A0A087XUJ6_POEFO Loading...

Phosphoinositide-3-kinase interacting protein 1

AlphaFold DB , UniProt , Accession A0A087XUJ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 264 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.7	Low	51.2	Low	202 Å²	202	126.8 Å²	126.8	100%	0.995	64%	0.644	S	S	*	*				0	-44.2	0	-77.4	-179.5	167.5	0	0	113.3	F3 S4 L5	M1-F3 PolarHBondContact O-N 3.05Å; M1-S4 PolarHBondContact O-N 3.13Å; M1-L5 PolarHBondContact O-N 3.46Å
2	F	49.3	Very low	51.1	Low	166 Å²	166	122.8 Å²	122.8	73%	0.728	64%	0.644	S	S	*	*	H	α-helix	trans	-63.9	-33.7	176.8	-72.9	-81.8	0	0	0	115.2	S4 L5 H6	F2-S4 PolarHBondContact O-N 3.49Å; F2-L5 PolarHBondContact O-N 3.49Å; F2-H6 PolarHBondContact O-CD2 2.81Å; F2-H6 PolarHBondContact O-N 3.01Å
3	F	49	Very low	51	Low	161 Å²	161	119 Å²	119	71%	0.706	64%	0.642	S	S	*	*	H	α-helix	trans	-68.4	-29.7	176.3	-78.8	-82.3	0	0	0	113.9	M1 I7	M1-F3 PolarHBondContact O-N 3.05Å; F3-I7 WeakPolarHBondContact O-CD1 3.49Å; F3-I7 WeakPolarHBondContact O-CG1 3.48Å; F3-I7 PolarHBondContact O-N 3.28Å
4	S	53.2	Low	51.3	Low	78 Å²	78	120.2 Å²	120.2	55%	0.545	65%	0.646	S	S	.	*	H	α-helix	trans	-76.6	-30.6	178.2	-54	0	0	0	0	112.3	M1 F2 I7 V8	M1-S4 PolarHBondContact O-N 3.13Å; F2-S4 PolarHBondContact O-N 3.49Å; S4-I7 PolarHBondContact O-N 3.04Å; S4-V8 VanDerWaalsContact O-CG2 3.29Å; S4-V8 WeakPolarHBondContact O-CG2 3.33Å; S4-V8 PolarHBondContact O-N 3.44Å
5	L	47.6	Very low	50.9	Low	101 Å²	101	120.9 Å²	120.9	53%	0.529	66%	0.656	S	S	.	*	H	α-helix	trans	-69.1	-35.5	175.7	-88.5	152.9	0	0	0	112.5	M1 F2 V8 F9	M1-L5 PolarHBondContact O-N 3.46Å; F2-L5 PolarHBondContact O-N 3.49Å; L5-V8 PolarHBondContact O-N 3.22Å; L5-F9 PolarHBondContact O-N 2.91Å
6	H	53.2	Low	50.6	Low	125 Å²	125	124.3 Å²	124.3	58%	0.579	67%	0.666	S	S	*	*	H	α-helix	trans	-69.1	-33.9	173.3	-73.6	-65.5	0	0	0	112.8	F2 F9 L10	F2-H6 PolarHBondContact O-CD2 2.81Å; F2-H6 PolarHBondContact O-N 3.01Å; H6-F9 PolarHBondContact O-N 3.1Å; H6-L10 WeakPolarHBondContact O-CB 3.2Å; H6-L10 WeakPolarHBondContact O-CD1 3.49Å; H6-L10 WeakPolarHBondContact O-CG 3.4Å; H6-L10 PolarHBondContact O-N 3.35Å
7	I	54.6	Low	50	Low	113 Å²	113	119.8 Å²	119.8	58%	0.579	66%	0.656	S	S	*	*	H	α-helix	trans	-71.1	-34.9	176.5	-66.3	167.9	0	0	0	111	F3 S4 S11	F3-I7 WeakPolarHBondContact O-CD1 3.49Å; F3-I7 WeakPolarHBondContact O-CG1 3.48Å; F3-I7 PolarHBondContact O-N 3.28Å; S4-I7 PolarHBondContact O-N 3.04Å; I7-S11 PolarHBondContact O-N 3.44Å; I7-S11 PolarHBondContact O-OG 3.45Å
8	V	53.8	Low	49.9	Very low	93 Å²	93	119.7 Å²	119.7	56%	0.564	67%	0.665	S	S	*	*	H	α-helix	trans	-72.8	-35.3	174.2	176.2	0	0	0	0	111.8	S4 L5 S11 A12	S4-V8 VanDerWaalsContact O-CG2 3.29Å; S4-V8 WeakPolarHBondContact O-CG2 3.33Å; S4-V8 PolarHBondContact O-N 3.44Å; L5-V8 PolarHBondContact O-N 3.22Å; V8-S11 WeakPolarHBondContact CA-OG 3.47Å; V8-S11 PolarHBondContact O-N 2.95Å; V8-S11 PolarHBondContact O-OG 3.28Å; V8-S11 VanDerWaalsContact O-OG 3.06Å; V8-A12 PolarHBondContact O-N 3.36Å; V8-A12 VanDerWaalsContact O-N 3.16Å
9	F	49.5	Very low	49.3	Very low	154 Å²	154	119.8 Å²	119.8	68%	0.675	67%	0.669	S	S	*	*	H	α-helix	trans	-73.5	-29.1	173	-97.6	-86.2	0	0	0	113.6	L5 H6 S11	L5-F9 PolarHBondContact O-N 2.91Å; H6-F9 PolarHBondContact O-N 3.1Å; F9-S11 VanDerWaalsContact C-N 3.31Å
10	L	49.9	Very low	49.2	Very low	129 Å²	129	119.7 Å²	119.7	68%	0.675	67%	0.674	S	S	*	*	H	α-helix	trans	-72.6	-22.3	171.7	-87.2	157.1	0	0	0	113.1	H6	H6-L10 WeakPolarHBondContact O-CB 3.2Å; H6-L10 WeakPolarHBondContact O-CD1 3.49Å; H6-L10 WeakPolarHBondContact O-CG 3.4Å; H6-L10 PolarHBondContact O-N 3.35Å
11	S	50.3	Low	48.9	Very low	73 Å²	73	118.4 Å²	118.4	51%	0.51	67%	0.673	S	S	.	*	H	α-helix	trans	-88.9	-21.9	174.3	34.5	0	0	0	0	113.1	I7 V8 F9 A13	I7-S11 PolarHBondContact O-N 3.44Å; I7-S11 PolarHBondContact O-OG 3.45Å; V8-S11 WeakPolarHBondContact CA-OG 3.47Å; V8-S11 PolarHBondContact O-N 2.95Å; V8-S11 PolarHBondContact O-OG 3.28Å; V8-S11 VanDerWaalsContact O-OG 3.06Å; F9-S11 VanDerWaalsContact C-N 3.31Å; S11-A13 VanDerWaalsContact C-N 3.33Å
12	A	49.8	Very low	48.9	Very low	78 Å²	78	112.2 Å²	112.2	65%	0.645	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-8.9	175.8	0	0	0	0	0	114.5	V8	V8-A12 PolarHBondContact O-N 3.36Å; V8-A12 VanDerWaalsContact O-N 3.16Å
13	A	50.2	Low	48.8	Very low	74 Å²	74	106.6 Å²	106.6	61%	0.612	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	1.7	175.3	0	0	0	0	0	113.9	S11	S11-A13 VanDerWaalsContact C-N 3.33Å
14	I	54.9	Low	49.1	Very low	136 Å²	136	108.2 Å²	108.2	70%	0.697	66%	0.659	S	S	*	*			trans	-114.1	50.5	172.3	-40.9	179.6	0	0	0	109.4
15	V	46.3	Very low	49.3	Very low	131 Å²	131	113.2 Å²	113.2	79%	0.794	67%	0.666	S	S	*	*			trans	-116.9	70.2	139.8	176.1	0	0	0	0	104.2	G17	V15-G17 PolarHBondContact O-N 2.98Å
16	E	44.8	Very low	50.8	Low	175 Å²	175	111.3 Å²	111.3	82%	0.818	66%	0.656	S	S	*	*			trans	-62.8	90.7	147.3	-81.5	-179.8	161.7	0	0	104.6	S18	E16-S18 PolarHBondContact O-N 3.25Å
17	G	41.3	Very low	52.5	Low	48 Å²	48	107.5 Å²	107.5	50%	0.495	64%	0.643	S	S	.	*			trans	-48	118.5	148.4	0	0	0	0	0	105	V15 T19	V15-G17 PolarHBondContact O-N 2.98Å; G17-T19 PolarHBondContact O-N 3.47Å
18	S	47.3	Very low	54.3	Low	117 Å²	117	102.6 Å²	102.6	82%	0.818	62%	0.619	S	S	*	*			trans	-56.4	79.5	173.7	35.7	0	0	0	0	108.9	E16 P20	E16-S18 PolarHBondContact O-N 3.25Å; S18-P20 VanDerWaalsContact O-CD 3.31Å; S18-P20 WeakPolarHBondContact O-CD 3.43Å
19	T	38.7	Very low	56	Low	122 Å²	122	104.5 Å²	104.5	75%	0.748	62%	0.616	S	S	*	*			trans	-65.2	115.6	156.2	40.6	0	0	0	0	104.9	G17 S21	G17-T19 PolarHBondContact O-N 3.47Å; T19-S21 VanDerWaalsContact C-N 3.35Å; T19-S21 PolarHBondContact O-N 3.32Å
20	P	46.8	Very low	57.9	Low	117 Å²	117	102.5 Å²	102.5	76%	0.76	62%	0.621	S	S	*	*			trans	-62.2	106.5	174.5	25.9	-29.6	0	0	0	105.6	S18 G22	S18-P20 VanDerWaalsContact O-CD 3.31Å; S18-P20 WeakPolarHBondContact O-CD 3.43Å; P20-G22 PolarHBondContact O-N 3.2Å
21	S	44.4	Very low	59.8	Low	94 Å²	94	103.2 Å²	103.2	66%	0.657	62%	0.615	S	S	*	*			trans	-61	92	170.9	160.9	0	0	0	0	105.9	T19 G23	T19-S21 VanDerWaalsContact C-N 3.35Å; T19-S21 PolarHBondContact O-N 3.32Å; S21-G23 PolarHBondContact O-N 3.4Å
22	G	52.3	Low	61.7	Low	71 Å²	71	99.8 Å²	99.8	73%	0.732	59%	0.591	S	S	*	*			trans	-67.1	67.5	176.1	0	0	0	0	0	111	P20 Q24	P20-G22 PolarHBondContact O-N 3.2Å; G22-Q24 VanDerWaalsContact C-N 3.26Å; G22-Q24 PolarHBondContact O-N 2.93Å; G22-Q24 VanDerWaalsContact O-N 3.09Å
23	G	47.7	Very low	63.7	Low	48 Å²	48	100.3 Å²	100.3	50%	0.495	58%	0.582	S	S	.	*			trans	-81.4	68.1	173.5	0	0	0	0	0	110.2	S21 R25	S21-G23 PolarHBondContact O-N 3.4Å; G23-R25 PolarHBondContact O-N 2.86Å
24	Q	53.8	Low	65.5	Low	196 Å²	196	100.9 Å²	100.9	92%	0.916	58%	0.575	S	S	*	*	S	Bend	trans	41.9	5.8	168	-82.1	-154.5	20.1	0	0	120.8	G22	G22-Q24 VanDerWaalsContact C-N 3.26Å; G22-Q24 PolarHBondContact O-N 2.93Å; G22-Q24 VanDerWaalsContact O-N 3.09Å
25	R	58.7	Low	67.2	Low	183 Å²	183	94.7 Å²	94.7	69%	0.691	54%	0.543	S	S	*	.			trans	-147.1	11.6	178.1	-65.2	-168.5	-179.8	127.3	0.1	114.3	G23 C27 Y35	G23-R25 PolarHBondContact O-N 2.86Å; R25-C27 PolarHBondContact O-N 3.05Å; R25-Y35 WeakPolarHBondContact O-CE2 3.4Å
26	D	78.9	Confident	69.3	Low	60 Å²	60	93 Å²	93	32%	0.321	52%	0.522	S	S	.	.			trans	-87.2	32.1	176.6	-73.3	-32.9	0	0	0	113.3	G37 E38	D26-G37 WeakPolarHBondContact OD1-CA 3.43Å; D26-E38 PolarHBondContact OD1-N 2.97Å
27	C	89	Confident	71.5	Confident	46 Å²	46	84.8 Å²	84.8	31%	0.311	49%	0.485	S	S	.	.	S	Bend	trans	-129.4	148.3	169.7	65.8	0	0	0	0	110.3	R25 E104 C106	R25-C27 PolarHBondContact O-N 3.05Å; C27-E104 CarbonylContact C-O 3.43Å; C27-E104 WeakPolarHBondContact CA-O 3.39Å; C27-E104 WeakPolarHBondContact CB-O 2.97Å; C27-C106 HydrophobicContact CB-CB 3.88Å; C27-C106 WeakPolarHBondContact CB-SG 3.42Å; C27-C106 PolarHBondContact O-SG 2.95Å; C27-C106 VanDerWaalsContact O-SG 3.32Å; C27-C106 WeakPolarHBondContact SG-CA 3.38Å; C27-C106 WeakPolarHBondContact SG-CB 3.22Å; C27-C106 CovalentContact SG-SG 2.03Å; C27-C106 PolarHBondContact SG-SG 2.86Å
28	V	91.6	Very high	74	Confident	10 Å²	10	90 Å²	90	6%	0.061	50%	0.496	C	S	.	.	B	Isolated β-bridge	trans	-89.9	129.3	178.7	169.2	0	0	0	0	109.2	Y35 P85 I103 E104 T105 C106	V28-Y35 HydrophobicContact CG2-CD2 3.82Å; V28-Y35 HydrophobicContact CG2-CE2 4.29Å; V28-Y35 HydrophobicContact CG2-CG 4.13Å; V28-P85 HydrophobicContact CG1-CG 4.43Å; V28-P85 HydrophobicContact CG2-CG 3.63Å; V28-I103 HydrophobicContact CG2-CB 3.7Å; V28-I103 HydrophobicContact CG2-CD1 4Å; V28-I103 HydrophobicContact CG2-CG1 4.49Å; V28-I103 HydrophobicContact CG2-CG2 3.65Å; V28-E104 PolarHBondContact N-O 3.21Å; V28-T105 CarbonylContact O-C 3.58Å; V28-T105 VanDerWaalsContact O-CA 3.31Å; V28-T105 WeakPolarHBondContact O-CA 2.99Å; V28-T105 WeakPolarHBondContact O-CG2 3.3Å; V28-C106 PolarHBondContact O-N 3.24Å
29	R	89.9	Confident	76.2	Confident	133 Å²	133	87.3 Å²	87.3	50%	0.502	47%	0.471	S	S	.	.			trans	-97.8	135.3	167	-172.7	-177.4	-69.5	125.5	-4.8	109.2	R31 G32 D34	R29-R31 PolarHBondContact O-N 3.31Å; R29-R31 VanDerWaalsContact O-N 3.1Å; R29-G32 PolarHBondContact O-N 2.92Å; R29-D34 IonicContact NH1-OD2 3.31Å; R29-D34 PolarHBondContact NH1-OD2 3.34Å
30	S	89	Confident	78.9	Confident	112 Å²	112	85.6 Å²	85.6	78%	0.783	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	-116.3	-179.8	-60	0	0	0	0	111.5
31	R	90.6	Very high	81.1	Confident	143 Å²	143	82.1 Å²	82.1	54%	0.54	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	0.2	176.8	-63.7	-175.9	-175.2	-171.1	0.9	114	R29 N78 A81 S82 G84	R29-R31 PolarHBondContact O-N 3.31Å; R29-R31 VanDerWaalsContact O-N 3.1Å; R31-N78 PolarHBondContact O-ND2 2.92Å; R31-A81 PolarHBondContact NH1-O 3.18Å; R31-S82 WeakPolarHBondContact CB-O 3.04Å; R31-S82 WeakPolarHBondContact CD-O 3.39Å; R31-G84 WeakPolarHBondContact O-CA 3.37Å
32	G	90.8	Very high	83.5	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.01	40%	0.403	C	S	.	.			trans	73.7	28.9	177.9	0	0	0	0	0	115.3	R29 D34 Y35	R29-G32 PolarHBondContact O-N 2.92Å; G32-D34 VanDerWaalsContact C-N 3.25Å; G32-D34 PolarHBondContact O-N 3.49Å; G32-Y35 VanDerWaalsContact O-CB 3.23Å; G32-Y35 WeakPolarHBondContact O-CB 3.48Å; G32-Y35 PolarHBondContact O-N 3.16Å
33	L	90.1	Very high	85.5	Confident	90 Å²	90	77.6 Å²	77.6	47%	0.471	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-39.4	171.2	-67.4	175.3	0	0	0	111.8	Y35 R36 N78 A81	L33-Y35 VanDerWaalsContact C-N 3.33Å; L33-R36 PolarHBondContact O-NH1 2.95Å; L33-N78 VanDerWaalsContact CD2-O 3.3Å; L33-N78 WeakPolarHBondContact CD2-O 3.46Å; L33-A81 HydrophobicContact CD2-CB 3.79Å
34	D	88.6	Confident	87.7	Confident	85 Å²	85	79.4 Å²	79.4	46%	0.455	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	5.4	177.9	64.4	-32.4	0	0	0	112.8	R29 G32 R36	R29-D34 IonicContact NH1-OD2 3.31Å; R29-D34 PolarHBondContact NH1-OD2 3.34Å; G32-D34 VanDerWaalsContact C-N 3.25Å; G32-D34 PolarHBondContact O-N 3.49Å; D34-R36 PolarHBondContact O-N 3.42Å
35	Y	90.4	Very high	89.5	Confident	7 Å²	7	72.5 Å²	72.5	3%	0.027	37%	0.373	C	S	.	.			trans	-65	124.3	179.5	-179	-104.9	0	0	0	110.2	R25 V28 G32 L33 G37 Q39 C76 R77 P85 I103	R25-Y35 WeakPolarHBondContact O-CE2 3.4Å; V28-Y35 HydrophobicContact CG2-CD2 3.82Å; V28-Y35 HydrophobicContact CG2-CE2 4.29Å; V28-Y35 HydrophobicContact CG2-CG 4.13Å; G32-Y35 VanDerWaalsContact O-CB 3.23Å; G32-Y35 WeakPolarHBondContact O-CB 3.48Å; G32-Y35 PolarHBondContact O-N 3.16Å; L33-Y35 VanDerWaalsContact C-N 3.33Å; Y35-G37 VanDerWaalsContact CZ-CA 3.46Å; Y35-G37 WeakPolarHBondContact OH-CA 3.29Å; Y35-Q39 HydrophobicContact CE1-CB 4.39Å; Y35-Q39 VanDerWaalsContact OH-CB 3.22Å; Y35-Q39 WeakPolarHBondContact OH-CB 3.49Å; Y35-Q39 PolarHBondContact OH-N 2.89Å; Y35-C76 VanDerWaalsContact CD1-O 3.3Å; Y35-C76 WeakPolarHBondContact CD1-O 3.33Å; Y35-C76 HydrophobicContact CE1-CB 4.39Å; Y35-R77 WeakPolarHBondContact O-CD 3.23Å; Y35-P85 HydrophobicContact CD1-CB 4.26Å; Y35-P85 HydrophobicContact CD1-CG 4.14Å; Y35-P85 HydrophobicContact CG-CG 4.19Å; Y35-I103 HydrophobicContact CD1-CD1 4Å; Y35-I103 HydrophobicContact CE1-CD1 3.47Å; Y35-I103 VanDerWaalsContact CE1-CD1 3.47Å; Y35-I103 HydrophobicContact CE2-CD1 4.17Å; Y35-I103 HydrophobicContact CE2-CG2 3.82Å
36	R	91.4	Very high	91.2	Very high	95 Å²	95	67 Å²	67	36%	0.358	36%	0.357	S	S	.	.			trans	-131.7	20.6	-180	-63.1	-63.4	-179.5	-82.7	0.7	112.2	L33 D34	L33-R36 PolarHBondContact O-NH1 2.95Å; D34-R36 PolarHBondContact O-N 3.42Å
37	G	91.1	Very high	92	Very high	3 Å²	3	68.8 Å²	68.8	3%	0.031	37%	0.37	C	S	.	.			trans	-71.5	177.8	175	0	0	0	0	0	112.7	D26 Y35 R77	D26-G37 WeakPolarHBondContact OD1-CA 3.43Å; Y35-G37 VanDerWaalsContact CZ-CA 3.46Å; Y35-G37 WeakPolarHBondContact OH-CA 3.29Å; G37-R77 PolarHBondContact O-NH1 2.8Å; G37-R77 PolarHBondContact O-NH2 3.34Å
38	E	92.8	Very high	92.3	Very high	158 Å²	158	66.9 Å²	66.9	74%	0.738	36%	0.357	S	S	*	.			trans	-104	18.3	-171.5	-61.5	-174.3	161.4	0	0	112.8	D26 Q40	D26-E38 PolarHBondContact OD1-N 2.97Å; E38-Q40 WeakPolarHBondContact O-CG 3.32Å; E38-Q40 PolarHBondContact O-N 3.41Å; E38-Q40 VanDerWaalsContact O-N 3.14Å
39	Q	93.3	Very high	92.4	Very high	60 Å²	60	68.9 Å²	68.9	28%	0.28	37%	0.367	S	S	.	.			trans	-60.4	118.2	174.1	-177.5	67.5	37.4	0	0	110.3	Y35 S41 C75 C76 C101 I103	Y35-Q39 HydrophobicContact CE1-CB 4.39Å; Y35-Q39 VanDerWaalsContact OH-CB 3.22Å; Y35-Q39 WeakPolarHBondContact OH-CB 3.49Å; Y35-Q39 PolarHBondContact OH-N 2.89Å; Q39-S41 PolarHBondContact NE2-O 2.93Å; Q39-C75 CarbonylContact O-C 3.51Å; Q39-C75 VanDerWaalsContact O-CA 3.3Å; Q39-C75 WeakPolarHBondContact O-CA 3.41Å; Q39-C76 HydrophobicContact CB-CB 4.49Å; Q39-C76 PolarHBondContact O-N 3.45Å; Q39-C76 PolarHBondContact O-SG 2.79Å; Q39-C101 HydrophobicContact CG-CB 4.28Å; Q39-I103 HydrophobicContact CB-CD1 4.06Å; Q39-I103 HydrophobicContact CB-CG1 3.88Å; Q39-I103 HydrophobicContact CG-CD1 4.14Å; Q39-I103 HydrophobicContact CG-CG1 3.68Å
40	Q	94.9	Very high	92.5	Very high	86 Å²	86	64.2 Å²	64.2	40%	0.402	35%	0.352	S	S	.	.			trans	-116.8	6.7	-178.4	-70.9	172.3	-1.4	0	0	113.3	E38 C48 N74	E38-Q40 WeakPolarHBondContact O-CG 3.32Å; E38-Q40 PolarHBondContact O-N 3.41Å; E38-Q40 VanDerWaalsContact O-N 3.14Å; Q40-C48 VanDerWaalsContact O-CB 3.24Å; Q40-C48 WeakPolarHBondContact O-CB 3.47Å; Q40-C48 PolarHBondContact O-N 3.43Å; Q40-C48 PolarHBondContact O-SG 3.08Å; Q40-N74 WeakPolarHBondContact CG-OD1 3.33Å; Q40-N74 PolarHBondContact NE2-OD1 3.32Å; Q40-N74 VanDerWaalsContact NE2-OD1 3.13Å
41	S	94.3	Very high	92.5	Very high	43 Å²	43	59 Å²	59	30%	0.301	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-118.2	138.8	177.2	-50.3	0	0	0	0	110.9	Q39 L46	Q39-S41 PolarHBondContact NE2-O 2.93Å; S41-L46 WeakPolarHBondContact CA-O 3.45Å
42	S	94.9	Very high	92.2	Very high	5 Å²	5	56.1 Å²	56.1	4%	0.035	31%	0.31	C	S	.	.			trans	-66.1	172.4	171	64.7	0	0	0	0	112.2	T44 G45 L46 Q99	S42-T44 PolarHBondContact O-N 3.46Å; S42-T44 PolarHBondContact OG-OG1 3.37Å; S42-G45 PolarHBondContact O-N 3.46Å; S42-L46 PolarHBondContact N-O 3.43Å; S42-L46 WeakPolarHBondContact OG-CB 3.34Å; S42-L46 PolarHBondContact OG-N 3.32Å; S42-L46 VanDerWaalsContact OG-N 3.11Å; S42-L46 PolarHBondContact OG-O 3.31Å; S42-Q99 PolarHBondContact OG-OE1 3.47Å
43	S	94.3	Very high	91.9	Very high	65 Å²	65	61.7 Å²	61.7	46%	0.455	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.6	175	48.1	0	0	0	0	114.2	G45 F100	S43-G45 VanDerWaalsContact C-N 3.32Å; S43-F100 WeakPolarHBondContact CB-O 3.41Å; S43-F100 PolarHBondContact N-O 2.69Å; S43-F100 PolarHBondContact OG-O 3.45Å
44	T	93.1	Very high	91.1	Very high	86 Å²	86	57.8 Å²	57.8	53%	0.528	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-0.1	174.7	62.8	0	0	0	0	113.2	S42 L46 Q99	S42-T44 PolarHBondContact O-N 3.46Å; S42-T44 PolarHBondContact OG-OG1 3.37Å; T44-L46 VanDerWaalsContact C-N 3.29Å; T44-Q99 PolarHBondContact OG1-OE1 2.97Å
45	G	92.4	Very high	89.9	Confident	52 Å²	52	60.4 Å²	60.4	54%	0.536	34%	0.339	S	S	.	.	S	Bend	trans	82.9	-0.3	-176.9	0	0	0	0	0	114.3	S42 S43	S42-G45 PolarHBondContact O-N 3.46Å; S43-G45 VanDerWaalsContact C-N 3.32Å
46	L	94.4	Very high	88.6	Confident	68 Å²	68	67.3 Å²	67.3	36%	0.356	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-69.1	138.8	173.8	-66.1	173.9	0	0	0	110.8	S41 S42 T44 I89	S41-L46 WeakPolarHBondContact CA-O 3.45Å; S42-L46 PolarHBondContact N-O 3.43Å; S42-L46 WeakPolarHBondContact OG-CB 3.34Å; S42-L46 PolarHBondContact OG-N 3.32Å; S42-L46 VanDerWaalsContact OG-N 3.11Å; S42-L46 PolarHBondContact OG-O 3.31Å; T44-L46 VanDerWaalsContact C-N 3.29Å; L46-I89 HydrophobicContact CB-CB 4.39Å; L46-I89 HydrophobicContact CB-CG2 4.06Å; L46-I89 HydrophobicContact CD1-CD1 3.58Å
47	T	94.9	Very high	87.2	Confident	97 Å²	97	70.5 Å²	70.5	60%	0.595	39%	0.389	S	S	*	.	B	Isolated β-bridge	trans	-64.9	131.4	178.6	-51.6	0	0	0	0	111
48	C	94.9	Very high	85.9	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.034	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-68.7	141.6	174.6	-64.7	0	0	0	0	111.3	Q40 N74 C87 Y88	Q40-C48 VanDerWaalsContact O-CB 3.24Å; Q40-C48 WeakPolarHBondContact O-CB 3.47Å; Q40-C48 PolarHBondContact O-N 3.43Å; Q40-C48 PolarHBondContact O-SG 3.08Å; C48-N74 HydrophobicContact CB-CB 4.28Å; C48-N74 WeakPolarHBondContact CB-O 3.17Å; C48-N74 WeakPolarHBondContact O-CB 3.31Å; C48-C87 HydrophobicContact CB-CB 3.5Å; C48-C87 WeakPolarHBondContact CB-SG 3.33Å; C48-C87 WeakPolarHBondContact SG-CB 3.31Å; C48-C87 CovalentContact SG-SG 2.03Å; C48-C87 PolarHBondContact SG-SG 3.11Å; C48-Y88 CarbonylContact C-O 3.53Å; C48-Y88 WeakPolarHBondContact CA-O 3.38Å
49	L	93.8	Very high	84.6	Confident	52 Å²	52	67 Å²	67	27%	0.272	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-80.3	158.3	170.8	-59.7	177.2	0	0	0	110.3	T54 Y88 I96	L49-T54 HydrophobicContact CB-CG2 3.81Å; L49-T54 HydrophobicContact CD1-CG2 4.02Å; L49-Y88 PolarHBondContact N-O 2.9Å; L49-I96 HydrophobicContact CD1-CD1 4.15Å; L49-I96 HydrophobicContact CD1-CG1 3.96Å; L49-I96 HydrophobicContact CD1-CG2 3.93Å
50	N	92.4	Very high	83.2	Confident	35 Å²	35	65 Å²	65	19%	0.187	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-71.8	131.1	176.1	-172.4	-32.7	0	0	0	110.4	I52 N53 T54 G71 D72 H73	N50-I52 VanDerWaalsContact C-N 3.3Å; N50-I52 PolarHBondContact O-N 3.4Å; N50-I52 WeakPolarHBondContact OD1-CG1 3.39Å; N50-I52 PolarHBondContact OD1-N 3.06Å; N50-I52 VanDerWaalsContact OD1-N 3.14Å; N50-N53 HydrophobicContact CB-CB 4.33Å; N50-N53 PolarHBondContact O-N 2.76Å; N50-N53 VanDerWaalsContact O-N 3.09Å; N50-T54 PolarHBondContact O-N 3.05Å; N50-T54 PolarHBondContact O-OG1 3.28Å; N50-G71 PolarHBondContact OD1-O 2.95Å; N50-D72 PolarHBondContact ND2-OD1 3.09Å; N50-H73 WeakPolarHBondContact CA-O 3.3Å; N50-H73 PolarHBondContact OD1-N 3.49Å; N50-H73 PolarHBondContact OD1-O 2.89Å
51	W	89.3	Confident	81.6	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.008	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-57.1	-38.6	-176.7	-64.1	98.3	0	0	0	113.5	N53 T54 V60 A70 G71 H73 C75 R77 P79 W86 C87 Y88	W51-N53 VanDerWaalsContact C-N 3.29Å; W51-N53 PolarHBondContact O-N 3.45Å; W51-T54 PolarHBondContact O-N 3.18Å; W51-T54 PolarHBondContact O-OG1 3.49Å; W51-V60 HydrophobicContact CB-CG2 4.04Å; W51-A70 HydrophobicContact CB-CB 4.48Å; W51-A70 HydrophobicContact CD2-CB 3.85Å; W51-A70 HydrophobicContact CE3-CB 4.13Å; W51-A70 HydrophobicContact CG-CB 3.98Å; W51-G71 WeakPolarHBondContact CB-O 3.44Å; W51-H73 AromaticContact CD1-CE1 3.74Å; W51-H73 AromaticContact CD1-ND1 3.59Å; W51-H73 PolarHBondContact N-O 2.91Å; W51-H73 AromaticContact NE1-CE1 3.81Å; W51-H73 AromaticContact NE1-ND1 3.81Å; W51-C75 PolarHBondContact NE1-O 3.16Å; W51-R77 HydrophobicContact CH2-CB 4.33Å; W51-R77 HydrophobicContact CZ2-CB 3.75Å; W51-R77 HydrophobicContact CZ2-CG 4.25Å; W51-P79 HydrophobicContact CZ3-CG 4.45Å; W51-W86 AromaticContact CH2-CD2 3.88Å; W51-W86 HydrophobicContact CH2-CD2 3.88Å; W51-W86 AromaticContact CH2-CE3 3.6Å; W51-W86 HydrophobicContact CH2-CE3 3.6Å; W51-W86 HydrophobicContact CH2-CH2 4.07Å; W51-W86 HydrophobicContact CH2-CZ2 4.28Å; W51-W86 AromaticContact CH2-CZ3 3.71Å; W51-W86 HydrophobicContact CH2-CZ3 3.71Å; W51-W86 VanDerWaalsContact CH2-O 3.27Å; W51-W86 WeakPolarHBondContact CH2-O 3.37Å; W51-W86 WeakPolarHBondContact CZ2-O 3.24Å; W51-W86 HydrophobicContact CZ3-CD2 4.37Å; W51-W86 AromaticContact CZ3-CE3 3.84Å; W51-W86 HydrophobicContact CZ3-CE3 3.84Å; W51-W86 AromaticContact CZ3-CH2 3.56Å; W51-W86 HydrophobicContact CZ3-CH2 3.56Å; W51-W86 HydrophobicContact CZ3-CZ2 4.06Å; W51-W86 AromaticContact CZ3-CZ3 3.42Å; W51-W86 HydrophobicContact CZ3-CZ3 3.42Å; W51-W86 VanDerWaalsContact CZ3-CZ3 3.42Å; W51-C87 HydrophobicContact CZ2-CB 4.34Å; W51-Y88 HydrophobicContact CE3-CD2 4.11Å; W51-Y88 AromaticContact CE3-CE2 3.98Å; W51-Y88 HydrophobicContact CE3-CE2 3.98Å; W51-Y88 HydrophobicContact CZ3-CD2 4.2Å; W51-Y88 AromaticContact CZ3-CE2 4Å; W51-Y88 HydrophobicContact CZ3-CE2 4Å
52	I	85.2	Confident	79.9	Confident	84 Å²	84	74.4 Å²	74.4	43%	0.431	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-73	-23	-179.2	61.3	156.9	0	0	0	112.8	N50 T54 V60 D72	N50-I52 VanDerWaalsContact C-N 3.3Å; N50-I52 PolarHBondContact O-N 3.4Å; N50-I52 WeakPolarHBondContact OD1-CG1 3.39Å; N50-I52 PolarHBondContact OD1-N 3.06Å; N50-I52 VanDerWaalsContact OD1-N 3.14Å; I52-T54 VanDerWaalsContact C-N 3.31Å; I52-V60 HydrophobicContact CG2-CG1 4.14Å; I52-D72 HydrophobicContact CD1-CB 4.04Å; I52-D72 WeakPolarHBondContact CD1-OD1 3.5Å; I52-D72 HydrophobicContact CG1-CB 4.4Å; I52-D72 HydrophobicContact CG2-CB 4.47Å
53	N	83.1	Confident	78.4	Confident	118 Å²	118	77.9 Å²	77.9	63%	0.631	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-88.5	-2.5	-179.5	-70.9	-13.4	0	0	0	112.6	N50 W51	N50-N53 HydrophobicContact CB-CB 4.33Å; N50-N53 PolarHBondContact O-N 2.76Å; N50-N53 VanDerWaalsContact O-N 3.09Å; W51-N53 VanDerWaalsContact C-N 3.29Å; W51-N53 PolarHBondContact O-N 3.45Å
54	T	74.3	Confident	76.9	Confident	7 Å²	7	78.4 Å²	78.4	4%	0.043	42%	0.423	C	S	.	.			trans	-108.5	88.3	-178.6	50.1	0	0	0	0	109.9	L49 N50 W51 I52 R56 Y88 I96	L49-T54 HydrophobicContact CB-CG2 3.81Å; L49-T54 HydrophobicContact CD1-CG2 4.02Å; N50-T54 PolarHBondContact O-N 3.05Å; N50-T54 PolarHBondContact O-OG1 3.28Å; W51-T54 PolarHBondContact O-N 3.18Å; W51-T54 PolarHBondContact O-OG1 3.49Å; I52-T54 VanDerWaalsContact C-N 3.31Å; T54-R56 PolarHBondContact O-N 2.86Å; T54-Y88 HydrophobicContact CG2-CD2 3.89Å; T54-Y88 HydrophobicContact CG2-CG 3.93Å; T54-Y88 WeakPolarHBondContact OG1-CD2 3.27Å; T54-Y88 WeakPolarHBondContact OG1-CE2 3.36Å; T54-I96 HydrophobicContact CG2-CG2 4.34Å
55	T	62.4	Low	75.4	Confident	141 Å²	141	78.2 Å²	78.2	87%	0.865	42%	0.419	S	S	*	.			trans	-72.6	70.6	178.1	-30	0	0	0	0	110.8
56	R	64.3	Low	73.9	Confident	152 Å²	152	81.1 Å²	81.1	57%	0.574	43%	0.431	S	S	*	.	S	Bend	trans	-136.2	-170	-175.3	-70.2	-62.9	-175.2	149.7	0.2	111.8	T54 Y58 Y88	T54-R56 PolarHBondContact O-N 2.86Å; R56-Y58 CarbonylContact O-C 3.39Å; R56-Y58 PolarHBondContact O-N 3.43Å; R56-Y88 HydrophobicContact CB-CE1 3.93Å
57	D	62.4	Low	72.6	Confident	162 Å²	162	84.8 Å²	84.8	87%	0.866	45%	0.446	S	S	*	.	S	Bend	trans	-41.5	-18.5	-169.2	-58.8	-25.7	0	0	0	117.8
58	Y	63.2	Low	71.6	Confident	19 Å²	19	80.9 Å²	80.9	8%	0.075	42%	0.422	C	S	.	.	S	Bend	trans	-116	107	173	-179.4	-99	0	0	0	109.7	R56 V60 H63 T68 A70 P79 Y88	R56-Y58 CarbonylContact O-C 3.39Å; R56-Y58 PolarHBondContact O-N 3.43Å; Y58-V60 HydrophobicContact CD1-CG2 4.14Å; Y58-V60 HydrophobicContact CE1-CG2 4.08Å; Y58-V60 PolarHBondContact O-N 3.29Å; Y58-H63 HydrophobicContact CE2-CB 4.1Å; Y58-H63 AromaticContact CE2-CG 3.91Å; Y58-H63 AromaticContact CE2-ND1 3.76Å; Y58-H63 WeakPolarHBondContact OH-CB 3.2Å; Y58-T68 WeakPolarHBondContact OH-CB 3.46Å; Y58-T68 VanDerWaalsContact OH-CG2 3.25Å; Y58-T68 WeakPolarHBondContact OH-CG2 3.15Å; Y58-T68 PolarHBondContact OH-OG1 3.02Å; Y58-A70 HydrophobicContact CE1-CB 3.96Å; Y58-P79 HydrophobicContact CD1-CB 4.33Å; Y58-P79 HydrophobicContact CD1-CG 3.98Å; Y58-P79 HydrophobicContact CD2-CB 3.9Å; Y58-P79 HydrophobicContact CD2-CG 3.86Å; Y58-P79 HydrophobicContact CE1-CB 3.82Å; Y58-P79 HydrophobicContact CE1-CG 3.94Å; Y58-P79 HydrophobicContact CE2-CB 3.35Å; Y58-P79 HydrophobicContact CE2-CG 3.84Å; Y58-P79 HydrophobicContact CG-CB 4.35Å; Y58-P79 HydrophobicContact CG-CG 3.93Å; Y58-P79 WeakPolarHBondContact OH-CB 3.29Å; Y58-Y88 PolarHBondContact N-OH 3.06Å
59	D	64.9	Low	71	Confident	68 Å²	68	81 Å²	81	36%	0.364	42%	0.424	S	S	.	.			trans	-82.2	110	177.8	-171.3	-0.6	0	0	0	110.1	E61 M62 H63	D59-E61 PolarHBondContact O-N 2.96Å; D59-E61 VanDerWaalsContact OD1-CB 3.32Å; D59-E61 WeakPolarHBondContact OD1-CB 3.33Å; D59-E61 PolarHBondContact OD1-N 3.42Å; D59-M62 HydrophobicContact CB-CB 4.03Å; D59-M62 HydrophobicContact CB-CG 3.91Å; D59-M62 PolarHBondContact O-N 3.49Å; D59-M62 WeakPolarHBondContact OD2-CG 3.46Å; D59-H63 PolarHBondContact O-N 3.23Å; D59-H63 PolarHBondContact O-ND1 3.46Å
60	V	63.8	Low	70.6	Confident	19 Å²	19	78.5 Å²	78.5	12%	0.115	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-27.2	176.1	-175.2	0	0	0	0	110.6	W51 I52 Y58 H63	W51-V60 HydrophobicContact CB-CG2 4.04Å; I52-V60 HydrophobicContact CG2-CG1 4.14Å; Y58-V60 HydrophobicContact CD1-CG2 4.14Å; Y58-V60 HydrophobicContact CE1-CG2 4.08Å; Y58-V60 PolarHBondContact O-N 3.29Å; V60-H63 CarbonylContact O-C 3.4Å; V60-H63 PolarHBondContact O-N 3.45Å; V60-H63 VanDerWaalsContact O-O 3.11Å
61	E	61.7	Low	70.3	Confident	181 Å²	181	76.8 Å²	76.8	85%	0.846	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-33.5	177.2	-60.2	-171.2	161.2	0	0	111.9	D59 H63	D59-E61 PolarHBondContact O-N 2.96Å; D59-E61 VanDerWaalsContact OD1-CB 3.32Å; D59-E61 WeakPolarHBondContact OD1-CB 3.33Å; D59-E61 PolarHBondContact OD1-N 3.42Å; E61-H63 VanDerWaalsContact C-N 3.35Å
62	M	59.5	Low	70.3	Confident	144 Å²	144	82.1 Å²	82.1	71%	0.709	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-23.4	176.6	-72.9	-93.3	-175.1	0	0	113.2	D59	D59-M62 HydrophobicContact CB-CB 4.03Å; D59-M62 HydrophobicContact CB-CG 3.91Å; D59-M62 PolarHBondContact O-N 3.49Å; D59-M62 WeakPolarHBondContact OD2-CG 3.46Å
63	H	62.7	Low	70.5	Confident	79 Å²	79	80.6 Å²	80.6	37%	0.366	42%	0.422	S	S	.	.	S	Bend	trans	-130.3	90.5	-174.3	-63.9	90.7	0	0	0	110.3	Y58 D59 V60 E61	Y58-H63 HydrophobicContact CE2-CB 4.1Å; Y58-H63 AromaticContact CE2-CG 3.91Å; Y58-H63 AromaticContact CE2-ND1 3.76Å; Y58-H63 WeakPolarHBondContact OH-CB 3.2Å; D59-H63 PolarHBondContact O-N 3.23Å; D59-H63 PolarHBondContact O-ND1 3.46Å; V60-H63 CarbonylContact O-C 3.4Å; V60-H63 PolarHBondContact O-N 3.45Å; V60-H63 VanDerWaalsContact O-O 3.11Å; E61-H63 VanDerWaalsContact C-N 3.35Å
64	P	61.5	Low	71	Confident	75 Å²	75	76.8 Å²	76.8	49%	0.487	40%	0.402	S	S	.	.			trans	-58.5	142.4	-174.7	22.7	-32.8	0	0	0	111.8	S66 Q67	P64-S66 PolarHBondContact O-N 3.02Å; P64-Q67 PolarHBondContact O-N 3.48Å
65	D	62.1	Low	72	Confident	82 Å²	82	77 Å²	77	44%	0.439	40%	0.403	S	S	.	.	H	α-helix	trans	-44.2	-28.6	-174.1	-57.5	2.6	0	0	0	114.9	Q67 G69 A70 G71	D65-Q67 VanDerWaalsContact C-N 3.31Å; D65-Q67 PolarHBondContact O-N 3.32Å; D65-G69 WeakPolarHBondContact O-CA 3.43Å; D65-G69 PolarHBondContact O-N 3.49Å; D65-A70 WeakPolarHBondContact CA-O 3.36Å; D65-G71 VanDerWaalsContact CG-CA 3.43Å; D65-G71 WeakPolarHBondContact OD1-CA 3.39Å; D65-G71 WeakPolarHBondContact OD2-CA 3.34Å
66	S	62.3	Low	73.5	Confident	113 Å²	113	70.3 Å²	70.3	79%	0.79	36%	0.362	S	S	*	.	H	α-helix	trans	-65.6	-31.8	-178.6	84.3	0	0	0	0	113.4	P64	P64-S66 PolarHBondContact O-N 3.02Å
67	Q	66.6	Low	74.9	Confident	145 Å²	145	63.8 Å²	63.8	68%	0.678	34%	0.337	S	S	*	.	H	α-helix	trans	-88.3	-40.1	-172.6	-164.2	162.9	29.8	0	0	112.2	P64 D65	P64-Q67 PolarHBondContact O-N 3.48Å; D65-Q67 VanDerWaalsContact C-N 3.31Å; D65-Q67 PolarHBondContact O-N 3.32Å
68	T	74.3	Confident	76.3	Confident	15 Å²	15	56.2 Å²	56.2	9%	0.092	30%	0.297	C	S	.	.	H	α-helix	trans	-109.8	-17	-173.6	39.2	0	0	0	0	113.6	Y58 A70 P79	Y58-T68 WeakPolarHBondContact OH-CB 3.46Å; Y58-T68 VanDerWaalsContact OH-CG2 3.25Å; Y58-T68 WeakPolarHBondContact OH-CG2 3.15Å; Y58-T68 PolarHBondContact OH-OG1 3.02Å; T68-A70 PolarHBondContact O-N 2.95Å; T68-P79 HydrophobicContact CG2-CB 3.62Å
69	G	81.3	Confident	77.5	Confident	7 Å²	7	56.3 Å²	56.3	7%	0.072	30%	0.3	C	S	.	.			trans	71.9	8	-179.7	0	0	0	0	0	114.4	D65 H73 R77	D65-G69 WeakPolarHBondContact O-CA 3.43Å; D65-G69 PolarHBondContact O-N 3.49Å; G69-H73 PolarHBondContact O-CE1 2.98Å; G69-H73 VanDerWaalsContact O-CE1 3.23Å; G69-H73 PolarHBondContact O-NE2 3.21Å; G69-R77 WeakPolarHBondContact O-CD 3.38Å; G69-R77 VanDerWaalsContact O-CG 3.26Å; G69-R77 WeakPolarHBondContact O-CG 3.32Å; G69-R77 PolarHBondContact O-NE 3.24Å
70	A	85.3	Confident	78.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.299	C	S	.	.			trans	-92.4	131.6	169.2	0	0	0	0	0	108.2	W51 Y58 D65 T68 R77	W51-A70 HydrophobicContact CB-CB 4.48Å; W51-A70 HydrophobicContact CD2-CB 3.85Å; W51-A70 HydrophobicContact CE3-CB 4.13Å; W51-A70 HydrophobicContact CG-CB 3.98Å; Y58-A70 HydrophobicContact CE1-CB 3.96Å; D65-A70 WeakPolarHBondContact CA-O 3.36Å; T68-A70 PolarHBondContact O-N 2.95Å; A70-R77 HydrophobicContact CB-CB 4.38Å; A70-R77 HydrophobicContact CB-CG 4.4Å
71	G	86.3	Confident	79.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.312	C	S	.	.	S	Bend	trans	-169.2	-153.4	-172.8	0	0	0	0	0	111.4	N50 W51 D65 H73	N50-G71 PolarHBondContact OD1-O 2.95Å; W51-G71 WeakPolarHBondContact CB-O 3.44Å; D65-G71 VanDerWaalsContact CG-CA 3.43Å; D65-G71 WeakPolarHBondContact OD1-CA 3.39Å; D65-G71 WeakPolarHBondContact OD2-CA 3.34Å; G71-H73 PolarHBondContact O-N 3.49Å
72	D	88.8	Confident	81.1	Confident	114 Å²	114	50.1 Å²	50.1	61%	0.61	28%	0.28	S	S	*	.	S	Bend	trans	-72.4	67.4	179.4	-171.8	18.5	0	0	0	113	N50 I52	N50-D72 PolarHBondContact ND2-OD1 3.09Å; I52-D72 HydrophobicContact CD1-CB 4.04Å; I52-D72 WeakPolarHBondContact CD1-OD1 3.5Å; I52-D72 HydrophobicContact CG1-CB 4.4Å; I52-D72 HydrophobicContact CG2-CB 4.47Å
73	H	90.2	Very high	82.7	Confident	52 Å²	52	51.1 Å²	51.1	24%	0.241	28%	0.283	C	S	.	.	S	Bend	trans	-161.5	173.6	174.7	61.1	63.4	0	0	0	110.2	N50 W51 G69 G71 C75	N50-H73 WeakPolarHBondContact CA-O 3.3Å; N50-H73 PolarHBondContact OD1-N 3.49Å; N50-H73 PolarHBondContact OD1-O 2.89Å; W51-H73 AromaticContact CD1-CE1 3.74Å; W51-H73 AromaticContact CD1-ND1 3.59Å; W51-H73 PolarHBondContact N-O 2.91Å; W51-H73 AromaticContact NE1-CE1 3.81Å; W51-H73 AromaticContact NE1-ND1 3.81Å; G69-H73 PolarHBondContact O-CE1 2.98Å; G69-H73 VanDerWaalsContact O-CE1 3.23Å; G69-H73 PolarHBondContact O-NE2 3.21Å; G71-H73 PolarHBondContact O-N 3.49Å; H73-C75 PolarHBondContact ND1-N 2.87Å
74	N	93.9	Very high	84.1	Confident	38 Å²	38	48 Å²	48	20%	0.203	27%	0.272	C	S	.	.			trans	-110.7	12	178.1	64.2	-28.4	0	0	0	113.9	Q40 C48	Q40-N74 WeakPolarHBondContact CG-OD1 3.33Å; Q40-N74 PolarHBondContact NE2-OD1 3.32Å; Q40-N74 VanDerWaalsContact NE2-OD1 3.13Å; C48-N74 HydrophobicContact CB-CB 4.28Å; C48-N74 WeakPolarHBondContact CB-O 3.17Å; C48-N74 WeakPolarHBondContact O-CB 3.31Å
75	C	94	Very high	85.7	Confident	11 Å²	11	44.7 Å²	44.7	7%	0.074	25%	0.251	C	S	.	.			trans	-71.5	144.6	179.7	-54	0	0	0	0	112.4	Q39 W51 H73	Q39-C75 CarbonylContact O-C 3.51Å; Q39-C75 VanDerWaalsContact O-CA 3.3Å; Q39-C75 WeakPolarHBondContact O-CA 3.41Å; W51-C75 PolarHBondContact NE1-O 3.16Å; H73-C75 PolarHBondContact ND1-N 2.87Å
76	C	93.7	Very high	87.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.23	C	C	.	.			trans	-62.5	136.4	178.4	-59.6	0	0	0	0	112.5	Y35 Q39 P85 W86 C101 I103	Y35-C76 VanDerWaalsContact CD1-O 3.3Å; Y35-C76 WeakPolarHBondContact CD1-O 3.33Å; Y35-C76 HydrophobicContact CE1-CB 4.39Å; Q39-C76 HydrophobicContact CB-CB 4.49Å; Q39-C76 PolarHBondContact O-N 3.45Å; Q39-C76 PolarHBondContact O-SG 2.79Å; C76-P85 HydrophobicContact CB-CB 4.1Å; C76-W86 WeakPolarHBondContact CA-O 3.05Å; C76-C101 HydrophobicContact CB-CB 3.65Å; C76-C101 WeakPolarHBondContact CB-SG 3.21Å; C76-C101 WeakPolarHBondContact SG-CB 3.4Å; C76-C101 CovalentContact SG-SG 2.01Å; C76-C101 PolarHBondContact SG-SG 2.03Å; C76-I103 HydrophobicContact CB-CD1 4.08Å
77	R	93.7	Very high	88.8	Confident	16 Å²	16	35.5 Å²	35.5	6%	0.06	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-144	164.1	-179.1	-63.4	-65.5	178.1	-105.9	3.7	110.6	Y35 G37 W51 G69 A70 P79 P85 W86	Y35-R77 WeakPolarHBondContact O-CD 3.23Å; G37-R77 PolarHBondContact O-NH1 2.8Å; G37-R77 PolarHBondContact O-NH2 3.34Å; W51-R77 HydrophobicContact CH2-CB 4.33Å; W51-R77 HydrophobicContact CZ2-CB 3.75Å; W51-R77 HydrophobicContact CZ2-CG 4.25Å; G69-R77 WeakPolarHBondContact O-CD 3.38Å; G69-R77 VanDerWaalsContact O-CG 3.26Å; G69-R77 WeakPolarHBondContact O-CG 3.32Å; G69-R77 PolarHBondContact O-NE 3.24Å; A70-R77 HydrophobicContact CB-CB 4.38Å; A70-R77 HydrophobicContact CB-CG 4.4Å; R77-P79 VanDerWaalsContact C-CD 3.48Å; R77-P85 WeakPolarHBondContact O-CA 3.5Å; R77-W86 PolarHBondContact N-O 2.94Å; R77-W86 PolarHBondContact O-N 2.81Å; R77-W86 VanDerWaalsContact O-O 3.07Å
78	N	93.2	Very high	90.1	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	16%	0.162	C	C	.	.			trans	-126.2	72.5	175.1	-171.1	9.2	0	0	0	110.6	R31 L33 D80 A81 S82	R31-N78 PolarHBondContact O-ND2 2.92Å; L33-N78 VanDerWaalsContact CD2-O 3.3Å; L33-N78 WeakPolarHBondContact CD2-O 3.46Å; N78-D80 VanDerWaalsContact C-N 3.34Å; N78-D80 PolarHBondContact OD1-OD1 3.39Å; N78-A81 PolarHBondContact OD1-N 2.89Å; N78-S82 PolarHBondContact ND2-O 2.91Å; N78-S82 WeakPolarHBondContact OD1-CB 3.27Å; N78-S82 PolarHBondContact OD1-N 3.29Å
79	P	88.7	Confident	91	Very high	21 Å²	21	28.5 Å²	28.5	14%	0.136	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-26.1	-176.8	31	-37.6	0	0	0	113.7	W51 Y58 T68 R77 W86	W51-P79 HydrophobicContact CZ3-CG 4.45Å; Y58-P79 HydrophobicContact CD1-CB 4.33Å; Y58-P79 HydrophobicContact CD1-CG 3.98Å; Y58-P79 HydrophobicContact CD2-CB 3.9Å; Y58-P79 HydrophobicContact CD2-CG 3.86Å; Y58-P79 HydrophobicContact CE1-CB 3.82Å; Y58-P79 HydrophobicContact CE1-CG 3.94Å; Y58-P79 HydrophobicContact CE2-CB 3.35Å; Y58-P79 HydrophobicContact CE2-CG 3.84Å; Y58-P79 HydrophobicContact CG-CB 4.35Å; Y58-P79 HydrophobicContact CG-CG 3.93Å; Y58-P79 WeakPolarHBondContact OH-CB 3.29Å; T68-P79 HydrophobicContact CG2-CB 3.62Å; R77-P79 VanDerWaalsContact C-CD 3.48Å; P79-W86 HydrophobicContact CG-CZ2 3.87Å
80	D	86.5	Confident	91.6	Very high	66 Å²	66	30.7 Å²	30.7	35%	0.353	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	12	-172.6	68.3	-29.1	0	0	0	113.3	N78 S82 W86 R98	N78-D80 VanDerWaalsContact C-N 3.34Å; N78-D80 PolarHBondContact OD1-OD1 3.39Å; D80-S82 PolarHBondContact O-N 3.25Å; D80-S82 VanDerWaalsContact O-N 3.14Å; D80-S82 WeakPolarHBondContact OD1-CB 3.39Å; D80-S82 PolarHBondContact OD1-OG 2.93Å; D80-S82 PolarHBondContact OD2-OG 2.97Å; D80-W86 PolarHBondContact OD1-NE1 3.26Å; D80-R98 IonicContact OD1-NH2 3.56Å; D80-R98 IonicContact OD2-CZ 3.26Å; D80-R98 VanDerWaalsContact OD2-CZ 3.26Å; D80-R98 IonicContact OD2-NH1 2.79Å; D80-R98 PolarHBondContact OD2-NH1 2.88Å; D80-R98 IonicContact OD2-NH2 3.18Å; D80-R98 PolarHBondContact OD2-NH2 3.37Å
81	A	88.4	Confident	91.8	Very high	45 Å²	45	31.2 Å²	31.2	37%	0.372	18%	0.18	S	C	.	.			trans	54.9	29.5	-178.3	0	0	0	0	0	115.3	R31 L33 N78	R31-A81 PolarHBondContact NH1-O 3.18Å; L33-A81 HydrophobicContact CD2-CB 3.79Å; N78-A81 PolarHBondContact OD1-N 2.89Å
82	S	90.9	Very high	91.9	Very high	27 Å²	27	37.7 Å²	37.7	19%	0.189	22%	0.222	C	C	.	.			trans	-62.7	178.5	171.6	-82.6	0	0	0	0	112.9	R31 N78 D80 G84 R98	R31-S82 WeakPolarHBondContact CB-O 3.04Å; R31-S82 WeakPolarHBondContact CD-O 3.39Å; N78-S82 PolarHBondContact ND2-O 2.91Å; N78-S82 WeakPolarHBondContact OD1-CB 3.27Å; N78-S82 PolarHBondContact OD1-N 3.29Å; D80-S82 PolarHBondContact O-N 3.25Å; D80-S82 VanDerWaalsContact O-N 3.14Å; D80-S82 WeakPolarHBondContact OD1-CB 3.39Å; D80-S82 PolarHBondContact OD1-OG 2.93Å; D80-S82 PolarHBondContact OD2-OG 2.97Å; S82-G84 PolarHBondContact O-N 2.64Å; S82-R98 PolarHBondContact OG-NH2 2.89Å
83	E	92.4	Very high	91.9	Very high	164 Å²	164	37.4 Å²	37.4	77%	0.766	22%	0.221	S	C	*	.	S	Bend	trans	-61.4	-26.1	-175.1	-61.4	-175.2	167.7	0	0	114
84	G	93.2	Very high	91.8	Very high	13 Å²	13	38 Å²	38	13%	0.134	24%	0.242	C	C	.	.	S	Bend	trans	-165.5	175.4	177.1	0	0	0	0	0	112.8	R31 S82	R31-G84 WeakPolarHBondContact O-CA 3.37Å; S82-G84 PolarHBondContact O-N 2.64Å
85	P	94.8	Very high	91.5	Very high	6 Å²	6	39.1 Å²	39.1	4%	0.039	25%	0.25	C	C	.	.			trans	-61.8	142.7	174.5	-20.4	32.8	0	0	0	112.3	V28 Y35 C76 R77 C101 I103	V28-P85 HydrophobicContact CG1-CG 4.43Å; V28-P85 HydrophobicContact CG2-CG 3.63Å; Y35-P85 HydrophobicContact CD1-CB 4.26Å; Y35-P85 HydrophobicContact CD1-CG 4.14Å; Y35-P85 HydrophobicContact CG-CG 4.19Å; C76-P85 HydrophobicContact CB-CB 4.1Å; R77-P85 WeakPolarHBondContact O-CA 3.5Å; P85-C101 PolarHBondContact O-N 2.78Å; P85-I103 HydrophobicContact CB-CD1 3.87Å; P85-I103 HydrophobicContact CG-CD1 3.99Å
86	W	94.3	Very high	91.4	Very high	3 Å²	3	41.9 Å²	41.9	1%	0.011	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	172	-178	58.6	-87.8	0	0	0	110	W51 C76 R77 P79 D80 Y88 R98 Q99 F100	W51-W86 AromaticContact CH2-CD2 3.88Å; W51-W86 HydrophobicContact CH2-CD2 3.88Å; W51-W86 AromaticContact CH2-CE3 3.6Å; W51-W86 HydrophobicContact CH2-CE3 3.6Å; W51-W86 HydrophobicContact CH2-CH2 4.07Å; W51-W86 HydrophobicContact CH2-CZ2 4.28Å; W51-W86 AromaticContact CH2-CZ3 3.71Å; W51-W86 HydrophobicContact CH2-CZ3 3.71Å; W51-W86 VanDerWaalsContact CH2-O 3.27Å; W51-W86 WeakPolarHBondContact CH2-O 3.37Å; W51-W86 WeakPolarHBondContact CZ2-O 3.24Å; W51-W86 HydrophobicContact CZ3-CD2 4.37Å; W51-W86 AromaticContact CZ3-CE3 3.84Å; W51-W86 HydrophobicContact CZ3-CE3 3.84Å; W51-W86 AromaticContact CZ3-CH2 3.56Å; W51-W86 HydrophobicContact CZ3-CH2 3.56Å; W51-W86 HydrophobicContact CZ3-CZ2 4.06Å; W51-W86 AromaticContact CZ3-CZ3 3.42Å; W51-W86 HydrophobicContact CZ3-CZ3 3.42Å; W51-W86 VanDerWaalsContact CZ3-CZ3 3.42Å; C76-W86 WeakPolarHBondContact CA-O 3.05Å; R77-W86 PolarHBondContact N-O 2.94Å; R77-W86 PolarHBondContact O-N 2.81Å; R77-W86 VanDerWaalsContact O-O 3.07Å; P79-W86 HydrophobicContact CG-CZ2 3.87Å; D80-W86 PolarHBondContact OD1-NE1 3.26Å; W86-Y88 HydrophobicContact CH2-CE1 4.46Å; W86-Y88 HydrophobicContact CH2-CE2 4.02Å; W86-Y88 AromaticContact CH2-CZ 3.83Å; W86-Y88 HydrophobicContact CZ3-CD1 4.29Å; W86-Y88 HydrophobicContact CZ3-CD2 4.03Å; W86-Y88 AromaticContact CZ3-CE1 3.91Å; W86-Y88 HydrophobicContact CZ3-CE1 3.91Å; W86-Y88 AromaticContact CZ3-CE2 3.65Å; W86-Y88 HydrophobicContact CZ3-CE2 3.65Å; W86-Y88 HydrophobicContact CZ3-CG 4.35Å; W86-Y88 AromaticContact CZ3-CZ 3.59Å; W86-R98 HydrophobicContact CB-CG 4.42Å; W86-R98 HydrophobicContact CD2-CG 3.85Å; W86-R98 VanDerWaalsContact CE2-CZ 3.48Å; W86-R98 HydrophobicContact CE3-CB 4.24Å; W86-R98 VanDerWaalsContact CE3-CD 3.46Å; W86-R98 HydrophobicContact CE3-CG 3.4Å; W86-R98 HydrophobicContact CG-CG 4.31Å; W86-R98 VanDerWaalsContact CG-NE 3.27Å; W86-R98 HydrophobicContact CZ3-CB 4.26Å; W86-R98 HydrophobicContact CZ3-CG 3.79Å; W86-Q99 VanDerWaalsContact CA-O 3.29Å; W86-Q99 WeakPolarHBondContact CA-O 3.16Å; W86-Q99 VanDerWaalsContact CB-O 3.3Å; W86-Q99 WeakPolarHBondContact CB-O 3.27Å; W86-F100 HydrophobicContact CB-CD1 3.94Å; W86-F100 HydrophobicContact CB-CE1 4.39Å
87	C	94.4	Very high	91.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	170.5	171	70.6	0	0	0	0	110.1	C48 W51 Q99	C48-C87 HydrophobicContact CB-CB 3.5Å; C48-C87 WeakPolarHBondContact CB-SG 3.33Å; C48-C87 WeakPolarHBondContact SG-CB 3.31Å; C48-C87 CovalentContact SG-SG 2.03Å; C48-C87 PolarHBondContact SG-SG 3.11Å; W51-C87 HydrophobicContact CZ2-CB 4.34Å; C87-Q99 PolarHBondContact N-O 3.4Å; C87-Q99 PolarHBondContact O-N 2.81Å
88	Y	93.8	Very high	91.1	Very high	6 Å²	6	50.2 Å²	50.2	2%	0.024	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	142.4	169.2	-67.9	-72.4	0	0	0	110.4	C48 L49 W51 T54 R56 Y58 W86 I96 Q97 R98	C48-Y88 CarbonylContact C-O 3.53Å; C48-Y88 WeakPolarHBondContact CA-O 3.38Å; L49-Y88 PolarHBondContact N-O 2.9Å; W51-Y88 HydrophobicContact CE3-CD2 4.11Å; W51-Y88 AromaticContact CE3-CE2 3.98Å; W51-Y88 HydrophobicContact CE3-CE2 3.98Å; W51-Y88 HydrophobicContact CZ3-CD2 4.2Å; W51-Y88 AromaticContact CZ3-CE2 4Å; W51-Y88 HydrophobicContact CZ3-CE2 4Å; T54-Y88 HydrophobicContact CG2-CD2 3.89Å; T54-Y88 HydrophobicContact CG2-CG 3.93Å; T54-Y88 WeakPolarHBondContact OG1-CD2 3.27Å; T54-Y88 WeakPolarHBondContact OG1-CE2 3.36Å; R56-Y88 HydrophobicContact CB-CE1 3.93Å; Y58-Y88 PolarHBondContact N-OH 3.06Å; W86-Y88 HydrophobicContact CH2-CE1 4.46Å; W86-Y88 HydrophobicContact CH2-CE2 4.02Å; W86-Y88 AromaticContact CH2-CZ 3.83Å; W86-Y88 HydrophobicContact CZ3-CD1 4.29Å; W86-Y88 HydrophobicContact CZ3-CD2 4.03Å; W86-Y88 AromaticContact CZ3-CE1 3.91Å; W86-Y88 HydrophobicContact CZ3-CE1 3.91Å; W86-Y88 AromaticContact CZ3-CE2 3.65Å; W86-Y88 HydrophobicContact CZ3-CE2 3.65Å; W86-Y88 HydrophobicContact CZ3-CG 4.35Å; W86-Y88 AromaticContact CZ3-CZ 3.59Å; Y88-I96 HydrophobicContact CD1-CG2 3.96Å; Y88-I96 HydrophobicContact CG-CG2 4.27Å; Y88-Q97 CarbonylContact C-O 3.55Å; Y88-Q97 WeakPolarHBondContact CA-O 2.98Å; Y88-R98 HydrophobicContact CD1-CB 4.3Å; Y88-R98 HydrophobicContact CE1-CB 4.26Å
89	I	94.2	Very high	91.2	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	154.6	175.9	56.4	147.4	0	0	0	109.9	L46 I96 Q97 Q99	L46-I89 HydrophobicContact CB-CB 4.39Å; L46-I89 HydrophobicContact CB-CG2 4.06Å; L46-I89 HydrophobicContact CD1-CD1 3.58Å; I89-I96 WeakPolarHBondContact O-CA 3.06Å; I89-Q97 HydrophobicContact CG1-CB 4.4Å; I89-Q97 VanDerWaalsContact CG1-O 3.27Å; I89-Q97 WeakPolarHBondContact CG1-O 3.48Å; I89-Q97 PolarHBondContact N-O 2.84Å; I89-Q97 PolarHBondContact O-N 3.46Å; I89-Q99 HydrophobicContact CD1-CB 4.23Å; I89-Q99 HydrophobicContact CG1-CB 4.1Å; I89-Q99 HydrophobicContact CG2-CB 4.48Å
90	A	93.2	Very high	91.6	Very high	54 Å²	54	55.6 Å²	55.6	45%	0.446	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	110.7	164.1	0	0	0	0	0	108.5
91	A	88.8	Confident	92	Very high	10 Å²	10	53 Å²	53	8%	0.083	31%	0.308	C	S	.	.			trans	-69.3	159.3	175	0	0	0	0	0	110.8	D93 G94 T95 Q97	A91-D93 WeakPolarHBondContact CB-OD1 3.19Å; A91-D93 PolarHBondContact O-N 2.93Å; A91-D93 VanDerWaalsContact O-N 3.09Å; A91-G94 PolarHBondContact O-N 3.14Å; A91-T95 WeakPolarHBondContact CB-O 3.29Å; A91-T95 PolarHBondContact N-O 3.2Å; A91-Q97 HydrophobicContact CB-CG 4.22Å
92	P	88.9	Confident	92.2	Very high	136 Å²	136	54.1 Å²	54.1	88%	0.883	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.2	-177.8	-24.9	34.7	0	0	0	114.6	G94	P92-G94 PolarHBondContact O-N 3.45Å
93	D	89.4	Confident	92.3	Very high	109 Å²	109	54.1 Å²	54.1	58%	0.583	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	2.8	175.4	64.2	-1.4	0	0	0	113.4	A91 T95	A91-D93 WeakPolarHBondContact CB-OD1 3.19Å; A91-D93 PolarHBondContact O-N 2.93Å; A91-D93 VanDerWaalsContact O-N 3.09Å; D93-T95 VanDerWaalsContact C-N 3.28Å; D93-T95 VanDerWaalsContact CG-OG1 3.28Å; D93-T95 PolarHBondContact O-N 3Å; D93-T95 WeakPolarHBondContact OD1-CB 3.3Å; D93-T95 PolarHBondContact OD1-N 2.89Å; D93-T95 PolarHBondContact OD1-OG1 3.42Å; D93-T95 PolarHBondContact OD2-OG1 2.91Å
94	G	86.7	Confident	92.2	Very high	65 Å²	65	53.6 Å²	53.6	67%	0.67	31%	0.312	S	S	*	.	S	Bend	trans	81.2	2.5	-178.2	0	0	0	0	0	114.2	A91 P92	A91-G94 PolarHBondContact O-N 3.14Å; P92-G94 PolarHBondContact O-N 3.45Å
95	T	89.4	Confident	92.1	Very high	61 Å²	61	57.9 Å²	57.9	37%	0.374	34%	0.335	S	S	.	.			trans	-81.1	144.3	176.5	65.8	0	0	0	0	111.1	A91 D93 Q97	A91-T95 WeakPolarHBondContact CB-O 3.29Å; A91-T95 PolarHBondContact N-O 3.2Å; D93-T95 VanDerWaalsContact C-N 3.28Å; D93-T95 VanDerWaalsContact CG-OG1 3.28Å; D93-T95 PolarHBondContact O-N 3Å; D93-T95 WeakPolarHBondContact OD1-CB 3.3Å; D93-T95 PolarHBondContact OD1-N 2.89Å; D93-T95 PolarHBondContact OD1-OG1 3.42Å; D93-T95 PolarHBondContact OD2-OG1 2.91Å; T95-Q97 PolarHBondContact OG1-NE2 3.38Å
96	I	90.2	Very high	91.8	Very high	69 Å²	69	59 Å²	59	35%	0.354	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	122.7	172.2	-62.6	174	0	0	0	107.8	L49 T54 Y88 I89	L49-I96 HydrophobicContact CD1-CD1 4.15Å; L49-I96 HydrophobicContact CD1-CG1 3.96Å; L49-I96 HydrophobicContact CD1-CG2 3.93Å; T54-I96 HydrophobicContact CG2-CG2 4.34Å; Y88-I96 HydrophobicContact CD1-CG2 3.96Å; Y88-I96 HydrophobicContact CG-CG2 4.27Å; I89-I96 WeakPolarHBondContact O-CA 3.06Å
97	Q	91.1	Very high	91.3	Very high	95 Å²	95	68.1 Å²	68.1	44%	0.444	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149.7	-179.5	-59.7	-173.7	14.9	0	0	110.5	Y88 I89 A91 T95	Y88-Q97 CarbonylContact C-O 3.55Å; Y88-Q97 WeakPolarHBondContact CA-O 2.98Å; I89-Q97 HydrophobicContact CG1-CB 4.4Å; I89-Q97 VanDerWaalsContact CG1-O 3.27Å; I89-Q97 WeakPolarHBondContact CG1-O 3.48Å; I89-Q97 PolarHBondContact N-O 2.84Å; I89-Q97 PolarHBondContact O-N 3.46Å; A91-Q97 HydrophobicContact CB-CG 4.22Å; T95-Q97 PolarHBondContact OG1-NE2 3.38Å
98	R	91.6	Very high	90.5	Very high	96 Å²	96	75.4 Å²	75.4	36%	0.362	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	133.3	172.1	166	173	176.2	-155.5	-0.6	109.6	D80 S82 W86 Y88	D80-R98 IonicContact OD1-NH2 3.56Å; D80-R98 IonicContact OD2-CZ 3.26Å; D80-R98 VanDerWaalsContact OD2-CZ 3.26Å; D80-R98 IonicContact OD2-NH1 2.79Å; D80-R98 PolarHBondContact OD2-NH1 2.88Å; D80-R98 IonicContact OD2-NH2 3.18Å; D80-R98 PolarHBondContact OD2-NH2 3.37Å; S82-R98 PolarHBondContact OG-NH2 2.89Å; W86-R98 HydrophobicContact CB-CG 4.42Å; W86-R98 HydrophobicContact CD2-CG 3.85Å; W86-R98 VanDerWaalsContact CE2-CZ 3.48Å; W86-R98 HydrophobicContact CE3-CB 4.24Å; W86-R98 VanDerWaalsContact CE3-CD 3.46Å; W86-R98 HydrophobicContact CE3-CG 3.4Å; W86-R98 HydrophobicContact CG-CG 4.31Å; W86-R98 VanDerWaalsContact CG-NE 3.27Å; W86-R98 HydrophobicContact CZ3-CB 4.26Å; W86-R98 HydrophobicContact CZ3-CG 3.79Å; Y88-R98 HydrophobicContact CD1-CB 4.3Å; Y88-R98 HydrophobicContact CE1-CB 4.26Å
99	Q	94.9	Very high	88.7	Confident	47 Å²	47	83.9 Å²	83.9	22%	0.22	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	141.3	176.6	-169.2	166.6	64.3	0	0	112.1	S42 T44 W86 C87 I89	S42-Q99 PolarHBondContact OG-OE1 3.47Å; T44-Q99 PolarHBondContact OG1-OE1 2.97Å; W86-Q99 VanDerWaalsContact CA-O 3.29Å; W86-Q99 WeakPolarHBondContact CA-O 3.16Å; W86-Q99 VanDerWaalsContact CB-O 3.3Å; W86-Q99 WeakPolarHBondContact CB-O 3.27Å; C87-Q99 PolarHBondContact N-O 3.4Å; C87-Q99 PolarHBondContact O-N 2.81Å; I89-Q99 HydrophobicContact CD1-CB 4.23Å; I89-Q99 HydrophobicContact CG1-CB 4.1Å; I89-Q99 HydrophobicContact CG2-CB 4.48Å
100	F	95.6	Very high	86.4	Confident	89 Å²	89	89 Å²	89	39%	0.39	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	148.3	175.1	-68.5	-68.1	0	0	0	111.8	S43 W86	S43-F100 WeakPolarHBondContact CB-O 3.41Å; S43-F100 PolarHBondContact N-O 2.69Å; S43-F100 PolarHBondContact OG-O 3.45Å; W86-F100 HydrophobicContact CB-CD1 3.94Å; W86-F100 HydrophobicContact CB-CE1 4.39Å
101	C	95.3	Very high	84.2	Confident	13 Å²	13	92.4 Å²	92.4	9%	0.088	50%	0.504	C	S	.	.			trans	-95.2	138.9	174.6	-58	0	0	0	0	110.7	Q39 C76 P85 I103	Q39-C101 HydrophobicContact CG-CB 4.28Å; C76-C101 HydrophobicContact CB-CB 3.65Å; C76-C101 WeakPolarHBondContact CB-SG 3.21Å; C76-C101 WeakPolarHBondContact SG-CB 3.4Å; C76-C101 CovalentContact SG-SG 2.01Å; C76-C101 PolarHBondContact SG-SG 2.03Å; P85-C101 PolarHBondContact O-N 2.78Å; C101-I103 HydrophobicContact CB-CD1 3.9Å; C101-I103 HydrophobicContact CB-CG1 4.12Å; C101-I103 PolarHBondContact O-N 2.75Å
102	A	93.3	Very high	82.1	Confident	68 Å²	68	95.8 Å²	95.8	56%	0.562	53%	0.532	S	S	*	.			trans	-84.4	93.9	174.3	0	0	0	0	0	109.2
103	I	92.6	Very high	80.2	Confident	27 Å²	27	93.1 Å²	93.1	14%	0.138	52%	0.521	C	S	.	.			trans	-121.4	134.9	177.3	-53.9	153.5	0	0	0	108.2	V28 Y35 Q39 C76 P85 C101	V28-I103 HydrophobicContact CG2-CB 3.7Å; V28-I103 HydrophobicContact CG2-CD1 4Å; V28-I103 HydrophobicContact CG2-CG1 4.49Å; V28-I103 HydrophobicContact CG2-CG2 3.65Å; Y35-I103 HydrophobicContact CD1-CD1 4Å; Y35-I103 HydrophobicContact CE1-CD1 3.47Å; Y35-I103 VanDerWaalsContact CE1-CD1 3.47Å; Y35-I103 HydrophobicContact CE2-CD1 4.17Å; Y35-I103 HydrophobicContact CE2-CG2 3.82Å; Q39-I103 HydrophobicContact CB-CD1 4.06Å; Q39-I103 HydrophobicContact CB-CG1 3.88Å; Q39-I103 HydrophobicContact CG-CD1 4.14Å; Q39-I103 HydrophobicContact CG-CG1 3.68Å; C76-I103 HydrophobicContact CB-CD1 4.08Å; P85-I103 HydrophobicContact CB-CD1 3.87Å; P85-I103 HydrophobicContact CG-CD1 3.99Å; C101-I103 HydrophobicContact CB-CD1 3.9Å; C101-I103 HydrophobicContact CB-CG1 4.12Å; C101-I103 PolarHBondContact O-N 2.75Å
104	E	91	Very high	77.9	Confident	153 Å²	153	93.8 Å²	93.8	72%	0.715	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-63.6	141.9	-178.8	-62.8	-167.9	171	0	0	111.7	C27 V28	C27-E104 CarbonylContact C-O 3.43Å; C27-E104 WeakPolarHBondContact CA-O 3.39Å; C27-E104 WeakPolarHBondContact CB-O 2.97Å; V28-E104 PolarHBondContact N-O 3.21Å
105	T	89.9	Confident	75.8	Confident	102 Å²	102	95 Å²	95	63%	0.626	54%	0.536	S	S	*	.	B	Isolated β-bridge	trans	-74.8	138	172.3	-47.4	0	0	0	0	110	V28 K107	V28-T105 CarbonylContact O-C 3.58Å; V28-T105 VanDerWaalsContact O-CA 3.31Å; V28-T105 WeakPolarHBondContact O-CA 2.99Å; V28-T105 WeakPolarHBondContact O-CG2 3.3Å; T105-K107 PolarHBondContact O-N 2.94Å
106	C	89.5	Confident	73.5	Confident	30 Å²	30	101 Å²	101	20%	0.203	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-60.8	123.4	176.8	-60	0	0	0	0	110.2	C27 V28 E108	C27-C106 HydrophobicContact CB-CB 3.88Å; C27-C106 WeakPolarHBondContact CB-SG 3.42Å; C27-C106 PolarHBondContact O-SG 2.95Å; C27-C106 VanDerWaalsContact O-SG 3.32Å; C27-C106 WeakPolarHBondContact SG-CA 3.38Å; C27-C106 WeakPolarHBondContact SG-CB 3.22Å; C27-C106 CovalentContact SG-SG 2.03Å; C27-C106 PolarHBondContact SG-SG 2.86Å; V28-C106 PolarHBondContact O-N 3.24Å; C106-E108 PolarHBondContact O-N 2.89Å; C106-E108 VanDerWaalsContact O-N 3.13Å
107	K	83.9	Confident	71.1	Confident	194 Å²	194	103.8 Å²	103.8	84%	0.843	58%	0.579	S	S	*	*			trans	-70	107.7	167	-66.9	176.2	-179	170.4	0	107.4	T105 Q109	T105-K107 PolarHBondContact O-N 2.94Å; K107-Q109 PolarHBondContact O-N 2.88Å
108	E	76.2	Confident	68.6	Low	154 Å²	154	103.1 Å²	103.1	72%	0.72	60%	0.597	S	S	*	*			trans	-60.8	113.6	168.5	-71.4	-175.2	171.1	0	0	107.5	C106 T110	C106-E108 PolarHBondContact O-N 2.89Å; C106-E108 VanDerWaalsContact O-N 3.13Å; E108-T110 PolarHBondContact O-N 2.66Å
109	Q	56.3	Low	65.8	Low	183 Å²	183	103.4 Å²	103.4	86%	0.855	62%	0.615	S	S	*	*			trans	-69	91	165.5	-69.1	-177	32.1	0	0	106	K107 T111	K107-Q109 PolarHBondContact O-N 2.88Å; Q109-T111 PolarHBondContact O-N 3.4Å
110	T	47.2	Very low	62.9	Low	114 Å²	114	109.3 Å²	109.3	70%	0.699	65%	0.647	S	S	*	*			trans	-61	86.1	166.2	-50.3	0	0	0	0	107.1	E108 A112	E108-T110 PolarHBondContact O-N 2.66Å; T110-A112 HydrophobicContact CG2-CB 4.17Å; T110-A112 PolarHBondContact O-N 3.47Å
111	T	45.5	Very low	59.9	Low	126 Å²	126	116.3 Å²	116.3	77%	0.773	67%	0.671	S	S	*	*			trans	-66.2	92.6	151.1	-59.6	0	0	0	0	103.8	Q109 A113	Q109-T111 PolarHBondContact O-N 3.4Å; T111-A113 PolarHBondContact O-N 3.19Å
112	A	46.4	Very low	57.3	Low	80 Å²	80	121.5 Å²	121.5	66%	0.661	70%	0.704	S	S	*	*			trans	-63.3	85.2	174.6	0	0	0	0	0	108.3	T110	T110-A112 HydrophobicContact CG2-CB 4.17Å; T110-A112 PolarHBondContact O-N 3.47Å
113	A	47.7	Very low	54.2	Low	80 Å²	80	124.1 Å²	124.1	66%	0.661	71%	0.713	S	S	*	*			trans	-75.4	120.8	144.6	0	0	0	0	0	105.5	T111 A115	T111-A113 PolarHBondContact O-N 3.19Å; A113-A115 PolarHBondContact O-N 2.89Å
114	P	41	Very low	51.4	Low	123 Å²	123	130.7 Å²	130.7	80%	0.799	74%	0.743	S	S	*	*			trans	-63.8	105.1	173.5	24.1	-29.2	0	0	0	108.1	E116	P114-E116 PolarHBondContact O-N 3.32Å
115	A	44.2	Very low	48.6	Very low	92 Å²	92	130.2 Å²	130.2	76%	0.76	74%	0.744	S	S	*	*			trans	-75.7	105.2	166.9	0	0	0	0	0	107.5	A113 V117	A113-A115 PolarHBondContact O-N 2.89Å; A115-V117 PolarHBondContact O-N 3.44Å
116	E	39.8	Very low	45.9	Very low	185 Å²	185	132.5 Å²	132.5	86%	0.864	75%	0.751	S	S	*	*			trans	-40.5	121.5	162.6	-75.1	-78	142	0	0	110.8	P114 G118	P114-E116 PolarHBondContact O-N 3.32Å; E116-G118 PolarHBondContact O-N 2.91Å
117	V	39.6	Very low	42.9	Very low	129 Å²	129	136.4 Å²	136.4	78%	0.782	78%	0.778	S	S	*	*			trans	-70.8	95.3	173.2	174.9	0	0	0	0	107.9	A115 S119	A115-V117 PolarHBondContact O-N 3.44Å; V117-S119 VanDerWaalsContact C-N 3.28Å; V117-S119 PolarHBondContact O-N 2.95Å
118	G	39.4	Very low	40.3	Very low	80 Å²	80	131.7 Å²	131.7	83%	0.825	77%	0.77	S	S	*	*			trans	-69.9	83.7	164.8	0	0	0	0	0	110.3	E116	E116-G118 PolarHBondContact O-N 2.91Å
119	S	33.2	Very low	38	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	78%	0.779	S	S	*	*			trans	-90.6	99.2	168.9	-164.4	0	0	0	0	109.4	V117	V117-S119 VanDerWaalsContact C-N 3.28Å; V117-S119 PolarHBondContact O-N 2.95Å
120	L	33.7	Very low	36.9	Very low	171 Å²	171	131.3 Å²	131.3	90%	0.895	78%	0.779	S	S	*	*			trans	-76.5	118	163.4	-89.3	155.8	0	0	0	108.8
121	R	32.2	Very low	35.9	Very low	236 Å²	236	131.8 Å²	131.8	89%	0.891	79%	0.786	S	S	*	*			trans	-136.8	146.9	150.1	-102.9	-166.7	-178.5	-175.9	2	111.6
122	P	40.4	Very low	35.3	Very low	122 Å²	122	133.2 Å²	133.2	79%	0.792	79%	0.789	S	S	*	*			trans	-87.2	162.4	-163	-7.6	28.1	0	0	0	115.3
123	T	29	Very low	34.6	Very low	122 Å²	122	139 Å²	139	75%	0.748	80%	0.802	S	S	*	*			trans	-42.1	153.9	-179.5	-24.1	0	0	0	0	120.1
124	E	32.4	Very low	33.8	Very low	166 Å²	166	139.9 Å²	139.9	78%	0.776	81%	0.809	S	S	*	*			trans	80.1	134.9	156.8	-50.1	-147	161.7	0	0	117.6
125	I	32.3	Very low	33.2	Very low	142 Å²	142	139 Å²	139	73%	0.728	81%	0.812	S	S	*	*			cis	-157.1	132.1	48.5	-72.5	169	0	0	0	111.6
126	I	34.1	Very low	32.5	Very low	150 Å²	150	142.6 Å²	142.6	77%	0.769	82%	0.818	S	S	*	*			trans	30.2	122.2	138.6	-47.2	168	0	0	0	120
127	S	26.1	Very low	32.3	Very low	112 Å²	112	139.7 Å²	139.7	78%	0.783	82%	0.815	S	S	*	*				-172.2	137.5	118.4	-161.8	0	0	0	0	113.5
128	S	30	Very low	31.7	Very low	95 Å²	95	137 Å²	137	66%	0.664	81%	0.813	S	S	*	*			trans	-58.1	149.9	-178.5	49.2	0	0	0	0	117.3
129	T	27.9	Very low	31.1	Very low	150 Å²	150	142.7 Å²	142.7	92%	0.92	82%	0.815	S	S	*	*				-164.5	142.7	119.5	-2.4	0	0	0	0	113.5
130	Q	32.5	Very low	31	Very low	180 Å²	180	146.4 Å²	146.4	84%	0.841	82%	0.821	S	S	*	*			trans	-75.8	153.7	-176.7	-76.8	161.7	-21	0	0	114.5
131	S	27.6	Very low	30.9	Very low	123 Å²	123	149.6 Å²	149.6	86%	0.86	82%	0.821	S	S	*	*				-162.1	114	125.6	61.5	0	0	0	0	112
132	L	31.7	Very low	31	Very low	157 Å²	157	146.9 Å²	146.9	82%	0.822	82%	0.819	S	S	*	*			trans	-77.1	146.3	165.8	-83.5	149	0	0	0	110.4
133	Q	32.3	Very low	30.7	Very low	201 Å²	201	147.4 Å²	147.4	94%	0.939	82%	0.819	S	S	*	*			trans	-168.6	143.4	132.3	-102.1	151.8	16.4	0	0	112.5
134	A	29.6	Very low	30.8	Very low	99 Å²	99	145.1 Å²	145.1	82%	0.818	81%	0.813	S	S	*	*			trans	-112.4	155.5	-172.3	0	0	0	0	0	111.4
135	A	28.8	Very low	31	Very low	103 Å²	103	142 Å²	142	85%	0.851	82%	0.816	S	S	*	*			trans	156.8	130.9	133.4	0	0	0	0	0	113.3
136	L	29.3	Very low	31.1	Very low	169 Å²	169	141.8 Å²	141.8	89%	0.885	82%	0.82	S	S	*	*			trans	-74.4	179.6	162.8	-82.9	129.4	0	0	0	111
137	P	36.8	Very low	31.2	Very low	124 Å²	124	143 Å²	143	81%	0.805	82%	0.823	S	S	*	*			cis	-140.6	173.3	13.1	36.2	-14.5	0	0	0	116.9
138	G	26.7	Very low	31.9	Very low	72 Å²	72	143.7 Å²	143.7	74%	0.742	83%	0.825	S	S	*	*			trans	157.5	106.4	155.6	0	0	0	0	0	119.1
139	K	26.6	Very low	32.2	Very low	200 Å²	200	145.7 Å²	145.7	87%	0.87	83%	0.833	S	S	*	*			trans	66.7	99.2	143.7	-94.4	180	170.2	-179	0	121.9
140	Q	32	Very low	32.9	Very low	180 Å²	180	147.4 Å²	147.4	84%	0.841	83%	0.833	S	S	*	*				45.7	108.9	115.8	-155.2	171.2	24.9	0	0	119.6
141	R	31.2	Very low	33.3	Very low	238 Å²	238	142 Å²	142	90%	0.898	83%	0.825	S	S	*	*				-161.6	116.7	125.8	-124.9	176.2	179.8	176.7	-0.7	112.4
142	E	33.7	Very low	34.6	Very low	180 Å²	180	144.4 Å²	144.4	84%	0.841	83%	0.826	S	S	*	*			trans	-80.1	131.2	168	-177.5	166.1	157.1	0	0	109.1
143	V	34.2	Very low	34.9	Very low	132 Å²	132	142 Å²	142	80%	0.8	82%	0.823	S	S	*	*			trans	-137.3	119.7	161.8	-174.9	0	0	0	0	108.3
144	A	31.9	Very low	35.7	Very low	75 Å²	75	140.5 Å²	140.5	62%	0.62	82%	0.815	S	S	*	*			trans	-63	142.8	-172.1	0	0	0	0	0	113.7	V146	A144-V146 PolarHBondContact O-N 3.47Å
145	A	36	Very low	36.6	Very low	101 Å²	101	146.6 Å²	146.6	84%	0.835	82%	0.817	S	S	*	*			trans	-64.8	115.4	165.9	0	0	0	0	0	110.1
146	V	35.3	Very low	37.8	Very low	136 Å²	136	146.5 Å²	146.5	82%	0.824	81%	0.806	S	S	*	*			trans	-92.1	114.1	169	179.7	0	0	0	0	107.8	A144	A144-V146 PolarHBondContact O-N 3.47Å
147	Q	36.3	Very low	38.8	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	81%	0.807	S	S	*	*			trans	-68.4	136.8	171.5	-64	-172.9	64.3	0	0	110.4
148	P	39	Very low	39.9	Very low	127 Å²	127	149.3 Å²	149.3	83%	0.825	80%	0.802	S	S	*	*			trans	-83.7	126.8	164.2	30.7	-27.4	0	0	0	110.9
149	V	38	Very low	41.5	Very low	137 Å²	137	148.2 Å²	148.2	83%	0.83	79%	0.79	S	S	*	*			trans	-25.4	132.5	168	172.6	0	0	0	0	115.8	G151	V149-G151 PolarHBondContact O-N 2.76Å
150	M	41.4	Very low	42.8	Very low	186 Å²	186	145.1 Å²	145.1	92%	0.916	79%	0.79	S	S	*	*			trans	-61	96.7	166.9	-80	-163.9	-95.5	0	0	110.9
151	G	41.8	Very low	43.7	Very low	65 Å²	65	145.3 Å²	145.3	67%	0.67	79%	0.788	S	S	*	*			trans	-76.3	123.7	160.6	0	0	0	0	0	109.7	V149 S153	V149-G151 PolarHBondContact O-N 2.76Å; G151-S153 PolarHBondContact O-N 2.85Å
152	I	53.7	Low	45.1	Very low	174 Å²	174	141.7 Å²	141.7	89%	0.892	78%	0.781	S	S	*	*			trans	-71.2	79.6	174.8	-47.5	165.2	0	0	0	107.7	Q154	I152-Q154 PolarHBondContact O-N 2.79Å
153	S	39.3	Very low	46.3	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	78%	0.782	S	S	*	*			trans	-81.4	105.9	165.6	-173.6	0	0	0	0	107.1	G151 R155	G151-S153 PolarHBondContact O-N 2.85Å; S153-R155 VanDerWaalsContact C-N 3.26Å; S153-R155 PolarHBondContact O-N 2.86Å
154	Q	47.8	Very low	47.7	Very low	169 Å²	169	143.4 Å²	143.4	79%	0.79	78%	0.775	S	S	*	*			trans	-59.3	93.5	170.4	-172.9	174.9	3	0	0	108.3	I152 V156	I152-Q154 PolarHBondContact O-N 2.79Å; Q154-V156 VanDerWaalsContact C-N 3.26Å; Q154-V156 PolarHBondContact O-N 3.41Å
155	R	48.5	Very low	49.2	Very low	227 Å²	227	145.4 Å²	145.4	86%	0.857	78%	0.776	S	S	*	*			trans	-66.7	91.5	170	-173.9	-178.4	-69.7	-121.3	2	106.7	S153 R157	S153-R155 VanDerWaalsContact C-N 3.26Å; S153-R155 PolarHBondContact O-N 2.86Å; R155-R157 PolarHBondContact O-N 3.43Å
156	V	53.7	Low	50.5	Low	102 Å²	102	147.5 Å²	147.5	62%	0.618	77%	0.772	S	S	*	*			trans	-57.6	107.7	164.2	178.9	0	0	0	0	105.6	Q154 T158	Q154-V156 VanDerWaalsContact C-N 3.26Å; Q154-V156 PolarHBondContact O-N 3.41Å; V156-T158 HydrophobicContact CG1-CG2 3.92Å; V156-T158 PolarHBondContact O-N 3.09Å
157	R	51.9	Low	52.3	Low	240 Å²	240	144 Å²	144	91%	0.906	76%	0.763	S	S	*	*			trans	-67.5	81	172	-128.5	-178.9	-176.5	135.9	-3	106.8	R155 G159	R155-R157 PolarHBondContact O-N 3.43Å; R157-G159 PolarHBondContact O-N 3.14Å; R157-G159 VanDerWaalsContact O-N 3.15Å
158	T	58	Low	54.4	Low	112 Å²	112	139.9 Å²	139.9	69%	0.687	75%	0.75	S	S	*	*			trans	-73.2	103.7	164.3	53.8	0	0	0	0	106.2	V156	V156-T158 HydrophobicContact CG1-CG2 3.92Å; V156-T158 PolarHBondContact O-N 3.09Å
159	G	60.3	Low	56.5	Low	48 Å²	48	137.3 Å²	137.3	50%	0.495	73%	0.732	S	S	.	*			trans	-54.4	162.8	171.6	0	0	0	0	0	111.3	R157 K161	R157-G159 PolarHBondContact O-N 3.14Å; R157-G159 VanDerWaalsContact O-N 3.15Å; G159-K161 VanDerWaalsContact C-N 3.33Å; G159-K161 PolarHBondContact O-N 3.3Å
160	P	54.1	Low	58.8	Low	135 Å²	135	132.8 Å²	132.8	88%	0.877	71%	0.714	S	S	*	*			trans	-62.5	97	179.3	27.3	-32.5	0	0	0	108.3	Q162	P160-Q162 PolarHBondContact O-N 2.9Å
161	K	51.2	Low	61	Low	185 Å²	185	131.2 Å²	131.2	80%	0.804	71%	0.706	S	S	*	*			trans	-67.5	110	170.8	-72.4	-160.9	178.4	-174.6	0	105.7	G159 K163	G159-K161 VanDerWaalsContact C-N 3.33Å; G159-K161 PolarHBondContact O-N 3.3Å; K161-K163 PolarHBondContact O-N 2.79Å
162	Q	61.7	Low	63.4	Low	161 Å²	161	132.1 Å²	132.1	75%	0.752	70%	0.698	S	S	*	*			trans	-47.3	109	164.9	-76.5	-176.1	7.8	0	0	107.2	P160 K164	P160-Q162 PolarHBondContact O-N 2.9Å; Q162-K164 PolarHBondContact O-N 3.05Å
163	K	57.9	Low	65.2	Low	194 Å²	194	128.6 Å²	128.6	84%	0.843	68%	0.681	S	S	*	*			trans	-69.2	86.7	163.8	-67.1	-175.3	-179.2	-173.4	0	104.3	K161 D165	K161-K163 PolarHBondContact O-N 2.79Å; K163-D165 PolarHBondContact O-N 2.95Å; K163-D165 VanDerWaalsContact O-N 3.17Å
164	K	63.6	Low	67.8	Low	154 Å²	154	125.2 Å²	125.2	67%	0.67	66%	0.662	S	S	*	*			trans	-58.3	120	168.5	-73.2	164.1	176	169	0	104.9	Q162 L166	Q162-K164 PolarHBondContact O-N 3.05Å; K164-L166 PolarHBondContact O-N 2.78Å
165	D	64.4	Low	69.9	Low	118 Å²	118	120.6 Å²	120.6	63%	0.631	65%	0.649	S	S	*	*			trans	-58.5	88.4	178	-61.1	-64.5	0	0	0	108.8	K163 G167 T168 T169	K163-D165 PolarHBondContact O-N 2.95Å; K163-D165 VanDerWaalsContact O-N 3.17Å; D165-G167 PolarHBondContact O-N 3.2Å; D165-T168 PolarHBondContact O-N 3.28Å; D165-T169 PolarHBondContact O-N 3.24Å; D165-T169 VanDerWaalsContact O-N 3.16Å; D165-T169 PolarHBondContact O-OG1 2.01Å
166	L	63.4	Low	72.1	Confident	145 Å²	145	114.1 Å²	114.1	76%	0.759	63%	0.631	S	S	*	*	H	α-helix	trans	-68.4	-24.5	-170	-157.5	67.1	0	0	0	110.4	K164 G170	K164-L166 PolarHBondContact O-N 2.78Å; L166-G170 PolarHBondContact O-N 3.25Å
167	G	71.3	Confident	74.1	Confident	61 Å²	61	114.4 Å²	114.4	63%	0.629	63%	0.627	S	S	*	*	H	α-helix	trans	-70.8	-46.5	174	0	0	0	0	0	113.4	D165 G170 M171	D165-G167 PolarHBondContact O-N 3.2Å; G167-G170 PolarHBondContact O-N 2.82Å; G167-M171 PolarHBondContact O-N 3.13Å
168	T	80.4	Confident	76.1	Confident	90 Å²	90	109 Å²	109	55%	0.552	61%	0.613	S	S	*	*	H	α-helix	trans	-67.9	-40.3	179.8	-44.9	0	0	0	0	111.2	D165 G170 M171 V172	D165-T168 PolarHBondContact O-N 3.28Å; T168-G170 VanDerWaalsContact C-N 3.31Å; T168-G170 PolarHBondContact O-N 3.49Å; T168-M171 PolarHBondContact O-N 3.38Å; T168-V172 HydrophobicContact CG2-CG2 4.5Å; T168-V172 VanDerWaalsContact O-CG2 3.3Å; T168-V172 WeakPolarHBondContact O-CG2 3.26Å; T168-V172 PolarHBondContact O-N 2.75Å
169	T	83.7	Confident	77.9	Confident	74 Å²	74	105.7 Å²	105.7	45%	0.454	60%	0.597	S	S	.	*	H	α-helix	trans	-61.6	-41	176.2	-56	0	0	0	0	111.3	D165 V172 L173	D165-T169 PolarHBondContact O-N 3.24Å; D165-T169 VanDerWaalsContact O-N 3.16Å; D165-T169 PolarHBondContact O-OG1 2.01Å; T169-V172 PolarHBondContact O-N 3.43Å; T169-L173 HydrophobicContact CG2-CD1 4.01Å; T169-L173 HydrophobicContact CG2-CG 4.44Å; T169-L173 WeakPolarHBondContact O-CB 3.34Å; T169-L173 VanDerWaalsContact O-CG 3.24Å; T169-L173 WeakPolarHBondContact O-CG 3.49Å; T169-L173 PolarHBondContact O-N 2.79Å
170	G	86.5	Confident	79.6	Confident	42 Å²	42	106.9 Å²	106.9	43%	0.433	59%	0.591	S	S	.	*	H	α-helix	trans	-64.5	-40.3	175.6	0	0	0	0	0	113.2	L166 G167 T168 L173 G174	L166-G170 PolarHBondContact O-N 3.25Å; G167-G170 PolarHBondContact O-N 2.82Å; T168-G170 VanDerWaalsContact C-N 3.31Å; T168-G170 PolarHBondContact O-N 3.49Å; G170-L173 PolarHBondContact O-N 3.22Å; G170-G174 PolarHBondContact O-N 3.04Å
171	M	87.6	Confident	81.7	Confident	152 Å²	152	105.6 Å²	105.6	75%	0.749	58%	0.576	S	S	*	*	H	α-helix	trans	-67.1	-41.1	177.8	-170.2	177.5	-78.2	0	0	112.1	G167 T168 G174 S175	G167-M171 PolarHBondContact O-N 3.13Å; T168-M171 PolarHBondContact O-N 3.38Å; M171-G174 PolarHBondContact O-N 3.14Å; M171-S175 WeakPolarHBondContact O-CB 3.34Å; M171-S175 PolarHBondContact O-N 3.3Å; M171-S175 PolarHBondContact O-OG 3.1Å
172	V	92.2	Very high	83.8	Confident	85 Å²	85	102.1 Å²	102.1	52%	0.515	57%	0.565	S	S	.	*	H	α-helix	trans	-67.8	-40.4	176.9	174.6	0	0	0	0	111.5	T168 T169 S175 L176	T168-V172 HydrophobicContact CG2-CG2 4.5Å; T168-V172 VanDerWaalsContact O-CG2 3.3Å; T168-V172 WeakPolarHBondContact O-CG2 3.26Å; T168-V172 PolarHBondContact O-N 2.75Å; T169-V172 PolarHBondContact O-N 3.43Å; V172-S175 PolarHBondContact O-OG 3.4Å; V172-L176 VanDerWaalsContact O-CB 3.26Å; V172-L176 WeakPolarHBondContact O-CB 3.46Å; V172-L176 PolarHBondContact O-N 2.9Å
173	L	91.4	Very high	85.5	Confident	100 Å²	100	100.1 Å²	100.1	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-67.2	-38.8	174.9	-70.3	174	0	0	0	111.6	T169 G170 L176 M177	T169-L173 HydrophobicContact CG2-CD1 4.01Å; T169-L173 HydrophobicContact CG2-CG 4.44Å; T169-L173 WeakPolarHBondContact O-CB 3.34Å; T169-L173 VanDerWaalsContact O-CG 3.24Å; T169-L173 WeakPolarHBondContact O-CG 3.49Å; T169-L173 PolarHBondContact O-N 2.79Å; G170-L173 PolarHBondContact O-N 3.22Å; L173-L176 PolarHBondContact O-N 3.43Å; L173-M177 WeakPolarHBondContact O-CB 3.31Å; L173-M177 VanDerWaalsContact O-CG 3.28Å; L173-M177 WeakPolarHBondContact O-CG 3.32Å; L173-M177 PolarHBondContact O-N 2.84Å
174	G	93.5	Very high	87.4	Confident	35 Å²	35	96 Å²	96	36%	0.361	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-44.6	175.6	0	0	0	0	0	112.8	G170 M171 M177 M178	G170-G174 PolarHBondContact O-N 3.04Å; M171-G174 PolarHBondContact O-N 3.14Å; G174-M177 PolarHBondContact O-N 3.42Å; G174-M178 WeakPolarHBondContact O-CG 3.26Å; G174-M178 PolarHBondContact O-N 3.22Å
175	S	92.5	Very high	88.9	Confident	72 Å²	72	90.3 Å²	90.3	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-65.3	-39.9	176.6	68.7	0	0	0	0	111.7	M171 V172 M178 A179	M171-S175 WeakPolarHBondContact O-CB 3.34Å; M171-S175 PolarHBondContact O-N 3.3Å; M171-S175 PolarHBondContact O-OG 3.1Å; V172-S175 PolarHBondContact O-OG 3.4Å; S175-M178 PolarHBondContact O-N 3.38Å; S175-A179 WeakPolarHBondContact O-CB 3.34Å; S175-A179 PolarHBondContact O-N 3.42Å
176	L	95.4	Very high	90.5	Very high	92 Å²	92	88.2 Å²	88.2	48%	0.482	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-44.4	175.1	-175	67.6	0	0	0	111.7	V172 L173 A179 I180	V172-L176 VanDerWaalsContact O-CB 3.26Å; V172-L176 WeakPolarHBondContact O-CB 3.46Å; V172-L176 PolarHBondContact O-N 2.9Å; L173-L176 PolarHBondContact O-N 3.43Å; L176-A179 PolarHBondContact O-N 2.95Å; L176-I180 HydrophobicContact CG-CD1 4.18Å; L176-I180 WeakPolarHBondContact O-CD1 3.4Å; L176-I180 VanDerWaalsContact O-CG1 3.28Å; L176-I180 WeakPolarHBondContact O-CG1 3.4Å; L176-I180 PolarHBondContact O-N 3.49Å; L176-I180 VanDerWaalsContact O-N 3.1Å
177	M	95.1	Very high	92.1	Very high	108 Å²	108	83.4 Å²	83.4	53%	0.532	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-43.1	176	-74	-66	101.8	0	0	112	L173 G174 I180 I181	L173-M177 WeakPolarHBondContact O-CB 3.31Å; L173-M177 VanDerWaalsContact O-CG 3.28Å; L173-M177 WeakPolarHBondContact O-CG 3.32Å; L173-M177 PolarHBondContact O-N 2.84Å; G174-M177 PolarHBondContact O-N 3.42Å; M177-I180 HydrophobicContact CE-CD1 3.62Å; M177-I180 PolarHBondContact O-N 3.17Å; M177-I181 WeakPolarHBondContact O-CG1 3.42Å; M177-I181 PolarHBondContact O-N 3.41Å; M177-I181 VanDerWaalsContact O-N 3.17Å
178	M	94.4	Very high	93.3	Very high	126 Å²	126	86.5 Å²	86.5	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-64.4	-43.6	176.7	-75	-61.9	-173.7	0	0	112.3	G174 S175 I180 I181 I182	G174-M178 WeakPolarHBondContact O-CG 3.26Å; G174-M178 PolarHBondContact O-N 3.22Å; S175-M178 PolarHBondContact O-N 3.38Å; M178-I180 VanDerWaalsContact C-N 3.31Å; M178-I180 PolarHBondContact O-N 2.97Å; M178-I181 PolarHBondContact O-N 2.96Å; M178-I181 HydrophobicContact SD-CD1 4.44Å; M178-I182 WeakPolarHBondContact O-CG1 3.41Å; M178-I182 PolarHBondContact O-N 2.91Å
179	A	95.1	Very high	94.1	Very high	43 Å²	43	85.6 Å²	85.6	36%	0.355	50%	0.502	S	S	.	.	H	α-helix	trans	-59.4	-41.6	177	0	0	0	0	0	112	S175 L176 I181 I182 I183	S175-A179 WeakPolarHBondContact O-CB 3.34Å; S175-A179 PolarHBondContact O-N 3.42Å; L176-A179 PolarHBondContact O-N 2.95Å; A179-I181 PolarHBondContact O-N 3.31Å; A179-I182 PolarHBondContact O-N 3.47Å; A179-I183 VanDerWaalsContact O-CG1 3.26Å; A179-I183 WeakPolarHBondContact O-CG1 3.3Å; A179-I183 PolarHBondContact O-N 2.75Å
180	I	96.7	Very high	94.7	Very high	72 Å²	72	87.4 Å²	87.4	37%	0.369	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-44	177.3	-68.9	163.1	0	0	0	111.1	L176 M177 M178 I182 I183 L184	L176-I180 HydrophobicContact CG-CD1 4.18Å; L176-I180 WeakPolarHBondContact O-CD1 3.4Å; L176-I180 VanDerWaalsContact O-CG1 3.28Å; L176-I180 WeakPolarHBondContact O-CG1 3.4Å; L176-I180 PolarHBondContact O-N 3.49Å; L176-I180 VanDerWaalsContact O-N 3.1Å; M177-I180 HydrophobicContact CE-CD1 3.62Å; M177-I180 PolarHBondContact O-N 3.17Å; M178-I180 VanDerWaalsContact C-N 3.31Å; M178-I180 PolarHBondContact O-N 2.97Å; I180-I182 VanDerWaalsContact C-N 3.31Å; I180-I182 PolarHBondContact O-N 3.41Å; I180-I183 PolarHBondContact O-N 3.18Å; I180-L184 HydrophobicContact CG2-CD1 4Å; I180-L184 HydrophobicContact CG2-CG 4.4Å; I180-L184 VanDerWaalsContact O-CG 3.31Å; I180-L184 WeakPolarHBondContact O-CG 3.45Å; I180-L184 PolarHBondContact O-N 2.67Å
181	I	96.8	Very high	95.2	Very high	109 Å²	109	87.2 Å²	87.2	56%	0.559	51%	0.506	S	S	*	.	H	α-helix	trans	-61.4	-42	178	-65.3	164.6	0	0	0	110.7	M177 M178 A179 L184 G185	M177-I181 WeakPolarHBondContact O-CG1 3.42Å; M177-I181 PolarHBondContact O-N 3.41Å; M177-I181 VanDerWaalsContact O-N 3.17Å; M178-I181 PolarHBondContact O-N 2.96Å; M178-I181 HydrophobicContact SD-CD1 4.44Å; A179-I181 PolarHBondContact O-N 3.31Å; I181-L184 PolarHBondContact O-N 3.16Å; I181-G185 PolarHBondContact O-N 2.9Å
182	I	96.3	Very high	95.6	Very high	111 Å²	111	86.7 Å²	86.7	57%	0.569	50%	0.497	S	S	*	.	H	α-helix	trans	-63.6	-46.8	177.5	-64.2	169.1	0	0	0	110.7	M178 A179 I180 L184 G185 V186	M178-I182 WeakPolarHBondContact O-CG1 3.41Å; M178-I182 PolarHBondContact O-N 2.91Å; A179-I182 PolarHBondContact O-N 3.47Å; I180-I182 VanDerWaalsContact C-N 3.31Å; I180-I182 PolarHBondContact O-N 3.41Å; I182-L184 VanDerWaalsContact C-N 3.32Å; I182-L184 PolarHBondContact O-N 3.36Å; I182-G185 PolarHBondContact O-N 3.35Å; I182-V186 HydrophobicContact CG2-CG2 4.37Å; I182-V186 WeakPolarHBondContact O-CG2 3.33Å; I182-V186 PolarHBondContact O-N 2.86Å
183	I	97.1	Very high	95.7	Very high	120 Å²	120	89.1 Å²	89.1	62%	0.615	50%	0.501	S	S	*	.	H	α-helix	trans	-60.1	-43.4	178.8	-68	164	0	0	0	110.8	A179 I180 V186 G187	A179-I183 VanDerWaalsContact O-CG1 3.26Å; A179-I183 WeakPolarHBondContact O-CG1 3.3Å; A179-I183 PolarHBondContact O-N 2.75Å; I180-I183 PolarHBondContact O-N 3.18Å; I183-V186 PolarHBondContact O-N 2.75Å; I183-G187 PolarHBondContact O-N 2.85Å
184	L	97.4	Very high	95.9	Very high	108 Å²	108	91.9 Å²	91.9	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-64.8	-42.1	176.4	-68.4	174.9	0	0	0	111.8	I180 I181 I182 G187 I188	I180-L184 HydrophobicContact CG2-CD1 4Å; I180-L184 HydrophobicContact CG2-CG 4.4Å; I180-L184 VanDerWaalsContact O-CG 3.31Å; I180-L184 WeakPolarHBondContact O-CG 3.45Å; I180-L184 PolarHBondContact O-N 2.67Å; I181-L184 PolarHBondContact O-N 3.16Å; I182-L184 VanDerWaalsContact C-N 3.32Å; I182-L184 PolarHBondContact O-N 3.36Å; L184-G187 PolarHBondContact O-N 2.79Å; L184-I188 VanDerWaalsContact O-CG1 3.27Å; L184-I188 WeakPolarHBondContact O-CG1 3.11Å; L184-I188 PolarHBondContact O-N 3.41Å
185	G	96.4	Very high	96	Very high	34 Å²	34	97.2 Å²	97.2	35%	0.351	52%	0.519	S	S	.	.	H	α-helix	trans	-61.5	-44.8	175.9	0	0	0	0	0	112.8	I181 I182 I188 T189	I181-G185 PolarHBondContact O-N 2.9Å; I182-G185 PolarHBondContact O-N 3.35Å; G185-I188 PolarHBondContact O-N 3.32Å; G185-T189 WeakPolarHBondContact O-CG2 3.42Å; G185-T189 PolarHBondContact O-N 3Å; G185-T189 PolarHBondContact O-OG1 2.74Å
186	V	96.9	Very high	96.1	Very high	73 Å²	73	99.8 Å²	99.8	44%	0.442	52%	0.517	S	S	.	.	H	α-helix	trans	-64.7	-42.4	175.2	174.5	0	0	0	0	110.8	I182 I183 I188 T189 L190	I182-V186 HydrophobicContact CG2-CG2 4.37Å; I182-V186 WeakPolarHBondContact O-CG2 3.33Å; I182-V186 PolarHBondContact O-N 2.86Å; I183-V186 PolarHBondContact O-N 2.75Å; V186-I188 PolarHBondContact O-N 3.48Å; V186-T189 WeakPolarHBondContact CA-OG1 3.49Å; V186-T189 PolarHBondContact O-N 2.71Å; V186-T189 PolarHBondContact O-OG1 3.32Å; V186-L190 HydrophobicContact CG1-CD1 3.7Å; V186-L190 HydrophobicContact CG1-CG 4.12Å; V186-L190 WeakPolarHBondContact O-CB 3.46Å; V186-L190 VanDerWaalsContact O-CG 3.3Å; V186-L190 WeakPolarHBondContact O-CG 3.44Å; V186-L190 PolarHBondContact O-N 3Å
187	G	96.7	Very high	96	Very high	44 Å²	44	97.1 Å²	97.1	45%	0.454	51%	0.512	S	S	.	.	H	α-helix	trans	-60.1	-44	176.6	0	0	0	0	0	113	I183 L184 G191	I183-G187 PolarHBondContact O-N 2.85Å; L184-G187 PolarHBondContact O-N 2.79Å; G187-G191 PolarHBondContact O-N 2.86Å
188	I	97.4	Very high	95.9	Very high	126 Å²	126	95.6 Å²	95.6	65%	0.646	50%	0.503	S	S	*	.	H	α-helix	trans	-68.2	-43.9	178.7	-66.3	164.5	0	0	0	111	L184 G185 V186 G191 Y192	L184-I188 VanDerWaalsContact O-CG1 3.27Å; L184-I188 WeakPolarHBondContact O-CG1 3.11Å; L184-I188 PolarHBondContact O-N 3.41Å; G185-I188 PolarHBondContact O-N 3.32Å; V186-I188 PolarHBondContact O-N 3.48Å; I188-G191 PolarHBondContact O-N 3.39Å; I188-Y192 WeakPolarHBondContact O-CB 3.28Å; I188-Y192 PolarHBondContact O-N 3.34Å
189	T	96.4	Very high	95.7	Very high	71 Å²	71	93.7 Å²	93.7	44%	0.436	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-49.2	179.2	50.1	0	0	0	0	111.2	G185 V186 G191 Y192 F193	G185-T189 WeakPolarHBondContact O-CG2 3.42Å; G185-T189 PolarHBondContact O-N 3Å; G185-T189 PolarHBondContact O-OG1 2.74Å; V186-T189 WeakPolarHBondContact CA-OG1 3.49Å; V186-T189 PolarHBondContact O-N 2.71Å; V186-T189 PolarHBondContact O-OG1 3.32Å; T189-G191 VanDerWaalsContact C-N 3.33Å; T189-G191 PolarHBondContact O-N 2.98Å; T189-Y192 PolarHBondContact O-N 3.48Å; T189-F193 WeakPolarHBondContact O-CD2 3.48Å; T189-F193 PolarHBondContact O-N 2.96Å
190	L	96.3	Very high	95.5	Very high	113 Å²	113	95.7 Å²	95.7	59%	0.592	50%	0.5	S	S	*	.	H	α-helix	trans	-59.9	-42.1	174.5	-70.4	177.6	0	0	0	111.8	V186 Y192 F193 Y194	V186-L190 HydrophobicContact CG1-CD1 3.7Å; V186-L190 HydrophobicContact CG1-CG 4.12Å; V186-L190 WeakPolarHBondContact O-CB 3.46Å; V186-L190 VanDerWaalsContact O-CG 3.3Å; V186-L190 WeakPolarHBondContact O-CG 3.44Å; V186-L190 PolarHBondContact O-N 3Å; L190-Y192 VanDerWaalsContact C-N 3.35Å; L190-Y192 PolarHBondContact O-N 3.36Å; L190-F193 PolarHBondContact O-N 3.4Å; L190-Y194 VanDerWaalsContact O-CB 3.23Å; L190-Y194 WeakPolarHBondContact O-CB 3.44Å; L190-Y194 PolarHBondContact O-N 2.79Å
191	G	96.7	Very high	95.3	Very high	38 Å²	38	98.3 Å²	98.3	39%	0.392	51%	0.509	S	S	.	.	H	α-helix	trans	-61.4	-40.9	175.5	0	0	0	0	0	112.9	G187 I188 T189 K195	G187-G191 PolarHBondContact O-N 2.86Å; I188-G191 PolarHBondContact O-N 3.39Å; T189-G191 VanDerWaalsContact C-N 3.33Å; T189-G191 PolarHBondContact O-N 2.98Å; G191-K195 VanDerWaalsContact O-CB 3.29Å; G191-K195 WeakPolarHBondContact O-CB 3.41Å; G191-K195 PolarHBondContact O-N 3.14Å
192	Y	96.7	Very high	95	Very high	141 Å²	141	98.9 Å²	98.9	55%	0.553	51%	0.507	S	S	*	.	H	α-helix	trans	-64.8	-46.9	175	177.3	-95.6	0	0	0	111.7	I188 T189 L190 K195 R196	I188-Y192 WeakPolarHBondContact O-CB 3.28Å; I188-Y192 PolarHBondContact O-N 3.34Å; T189-Y192 PolarHBondContact O-N 3.48Å; L190-Y192 VanDerWaalsContact C-N 3.35Å; L190-Y192 PolarHBondContact O-N 3.36Å; Y192-K195 PolarHBondContact O-N 2.88Å; Y192-R196 VanDerWaalsContact O-CB 3.31Å; Y192-R196 WeakPolarHBondContact O-CB 3.28Å; Y192-R196 PolarHBondContact O-N 2.98Å
193	F	95.1	Very high	94.5	Very high	135 Å²	135	99.2 Å²	99.2	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-64.1	-41.1	176.9	-81.2	-70.2	0	0	0	112.1	T189 L190 R196 G197	T189-F193 WeakPolarHBondContact O-CD2 3.48Å; T189-F193 PolarHBondContact O-N 2.96Å; L190-F193 PolarHBondContact O-N 3.4Å; F193-R196 PolarHBondContact O-N 2.81Å; F193-G197 PolarHBondContact O-N 3.19Å
194	Y	95.4	Very high	94.1	Very high	159 Å²	159	99.4 Å²	99.4	62%	0.624	51%	0.505	S	S	*	.	H	α-helix	trans	-63.1	-46	176	-176.6	-100.9	0	0	0	111.4	L190 R196 G197 Q198	L190-Y194 VanDerWaalsContact O-CB 3.23Å; L190-Y194 WeakPolarHBondContact O-CB 3.44Å; L190-Y194 PolarHBondContact O-N 2.79Å; Y194-R196 VanDerWaalsContact C-N 3.34Å; Y194-R196 PolarHBondContact O-N 3.1Å; Y194-G197 PolarHBondContact O-N 2.75Å; Y194-Q198 HydrophobicContact CD1-CG 4.37Å; Y194-Q198 HydrophobicContact CE1-CG 3.96Å; Y194-Q198 WeakPolarHBondContact O-CB 3.4Å; Y194-Q198 PolarHBondContact O-N 3.32Å; Y194-Q198 PolarHBondContact OH-NE2 3.17Å; Y194-Q198 VanDerWaalsContact OH-NE2 3.14Å
195	K	95.4	Very high	93.8	Very high	147 Å²	147	99.5 Å²	99.5	64%	0.639	50%	0.502	S	S	*	.	H	α-helix	trans	-62.2	-41	175.7	-172	171.2	-175.4	174	0	111.6	G191 Y192 N199	G191-K195 VanDerWaalsContact O-CB 3.29Å; G191-K195 WeakPolarHBondContact O-CB 3.41Å; G191-K195 PolarHBondContact O-N 3.14Å; Y192-K195 PolarHBondContact O-N 2.88Å; K195-N199 VanDerWaalsContact O-CG 3.27Å; K195-N199 PolarHBondContact O-N 2.79Å; K195-N199 PolarHBondContact O-ND2 2.72Å
196	R	94.3	Very high	93.5	Very high	125 Å²	125	104.7 Å²	104.7	47%	0.472	52%	0.517	S	S	.	.	H	α-helix	trans	-65.8	-41.8	175.9	-172.6	172.9	179.8	172.5	-2.1	111.9	Y192 F193 Y194 N199 L200	Y192-R196 VanDerWaalsContact O-CB 3.31Å; Y192-R196 WeakPolarHBondContact O-CB 3.28Å; Y192-R196 PolarHBondContact O-N 2.98Å; F193-R196 PolarHBondContact O-N 2.81Å; Y194-R196 VanDerWaalsContact C-N 3.34Å; Y194-R196 PolarHBondContact O-N 3.1Å; R196-N199 PolarHBondContact O-N 3.23Å; R196-L200 WeakPolarHBondContact O-CG 3.48Å; R196-L200 PolarHBondContact O-N 2.94Å
197	G	93.8	Very high	92.9	Very high	36 Å²	36	108.7 Å²	108.7	37%	0.371	52%	0.524	S	S	.	.	H	α-helix	trans	-63.5	-43.6	175.7	0	0	0	0	0	112.4	F193 Y194 N199 L200 K201	F193-G197 PolarHBondContact O-N 3.19Å; Y194-G197 PolarHBondContact O-N 2.75Å; G197-N199 PolarHBondContact O-N 2.96Å; G197-L200 PolarHBondContact O-N 3.46Å; G197-K201 WeakPolarHBondContact O-CB 3.11Å; G197-K201 PolarHBondContact O-N 3.17Å
198	Q	93.2	Very high	92.3	Very high	76 Å²	76	114 Å²	114	36%	0.355	53%	0.531	S	S	.	.	H	α-helix	trans	-59.1	-44.2	172.5	-84.5	-96.4	4.1	0	0	112.3	Y194 L200 K201 K202	Y194-Q198 HydrophobicContact CD1-CG 4.37Å; Y194-Q198 HydrophobicContact CE1-CG 3.96Å; Y194-Q198 WeakPolarHBondContact O-CB 3.4Å; Y194-Q198 PolarHBondContact O-N 3.32Å; Y194-Q198 PolarHBondContact OH-NE2 3.17Å; Y194-Q198 VanDerWaalsContact OH-NE2 3.14Å; Q198-L200 VanDerWaalsContact C-N 3.35Å; Q198-L200 PolarHBondContact O-N 2.87Å; Q198-K201 PolarHBondContact O-N 3.24Å; Q198-K202 WeakPolarHBondContact O-CG 3.25Å; Q198-K202 PolarHBondContact O-N 2.91Å
199	N	89.9	Confident	91.7	Very high	87 Å²	87	115.4 Å²	115.4	47%	0.465	53%	0.529	S	S	.	.	H	α-helix	trans	-62.8	-40.9	176.8	-72.4	-27.7	0	0	0	112.1	K195 R196 G197 K202 Q203	K195-N199 VanDerWaalsContact O-CG 3.27Å; K195-N199 PolarHBondContact O-N 2.79Å; K195-N199 PolarHBondContact O-ND2 2.72Å; R196-N199 PolarHBondContact O-N 3.23Å; G197-N199 PolarHBondContact O-N 2.96Å; N199-K202 PolarHBondContact O-N 3.19Å; N199-Q203 WeakPolarHBondContact O-CG 3.19Å; N199-Q203 PolarHBondContact O-N 3.32Å; N199-Q203 VanDerWaalsContact O-N 3.08Å
200	L	91.3	Very high	91.1	Very high	84 Å²	84	117.9 Å²	117.9	44%	0.44	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-41.2	175.2	-71.8	170.3	0	0	0	111.8	R196 G197 Q198 K202 Q203 H204	R196-L200 WeakPolarHBondContact O-CG 3.48Å; R196-L200 PolarHBondContact O-N 2.94Å; G197-L200 PolarHBondContact O-N 3.46Å; Q198-L200 VanDerWaalsContact C-N 3.35Å; Q198-L200 PolarHBondContact O-N 2.87Å; L200-K202 PolarHBondContact O-N 3.39Å; L200-Q203 PolarHBondContact O-N 2.85Å; L200-H204 PolarHBondContact O-CD2 3.25Å; L200-H204 VanDerWaalsContact O-CD2 3.31Å; L200-H204 PolarHBondContact O-N 3.18Å
201	K	91.3	Very high	90.3	Very high	127 Å²	127	119.8 Å²	119.8	55%	0.552	54%	0.535	S	S	*	.	H	α-helix	trans	-59.8	-46.9	176.6	-173.1	176.8	177.7	-177.8	0	111.2	G197 Q198 Q203 H204 E205	G197-K201 WeakPolarHBondContact O-CB 3.11Å; G197-K201 PolarHBondContact O-N 3.17Å; Q198-K201 PolarHBondContact O-N 3.24Å; K201-Q203 VanDerWaalsContact C-N 3.35Å; K201-Q203 PolarHBondContact O-N 3.13Å; K201-H204 PolarHBondContact O-N 2.63Å; K201-E205 WeakPolarHBondContact CE-OE1 3Å; K201-E205 WeakPolarHBondContact O-CG 3.49Å; K201-E205 PolarHBondContact O-N 3.42Å
202	K	90.7	Very high	89.6	Confident	122 Å²	122	122.8 Å²	122.8	53%	0.53	54%	0.539	S	S	.	.	H	α-helix	trans	-59.5	-42.8	175.1	-71.1	-178.8	-179.1	-175.3	0	112.3	Q198 N199 L200 H204 E205 Q206	Q198-K202 WeakPolarHBondContact O-CG 3.25Å; Q198-K202 PolarHBondContact O-N 2.91Å; N199-K202 PolarHBondContact O-N 3.19Å; L200-K202 PolarHBondContact O-N 3.39Å; K202-H204 PolarHBondContact O-N 3.09Å; K202-E205 PolarHBondContact O-N 2.97Å; K202-Q206 WeakPolarHBondContact O-CB 3.3Å; K202-Q206 PolarHBondContact O-N 3.07Å
203	Q	87.4	Confident	88.3	Confident	118 Å²	118	121.3 Å²	121.3	55%	0.551	54%	0.538	S	S	*	.	H	α-helix	trans	-62.9	-40.2	175.3	-75.4	-169.1	-14.1	0	0	112.8	N199 L200 K201 Q206 R207	N199-Q203 WeakPolarHBondContact O-CG 3.19Å; N199-Q203 PolarHBondContact O-N 3.32Å; N199-Q203 VanDerWaalsContact O-N 3.08Å; L200-Q203 PolarHBondContact O-N 2.85Å; K201-Q203 VanDerWaalsContact C-N 3.35Å; K201-Q203 PolarHBondContact O-N 3.13Å; Q203-Q206 PolarHBondContact O-N 2.03Å; Q203-R207 WeakPolarHBondContact O-CG 3.23Å; Q203-R207 PolarHBondContact O-N 3.49Å
204	H	88.1	Confident	86.9	Confident	124 Å²	124	121.1 Å²	121.1	57%	0.574	54%	0.539	S	S	*	.	H	α-helix	trans	-65.8	-42.9	176.6	-88.1	-72.2	0	0	0	112.5	L200 K201 K202 Q206 R207 R208	L200-H204 PolarHBondContact O-CD2 3.25Å; L200-H204 VanDerWaalsContact O-CD2 3.31Å; L200-H204 PolarHBondContact O-N 3.18Å; K201-H204 PolarHBondContact O-N 2.63Å; K202-H204 PolarHBondContact O-N 3.09Å; H204-Q206 VanDerWaalsContact C-N 3.33Å; H204-R207 PolarHBondContact O-N 3.33Å; H204-R208 WeakPolarHBondContact O-CB 3.19Å; H204-R208 PolarHBondContact O-N 2.97Å
205	E	91.4	Very high	85.2	Confident	110 Å²	110	123.6 Å²	123.6	51%	0.514	55%	0.547	S	S	.	.	H	α-helix	trans	-61.7	-42	174.9	-73.8	172.8	-178.6	0	0	111	K201 K202 R208 Y209	K201-E205 WeakPolarHBondContact CE-OE1 3Å; K201-E205 WeakPolarHBondContact O-CG 3.49Å; K201-E205 PolarHBondContact O-N 3.42Å; K202-E205 PolarHBondContact O-N 2.97Å; E205-R208 WeakPolarHBondContact O-CB 3.13Å; E205-R208 PolarHBondContact O-N 3.31Å; E205-R208 VanDerWaalsContact O-N 3.16Å; E205-Y209 PolarHBondContact O-N 3.48Å
206	Q	88.6	Confident	83.6	Confident	143 Å²	143	123.9 Å²	123.9	67%	0.668	55%	0.554	S	S	*	*	H	α-helix	trans	-65.8	-43.1	177.3	-166	149.1	-9.4	0	0	112.7	K202 Q203 H204 R208 Y209 E210	K202-Q206 WeakPolarHBondContact O-CB 3.3Å; K202-Q206 PolarHBondContact O-N 3.07Å; Q203-Q206 PolarHBondContact O-N 2.03Å; H204-Q206 VanDerWaalsContact C-N 3.33Å; Q206-R208 PolarHBondContact O-N 2.85Å; Q206-Y209 PolarHBondContact O-N 3.3Å; Q206-E210 WeakPolarHBondContact O-CB 3.41Å; Q206-E210 PolarHBondContact O-N 2.69Å
207	R	85.1	Confident	81.8	Confident	156 Å²	156	121.6 Å²	121.6	59%	0.589	56%	0.558	S	S	*	*	H	α-helix	trans	-65.4	-25.7	172.6	-73.3	-173.6	-171.6	-162.2	3.7	113.3	Q203 H204 R211	Q203-R207 WeakPolarHBondContact O-CG 3.23Å; Q203-R207 PolarHBondContact O-N 3.49Å; H204-R207 PolarHBondContact O-N 3.33Å; R207-R211 PolarHBondContact O-N 3.23Å; R207-R211 PolarHBondContact O-NE 2.86Å; R207-R211 VanDerWaalsContact O-NE 3.1Å
208	R	83.6	Confident	80.2	Confident	156 Å²	156	124.7 Å²	124.7	59%	0.589	57%	0.565	S	S	*	*	H	α-helix	trans	-74.2	-47.8	174.4	-173.1	-170.1	-177.6	163.7	10.4	109.9	H204 E205 Q206 E210 R211 E212	H204-R208 WeakPolarHBondContact O-CB 3.19Å; H204-R208 PolarHBondContact O-N 2.97Å; E205-R208 WeakPolarHBondContact O-CB 3.13Å; E205-R208 PolarHBondContact O-N 3.31Å; E205-R208 VanDerWaalsContact O-N 3.16Å; Q206-R208 PolarHBondContact O-N 2.85Å; R208-E210 VanDerWaalsContact C-N 3.3Å; R208-E210 PolarHBondContact O-N 3.17Å; R208-R211 PolarHBondContact O-N 2.74Å; R208-E212 IonicContact CZ-OE1 3.93Å; R208-E212 IonicContact NE-OE1 3.05Å; R208-E212 PolarHBondContact NE-OE1 3.05Å; R208-E212 WeakPolarHBondContact O-CG 3.34Å; R208-E212 PolarHBondContact O-N 2.92Å
209	Y	84.6	Confident	78.4	Confident	155 Å²	155	125 Å²	125	61%	0.608	57%	0.574	S	S	*	*	H	α-helix	trans	-56.3	-43.8	174.7	-179.7	-97.3	0	0	0	111.8	E205 Q206 R211 E212 M213	E205-Y209 PolarHBondContact O-N 3.48Å; Q206-Y209 PolarHBondContact O-N 3.3Å; Y209-R211 PolarHBondContact O-N 2.92Å; Y209-E212 PolarHBondContact O-N 2.77Å; Y209-M213 HydrophobicContact CE1-SD 4.18Å; Y209-M213 WeakPolarHBondContact O-CB 3.04Å; Y209-M213 PolarHBondContact O-N 3.28Å
210	E	84.4	Confident	76.6	Confident	123 Å²	123	128.7 Å²	128.7	58%	0.575	59%	0.592	S	S	*	*	H	α-helix	trans	-60	-45.1	176.2	-173.6	175.8	-162.4	0	0	112.5	Q206 R208 E212 M213 Q214	Q206-E210 WeakPolarHBondContact O-CB 3.41Å; Q206-E210 PolarHBondContact O-N 2.69Å; R208-E210 VanDerWaalsContact C-N 3.3Å; R208-E210 PolarHBondContact O-N 3.17Å; E210-E212 VanDerWaalsContact C-N 3.34Å; E210-E212 PolarHBondContact O-N 2.88Å; E210-M213 PolarHBondContact O-N 3.16Å; E210-Q214 WeakPolarHBondContact O-CB 3.04Å; E210-Q214 PolarHBondContact O-N 3.05Å
211	R	79.8	Confident	74.8	Confident	153 Å²	153	128.7 Å²	128.7	58%	0.577	60%	0.599	S	S	*	*	H	α-helix	trans	-65.6	-34.5	176.2	-80.3	-178.8	-80.6	139.5	-9.4	113.3	R207 R208 Y209 R215	R207-R211 PolarHBondContact O-N 3.23Å; R207-R211 PolarHBondContact O-NE 2.86Å; R207-R211 VanDerWaalsContact O-NE 3.1Å; R208-R211 PolarHBondContact O-N 2.74Å; Y209-R211 PolarHBondContact O-N 2.92Å; R211-R215 PolarHBondContact O-N 3.17Å
212	E	81.1	Confident	73	Confident	101 Å²	101	125.9 Å²	125.9	47%	0.472	60%	0.6	S	S	.	*	H	α-helix	trans	-71.4	-39.3	175.8	-72.6	173.5	-170.9	0	0	110.9	R208 Y209 E210 R215	R208-E212 IonicContact CZ-OE1 3.93Å; R208-E212 IonicContact NE-OE1 3.05Å; R208-E212 PolarHBondContact NE-OE1 3.05Å; R208-E212 WeakPolarHBondContact O-CG 3.34Å; R208-E212 PolarHBondContact O-N 2.92Å; Y209-E212 PolarHBondContact O-N 2.77Å; E210-E212 VanDerWaalsContact C-N 3.34Å; E210-E212 PolarHBondContact O-N 2.88Å; E212-R215 PolarHBondContact O-N 3.31Å
213	M	69.8	Low	71.2	Confident	111 Å²	111	128.6 Å²	128.6	55%	0.547	61%	0.612	S	S	.	*	H	α-helix	trans	-66.6	-39.3	175	-172.5	176	159.2	0	0	112.3	Y209 E210 R215 I216 S217	Y209-M213 HydrophobicContact CE1-SD 4.18Å; Y209-M213 WeakPolarHBondContact O-CB 3.04Å; Y209-M213 PolarHBondContact O-N 3.28Å; E210-M213 PolarHBondContact O-N 3.16Å; M213-R215 PolarHBondContact O-N 3.26Å; M213-I216 WeakPolarHBondContact O-CB 3.31Å; M213-I216 PolarHBondContact O-N 2.77Å; M213-S217 PolarHBondContact O-N 2.96Å
214	Q	65.1	Low	69.8	Low	130 Å²	130	127.3 Å²	127.3	61%	0.607	62%	0.616	S	S	*	*	H	α-helix	trans	-66.6	-22.5	178.4	-155.8	174.6	-1	0	0	113.1	E210 I216	E210-Q214 WeakPolarHBondContact O-CB 3.04Å; E210-Q214 PolarHBondContact O-N 3.05Å; Q214-I216 VanDerWaalsContact C-N 3.31Å
215	R	61.5	Low	68.1	Low	212 Å²	212	127.3 Å²	127.3	80%	0.8	62%	0.62	S	S	*	*	H	α-helix	trans	-71.2	-24.4	169.3	-77.3	-165.9	-177.7	-179.5	1.1	113.3	R211 E212 M213 L218	R211-R215 PolarHBondContact O-N 3.17Å; E212-R215 PolarHBondContact O-N 3.31Å; M213-R215 PolarHBondContact O-N 3.26Å; R215-L218 WeakPolarHBondContact O-CD1 3.3Å
216	I	60	Low	66.6	Low	152 Å²	152	127.9 Å²	127.9	78%	0.779	63%	0.634	S	S	*	*	H	α-helix	trans	-86.6	-29.2	179.8	-58.7	170.1	0	0	0	110.3	M213 Q214 L218	M213-I216 WeakPolarHBondContact O-CB 3.31Å; M213-I216 PolarHBondContact O-N 2.77Å; Q214-I216 VanDerWaalsContact C-N 3.31Å; I216-L218 PolarHBondContact O-N 3.03Å
217	S	57.3	Low	64.9	Low	78 Å²	78	126.2 Å²	126.2	55%	0.545	63%	0.633	S	S	.	*			trans	-94.6	39.3	175.5	71.8	0	0	0	0	113.2	M213	M213-S217 PolarHBondContact O-N 2.96Å
218	L	61	Low	63.4	Low	100 Å²	100	124.5 Å²	124.5	52%	0.524	64%	0.644	S	S	.	*			trans	-62	126.4	165.2	-97.5	90	0	0	0	107.5	R215 I216 L220	R215-L218 WeakPolarHBondContact O-CD1 3.3Å; I216-L218 PolarHBondContact O-N 3.03Å; L218-L220 PolarHBondContact O-N 3.15Å
219	P	54.2	Low	61.8	Low	84 Å²	84	126.2 Å²	126.2	55%	0.545	66%	0.659	S	S	.	*			trans	-62.7	132.6	177.3	29.7	-34.8	0	0	0	107.5	S221 A222	P219-S221 WeakPolarHBondContact CB-OG 3.26Å; P219-S221 WeakPolarHBondContact CG-OG 3.24Å; P219-S221 PolarHBondContact O-N 2.81Å; P219-A222 PolarHBondContact O-N 2.79Å
220	L	52.5	Low	60.7	Low	163 Å²	163	126.4 Å²	126.4	85%	0.853	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-54.4	-6.8	174.8	-71.5	163.3	0	0	0	113.1	L218 A222 F223	L218-L220 PolarHBondContact O-N 3.15Å; L220-A222 VanDerWaalsContact C-N 3.31Å; L220-A222 PolarHBondContact O-N 2.85Å; L220-F223 PolarHBondContact O-N 3.36Å
221	S	52.8	Low	59.2	Low	84 Å²	84	128.3 Å²	128.3	59%	0.587	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-72	-12.6	171.4	57.7	0	0	0	0	115.1	P219 F223	P219-S221 WeakPolarHBondContact CB-OG 3.26Å; P219-S221 WeakPolarHBondContact CG-OG 3.24Å; P219-S221 PolarHBondContact O-N 2.81Å; S221-F223 VanDerWaalsContact C-N 3.26Å; S221-F223 PolarHBondContact O-N 2.92Å
222	A	53.9	Low	58.3	Low	69 Å²	69	127.8 Å²	127.8	57%	0.57	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-78	-9.8	173	0	0	0	0	0	113.4	P219 L220	P219-A222 PolarHBondContact O-N 2.79Å; L220-A222 VanDerWaalsContact C-N 3.31Å; L220-A222 PolarHBondContact O-N 2.85Å
223	F	53.8	Low	57.2	Low	179 Å²	179	131.3 Å²	131.3	79%	0.785	71%	0.707	S	S	*	*	S	Bend	trans	-119.3	-0	-177.5	-83.4	-81	0	0	0	114.9	L220 S221 N225	L220-F223 PolarHBondContact O-N 3.36Å; S221-F223 VanDerWaalsContact C-N 3.26Å; S221-F223 PolarHBondContact O-N 2.92Å; F223-N225 PolarHBondContact O-N 2.83Å
224	S	56.6	Low	56.1	Low	91 Å²	91	132 Å²	132	64%	0.636	71%	0.713	S	S	*	*			trans	-80.2	88.7	173.5	60.6	0	0	0	0	110.5	P226	S224-P226 WeakPolarHBondContact O-CD 3.42Å
225	N	53.8	Low	55	Low	123 Å²	123	131.2 Å²	131.2	66%	0.658	72%	0.718	S	S	*	*			trans	-78.8	118.3	163.6	-170.9	-11.3	0	0	0	108.6	F223 T227	F223-N225 PolarHBondContact O-N 2.83Å; N225-T227 PolarHBondContact O-N 2.98Å; N225-T227 VanDerWaalsContact O-N 3.13Å; N225-T227 PolarHBondContact OD1-OG1 3.3Å; N225-T227 VanDerWaalsContact OD1-OG1 3.05Å
226	P	59.4	Low	54.1	Low	122 Å²	122	128.4 Å²	128.4	79%	0.792	72%	0.717	S	S	*	*	S	Bend	trans	-76	12	-172.3	30	-35.5	0	0	0	115.7	S224	S224-P226 WeakPolarHBondContact O-CD 3.42Å
227	T	51.9	Low	53.3	Low	108 Å²	108	127.8 Å²	127.8	66%	0.663	72%	0.719	S	S	*	*			trans	-107.8	29.5	-172.4	52.6	0	0	0	0	116.2	N225	N225-T227 PolarHBondContact O-N 2.98Å; N225-T227 VanDerWaalsContact O-N 3.13Å; N225-T227 PolarHBondContact OD1-OG1 3.3Å; N225-T227 VanDerWaalsContact OD1-OG1 3.05Å
228	C	53.7	Low	52.7	Low	121 Å²	121	131.1 Å²	131.1	82%	0.818	73%	0.73	S	S	*	*			trans	-123.9	74.9	165.7	-78.1	0	0	0	0	110.3
229	E	51.4	Low	51.4	Low	191 Å²	191	132.3 Å²	132.3	89%	0.893	74%	0.741	S	S	*	*			trans	-86	140.8	154.3	-100.5	-161.8	153.6	0	0	110
230	L	60.7	Low	50.8	Low	160 Å²	160	132.5 Å²	132.5	84%	0.838	75%	0.75	S	S	*	*			trans	-58.9	139.4	-176.4	-76	62.8	0	0	0	112.7
231	I	53.3	Low	50.2	Low	163 Å²	163	134.3 Å²	134.3	84%	0.836	75%	0.754	S	S	*	*			trans	-118.8	109.1	146	-98.1	156.8	0	0	0	107.4
232	D	60.1	Low	49.3	Very low	142 Å²	142	137.8 Å²	137.8	76%	0.759	76%	0.761	S	S	*	*			trans	-80.6	117	164.5	177	58.5	0	0	0	106.8
233	E	57.5	Low	48.4	Very low	175 Å²	175	141.4 Å²	141.4	82%	0.818	77%	0.766	S	S	*	*			trans	-140.4	103.5	162.4	-157.3	166.2	152.8	0	0	110.3
234	N	48.5	Very low	47.4	Very low	125 Å²	125	137.9 Å²	137.9	67%	0.668	76%	0.759	S	S	*	*			trans	-72.2	151.1	172.1	-127.2	27.3	0	0	0	110.4
235	T	41.9	Very low	46.2	Very low	114 Å²	114	139.4 Å²	139.4	70%	0.699	77%	0.765	S	S	*	*			trans	69.4	106.2	153.1	55	0	0	0	0	120.1
236	I	40.9	Very low	45.8	Very low	153 Å²	153	139 Å²	139	79%	0.785	77%	0.769	S	S	*	*				-145.9	123	122.3	-72	113	0	0	0	108.8	I238	I236-I238 HydrophobicContact CG2-CD1 4.12Å; I236-I238 HydrophobicContact CG2-CG1 3.78Å
237	V	44.5	Very low	44.5	Very low	138 Å²	138	138.8 Å²	138.8	84%	0.836	77%	0.765	S	S	*	*			trans	-81.7	120.5	164.9	170.5	0	0	0	0	108.1
238	I	43.6	Very low	43.6	Very low	149 Å²	149	141.2 Å²	141.2	76%	0.764	77%	0.769	S	S	*	*			trans	-139.9	105.9	155.2	-57.9	-179.1	0	0	0	109.9	I236	I236-I238 HydrophobicContact CG2-CD1 4.12Å; I236-I238 HydrophobicContact CG2-CG1 3.78Å
239	T	35	Very low	42.7	Very low	125 Å²	125	143.3 Å²	143.3	77%	0.767	77%	0.766	S	S	*	*			trans	17	134.8	139.9	-39.5	0	0	0	0	120.6
240	A	42	Very low	41.9	Very low	88 Å²	88	138 Å²	138	73%	0.727	76%	0.763	S	S	*	*			trans	-49.1	151.8	171.3	0	0	0	0	0	116.2
241	E	38.9	Very low	40.7	Very low	200 Å²	200	134 Å²	134	94%	0.935	76%	0.76	S	S	*	*				-155.4	152.9	129.1	-114.9	175.6	177.4	0	0	112.7
242	H	34.7	Very low	40	Very low	158 Å²	158	133.9 Å²	133.9	73%	0.731	76%	0.762	S	S	*	*			trans	-91.9	168.7	-166.4	178.8	-102	0	0	0	110.8
243	E	34.6	Very low	39.6	Very low	145 Å²	145	132.1 Å²	132.1	68%	0.678	76%	0.758	S	S	*	*			trans	119	101.6	139.9	-144.7	137.3	163.6	0	0	118.3
244	T	33.4	Very low	38.9	Very low	104 Å²	104	131 Å²	131	64%	0.638	76%	0.757	S	S	*	*			trans	54.8	148.1	131.5	62.4	0	0	0	0	121.8
245	T	31.6	Very low	38.8	Very low	124 Å²	124	133.4 Å²	133.4	76%	0.761	77%	0.766	S	S	*	*			cis	-169.4	-165.2	-7.9	34.8	0	0	0	0	104.2
246	P	44.4	Very low	38.9	Very low	113 Å²	113	131 Å²	131	73%	0.734	76%	0.764	S	S	*	*				-120.3	-158.5	-113.4	31.7	-5	0	0	0	113.3
247	V	32	Very low	39.1	Very low	118 Å²	118	131.7 Å²	131.7	72%	0.715	76%	0.764	S	S	*	*			trans	114.1	98.2	161.8	-177	0	0	0	0	111.9
248	Q	33.6	Very low	39.2	Very low	159 Å²	159	133.1 Å²	133.1	74%	0.743	76%	0.761	S	S	*	*				69.3	135.1	90.7	-115.8	178.5	-24.9	0	0	111.3
249	E	33.8	Very low	39.5	Very low	165 Å²	165	130.4 Å²	130.4	77%	0.771	76%	0.761	S	S	*	*			cis	-177.8	151.2	28.7	-164.6	172.2	-175.2	0	0	109.3
250	G	34.9	Very low	40.3	Very low	79 Å²	79	127.8 Å²	127.8	81%	0.814	76%	0.759	S	S	*	*			trans	79.7	131.9	148.6	0	0	0	0	0	117.4
251	G	35.3	Very low	41	Very low	76 Å²	76	130.5 Å²	130.5	78%	0.784	77%	0.766	S	S	*	*			cis	167.9	118.6	4.3	0	0	0	0	0	107.7
252	D	39.2	Very low	42.2	Very low	162 Å²	162	126.8 Å²	126.8	87%	0.866	76%	0.76	S	S	*	*			trans	-81	169.1	155.3	-95.7	-40.3	0	0	0	108.3
253	P	52	Low	42.9	Very low	105 Å²	105	123.2 Å²	123.2	68%	0.682	77%	0.766	S	S	*	*			cis	-142.7	177.7	20	30.9	-6.9	0	0	0	114.6
254	L	43.3	Very low	43.8	Very low	152 Å²	152	124.9 Å²	124.9	80%	0.796	80%	0.804	S	S	*	*				169.2	118.9	119.9	-93	160.9	0	0	0	114.4
255	M	46.4	Very low	44.3	Very low	175 Å²	175	125.9 Å²	125.9	86%	0.862	81%	0.812	S	S	*	*			trans	48.8	122.3	131	-83.5	-81.8	-116	0	0	121.2
256	G	42.6	Very low	45	Very low	63 Å²	63	126 Å²	126	65%	0.649	82%	0.815	S	S	*	*				118.4	97.6	109.5	0	0	0	0	0	118.6
257	Q	46.3	Very low	45	Very low	167 Å²	167	126.7 Å²	126.7	78%	0.78	82%	0.819	S	S	*	*				70.7	140.8	117.8	-127.4	172.5	28.9	0	0	121.2
258	H	46.8	Very low	45.8	Very low	168 Å²	168	127.2 Å²	127.2	78%	0.778	83%	0.826	S	S	*	*			trans	85.5	139.7	166.4	-58.6	83	0	0	0	116
259	A	49.6	Very low	46.6	Very low	92 Å²	92	125.3 Å²	125.3	76%	0.76	83%	0.831	S	S	*	*			cis	-157.7	157.2	5.1	0	0	0	0	0	108.5
260	G	50.1	Low	47.4	Very low	71 Å²	71	122.6 Å²	122.6	73%	0.732	84%	0.835	S	S	*	*			trans	-76.9	175.1	171.2	0	0	0	0	0	113.8
261	T	57.5	Low	48.3	Very low	144 Å²	144	125.7 Å²	125.7	88%	0.883	84%	0.836	S	S	*	*			trans	-160.4	153.8	155.2	10.7	0	0	0	0	109.5
262	P	64.9	Low	49.3	Very low	123 Å²	123	129.5 Å²	129.5	80%	0.799	84%	0.84	S	S	*	*			trans	-103.7	170.7	-156.5	19.7	0.9	0	0	0	113.8
263	G	48.1	Very low	50.2	Low	83 Å²	83	126.8 Å²	126.8	86%	0.856	84%	0.838	S	S	*	*			trans	-65.5	165.9	177.8	0	0	0	0	0	115.6
264	A	54.3	Low	50	Low	179 Å²	179	128.8 Å²	128.8	100%	1.479	85%	0.852	S	S	*	*			trans	-126.9	0	160.3	0	0	0	0	0	107.3

Retrieved 264 of 264 residues in 111.7 ms (Link to these results)

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