140-M144 WeakPolarHBondContact O-CE 3.38Å; Y141-M144 HydrophobicContact CD1-CE 4.18Å; Y141-M144 HydrophobicContact CD1-SD 4.05Å; Y141-M144 HydrophobicContact CE1-SD 4.32Å; Y141-M144 PolarHBondContact O-N 2.96Å; S142-M144 PolarHBondContact O-N 3.39Å; M144-F155 WeakPolarHBondContact CA-O 3.46Å; M144-V156 HydrophobicContact CE-CG1 4.1Å; M144-V156 HydrophobicContact CE-CG2 4.27Å; M144-V156 HydrophobicContact CG-CG2 4.41Å
145	Q	96.6	Very high	93.9	Very high	64 Å²	64	65.2 Å²	65.2	30%	0.299	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.8	-179.1	-64.7	162.4	39.3	0	0	109.8	A143 Y147 V154 F155	A143-Q145 WeakPolarHBondContact O-CG 3.34Å; A143-Q145 PolarHBondContact O-N 3.39Å; A143-Q145 PolarHBondContact O-NE2 2.87Å; Q145-Y147 HydrophobicContact CB-CD2 4.27Å; Q145-Y147 HydrophobicContact CB-CE2 3.68Å; Q145-Y147 HydrophobicContact CG-CE2 4.35Å; Q145-Y147 VanDerWaalsContact OE1-CE2 3.25Å; Q145-Y147 PolarHBondContact OE1-OH 3.43Å; Q145-V154 VanDerWaalsContact O-CA 3.31Å; Q145-V154 WeakPolarHBondContact O-CA 3.12Å; Q145-F155 HydrophobicContact CB-CB 4.16Å; Q145-F155 HydrophobicContact CB-CD2 4.01Å; Q145-F155 HydrophobicContact CB-CG 4.49Å; Q145-F155 PolarHBondContact N-O 2.67Å; Q145-F155 PolarHBondContact O-N 2.75Å
146	V	97	Very high	94.1	Very high	28 Å²	28	59.1 Å²	59.1	17%	0.17	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	108.9	174.1	179.6	0	0	0	0	107	L42 F46 L78 Q79 L82 V154	L42-V146 HydrophobicContact CD1-CG1 4Å; F46-V146 HydrophobicContact CE2-CG1 4.13Å; L78-V146 HydrophobicContact CB-CB 4.47Å; L78-V146 HydrophobicContact CB-CG1 4.12Å; L78-V146 HydrophobicContact CD1-CG1 4.11Å; Q79-V146 HydrophobicContact CG-CG2 4.18Å; L82-V146 HydrophobicContact CD2-CG2 3.82Å; V146-V154 HydrophobicContact CB-CG1 4.41Å; V146-V154 HydrophobicContact CG1-CG1 4.1Å; V146-V154 HydrophobicContact CG2-CG1 4.15Å
147	Y	96.8	Very high	94.3	Very high	99 Å²	99	60.1 Å²	60.1	39%	0.388	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112	174.9	-62.6	-81.4	0	0	0	108.1	Q145 P152 E153 F155	Q145-Y147 HydrophobicContact CB-CD2 4.27Å; Q145-Y147 HydrophobicContact CB-CE2 3.68Å; Q145-Y147 HydrophobicContact CG-CE2 4.35Å; Q145-Y147 VanDerWaalsContact OE1-CE2 3.25Å; Q145-Y147 PolarHBondContact OE1-OH 3.43Å; Y147-P152 WeakPolarHBondContact O-CA 3.31Å; Y147-E153 HydrophobicContact CD2-CG 3.83Å; Y147-E153 HydrophobicContact CG-CG 4.15Å; Y147-E153 PolarHBondContact N-O 2.96Å; Y147-E153 PolarHBondContact O-N 2.77Å; Y147-F155 HydrophobicContact CD2-CD2 4.01Å; Y147-F155 AromaticContact CD2-CE2 3.76Å; Y147-F155 HydrophobicContact CD2-CE2 3.76Å; Y147-F155 AromaticContact CE2-CD2 3.77Å; Y147-F155 HydrophobicContact CE2-CD2 3.77Å; Y147-F155 AromaticContact CE2-CE2 3.6Å; Y147-F155 HydrophobicContact CE2-CE2 3.6Å
148	N	93.8	Very high	94.4	Very high	65 Å²	65	54.3 Å²	54.3	35%	0.348	28%	0.279	S	S	.	.			trans	-110.3	64.5	-178.3	-174.2	26.2	0	0	0	109.8	L42 L78 Q111	L42-N148 HydrophobicContact CD1-CB 4.23Å; L78-N148 HydrophobicContact CD1-CB 4.31Å; Q111-N148 PolarHBondContact OE1-ND2 3.05Å
149	E	91.4	Very high	94.5	Very high	161 Å²	161	53.9 Å²	53.9	75%	0.752	27%	0.272	S	S	*	.	S	Bend	trans	-112.6	-154.1	177.7	-60.6	-166.3	-177.5	0	0	110.6	N151 P152	E149-N151 VanDerWaalsContact C-N 3.26Å; E149-N151 PolarHBondContact O-N 2.8Å; E149-P152 WeakPolarHBondContact O-CD 3.48Å; E149-P152 WeakPolarHBondContact O-CG 3.27Å
150	E	86.9	Confident	94.3	Very high	178 Å²	178	54.9 Å²	54.9	83%	0.832	28%	0.277	S	S	*	.	S	Bend	trans	-61.6	-31.6	-175.9	-169.6	173.2	-167.4	0	0	113.3
151	N	92.4	Very high	94.3	Very high	110 Å²	110	56.5 Å²	56.5	59%	0.588	28%	0.283	S	S	*	.	S	Bend	trans	-123.2	93.4	170.5	-59.9	-62.8	0	0	0	108.2	E149 E153	E149-N151 VanDerWaalsContact C-N 3.26Å; E149-N151 PolarHBondContact O-N 2.8Å; N151-E153 PolarHBondContact O-N 3.4Å
152	P	96.6	Very high	94.4	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.032	28%	0.276	C	S	.	.			trans	-61.1	134	-178.9	-28.1	37.9	0	0	0	112.2	W38 G39 L42 A45 Y147 E149	W38-P152 VanDerWaalsContact CA-O 3.25Å; W38-P152 WeakPolarHBondContact CA-O 3.23Å; G39-P152 PolarHBondContact N-O 3.33Å; G39-P152 VanDerWaalsContact N-O 3.1Å; G39-P152 WeakPolarHBondContact O-CD 3.4Å; L42-P152 HydrophobicContact CB-CB 4.4Å; L42-P152 HydrophobicContact CD1-CB 4.21Å; A45-P152 HydrophobicContact CB-CB 4.11Å; Y147-P152 WeakPolarHBondContact O-CA 3.31Å; E149-P152 WeakPolarHBondContact O-CD 3.48Å; E149-P152 WeakPolarHBondContact O-CG 3.27Å
153	E	97.6	Very high	94.6	Very high	67 Å²	67	53.2 Å²	53.2	31%	0.313	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	148.4	178.1	60.3	178.9	-156	0	0	111	H36 A37 W38 Y147 N151 F155	H36-E153 IonicContact NE2-OE2 3.59Å; A37-E153 CarbonylContact O-C 3.6Å; A37-E153 VanDerWaalsContact O-CA 3.28Å; A37-E153 WeakPolarHBondContact O-CA 3.25Å; W38-E153 HydrophobicContact CB-CB 3.99Å; Y147-E153 HydrophobicContact CD2-CG 3.83Å; Y147-E153 HydrophobicContact CG-CG 4.15Å; Y147-E153 PolarHBondContact N-O 2.96Å; Y147-E153 PolarHBondContact O-N 2.77Å; N151-E153 PolarHBondContact O-N 3.4Å; E153-F155 HydrophobicContact CG-CE2 4.04Å
154	V	97.7	Very high	94.8	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	142	-177.5	-60.3	0	0	0	0	110.9	H36 A37 A45 F46 C49 L82 Q145 V146	H36-V154 WeakPolarHBondContact CA-O 3.44Å; A37-V154 HydrophobicContact CB-CG2 4.02Å; A37-V154 PolarHBondContact N-O 2.93Å; A37-V154 PolarHBondContact O-N 2.98Å; A45-V154 HydrophobicContact CB-CG1 4.34Å; F46-V154 HydrophobicContact CD2-CG1 4.07Å; F46-V154 HydrophobicContact CE2-CG1 3.91Å; C49-V154 HydrophobicContact CB-CG2 3.68Å; L82-V154 HydrophobicContact CD2-CB 3.88Å; L82-V154 HydrophobicContact CD2-CG1 4.01Å; L82-V154 HydrophobicContact CD2-CG2 4.36Å; Q145-V154 VanDerWaalsContact O-CA 3.31Å; Q145-V154 WeakPolarHBondContact O-CA 3.12Å; V146-V154 HydrophobicContact CB-CG1 4.41Å; V146-V154 HydrophobicContact CG1-CG1 4.1Å; V146-V154 HydrophobicContact CG2-CG1 4.15Å
155	F	97.6	Very high	94.8	Very high	33 Å²	33	55.7 Å²	55.7	15%	0.145	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.9	176	-58.6	-99.3	0	0	0	108.7	L35 H36 M144 Q145 Y147 E153	L35-F155 CarbonylContact O-C 3.6Å; L35-F155 WeakPolarHBondContact O-CA 3.46Å; H36-F155 HydrophobicContact CB-CD1 3.94Å; H36-F155 HydrophobicContact CB-CE1 3.91Å; H36-F155 AromaticContact CD2-CD1 3.79Å; H36-F155 AromaticContact CD2-CE1 3.27Å; H36-F155 WeakPolarHBondContact CD2-CE1 3.26Å; H36-F155 AromaticContact CD2-CE2 3.86Å; H36-F155 AromaticContact CD2-CZ 3.31Å; H36-F155 WeakPolarHBondContact CD2-CZ 3.36Å; H36-F155 AromaticContact CE1-CZ 4Å; H36-F155 AromaticContact CG-CD1 3.93Å; H36-F155 AromaticContact CG-CE1 3.44Å; H36-F155 VanDerWaalsContact CG-CE1 3.44Å; H36-F155 AromaticContact CG-CZ 3.93Å; H36-F155 AromaticContact ND1-CE1 3.96Å; H36-F155 AromaticContact NE2-CE1 3.76Å; H36-F155 AromaticContact NE2-CZ 3.4Å; H36-F155 WeakPolarHBondContact NE2-CZ 3.3Å; M144-F155 WeakPolarHBondContact CA-O 3.46Å; Q145-F155 HydrophobicContact CB-CB 4.16Å; Q145-F155 HydrophobicContact CB-CD2 4.01Å; Q145-F155 HydrophobicContact CB-CG 4.49Å; Q145-F155 PolarHBondContact N-O 2.67Å; Q145-F155 PolarHBondContact O-N 2.75Å; Y147-F155 HydrophobicContact CD2-CD2 4.01Å; Y147-F155 AromaticContact CD2-CE2 3.76Å; Y147-F155 HydrophobicContact CD2-CE2 3.76Å; Y147-F155 AromaticContact CE2-CD2 3.77Å; Y147-F155 HydrophobicContact CE2-CD2 3.77Å; Y147-F155 AromaticContact CE2-CE2 3.6Å; Y147-F155 HydrophobicContact CE2-CE2 3.6Å; E153-F155 HydrophobicContact CG-CE2 4.04Å
156	V	97.1	Very high	94.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.8	-177.7	179.8	0	0	0	0	109.8	E34 L35 L82 L86 I139 M144 I158	E34-V156 CarbonylContact C-O 3.55Å; E34-V156 WeakPolarHBondContact CA-O 3.26Å; L35-V156 PolarHBondContact N-O 3.01Å; L35-V156 PolarHBondContact O-N 3.34Å; L82-V156 HydrophobicContact CD2-CG2 3.48Å; L82-V156 VanDerWaalsContact CD2-CG2 3.48Å; L82-V156 HydrophobicContact CG-CG2 4.08Å; L86-V156 HydrophobicContact CD1-CB 4.3Å; L86-V156 HydrophobicContact CD1-CG1 3.87Å; L86-V156 HydrophobicContact CD1-CG2 4Å; I139-V156 HydrophobicContact CG2-CG1 3.76Å; M144-V156 HydrophobicContact CE-CG1 4.1Å; M144-V156 HydrophobicContact CE-CG2 4.27Å; M144-V156 HydrophobicContact CG-CG2 4.41Å; V156-I158 HydrophobicContact CG1-CG2 4.31Å
157	I	95.9	Very high	94.5	Very high	24 Å²	24	57.1 Å²	57.1	12%	0.123	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.2	171.9	-63.1	-179.2	0	0	0	109.9	E32 C33 E34 T140 S142 A143	E32-I157 HydrophobicContact CB-CG2 3.77Å; E32-I157 HydrophobicContact CG-CG2 4.13Å; C33-I157 CarbonylContact O-C 3.52Å; C33-I157 WeakPolarHBondContact O-CA 3.31Å; E34-I157 HydrophobicContact CB-CG1 4.19Å; E34-I157 HydrophobicContact CG-CG1 4.25Å; T140-I157 WeakPolarHBondContact CB-O 3.27Å; T140-I157 PolarHBondContact N-O 3.26Å; T140-I157 WeakPolarHBondContact OG1-CB 3.36Å; T140-I157 PolarHBondContact OG1-O 3.21Å; S142-I157 WeakPolarHBondContact O-CD1 3.5Å; S142-I157 WeakPolarHBondContact O-CG1 3.3Å; A143-I157 HydrophobicContact CB-CD1 4Å
158	I	94.4	Very high	94.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	145.3	176	60.2	167.6	0	0	0	111.2	E32 C33 L35 V136 A138 I139 V156 I160	E32-I158 CarbonylContact C-O 3.56Å; E32-I158 VanDerWaalsContact CA-O 3.27Å; E32-I158 WeakPolarHBondContact CA-O 3.48Å; C33-I158 HydrophobicContact CB-CD1 4.4Å; C33-I158 HydrophobicContact CB-CG1 3.98Å; C33-I158 PolarHBondContact N-O 3Å; C33-I158 WeakPolarHBondContact O-CG1 3.5Å; C33-I158 PolarHBondContact O-N 3.12Å; L35-I158 HydrophobicContact CD1-CD1 4.08Å; L35-I158 HydrophobicContact CD1-CG1 4.49Å; L35-I158 HydrophobicContact CD1-CG2 3.94Å; L35-I158 HydrophobicContact CD2-CD1 4.05Å; L35-I158 HydrophobicContact CG-CD1 4.11Å; L35-I158 HydrophobicContact CG-CG1 4.28Å; L35-I158 HydrophobicContact CG-CG2 4.38Å; V136-I158 HydrophobicContact CB-CD1 4.45Å; V136-I158 HydrophobicContact CG1-CB 3.88Å; V136-I158 HydrophobicContact CG1-CD1 3.87Å; V136-I158 HydrophobicContact CG1-CG1 4.38Å; V136-I158 HydrophobicContact CG1-CG2 4.32Å; V136-I158 HydrophobicContact CG2-CD1 3.73Å; A138-I158 WeakPolarHBondContact O-CA 3.45Å; I139-I158 HydrophobicContact CD1-CG2 3.76Å; V156-I158 HydrophobicContact CG1-CG2 4.31Å; I158-I160 HydrophobicContact CD1-CG2 4.03Å; I158-I160 HydrophobicContact CG1-CG2 4.19Å
159	D	94.3	Very high	94.4	Very high	26 Å²	26	52.9 Å²	52.9	14%	0.139	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	132.4	172.3	-165.1	-7	0	0	0	108.9	K137 A138	K137-D159 PolarHBondContact N-O 3.15Å; A138-D159 HydrophobicContact CB-CB 4.35Å; A138-D159 PolarHBondContact N-O 3.48Å; A138-D159 PolarHBondContact O-N 3.37Å
160	I	90.4	Very high	94.6	Very high	31 Å²	31	43.1 Å²	43.1	16%	0.159	21%	0.212	C	C	.	.			trans	-123.2	0	-175.1	64	176.5	0	0	0	112.1	Y31 C33 Y56 T134 E135 V136 K137 I158	Y31-I160 WeakPolarHBondContact O-CG1 3.33Å; Y31-I160 PolarHBondContact O-N 3.29Å; C33-I160 HydrophobicContact CB-CD1 4.43Å; Y56-I160 HydrophobicContact CD1-CG2 4.22Å; Y56-I160 HydrophobicContact CE1-CD1 3.75Å; Y56-I160 HydrophobicContact CE1-CG2 3.96Å; T134-I160 HydrophobicContact CG2-CB 3.94Å; T134-I160 HydrophobicContact CG2-CD1 4.2Å; T134-I160 HydrophobicContact CG2-CG1 4.39Å; E135-I160 WeakPolarHBondContact O-CA 2.95Å; E135-I160 WeakPolarHBondContact O-CB 3.25Å; V136-I160 HydrophobicContact CG2-CG2 4.37Å; K137-I160 WeakPolarHBondContact CE-OXT 3.2Å; K137-I160 PolarHBondContact NZ-O 2.69Å; K137-I160 PolarHBondContact NZ-OXT 3Å; I158-I160 HydrophobicContact CD1-CG2 4.03Å; I158-I160 HydrophobicContact CG1-CG2 4.19Å

Retrieved 160 of 160 residues in 87.3 ms (Link to these results)

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