A0A087XX54_POEFO Loading...

Spi-C transcription factor (Spi-1/PU.1 related)

AlphaFold DB , UniProt , Accession A0A087XX54, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 267 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	44.6	Very low	67.2	Low	244 Å²	244	129.1 Å²	129.1	100%	1.202	68%	0.68	S	S	*	*				0	116.2	0	-72.9	-161.8	152.6	0	0	106.8
2	S	52.3	Low	69	Low	126 Å²	126	126.8 Å²	126.8	88%	0.881	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-78.8	121.2	-173	-153.4	0	0	0	0	108.6
3	L	56.9	Low	70.4	Confident	160 Å²	160	122.9 Å²	122.9	84%	0.838	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-70.3	132	175	-69.8	165.7	0	0	0	108.7
4	D	59.3	Low	71.7	Confident	114 Å²	114	117.6 Å²	117.6	61%	0.61	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-57.4	123.8	-177.6	-107.2	-56.3	0	0	0	111.1	D6	D4-D6 PolarHBondContact O-N 3.43Å
5	P	62.1	Low	72.8	Confident	103 Å²	103	115.1 Å²	115.1	67%	0.669	61%	0.612	S	S	*	*	H	α-helix	trans	-64.9	-16.5	177.3	26	-32.5	0	0	0	112.9	I7 Q9	P5-I7 PolarHBondContact O-N 3.4Å; P5-Q9 PolarHBondContact O-N 3.44Å
6	D	67.6	Low	73.7	Confident	93 Å²	93	113.1 Å²	113.1	50%	0.497	60%	0.601	S	S	.	*	H	α-helix	trans	-70.1	-30.9	-174.7	-158.4	40.9	0	0	0	113.4	D4 Q9 H10	D4-D6 PolarHBondContact O-N 3.43Å; D6-Q9 PolarHBondContact O-N 3.22Å; D6-H10 PolarHBondContact O-N 2.96Å; D6-H10 VanDerWaalsContact O-N 3.15Å; D6-H10 PolarHBondContact O-ND1 3.26Å; D6-H10 VanDerWaalsContact O-ND1 3.16Å; D6-H10 IonicContact OD1-CE1 3.83Å; D6-H10 IonicContact OD2-CE1 3.39Å; D6-H10 PolarHBondContact OD2-CE1 3.25Å
7	I	73.8	Confident	74.5	Confident	101 Å²	101	110.8 Å²	110.8	52%	0.518	59%	0.592	S	S	.	*	H	α-helix	trans	-70.5	-41.5	179.5	-72.9	170.1	0	0	0	110.9	P5 Q9 H10 F11	P5-I7 PolarHBondContact O-N 3.4Å; I7-Q9 VanDerWaalsContact C-N 3.26Å; I7-Q9 PolarHBondContact O-N 3.26Å; I7-H10 PolarHBondContact O-N 3.03Å; I7-F11 HydrophobicContact CG2-CD2 3.9Å; I7-F11 HydrophobicContact CG2-CE2 3.98Å; I7-F11 WeakPolarHBondContact O-CD2 3.45Å; I7-F11 PolarHBondContact O-N 3Å; I7-F11 VanDerWaalsContact O-N 3.12Å
8	N	74.1	Confident	74.9	Confident	116 Å²	116	111.1 Å²	111.1	62%	0.62	59%	0.593	S	S	*	*	H	α-helix	trans	-65.6	-34	179.8	-70.8	-62.1	0	0	0	111.3	F11 Q12	N8-F11 PolarHBondContact O-N 2.94Å; N8-Q12 PolarHBondContact O-N 2.96Å; N8-Q12 VanDerWaalsContact O-N 3.09Å
9	Q	84.1	Confident	75.2	Confident	103 Å²	103	110.9 Å²	110.9	48%	0.481	59%	0.588	S	S	.	*	H	α-helix	trans	-67.1	-46.8	175.6	-169.3	60.9	59.3	0	0	111.8	P5 D6 I7 F11 Q12 D13	P5-Q9 PolarHBondContact O-N 3.44Å; D6-Q9 PolarHBondContact O-N 3.22Å; I7-Q9 VanDerWaalsContact C-N 3.26Å; I7-Q9 PolarHBondContact O-N 3.26Å; Q9-F11 VanDerWaalsContact C-N 3.26Å; Q9-F11 PolarHBondContact O-N 3.49Å; Q9-Q12 PolarHBondContact O-N 2.91Å; Q9-D13 PolarHBondContact NE2-OD1 3.21Å; Q9-D13 PolarHBondContact O-N 2.82Å
10	H	81.8	Confident	75.2	Confident	114 Å²	114	112.4 Å²	112.4	53%	0.528	59%	0.591	S	S	.	*	H	α-helix	trans	-60.1	-35.6	177.3	-71.6	139.7	0	0	0	113.1	D6 I7 A14	D6-H10 PolarHBondContact O-N 2.96Å; D6-H10 VanDerWaalsContact O-N 3.15Å; D6-H10 PolarHBondContact O-ND1 3.26Å; D6-H10 VanDerWaalsContact O-ND1 3.16Å; D6-H10 IonicContact OD1-CE1 3.83Å; D6-H10 IonicContact OD2-CE1 3.39Å; D6-H10 PolarHBondContact OD2-CE1 3.25Å; I7-H10 PolarHBondContact O-N 3.03Å; H10-A14 WeakPolarHBondContact O-CB 3.37Å; H10-A14 PolarHBondContact O-N 3.39Å; H10-A14 VanDerWaalsContact O-N 3.15Å
11	F	83.1	Confident	74.8	Confident	146 Å²	146	113.4 Å²	113.4	64%	0.64	59%	0.593	S	S	*	*	H	α-helix	trans	-66.9	-42.4	173.9	-91.8	-79	0	0	0	111.9	I7 N8 Q9 A14 I15	I7-F11 HydrophobicContact CG2-CD2 3.9Å; I7-F11 HydrophobicContact CG2-CE2 3.98Å; I7-F11 WeakPolarHBondContact O-CD2 3.45Å; I7-F11 PolarHBondContact O-N 3Å; I7-F11 VanDerWaalsContact O-N 3.12Å; N8-F11 PolarHBondContact O-N 2.94Å; Q9-F11 VanDerWaalsContact C-N 3.26Å; Q9-F11 PolarHBondContact O-N 3.49Å; F11-A14 PolarHBondContact O-N 3.33Å; F11-I15 WeakPolarHBondContact O-CG1 3.42Å; F11-I15 PolarHBondContact O-N 3.48Å
12	Q	88	Confident	75.8	Confident	101 Å²	101	105.5 Å²	105.5	47%	0.472	56%	0.561	S	S	.	*	H	α-helix	trans	-65.9	-43.4	179.4	-165	58	62.2	0	0	111.8	N8 Q9 A14 I15 D16	N8-Q12 PolarHBondContact O-N 2.96Å; N8-Q12 VanDerWaalsContact O-N 3.09Å; Q9-Q12 PolarHBondContact O-N 2.91Å; Q12-A14 VanDerWaalsContact C-N 3.33Å; Q12-A14 PolarHBondContact O-N 3.1Å; Q12-I15 PolarHBondContact O-N 3.32Å; Q12-D16 PolarHBondContact NE2-OD1 3.35Å; Q12-D16 PolarHBondContact O-N 3.41Å
13	D	87.5	Confident	76.2	Confident	77 Å²	77	107 Å²	107	41%	0.412	55%	0.554	S	S	.	*	H	α-helix	trans	-61.1	-40	176.9	-74.4	11.8	0	0	0	111.9	Q9 I15 D16 V17	Q9-D13 PolarHBondContact NE2-OD1 3.21Å; Q9-D13 PolarHBondContact O-N 2.82Å; D13-I15 PolarHBondContact O-N 3.25Å; D13-D16 PolarHBondContact O-N 3.23Å; D13-V17 VanDerWaalsContact O-CG2 3.31Å; D13-V17 WeakPolarHBondContact O-CG2 3.31Å; D13-V17 PolarHBondContact O-N 3.36Å
14	A	88.4	Confident	76.2	Confident	49 Å²	49	105.9 Å²	105.9	41%	0.405	55%	0.549	S	S	.	.	H	α-helix	trans	-65.2	-38.5	177.9	0	0	0	0	0	112.4	H10 F11 Q12 I18	H10-A14 WeakPolarHBondContact O-CB 3.37Å; H10-A14 PolarHBondContact O-N 3.39Å; H10-A14 VanDerWaalsContact O-N 3.15Å; F11-A14 PolarHBondContact O-N 3.33Å; Q12-A14 VanDerWaalsContact C-N 3.33Å; Q12-A14 PolarHBondContact O-N 3.1Å; A14-I18 WeakPolarHBondContact O-CD1 3.33Å; A14-I18 VanDerWaalsContact O-CG1 3.3Å; A14-I18 WeakPolarHBondContact O-CG1 3.35Å; A14-I18 PolarHBondContact O-N 3.24Å
15	I	88.6	Confident	76.1	Confident	80 Å²	80	104.7 Å²	104.7	41%	0.41	56%	0.555	S	S	.	*	H	α-helix	trans	-66.6	-40.5	176	-66.4	-64.8	0	0	0	110.8	F11 Q12 D13 I18 Q19	F11-I15 WeakPolarHBondContact O-CG1 3.42Å; F11-I15 PolarHBondContact O-N 3.48Å; Q12-I15 PolarHBondContact O-N 3.32Å; D13-I15 PolarHBondContact O-N 3.25Å; I15-I18 PolarHBondContact O-N 3.48Å; I15-Q19 PolarHBondContact O-N 2.73Å; I15-Q19 VanDerWaalsContact O-N 3.1Å
16	D	87.7	Confident	75.6	Confident	82 Å²	82	109.6 Å²	109.6	44%	0.439	56%	0.562	S	S	.	*	H	α-helix	trans	-67.1	-40.8	179.8	-72.7	-7.1	0	0	0	111.9	Q12 D13 I18 Q19 Q20	Q12-D16 PolarHBondContact NE2-OD1 3.35Å; Q12-D16 PolarHBondContact O-N 3.41Å; D13-D16 PolarHBondContact O-N 3.23Å; D16-I18 VanDerWaalsContact C-N 3.33Å; D16-I18 PolarHBondContact O-N 2.86Å; D16-Q19 PolarHBondContact O-N 2.89Å; D16-Q20 WeakPolarHBondContact O-CB 3.44Å; D16-Q20 PolarHBondContact O-N 3.27Å
17	V	87.6	Confident	74.9	Confident	74 Å²	74	115 Å²	115	45%	0.448	58%	0.577	S	S	.	*	H	α-helix	trans	-59.5	-43.4	174	170.1	0	0	0	0	111.1	D13 Q19 Q20 H21	D13-V17 VanDerWaalsContact O-CG2 3.31Å; D13-V17 WeakPolarHBondContact O-CG2 3.31Å; D13-V17 PolarHBondContact O-N 3.36Å; V17-Q19 VanDerWaalsContact C-N 3.35Å; V17-Q19 PolarHBondContact O-N 3.22Å; V17-Q20 PolarHBondContact O-N 3.42Å; V17-H21 PolarHBondContact O-N 3.15Å; V17-H21 PolarHBondContact O-ND1 3.44Å
18	I	81.8	Confident	73.5	Confident	116 Å²	116	114.9 Å²	114.9	60%	0.595	58%	0.577	S	S	*	*	H	α-helix	trans	-65.2	-40.2	179.9	-67.5	165.7	0	0	0	111	A14 I15 D16 S22	A14-I18 WeakPolarHBondContact O-CD1 3.33Å; A14-I18 VanDerWaalsContact O-CG1 3.3Å; A14-I18 WeakPolarHBondContact O-CG1 3.35Å; A14-I18 PolarHBondContact O-N 3.24Å; I15-I18 PolarHBondContact O-N 3.48Å; D16-I18 VanDerWaalsContact C-N 3.33Å; D16-I18 PolarHBondContact O-N 2.86Å; I18-S22 PolarHBondContact O-N 3.17Å
19	Q	78.8	Confident	72.4	Confident	109 Å²	109	114.2 Å²	114.2	51%	0.509	58%	0.579	S	S	.	*	H	α-helix	trans	-71	-33	177.5	-73.1	-174.7	58.8	0	0	113.1	I15 D16 V17 S22 H23	I15-Q19 PolarHBondContact O-N 2.73Å; I15-Q19 VanDerWaalsContact O-N 3.1Å; D16-Q19 PolarHBondContact O-N 2.89Å; V17-Q19 VanDerWaalsContact C-N 3.35Å; V17-Q19 PolarHBondContact O-N 3.22Å; Q19-S22 PolarHBondContact O-N 3.5Å; Q19-S22 PolarHBondContact O-OG 3.02Å; Q19-H23 PolarHBondContact O-ND1 3.49Å
20	Q	75.3	Confident	70.4	Confident	139 Å²	139	117.7 Å²	117.7	65%	0.65	60%	0.595	S	S	*	*	H	α-helix	trans	-64.7	-40.5	176.6	-170.4	-178.9	11.8	0	0	111.9	D16 V17	D16-Q20 WeakPolarHBondContact O-CB 3.44Å; D16-Q20 PolarHBondContact O-N 3.27Å; V17-Q20 PolarHBondContact O-N 3.42Å
21	H	67.4	Low	68.6	Low	134 Å²	134	117.8 Å²	117.8	62%	0.62	61%	0.608	S	S	*	*	H	α-helix	trans	-80.9	-17.6	-179.1	-65.5	87.2	0	0	0	113.4	V17 H23	V17-H21 PolarHBondContact O-N 3.15Å; V17-H21 PolarHBondContact O-ND1 3.44Å; H21-H23 VanDerWaalsContact C-N 3.29Å; H21-H23 PolarHBondContact O-N 3.35Å
22	S	65.1	Low	66.6	Low	78 Å²	78	119.7 Å²	119.7	55%	0.545	62%	0.616	S	S	.	*	H	α-helix	trans	-74.2	-19.7	175.8	70.9	0	0	0	0	113.3	I18 Q19 N24	I18-S22 PolarHBondContact O-N 3.17Å; Q19-S22 PolarHBondContact O-N 3.5Å; Q19-S22 PolarHBondContact O-OG 3.02Å; S22-N24 VanDerWaalsContact C-N 3.35Å
23	H	62.1	Low	64.4	Low	159 Å²	159	125.1 Å²	125.1	74%	0.736	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-3.1	178.8	-75.2	64.1	0	0	0	113.9	Q19 H21	Q19-H23 PolarHBondContact O-ND1 3.49Å; H21-H23 VanDerWaalsContact C-N 3.29Å; H21-H23 PolarHBondContact O-N 3.35Å
24	N	57	Low	62.1	Low	135 Å²	135	131.2 Å²	131.2	72%	0.722	66%	0.657	S	S	*	*			trans	-116	54.8	-177.3	-126.2	-13.7	0	0	0	111.4	S22 Y26	S22-N24 VanDerWaalsContact C-N 3.35Å; N24-Y26 VanDerWaalsContact C-N 3.27Å; N24-Y26 PolarHBondContact O-N 3.39Å
25	A	56.5	Low	59.8	Low	90 Å²	90	138 Å²	138	74%	0.744	68%	0.68	S	S	*	*			trans	-68.1	91.1	162.6	0	0	0	0	0	108.2	Y27	A25-Y27 PolarHBondContact O-N 3.49Å
26	Y	52.2	Low	57.8	Low	206 Å²	206	140.3 Å²	140.3	81%	0.808	70%	0.698	S	S	*	*			trans	-58.7	104.4	172.5	-169.4	-92.9	0	0	0	108.6	N24 D28	N24-Y26 VanDerWaalsContact C-N 3.27Å; N24-Y26 PolarHBondContact O-N 3.39Å; Y26-D28 PolarHBondContact O-N 3.15Å
27	Y	51.4	Low	55.7	Low	207 Å²	207	145.2 Å²	145.2	81%	0.812	72%	0.723	S	S	*	*			trans	-76.5	105.4	179.1	-154.9	-91.1	0	0	0	108.1	A25 P29	A25-Y27 PolarHBondContact O-N 3.49Å; Y27-P29 WeakPolarHBondContact O-CD 3.45Å
28	D	44.6	Very low	53.3	Low	97 Å²	97	145.1 Å²	145.1	52%	0.519	74%	0.737	S	S	.	*			trans	-80.3	113.4	173.8	-175.3	4.3	0	0	0	109.7	Y26 E30	Y26-D28 PolarHBondContact O-N 3.15Å; D28-E30 VanDerWaalsContact C-N 3.27Å; D28-E30 PolarHBondContact O-N 3.47Å
29	P	50.4	Low	51.3	Low	103 Å²	103	145.1 Å²	145.1	67%	0.669	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-3.3	-171.3	-13.4	29.5	0	0	0	115.4	Y27	Y27-P29 WeakPolarHBondContact O-CD 3.45Å
30	E	43.8	Very low	49.2	Very low	175 Å²	175	148.6 Å²	148.6	82%	0.818	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-1.6	-168.9	-109.5	-179.1	167	0	0	115.8	D28 K32	D28-E30 VanDerWaalsContact C-N 3.27Å; D28-E30 PolarHBondContact O-N 3.47Å; E30-K32 PolarHBondContact O-N 3.16Å
31	C	43.9	Very low	47.6	Very low	117 Å²	117	147.4 Å²	147.4	79%	0.791	77%	0.768	S	S	*	*			trans	-81.6	49.9	178.6	-75.5	0	0	0	0	113.7
32	K	39.7	Very low	45.9	Very low	186 Å²	186	146.9 Å²	146.9	81%	0.809	78%	0.78	S	S	*	*			trans	-100.9	70.2	166.5	-72.2	-168.7	178.2	-177.2	0	110.7	E30	E30-K32 PolarHBondContact O-N 3.16Å
33	Y	42.4	Very low	44.8	Very low	214 Å²	214	148.6 Å²	148.6	84%	0.839	79%	0.791	S	S	*	*	S	Bend	trans	-147.4	5.9	169.7	-125.2	-87	0	0	0	117.2
34	F	39.1	Very low	43.6	Very low	206 Å²	206	148.8 Å²	148.8	90%	0.904	80%	0.797	S	S	*	*	S	Bend	trans	-126.2	12	177.9	-71.4	-72.8	0	0	0	115.5	T36	F34-T36 VanDerWaalsContact C-N 3.34Å; F34-T36 PolarHBondContact O-N 3.39Å
35	E	40.4	Very low	42.8	Very low	191 Å²	191	151.8 Å²	151.8	89%	0.893	81%	0.807	S	S	*	*			trans	-99.8	48.9	-179.9	-152	161.4	-162.1	0	0	111.9
36	T	46.4	Very low	41.6	Very low	129 Å²	129	153.2 Å²	153.2	79%	0.791	81%	0.806	S	S	*	*			trans	-149.5	90	168.2	-35.1	0	0	0	0	108.1	F34	F34-T36 VanDerWaalsContact C-N 3.34Å; F34-T36 PolarHBondContact O-N 3.39Å
37	L	43.7	Very low	41	Very low	184 Å²	184	152.5 Å²	152.5	96%	0.963	81%	0.81	S	S	*	*			trans	169.5	68	150.1	-87.3	-176.9	0	0	0	107.7
38	G	37.5	Very low	40.1	Very low	72 Å²	72	149.9 Å²	149.9	74%	0.742	81%	0.807	S	S	*	*			trans	-140.6	80.5	175.7	0	0	0	0	0	110.3
39	S	40	Very low	39.7	Very low	117 Å²	117	149.5 Å²	149.5	82%	0.818	81%	0.812	S	S	*	*			trans	-172.9	100.1	159.7	-79.3	0	0	0	0	110.2
40	Q	34.6	Very low	38.8	Very low	182 Å²	182	153.8 Å²	153.8	85%	0.85	82%	0.816	S	S	*	*				-174.5	136.9	124.2	-89	-58.5	19.1	0	0	109.5
41	P	41.8	Very low	38.6	Very low	113 Å²	113	153 Å²	153	73%	0.734	81%	0.812	S	S	*	*			trans	-94.4	135	-175.9	35.1	-27.6	0	0	0	111.7
42	S	31.8	Very low	38	Very low	124 Å²	124	152.8 Å²	152.8	87%	0.867	81%	0.807	S	S	*	*			trans	-117.4	123.3	162.2	-80.2	0	0	0	0	109.4
43	S	41.9	Very low	37.7	Very low	113 Å²	113	153 Å²	153	79%	0.79	81%	0.809	S	S	*	*			trans	-53.2	122.2	-178.3	53.4	0	0	0	0	114.2
44	L	36.3	Very low	37.5	Very low	164 Å²	164	147 Å²	147	86%	0.859	80%	0.803	S	S	*	*			trans	-137.1	108.1	145.1	-74.8	178.1	0	0	0	107.7	V46	L44-V46 PolarHBondContact O-N 3.09Å
45	Q	40.6	Very low	37.6	Very low	197 Å²	197	146 Å²	146	92%	0.921	80%	0.801	S	S	*	*			trans	-58.6	106.6	167.6	-92.1	-176.8	-41.8	0	0	108.8
46	V	30.8	Very low	37.1	Very low	121 Å²	121	146.3 Å²	146.3	73%	0.733	80%	0.802	S	S	*	*			trans	-98.8	103.7	156.6	175	0	0	0	0	105.8	L44 M48	L44-V46 PolarHBondContact O-N 3.09Å; V46-M48 VanDerWaalsContact C-N 3.34Å; V46-M48 HydrophobicContact CG1-CG 3.96Å; V46-M48 PolarHBondContact O-N 3.49Å
47	Q	39	Very low	36.7	Very low	190 Å²	190	144.5 Å²	144.5	89%	0.888	80%	0.795	S	S	*	*			trans	-75.5	88	177.8	-159.4	174.6	4.6	0	0	108.3
48	M	34.4	Very low	36.4	Very low	152 Å²	152	143 Å²	143	75%	0.749	79%	0.788	S	S	*	*			trans	-85.2	108	165.6	-70.1	-135.6	71.5	0	0	108.3	V46 Y50	V46-M48 VanDerWaalsContact C-N 3.34Å; V46-M48 HydrophobicContact CG1-CG 3.96Å; V46-M48 PolarHBondContact O-N 3.49Å; M48-Y50 PolarHBondContact O-N 3.28Å; M48-Y50 VanDerWaalsContact O-N 3.13Å
49	S	35	Very low	36.3	Very low	90 Å²	90	147.4 Å²	147.4	63%	0.629	79%	0.793	S	S	*	*			trans	-60.4	107.1	167.5	174.1	0	0	0	0	109.2	H51	S49-H51 PolarHBondContact OG-NE2 3.12Å
50	Y	32.8	Very low	36.4	Very low	193 Å²	193	147.2 Å²	147.2	76%	0.757	79%	0.789	S	S	*	*			trans	-97.3	111.8	164.4	55.5	-89.5	0	0	0	107.5	M48 V52	M48-Y50 PolarHBondContact O-N 3.28Å; M48-Y50 VanDerWaalsContact O-N 3.13Å; Y50-V52 HydrophobicContact CD2-CG2 3.71Å; Y50-V52 HydrophobicContact CE2-CG2 3.87Å; Y50-V52 PolarHBondContact O-N 3.34Å
51	H	37.9	Very low	37	Very low	158 Å²	158	143.4 Å²	143.4	73%	0.731	79%	0.788	S	S	*	*			trans	-76	107.2	166.4	-68.5	-72.5	0	0	0	107.8	S49 F53	S49-H51 PolarHBondContact OG-NE2 3.12Å; H51-F53 PolarHBondContact O-N 3.07Å
52	V	31.4	Very low	36.7	Very low	113 Å²	113	144.3 Å²	144.3	69%	0.685	79%	0.791	S	S	*	*			trans	-67.2	111.8	167.1	173.3	0	0	0	0	107.7	Y50	Y50-V52 HydrophobicContact CD2-CG2 3.71Å; Y50-V52 HydrophobicContact CE2-CG2 3.87Å; Y50-V52 PolarHBondContact O-N 3.34Å
53	F	34.2	Very low	37.4	Very low	191 Å²	191	142 Å²	142	84%	0.838	79%	0.787	S	S	*	*			trans	-83.7	111.8	163.5	-92.1	-89.5	0	0	0	108.2	H51	H51-F53 PolarHBondContact O-N 3.07Å
54	A	37.5	Very low	37.1	Very low	87 Å²	87	147.1 Å²	147.1	72%	0.719	79%	0.791	S	S	*	*			trans	-64.7	137.5	172.8	0	0	0	0	0	110.1	Q56	A54-Q56 PolarHBondContact O-N 2.9Å
55	H	41.5	Very low	37.3	Very low	186 Å²	186	145.6 Å²	145.6	86%	0.861	78%	0.783	S	S	*	*			trans	-54.5	129.3	167.1	-78.9	-106.6	0	0	0	110.5
56	Q	29.4	Very low	37.5	Very low	196 Å²	196	147 Å²	147	92%	0.916	78%	0.78	S	S	*	*			trans	-137.1	105.3	157.9	-156.3	154.5	86.7	0	0	108	A54	A54-Q56 PolarHBondContact O-N 2.9Å
57	S	38.7	Very low	38.3	Very low	92 Å²	92	144.7 Å²	144.7	64%	0.643	77%	0.769	S	S	*	*			trans	-72.5	133.5	168.6	-50.9	0	0	0	0	109
58	D	36.4	Very low	38.4	Very low	152 Å²	152	144.5 Å²	144.5	81%	0.813	77%	0.768	S	S	*	*				156.1	150.3	122.9	-79.5	-33.8	0	0	0	111.3
59	I	35.6	Very low	38.7	Very low	165 Å²	165	143.2 Å²	143.2	85%	0.846	77%	0.769	S	S	*	*			trans	109.7	136	161.5	-55.5	-166.6	0	0	0	115.8
60	P	42.6	Very low	39.5	Very low	113 Å²	113	142.7 Å²	142.7	73%	0.734	77%	0.77	S	S	*	*			trans	-103.1	174.8	-134.4	40.7	-36.4	0	0	0	115.5
61	A	47	Very low	40.3	Very low	101 Å²	101	142.1 Å²	142.1	84%	0.835	77%	0.774	S	S	*	*			trans	-35.7	128.8	178	0	0	0	0	0	116.6
62	V	36.3	Very low	39.9	Very low	133 Å²	133	140 Å²	140	81%	0.806	78%	0.777	S	S	*	*			trans	-130.6	119.1	149.9	172.8	0	0	0	0	106.8	Y64	V62-Y64 PolarHBondContact O-N 3.19Å
63	G	45.5	Very low	40.5	Very low	75 Å²	75	146.7 Å²	146.7	77%	0.773	79%	0.79	S	S	*	*			trans	-63.9	127.7	179.6	0	0	0	0	0	111.1
64	Y	36.4	Very low	40.7	Very low	221 Å²	221	142.8 Å²	142.8	87%	0.867	78%	0.784	S	S	*	*			trans	-92.5	102.4	171.3	-124	-88.9	0	0	0	108.6	V62	V62-Y64 PolarHBondContact O-N 3.19Å
65	D	40.5	Very low	41.1	Very low	131 Å²	131	147.1 Å²	147.1	70%	0.701	79%	0.79	S	S	*	*			trans	-77.9	122.6	161.3	-178.1	12.7	0	0	0	107.9
66	W	45.2	Very low	41	Very low	228 Å²	228	144.6 Å²	144.6	86%	0.864	79%	0.787	S	S	*	*			trans	-97.4	14.8	-170.4	60.1	-86.3	0	0	0	113.6
67	S	46.9	Very low	41.9	Very low	71 Å²	71	142.2 Å²	142.2	50%	0.497	78%	0.779	S	S	.	*			trans	-120.1	58.6	-169.3	-53.4	0	0	0	0	114.6
68	E	40.8	Very low	42.3	Very low	187 Å²	187	143.6 Å²	143.6	87%	0.874	79%	0.785	S	S	*	*			trans	-164.8	148.1	153.2	-125.3	168	138.5	0	0	112.1
69	T	42.2	Very low	42.9	Very low	124 Å²	124	143 Å²	143	76%	0.761	78%	0.782	S	S	*	*			trans	89.6	58.6	-179.2	-18.4	0	0	0	0	116.8
70	A	51.3	Low	43.1	Very low	80 Å²	80	141.8 Å²	141.8	66%	0.661	78%	0.782	S	S	*	*			trans	-61.9	142.4	132.3	0	0	0	0	0	108.5
71	H	48.2	Very low	43.2	Very low	181 Å²	181	140.7 Å²	140.7	84%	0.838	78%	0.778	S	S	*	*			trans	94.8	85.2	178.9	-46.6	-52.3	0	0	0	116.7
72	S	30.8	Very low	42.7	Very low	113 Å²	113	143.4 Å²	143.4	79%	0.79	78%	0.777	S	S	*	*				178.3	110.1	127.2	-173.9	0	0	0	0	109.6
73	W	43.1	Very low	42.9	Very low	253 Å²	253	141.3 Å²	141.3	96%	0.958	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-87.1	123.2	164	-76.1	93	0	0	0	107.9	Q75	W73-Q75 PolarHBondContact O-N 3.42Å
74	P	39.1	Very low	42.6	Very low	110 Å²	110	147 Å²	147	71%	0.714	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-79.3	116	170.4	11.8	1	0	0	0	109.7
75	Q	44.8	Very low	43.2	Very low	178 Å²	178	142.3 Å²	142.3	83%	0.832	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-75.6	117.5	157.3	-74.5	-156.6	-18	0	0	109.2	W73	W73-Q75 PolarHBondContact O-N 3.42Å
76	V	40.1	Very low	43.1	Very low	132 Å²	132	142.2 Å²	142.2	80%	0.8	78%	0.778	S	S	*	*			trans	-138.4	109.6	159.9	-176.1	0	0	0	0	108
77	I	48.1	Very low	42.8	Very low	147 Å²	147	139.6 Å²	139.6	75%	0.754	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-99.9	132.8	169.2	-60	179.2	0	0	0	107
78	P	47.7	Very low	42.7	Very low	120 Å²	120	143.7 Å²	143.7	78%	0.779	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-82	122	165.1	-1.2	19.6	0	0	0	110.1
79	D	48.4	Very low	42.6	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-67.5	126.1	165.6	177.1	-104.8	0	0	0	110.1
80	V	40.2	Very low	42.6	Very low	139 Å²	139	139.2 Å²	139.2	84%	0.842	78%	0.776	S	S	*	*			trans	-147.3	103.2	149.1	82.2	0	0	0	0	109.3
81	S	44.4	Very low	42.4	Very low	91 Å²	91	141 Å²	141	64%	0.636	78%	0.781	S	S	*	*			trans	-82.5	133.1	164.4	-71.1	0	0	0	0	109.6
82	L	37.7	Very low	42.3	Very low	157 Å²	157	139 Å²	139	82%	0.822	77%	0.771	S	S	*	*				155	111.3	109.3	-151	72.8	0	0	0	112.2
83	S	38.6	Very low	42.9	Very low	90 Å²	90	142.7 Å²	142.7	63%	0.629	77%	0.773	S	S	*	*			trans	51.4	110.7	142.7	65.2	0	0	0	0	120.8
84	H	40.2	Very low	43.1	Very low	193 Å²	193	139.9 Å²	139.9	89%	0.894	76%	0.764	S	S	*	*			trans	-139.5	122.9	132.6	-89.8	-93.7	0	0	0	109.6	V86	H84-V86 PolarHBondContact O-N 3.15Å
85	S	49.7	Very low	43.3	Very low	124 Å²	124	139.3 Å²	139.3	87%	0.867	76%	0.763	S	S	*	*			trans	-57.7	119.9	175.3	179.6	0	0	0	0	111.3
86	V	38.4	Very low	43.6	Very low	128 Å²	128	138 Å²	138	78%	0.776	76%	0.76	S	S	*	*			trans	-139.2	136	160.7	-169.8	0	0	0	0	109	H84	H84-V86 PolarHBondContact O-N 3.15Å
87	Q	37.8	Very low	44.2	Very low	173 Å²	173	138.2 Å²	138.2	81%	0.808	76%	0.755	S	S	*	*			trans	-46.1	138.6	-170.6	-70.8	154.9	-29	0	0	115.2	D89	Q87-D89 PolarHBondContact O-N 3.18Å; Q87-D89 VanDerWaalsContact O-N 3.07Å
88	N	45.6	Very low	44.5	Very low	157 Å²	157	135.6 Å²	135.6	84%	0.84	75%	0.747	S	S	*	*			trans	-54.5	98.9	163.1	174.1	74.1	0	0	0	111.1
89	D	38.7	Very low	44.8	Very low	139 Å²	139	135.6 Å²	135.6	74%	0.743	75%	0.747	S	S	*	*			trans	-126	110	153.3	-96.9	-61.9	0	0	0	108.6	Q87	Q87-D89 PolarHBondContact O-N 3.18Å; Q87-D89 VanDerWaalsContact O-N 3.07Å
90	S	42.6	Very low	44.8	Very low	79 Å²	79	137.1 Å²	137.1	55%	0.552	75%	0.75	S	S	*	*			trans	-49.1	132	173.4	-179.6	0	0	0	0	110.1	H92	S90-H92 VanDerWaalsContact C-N 3.33Å; S90-H92 PolarHBondContact O-N 3.47Å; S90-H92 PolarHBondContact O-ND1 3.42Å
91	P	46.1	Very low	45.5	Very low	118 Å²	118	140.2 Å²	140.2	77%	0.766	75%	0.747	S	S	*	*			trans	-63.8	103.3	171.1	26.7	-29.7	0	0	0	106.7	F93	P91-F93 PolarHBondContact O-N 3.33Å
92	H	46.5	Very low	45.9	Very low	138 Å²	138	141 Å²	141	64%	0.639	74%	0.743	S	S	*	*			trans	-56.6	89.3	168.2	-87.5	66.9	0	0	0	107.4	S90 Y94	S90-H92 VanDerWaalsContact C-N 3.33Å; S90-H92 PolarHBondContact O-N 3.47Å; S90-H92 PolarHBondContact O-ND1 3.42Å; H92-Y94 HydrophobicContact CB-CD1 4.47Å; H92-Y94 HydrophobicContact CB-CE1 4.17Å; H92-Y94 WeakPolarHBondContact O-CD2 3.3Å; H92-Y94 WeakPolarHBondContact O-CE2 3.37Å; H92-Y94 PolarHBondContact O-N 2.97Å
93	F	43.8	Very low	46.7	Very low	190 Å²	190	136.1 Å²	136.1	83%	0.833	72%	0.723	S	S	*	*			trans	-63.5	91.4	162	-149.8	-91.5	0	0	0	104.4	P91 S95	P91-F93 PolarHBondContact O-N 3.33Å; F93-S95 VanDerWaalsContact C-N 3.31Å; F93-S95 PolarHBondContact O-N 3.29Å
94	Y	46.2	Very low	47	Very low	194 Å²	194	140.5 Å²	140.5	76%	0.761	73%	0.731	S	S	*	*			trans	-55.8	105.2	176.1	-43	-81.6	0	0	0	106	H92 I96	H92-Y94 HydrophobicContact CB-CD1 4.47Å; H92-Y94 HydrophobicContact CB-CE1 4.17Å; H92-Y94 WeakPolarHBondContact O-CD2 3.3Å; H92-Y94 WeakPolarHBondContact O-CE2 3.37Å; H92-Y94 PolarHBondContact O-N 2.97Å; Y94-I96 PolarHBondContact O-N 2.85Å
95	S	44.2	Very low	47.6	Very low	99 Å²	99	135.2 Å²	135.2	69%	0.692	73%	0.728	S	S	*	*			trans	-62	98.1	168.3	-73.4	0	0	0	0	105.1	F93 I97	F93-S95 VanDerWaalsContact C-N 3.31Å; F93-S95 PolarHBondContact O-N 3.29Å; S95-I97 PolarHBondContact O-N 2.48Å
96	I	50.5	Low	48.1	Very low	151 Å²	151	137.2 Å²	137.2	77%	0.774	72%	0.716	S	S	*	*			trans	-65.7	85.3	162.1	-58.2	171.8	0	0	0	104	Y94 P98	Y94-I96 PolarHBondContact O-N 2.85Å; I96-P98 WeakPolarHBondContact O-CD 3.32Å; I96-P98 VanDerWaalsContact O-N 3.08Å
97	I	53.8	Low	49.9	Very low	136 Å²	136	140.9 Å²	140.9	70%	0.697	72%	0.722	S	S	*	*			trans	-55.9	113	161.6	-61.5	171.5	0	0	0	103.8	S95	S95-I97 PolarHBondContact O-N 2.48Å
98	P	54.2	Low	52.2	Low	91 Å²	91	140.7 Å²	140.7	59%	0.591	72%	0.718	S	S	*	*			trans	-56	129	171.1	-16.7	29.7	0	0	0	106	I96 Q100	I96-P98 WeakPolarHBondContact O-CD 3.32Å; I96-P98 VanDerWaalsContact O-N 3.08Å; P98-Q100 PolarHBondContact O-N 3.06Å
99	P	54.3	Low	54.5	Low	120 Å²	120	135.6 Å²	135.6	78%	0.779	69%	0.691	S	S	*	*			trans	-51.9	121.2	178.5	20.2	-31.1	0	0	0	107.8	R101	P99-R101 PolarHBondContact O-N 3.41Å
100	Q	47	Very low	57.3	Low	172 Å²	172	135.1 Å²	135.1	80%	0.804	68%	0.678	S	S	*	*			trans	-16.3	99	-179.3	-100.7	-77.1	-17.3	0	0	112.2	P98 N102	P98-Q100 PolarHBondContact O-N 3.06Å; Q100-N102 PolarHBondContact O-N 3.1Å
101	R	55.2	Low	59.9	Low	205 Å²	205	131.5 Å²	131.5	77%	0.774	65%	0.653	S	S	*	*			trans	-68.2	86.7	171.8	-115.8	173.7	67.3	-172.7	-1	107	P99 S103	P99-R101 PolarHBondContact O-N 3.41Å; R101-S103 PolarHBondContact NE-OG 2.91Å; R101-S103 PolarHBondContact O-N 3.23Å
102	N	52.1	Low	62.4	Low	106 Å²	106	126.2 Å²	126.2	57%	0.567	62%	0.618	S	S	*	*			trans	-73.3	56.1	161.2	-152.5	18	0	0	0	108.7	Q100 R106	Q100-N102 PolarHBondContact O-N 3.1Å; N102-R106 PolarHBondContact ND2-NH2 3.19Å; N102-R106 PolarHBondContact O-NH2 3.4Å
103	S	54.5	Low	64.8	Low	56 Å²	56	121.9 Å²	121.9	39%	0.392	60%	0.598	S	S	.	*			trans	-107.1	63.3	-177.2	66	0	0	0	0	109.6	R101 G105	R101-S103 PolarHBondContact NE-OG 2.91Å; R101-S103 PolarHBondContact O-N 3.23Å; S103-G105 VanDerWaalsContact C-N 3.28Å; S103-G105 PolarHBondContact O-N 2.86Å; S103-G105 VanDerWaalsContact O-N 3.14Å
104	K	46.5	Very low	67.4	Low	182 Å²	182	113 Å²	113	79%	0.791	56%	0.559	S	S	*	*	S	Bend	trans	-69	92	150.6	-68.5	-178.4	178.8	178.6	0	106.6	R106	K104-R106 PolarHBondContact O-N 3.21Å
105	G	51.9	Low	69.9	Low	81 Å²	81	103.7 Å²	103.7	84%	0.835	52%	0.522	S	S	*	.	S	Bend	trans	51.3	9.8	166	0	0	0	0	0	119.5	S103 K107	S103-G105 VanDerWaalsContact C-N 3.28Å; S103-G105 PolarHBondContact O-N 2.86Å; S103-G105 VanDerWaalsContact O-N 3.14Å; G105-K107 PolarHBondContact O-N 3.3Å
106	R	59.7	Low	72.5	Confident	166 Å²	166	99.7 Å²	99.7	63%	0.626	49%	0.493	S	S	*	.			trans	-74	123	-171.9	-84	-173.4	-76.1	-137.9	-1.4	110.6	N102 K104 K108	N102-R106 PolarHBondContact ND2-NH2 3.19Å; N102-R106 PolarHBondContact O-NH2 3.4Å; K104-R106 PolarHBondContact O-N 3.21Å; R106-K108 PolarHBondContact O-N 3.12Å
107	K	76.1	Confident	74.7	Confident	206 Å²	206	96.1 Å²	96.1	90%	0.896	47%	0.473	S	S	*	.			trans	-48.6	137.6	170.9	-58.9	176.7	-176.4	176.1	0	108.9	G105 L109	G105-K107 PolarHBondContact O-N 3.3Å; K107-L109 PolarHBondContact O-N 3.43Å
108	K	86.9	Confident	76.8	Confident	169 Å²	169	89.7 Å²	89.7	74%	0.735	44%	0.44	S	S	*	.			trans	-65.3	115.6	-178.9	-172.6	-179.6	-169.9	176.4	0	109.3	R106 R110 K156	R106-K108 PolarHBondContact O-N 3.12Å; K108-R110 PolarHBondContact O-N 3.01Å; K108-K156 VanDerWaalsContact CE-NZ 3.32Å; K108-K156 VanDerWaalsContact CG-NZ 3.31Å
109	L	93.6	Very high	78.9	Confident	49 Å²	49	86.1 Å²	86.1	26%	0.257	42%	0.416	S	S	.	.			trans	-48.3	127.6	178.1	-174.9	72.2	0	0	0	110.8	K107 E113 W152 R155 K156	K107-L109 PolarHBondContact O-N 3.43Å; L109-E113 HydrophobicContact CD1-CB 3.63Å; L109-E113 HydrophobicContact CG-CB 4.47Å; L109-W152 HydrophobicContact CD2-CZ3 4.08Å; L109-W152 HydrophobicContact CG-CZ3 4.36Å; L109-W152 WeakPolarHBondContact O-CH2 3.15Å; L109-R155 HydrophobicContact CD2-CG 4.11Å; L109-K156 PolarHBondContact O-NZ 3.47Å
110	R	96.8	Very high	80.8	Confident	129 Å²	129	85 Å²	85	49%	0.487	40%	0.403	S	S	.	.			trans	-92.2	158	179	-60.3	-178.1	-179.3	-169.7	1.9	110.3	K108 Y112 E113 Y114	K108-R110 PolarHBondContact O-N 3.01Å; R110-Y112 HydrophobicContact CB-CD1 3.93Å; R110-Y112 HydrophobicContact CB-CE1 3.7Å; R110-Y112 HydrophobicContact CG-CE1 4.18Å; R110-Y112 PolarHBondContact O-N 3.09Å; R110-E113 HydrophobicContact CB-CG 4.13Å; R110-E113 WeakPolarHBondContact CB-OE2 3.49Å; R110-E113 PolarHBondContact N-OE2 3.31Å; R110-E113 WeakPolarHBondContact O-CB 3.47Å; R110-E113 PolarHBondContact O-N 3.12Å; R110-Y114 PolarHBondContact O-N 3.33Å
111	L	98.2	Very high	83.2	Confident	4 Å²	4	79.6 Å²	79.6	2%	0.021	38%	0.38	C	S	.	.	H	α-helix	trans	-62	-42	-177.2	169.6	66.5	0	0	0	111.9	E113 Y114 L115 W152 M167 A170 L171 Y174	L111-E113 PolarHBondContact O-N 3.06Å; L111-Y114 HydrophobicContact CD1-CD1 4.19Å; L111-Y114 WeakPolarHBondContact O-CB 3.45Å; L111-Y114 PolarHBondContact O-N 2.79Å; L111-L115 HydrophobicContact CD1-CD1 4.21Å; L111-L115 HydrophobicContact CD1-CD2 4.14Å; L111-L115 HydrophobicContact CD1-CG 3.92Å; L111-L115 HydrophobicContact CG-CD1 4.05Å; L111-L115 HydrophobicContact CG-CG 4.2Å; L111-L115 WeakPolarHBondContact O-CG 3.32Å; L111-L115 PolarHBondContact O-N 3.09Å; L111-W152 HydrophobicContact CB-CH2 4.24Å; L111-W152 HydrophobicContact CB-CZ2 3.72Å; L111-W152 HydrophobicContact CD1-CD2 3.94Å; L111-W152 HydrophobicContact CD1-CG 3.96Å; L111-W152 HydrophobicContact CD1-CZ2 4.37Å; L111-M167 HydrophobicContact CD1-CG 3.86Å; L111-M167 HydrophobicContact CD1-SD 3.78Å; L111-M167 HydrophobicContact CD2-CG 3.57Å; L111-M167 HydrophobicContact CG-CG 4.37Å; L111-A170 HydrophobicContact CD2-CB 3.75Å; L111-L171 HydrophobicContact CD2-CD2 4.24Å; L111-L171 HydrophobicContact CD2-CG 4.35Å; L111-Y174 HydrophobicContact CB-CE2 3.91Å; L111-Y174 HydrophobicContact CD2-CE2 4.12Å; L111-Y174 HydrophobicContact CG-CE2 4.21Å; L111-Y174 PolarHBondContact N-OH 2.97Å
112	Y	98.1	Very high	85	Confident	6 Å²	6	75.3 Å²	75.3	2%	0.024	38%	0.379	C	S	.	.	H	α-helix	trans	-63.4	-32.4	-179	73.9	-102.7	0	0	0	112	R110 L115 H116 Y174 E179 F191 I195 L199	R110-Y112 HydrophobicContact CB-CD1 3.93Å; R110-Y112 HydrophobicContact CB-CE1 3.7Å; R110-Y112 HydrophobicContact CG-CE1 4.18Å; R110-Y112 PolarHBondContact O-N 3.09Å; Y112-L115 PolarHBondContact O-N 3.37Å; Y112-H116 PolarHBondContact O-N 2.94Å; Y112-H116 VanDerWaalsContact O-N 3.09Å; Y112-Y174 HydrophobicContact CD1-CE1 4.04Å; Y112-Y174 HydrophobicContact CD1-CE2 4.38Å; Y112-Y174 AromaticContact CD1-CZ 3.91Å; Y112-E179 HydrophobicContact CD1-CB 4.28Å; Y112-E179 HydrophobicContact CD1-CG 4.23Å; Y112-E179 HydrophobicContact CE1-CG 4.21Å; Y112-E179 HydrophobicContact CG-CB 4.37Å; Y112-F191 WeakPolarHBondContact O-CZ 3.26Å; Y112-I195 HydrophobicContact CD2-CG2 3.96Å; Y112-I195 HydrophobicContact CE2-CG2 3.97Å; Y112-L199 HydrophobicContact CD2-CD1 3.98Å; Y112-L199 HydrophobicContact CE2-CD1 4.16Å; Y112-L199 HydrophobicContact CE2-CD2 4.2Å
113	E	97.6	Very high	87.1	Confident	47 Å²	47	76.7 Å²	76.7	22%	0.22	39%	0.386	C	S	.	.	H	α-helix	trans	-66.9	-46.8	176	-57	173.6	150	0	0	109.9	L109 R110 L111 L115 H116 E117 L199	L109-E113 HydrophobicContact CD1-CB 3.63Å; L109-E113 HydrophobicContact CG-CB 4.47Å; R110-E113 HydrophobicContact CB-CG 4.13Å; R110-E113 WeakPolarHBondContact CB-OE2 3.49Å; R110-E113 PolarHBondContact N-OE2 3.31Å; R110-E113 WeakPolarHBondContact O-CB 3.47Å; R110-E113 PolarHBondContact O-N 3.12Å; L111-E113 PolarHBondContact O-N 3.06Å; E113-L115 VanDerWaalsContact C-N 3.35Å; E113-L115 PolarHBondContact O-N 3.38Å; E113-H116 PolarHBondContact O-N 2.81Å; E113-E117 WeakPolarHBondContact O-CG 3.46Å; E113-E117 PolarHBondContact O-N 3.34Å; E113-L199 HydrophobicContact CB-CD2 4.44Å; E113-L199 HydrophobicContact CG-CD2 4.08Å
114	Y	98.2	Very high	89	Confident	3 Å²	3	75.3 Å²	75.3	1%	0.012	37%	0.374	C	S	.	.	H	α-helix	trans	-60.2	-41	174.2	171.5	-107.2	0	0	0	113.2	R110 L111 H116 E117 A118 M124 L148 C151 W152 R155	R110-Y114 PolarHBondContact O-N 3.33Å; L111-Y114 HydrophobicContact CD1-CD1 4.19Å; L111-Y114 WeakPolarHBondContact O-CB 3.45Å; L111-Y114 PolarHBondContact O-N 2.79Å; Y114-H116 VanDerWaalsContact C-N 3.31Å; Y114-H116 PolarHBondContact O-N 2.92Å; Y114-E117 WeakPolarHBondContact O-CB 3.39Å; Y114-E117 PolarHBondContact O-N 3.3Å; Y114-A118 WeakPolarHBondContact O-CB 3.29Å; Y114-A118 PolarHBondContact O-N 2.61Å; Y114-M124 HydrophobicContact CE2-CE 4.45Å; Y114-M124 WeakPolarHBondContact OH-CE 3.12Å; Y114-L148 HydrophobicContact CE1-CD1 4.01Å; Y114-L148 HydrophobicContact CE1-CG 4.34Å; Y114-C151 VanDerWaalsContact OH-CB 3.25Å; Y114-C151 WeakPolarHBondContact OH-CB 3.29Å; Y114-W152 HydrophobicContact CD1-CB 3.96Å; Y114-W152 HydrophobicContact CD1-CD2 4.1Å; Y114-W152 AromaticContact CD1-CE3 3.64Å; Y114-W152 HydrophobicContact CD1-CE3 3.64Å; Y114-W152 HydrophobicContact CD1-CG 4.26Å; Y114-W152 HydrophobicContact CD1-CZ3 4.38Å; Y114-W152 HydrophobicContact CD2-CE3 4.16Å; Y114-W152 HydrophobicContact CE1-CB 3.63Å; Y114-W152 HydrophobicContact CE1-CE3 4.32Å; Y114-W152 HydrophobicContact CE1-CG 4.41Å; Y114-W152 HydrophobicContact CG-CD2 4.42Å; Y114-W152 AromaticContact CG-CE3 3.52Å; Y114-W152 HydrophobicContact CG-CE3 3.52Å; Y114-W152 AromaticContact CG-CZ3 3.91Å; Y114-W152 HydrophobicContact CG-CZ3 3.91Å; Y114-R155 VanDerWaalsContact CD2-NH1 3.29Å
115	L	98.4	Very high	91.3	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-65	-38.4	178.3	-67.3	177.3	0	0	0	111.5	L111 Y112 E113 A118 L119 I128 F138 F140 L148 L171 I180 F191	L111-L115 HydrophobicContact CD1-CD1 4.21Å; L111-L115 HydrophobicContact CD1-CD2 4.14Å; L111-L115 HydrophobicContact CD1-CG 3.92Å; L111-L115 HydrophobicContact CG-CD1 4.05Å; L111-L115 HydrophobicContact CG-CG 4.2Å; L111-L115 WeakPolarHBondContact O-CG 3.32Å; L111-L115 PolarHBondContact O-N 3.09Å; Y112-L115 PolarHBondContact O-N 3.37Å; E113-L115 VanDerWaalsContact C-N 3.35Å; E113-L115 PolarHBondContact O-N 3.38Å; L115-A118 PolarHBondContact O-N 3.37Å; L115-L119 WeakPolarHBondContact O-CB 3.11Å; L115-L119 WeakPolarHBondContact O-CD1 3.46Å; L115-L119 VanDerWaalsContact O-CG 3.27Å; L115-L119 WeakPolarHBondContact O-CG 3.4Å; L115-L119 PolarHBondContact O-N 3.48Å; L115-I128 HydrophobicContact CB-CD1 4.42Å; L115-I128 HydrophobicContact CD2-CD1 3.92Å; L115-F138 HydrophobicContact CD1-CE2 4.48Å; L115-F138 HydrophobicContact CD1-CZ 4.3Å; L115-F140 HydrophobicContact CD1-CZ 4.18Å; L115-F140 HydrophobicContact CD2-CE1 3.8Å; L115-F140 HydrophobicContact CD2-CZ 4.02Å; L115-L148 HydrophobicContact CD2-CD2 4.09Å; L115-L171 HydrophobicContact CD1-CD2 3.68Å; L115-I180 HydrophobicContact CD1-CD1 4.01Å; L115-F191 HydrophobicContact CB-CZ 4.16Å
116	H	98.1	Very high	93.5	Very high	14 Å²	14	67.6 Å²	67.6	7%	0.065	33%	0.328	C	S	.	.	H	α-helix	trans	-65.9	-42.8	174.1	178.6	-99.5	0	0	0	112	Y112 E113 Y114 A118 L119 N120 F191 L196 L199	Y112-H116 PolarHBondContact O-N 2.94Å; Y112-H116 VanDerWaalsContact O-N 3.09Å; E113-H116 PolarHBondContact O-N 2.81Å; Y114-H116 VanDerWaalsContact C-N 3.31Å; Y114-H116 PolarHBondContact O-N 2.92Å; H116-A118 VanDerWaalsContact C-N 3.31Å; H116-A118 PolarHBondContact O-N 3.39Å; H116-L119 PolarHBondContact O-N 2.86Å; H116-N120 PolarHBondContact CE1-ND2 2.75Å; H116-N120 PolarHBondContact NE2-ND2 2.76Å; H116-N120 PolarHBondContact O-N 3.2Å; H116-N120 PolarHBondContact O-ND2 3.4Å; H116-F191 HydrophobicContact CB-CZ 4.06Å; H116-L196 VanDerWaalsContact CD2-CD1 3.44Å; H116-L196 WeakPolarHBondContact CD2-CD1 3.45Å; H116-L199 HydrophobicContact CB-CD1 3.86Å
117	E	97.4	Very high	95.3	Very high	76 Å²	76	60 Å²	60	36%	0.355	30%	0.3	S	S	.	.	H	α-helix	trans	-56.4	-47.5	171.5	-70.9	173.5	178.6	0	0	111.2	E113 Y114 L119 N120 D121 R155	E113-E117 WeakPolarHBondContact O-CG 3.46Å; E113-E117 PolarHBondContact O-N 3.34Å; Y114-E117 WeakPolarHBondContact O-CB 3.39Å; Y114-E117 PolarHBondContact O-N 3.3Å; E117-L119 VanDerWaalsContact C-N 3.3Å; E117-L119 PolarHBondContact O-N 2.91Å; E117-N120 PolarHBondContact O-N 2.59Å; E117-N120 VanDerWaalsContact O-N 3.12Å; E117-D121 PolarHBondContact O-N 3.46Å; E117-R155 IonicContact OE2-CZ 3.98Å; E117-R155 IonicContact OE2-NH1 2.79Å; E117-R155 PolarHBondContact OE2-NH1 3.47Å
118	A	97.8	Very high	96.4	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-35.8	-179.1	0	0	0	0	0	113.3	Y114 L115 H116 N120 D121 M124 I128 L148	Y114-A118 WeakPolarHBondContact O-CB 3.29Å; Y114-A118 PolarHBondContact O-N 2.61Å; L115-A118 PolarHBondContact O-N 3.37Å; H116-A118 VanDerWaalsContact C-N 3.31Å; H116-A118 PolarHBondContact O-N 3.39Å; A118-N120 PolarHBondContact O-N 2.96Å; A118-D121 PolarHBondContact O-N 2.75Å; A118-M124 VanDerWaalsContact CA-SD 3.53Å; A118-M124 HydrophobicContact CB-CE 3.27Å; A118-M124 HydrophobicContact CB-SD 3.66Å; A118-M124 WeakPolarHBondContact O-CB 3.38Å; A118-I128 HydrophobicContact CB-CG2 3.9Å; A118-L148 HydrophobicContact CB-CD1 4.03Å
119	L	97.8	Very high	97	Very high	16 Å²	16	46.2 Å²	46.2	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-70.4	-18.7	177.3	-82.5	163.4	0	0	0	113.7	L115 H116 E117 I128 W130 F138 F191	L115-L119 WeakPolarHBondContact O-CB 3.11Å; L115-L119 WeakPolarHBondContact O-CD1 3.46Å; L115-L119 VanDerWaalsContact O-CG 3.27Å; L115-L119 WeakPolarHBondContact O-CG 3.4Å; L115-L119 PolarHBondContact O-N 3.48Å; H116-L119 PolarHBondContact O-N 2.86Å; E117-L119 VanDerWaalsContact C-N 3.3Å; E117-L119 PolarHBondContact O-N 2.91Å; L119-I128 HydrophobicContact CD1-CD1 4.1Å; L119-I128 HydrophobicContact CD2-CD1 4.11Å; L119-I128 HydrophobicContact CD2-CG1 3.69Å; L119-I128 HydrophobicContact CG-CD1 3.8Å; L119-I128 HydrophobicContact CG-CG1 3.94Å; L119-W130 HydrophobicContact CB-CD2 4.42Å; L119-W130 HydrophobicContact CB-CH2 4.46Å; L119-W130 HydrophobicContact CB-CZ2 3.65Å; L119-W130 HydrophobicContact CD1-CD2 4.33Å; L119-W130 HydrophobicContact CD1-CE3 4.28Å; L119-W130 HydrophobicContact CD1-CH2 3.67Å; L119-W130 HydrophobicContact CD1-CZ2 3.71Å; L119-W130 HydrophobicContact CD1-CZ3 3.95Å; L119-W130 HydrophobicContact CD2-CD2 3.94Å; L119-W130 HydrophobicContact CD2-CE3 4.41Å; L119-W130 HydrophobicContact CD2-CG 4.08Å; L119-W130 HydrophobicContact CG-CD2 4.47Å; L119-W130 HydrophobicContact CG-CZ2 4.16Å; L119-W130 PolarHBondContact O-NE1 2.89Å; L119-F138 HydrophobicContact CD1-CB 3.86Å; L119-F138 HydrophobicContact CD1-CD1 4.08Å; L119-F138 HydrophobicContact CD1-CD2 4.14Å; L119-F138 HydrophobicContact CD1-CG 3.77Å; L119-F138 HydrophobicContact CD2-CB 3.83Å; L119-F138 HydrophobicContact CD2-CG 4.48Å; L119-F191 HydrophobicContact CD1-CE2 3.72Å
120	N	95.9	Very high	97.2	Very high	97 Å²	97	46.7 Å²	46.7	52%	0.519	24%	0.24	S	C	.	.	H	α-helix	trans	-101	-4.3	176.8	-63.9	-29.9	0	0	0	112.6	H116 E117 A118	H116-N120 PolarHBondContact CE1-ND2 2.75Å; H116-N120 PolarHBondContact NE2-ND2 2.76Å; H116-N120 PolarHBondContact O-N 3.2Å; H116-N120 PolarHBondContact O-ND2 3.4Å; E117-N120 PolarHBondContact O-N 2.59Å; E117-N120 VanDerWaalsContact O-N 3.12Å; A118-N120 PolarHBondContact O-N 2.96Å
121	D	95.9	Very high	97.2	Very high	58 Å²	58	44.5 Å²	44.5	31%	0.31	24%	0.241	S	C	.	.			trans	-91.4	114.3	175.5	-174.7	-9	0	0	0	110	E117 A118 N123 M124	E117-D121 PolarHBondContact O-N 3.46Å; A118-D121 PolarHBondContact O-N 2.75Å; D121-N123 PolarHBondContact O-N 2.86Å; D121-N123 VanDerWaalsContact O-N 3.14Å; D121-N123 VanDerWaalsContact OD1-CB 3.31Å; D121-N123 WeakPolarHBondContact OD1-CB 3.14Å; D121-N123 PolarHBondContact OD1-N 3.36Å; D121-N123 PolarHBondContact OD1-ND2 3.4Å; D121-M124 HydrophobicContact CB-CB 4.26Å; D121-M124 HydrophobicContact CB-CG 3.93Å; D121-M124 HydrophobicContact CB-SD 3.85Å; D121-M124 PolarHBondContact O-N 2.89Å
122	P	93.9	Very high	97.2	Very high	116 Å²	116	47.3 Å²	47.3	75%	0.753	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.6	179.4	25.7	-34.6	0	0	0	112.9	M124	P122-M124 PolarHBondContact O-N 3.09Å
123	N	95.4	Very high	97.1	Very high	134 Å²	134	50.8 Å²	50.8	72%	0.717	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-73	-16.5	178.7	-56.5	-61	0	0	0	113	D121	D121-N123 PolarHBondContact O-N 2.86Å; D121-N123 VanDerWaalsContact O-N 3.14Å; D121-N123 VanDerWaalsContact OD1-CB 3.31Å; D121-N123 WeakPolarHBondContact OD1-CB 3.14Å; D121-N123 PolarHBondContact OD1-N 3.36Å; D121-N123 PolarHBondContact OD1-ND2 3.4Å
124	M	95.6	Very high	97	Very high	27 Å²	27	53.5 Å²	53.5	13%	0.133	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-99	0.1	-175.9	-63	-179.6	74	0	0	112.9	Y114 A118 D121 P122 D126 S127 I128 L148	Y114-M124 HydrophobicContact CE2-CE 4.45Å; Y114-M124 WeakPolarHBondContact OH-CE 3.12Å; A118-M124 VanDerWaalsContact CA-SD 3.53Å; A118-M124 HydrophobicContact CB-CE 3.27Å; A118-M124 HydrophobicContact CB-SD 3.66Å; A118-M124 WeakPolarHBondContact O-CB 3.38Å; D121-M124 HydrophobicContact CB-CB 4.26Å; D121-M124 HydrophobicContact CB-CG 3.93Å; D121-M124 HydrophobicContact CB-SD 3.85Å; D121-M124 PolarHBondContact O-N 2.89Å; P122-M124 PolarHBondContact O-N 3.09Å; M124-D126 PolarHBondContact O-N 2.77Å; M124-S127 PolarHBondContact O-N 3.25Å; M124-S127 PolarHBondContact O-OG 2.99Å; M124-I128 HydrophobicContact CB-CG2 4.5Å; M124-I128 PolarHBondContact O-N 3.33Å; M124-L148 HydrophobicContact CE-CD1 3.2Å
125	G	94.9	Very high	96.9	Very high	26 Å²	26	55.1 Å²	55.1	27%	0.268	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-19.3	-179.1	0	0	0	0	0	114.1	S127 Q129	G125-S127 PolarHBondContact O-N 3.39Å; G125-Q129 WeakPolarHBondContact O-CG 3.41Å; G125-Q129 PolarHBondContact O-NE2 3.42Å
126	D	97.3	Very high	96.9	Very high	76 Å²	76	55.1 Å²	55.1	41%	0.406	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-9.6	175	81.2	-27.4	0	0	0	113.6	M124 I141 N144	M124-D126 PolarHBondContact O-N 2.77Å; D126-I141 VanDerWaalsContact O-CB 3.26Å; D126-I141 WeakPolarHBondContact O-CB 3.45Å; D126-I141 WeakPolarHBondContact O-CG1 3.46Å; D126-I141 WeakPolarHBondContact O-CG2 3.44Å; D126-N144 VanDerWaalsContact CG-ND2 3.34Å; D126-N144 WeakPolarHBondContact O-CB 3.29Å; D126-N144 PolarHBondContact O-ND2 2.97Å; D126-N144 PolarHBondContact OD2-ND2 3.07Å
127	S	98.2	Very high	96.9	Very high	5 Å²	5	55.2 Å²	55.2	4%	0.035	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-31.8	-170.3	72.9	0	0	0	0	114.1	M124 G125 I141	M124-S127 PolarHBondContact O-N 3.25Å; M124-S127 PolarHBondContact O-OG 2.99Å; G125-S127 PolarHBondContact O-N 3.39Å; S127-I141 PolarHBondContact O-N 3.41Å
128	I	98.6	Very high	96.9	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.015	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	138.9	177.2	-171.1	172.9	0	0	0	109.8	L115 A118 L119 M124 F138 H139 F140 L148	L115-I128 HydrophobicContact CB-CD1 4.42Å; L115-I128 HydrophobicContact CD2-CD1 3.92Å; A118-I128 HydrophobicContact CB-CG2 3.9Å; L119-I128 HydrophobicContact CD1-CD1 4.1Å; L119-I128 HydrophobicContact CD2-CD1 4.11Å; L119-I128 HydrophobicContact CD2-CG1 3.69Å; L119-I128 HydrophobicContact CG-CD1 3.8Å; L119-I128 HydrophobicContact CG-CG1 3.94Å; M124-I128 HydrophobicContact CB-CG2 4.5Å; M124-I128 PolarHBondContact O-N 3.33Å; I128-F138 HydrophobicContact CD1-CD2 3.78Å; I128-F138 HydrophobicContact CD1-CE2 3.96Å; I128-F138 HydrophobicContact CG1-CD2 4.05Å; I128-H139 WeakPolarHBondContact CA-O 3.24Å; I128-F140 HydrophobicContact CB-CD1 4.45Å; I128-F140 HydrophobicContact CD1-CD1 4.19Å; I128-F140 HydrophobicContact CD1-CE1 3.84Å; I128-F140 HydrophobicContact CD1-CZ 4.39Å; I128-F140 HydrophobicContact CG1-CD1 4.3Å; I128-F140 HydrophobicContact CG1-CE1 4.44Å; I128-L148 HydrophobicContact CB-CD2 3.93Å; I128-L148 HydrophobicContact CD1-CD2 4.12Å; I128-L148 HydrophobicContact CG2-CD1 4.14Å; I128-L148 HydrophobicContact CG2-CD2 4.17Å
129	Q	98.4	Very high	97	Very high	83 Å²	83	53.8 Å²	53.8	39%	0.388	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.5	-177.6	-63.8	-177.9	6.3	0	0	111.7	G125 T131 F138 H139 I141	G125-Q129 WeakPolarHBondContact O-CG 3.41Å; G125-Q129 PolarHBondContact O-NE2 3.42Å; Q129-T131 PolarHBondContact O-N 2.99Å; Q129-F138 CarbonylContact O-C 3.58Å; Q129-F138 VanDerWaalsContact O-CA 3.27Å; Q129-F138 WeakPolarHBondContact O-CA 3.45Å; Q129-F138 WeakPolarHBondContact O-CB 3.45Å; Q129-H139 PolarHBondContact N-O 2.81Å; Q129-H139 PolarHBondContact O-N 3Å; Q129-H139 PolarHBondContact O-ND1 3.12Å; Q129-I141 HydrophobicContact CG-CD1 4.14Å; Q129-I141 HydrophobicContact CG-CG1 4.38Å
130	W	98.3	Very high	97	Very high	59 Å²	59	53.1 Å²	53.1	22%	0.223	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	128.6	162.9	-64.9	112.5	0	0	0	109.4	L119 F138 F191 L196	L119-W130 HydrophobicContact CB-CD2 4.42Å; L119-W130 HydrophobicContact CB-CH2 4.46Å; L119-W130 HydrophobicContact CB-CZ2 3.65Å; L119-W130 HydrophobicContact CD1-CD2 4.33Å; L119-W130 HydrophobicContact CD1-CE3 4.28Å; L119-W130 HydrophobicContact CD1-CH2 3.67Å; L119-W130 HydrophobicContact CD1-CZ2 3.71Å; L119-W130 HydrophobicContact CD1-CZ3 3.95Å; L119-W130 HydrophobicContact CD2-CD2 3.94Å; L119-W130 HydrophobicContact CD2-CE3 4.41Å; L119-W130 HydrophobicContact CD2-CG 4.08Å; L119-W130 HydrophobicContact CG-CD2 4.47Å; L119-W130 HydrophobicContact CG-CZ2 4.16Å; L119-W130 PolarHBondContact O-NE1 2.89Å; W130-F138 HydrophobicContact CE3-CB 3.92Å; W130-F138 HydrophobicContact CZ3-CB 4.21Å; W130-F138 HydrophobicContact CZ3-CD1 4.37Å; W130-F191 AromaticContact CH2-CD2 3.89Å; W130-F191 HydrophobicContact CH2-CD2 3.89Å; W130-F191 HydrophobicContact CH2-CE2 4.12Å; W130-F191 HydrophobicContact CZ3-CD2 4.02Å; W130-F191 HydrophobicContact CZ3-CE2 4.47Å; W130-L196 HydrophobicContact CH2-CD1 3.9Å; W130-L196 HydrophobicContact CZ2-CD1 4.47Å
131	T	97.9	Very high	97.2	Very high	84 Å²	84	50.4 Å²	50.4	52%	0.515	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-40.6	163.2	-59.6	0	0	0	0	109.4	Q129 T137 H139	Q129-T131 PolarHBondContact O-N 2.99Å; T131-T137 PolarHBondContact N-O 3.06Å; T131-H139 PolarHBondContact OG1-ND1 3.35Å
132	D	97.6	Very high	97.3	Very high	63 Å²	63	50.6 Å²	50.6	34%	0.337	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	108.3	173.3	170.5	14.9	0	0	0	107.6	S134 S135 G136 T137	D132-S134 VanDerWaalsContact C-N 3.28Å; D132-S134 PolarHBondContact O-N 2.99Å; D132-S134 WeakPolarHBondContact OD1-CB 3.39Å; D132-S134 PolarHBondContact OD1-N 3.42Å; D132-S134 PolarHBondContact OD1-OG 2.97Å; D132-S134 PolarHBondContact OD2-OG 3.43Å; D132-S135 WeakPolarHBondContact CB-OG 3.31Å; D132-S135 PolarHBondContact OD1-N 3.13Å; D132-S135 WeakPolarHBondContact OD2-CB 3.32Å; D132-S135 PolarHBondContact OD2-N 3.19Å; D132-S135 PolarHBondContact OD2-OG 3.28Å; D132-G136 PolarHBondContact O-N 3.4Å; D132-T137 PolarHBondContact N-O 2.89Å; D132-T137 PolarHBondContact O-N 3.47Å
133	S	95.4	Very high	97.5	Very high	79 Å²	79	54 Å²	54	55%	0.552	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-27.5	-178.9	53.5	0	0	0	0	112.4	G136	S133-G136 PolarHBondContact O-N 3.04Å
134	S	95.2	Very high	97.6	Very high	104 Å²	104	48.7 Å²	48.7	73%	0.727	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-42.1	-178.8	72.2	0	0	0	0	111.8	D132 G136	D132-S134 VanDerWaalsContact C-N 3.28Å; D132-S134 PolarHBondContact O-N 2.99Å; D132-S134 WeakPolarHBondContact OD1-CB 3.39Å; D132-S134 PolarHBondContact OD1-N 3.42Å; D132-S134 PolarHBondContact OD1-OG 2.97Å; D132-S134 PolarHBondContact OD2-OG 3.43Å; S134-G136 VanDerWaalsContact C-N 3.31Å
135	S	96.4	Very high	97.8	Very high	36 Å²	36	49.4 Å²	49.4	25%	0.252	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.3	173.8	67	0	0	0	0	113.9	D132 T137 Q190	D132-S135 WeakPolarHBondContact CB-OG 3.31Å; D132-S135 PolarHBondContact OD1-N 3.13Å; D132-S135 WeakPolarHBondContact OD2-CB 3.32Å; D132-S135 PolarHBondContact OD2-N 3.19Å; D132-S135 PolarHBondContact OD2-OG 3.28Å; S135-T137 VanDerWaalsContact C-N 3.25Å; S135-T137 PolarHBondContact O-N 3.33Å; S135-T137 PolarHBondContact OG-OG1 3.05Å; S135-Q190 WeakPolarHBondContact O-CG 3.38Å; S135-Q190 PolarHBondContact O-NE2 3.14Å
136	G	97.9	Very high	97.9	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.01	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	21.7	-175.2	0	0	0	0	0	114	D132 S133 S134 Q190 F191	D132-G136 PolarHBondContact O-N 3.4Å; S133-G136 PolarHBondContact O-N 3.04Å; S134-G136 VanDerWaalsContact C-N 3.31Å; G136-Q190 WeakPolarHBondContact O-CA 3.21Å; G136-F191 PolarHBondContact O-N 3.4Å
137	T	98.6	Very high	98	Very high	15 Å²	15	53 Å²	53	9%	0.092	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.4	179.7	-57	0	0	0	0	110.6	T131 D132 S135 T188	T131-T137 PolarHBondContact N-O 3.06Å; D132-T137 PolarHBondContact N-O 2.89Å; D132-T137 PolarHBondContact O-N 3.47Å; S135-T137 VanDerWaalsContact C-N 3.25Å; S135-T137 PolarHBondContact O-N 3.33Å; S135-T137 PolarHBondContact OG-OG1 3.05Å; T137-T188 HydrophobicContact CG2-CG2 3.69Å
138	F	98.8	Very high	98	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	164.6	179.5	69.9	-86.9	0	0	0	112.1	L115 L119 I128 Q129 W130 F140 I180 T188 Y189 F191	L115-F138 HydrophobicContact CD1-CE2 4.48Å; L115-F138 HydrophobicContact CD1-CZ 4.3Å; L119-F138 HydrophobicContact CD1-CB 3.86Å; L119-F138 HydrophobicContact CD1-CD1 4.08Å; L119-F138 HydrophobicContact CD1-CD2 4.14Å; L119-F138 HydrophobicContact CD1-CG 3.77Å; L119-F138 HydrophobicContact CD2-CB 3.83Å; L119-F138 HydrophobicContact CD2-CG 4.48Å; I128-F138 HydrophobicContact CD1-CD2 3.78Å; I128-F138 HydrophobicContact CD1-CE2 3.96Å; I128-F138 HydrophobicContact CG1-CD2 4.05Å; Q129-F138 CarbonylContact O-C 3.58Å; Q129-F138 VanDerWaalsContact O-CA 3.27Å; Q129-F138 WeakPolarHBondContact O-CA 3.45Å; Q129-F138 WeakPolarHBondContact O-CB 3.45Å; W130-F138 HydrophobicContact CE3-CB 3.92Å; W130-F138 HydrophobicContact CZ3-CB 4.21Å; W130-F138 HydrophobicContact CZ3-CD1 4.37Å; F138-F140 AromaticContact CE2-CE2 3.92Å; F138-F140 HydrophobicContact CE2-CE2 3.92Å; F138-F140 AromaticContact CE2-CZ 3.91Å; F138-F140 HydrophobicContact CE2-CZ 3.91Å; F138-I180 HydrophobicContact CE1-CG2 4.27Å; F138-I180 HydrophobicContact CZ-CD1 4.23Å; F138-I180 HydrophobicContact CZ-CG2 4.21Å; F138-T188 CarbonylContact O-C 3.56Å; F138-T188 WeakPolarHBondContact O-CA 3.46Å; F138-T188 WeakPolarHBondContact O-CG2 3.4Å; F138-Y189 WeakPolarHBondContact CD1-O 3.42Å; F138-Y189 HydrophobicContact CE2-CD2 4.4Å; F138-Y189 HydrophobicContact CZ-CG 4.34Å; F138-Y189 PolarHBondContact N-O 3.3Å; F138-Y189 PolarHBondContact O-N 2.7Å; F138-F191 AromaticContact CD1-CD2 3.59Å; F138-F191 HydrophobicContact CD1-CD2 3.59Å; F138-F191 AromaticContact CD1-CE2 3.64Å; F138-F191 HydrophobicContact CD1-CE2 3.64Å; F138-F191 AromaticContact CE1-CD2 3.43Å; F138-F191 HydrophobicContact CE1-CD2 3.43Å; F138-F191 VanDerWaalsContact CE1-CD2 3.43Å; F138-F191 AromaticContact CE1-CE2 3.32Å; F138-F191 HydrophobicContact CE1-CE2 3.32Å; F138-F191 HydrophobicContact CE1-CG 4.33Å; F138-F191 HydrophobicContact CE1-CZ 4.17Å; F138-F191 HydrophobicContact CZ-CE2 4.03Å
139	H	98.8	Very high	98	Very high	47 Å²	47	52.6 Å²	52.6	22%	0.218	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	152.9	175.5	70.2	-71.4	0	0	0	112.4	I128 Q129 T131 I141 L187 T188	I128-H139 WeakPolarHBondContact CA-O 3.24Å; Q129-H139 PolarHBondContact N-O 2.81Å; Q129-H139 PolarHBondContact O-N 3Å; Q129-H139 PolarHBondContact O-ND1 3.12Å; T131-H139 PolarHBondContact OG1-ND1 3.35Å; H139-I141 VanDerWaalsContact NE2-CD1 3.33Å; H139-I141 WeakPolarHBondContact NE2-CD1 3.48Å; H139-L187 VanDerWaalsContact CA-O 3.29Å; H139-L187 WeakPolarHBondContact CA-O 3.17Å; H139-T188 HydrophobicContact CB-CG2 4.49Å
140	F	98.8	Very high	98	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.009	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	138.2	169.6	-56.5	-88.4	0	0	0	110.3	L115 I128 F138 S142 K145 L148 Y164 M167 L171 L187 Y189	L115-F140 HydrophobicContact CD1-CZ 4.18Å; L115-F140 HydrophobicContact CD2-CE1 3.8Å; L115-F140 HydrophobicContact CD2-CZ 4.02Å; I128-F140 HydrophobicContact CB-CD1 4.45Å; I128-F140 HydrophobicContact CD1-CD1 4.19Å; I128-F140 HydrophobicContact CD1-CE1 3.84Å; I128-F140 HydrophobicContact CD1-CZ 4.39Å; I128-F140 HydrophobicContact CG1-CD1 4.3Å; I128-F140 HydrophobicContact CG1-CE1 4.44Å; F138-F140 AromaticContact CE2-CE2 3.92Å; F138-F140 HydrophobicContact CE2-CE2 3.92Å; F138-F140 AromaticContact CE2-CZ 3.91Å; F138-F140 HydrophobicContact CE2-CZ 3.91Å; F140-S142 PolarHBondContact O-N 3.45Å; F140-K145 HydrophobicContact CB-CB 3.97Å; F140-L148 HydrophobicContact CD1-CD2 3.43Å; F140-L148 VanDerWaalsContact CD1-CD2 3.43Å; F140-L148 HydrophobicContact CE1-CD2 3.35Å; F140-Y164 HydrophobicContact CB-CE2 4.19Å; F140-Y164 HydrophobicContact CD1-CE2 4.03Å; F140-Y164 AromaticContact CD2-CE2 3.62Å; F140-Y164 HydrophobicContact CD2-CE2 3.62Å; F140-Y164 AromaticContact CD2-CZ 3.99Å; F140-Y164 WeakPolarHBondContact CD2-OH 3.27Å; F140-Y164 HydrophobicContact CE1-CE2 4.31Å; F140-Y164 AromaticContact CE2-CE2 3.95Å; F140-Y164 HydrophobicContact CE2-CE2 3.95Å; F140-Y164 AromaticContact CG-CE2 3.67Å; F140-Y164 HydrophobicContact CG-CE2 3.67Å; F140-Y164 HydrophobicContact CZ-CE2 4.28Å; F140-M167 HydrophobicContact CD1-CE 4.2Å; F140-M167 HydrophobicContact CE1-CE 3.58Å; F140-M167 HydrophobicContact CZ-CE 4Å; F140-L171 HydrophobicContact CE2-CD1 3.61Å; F140-L171 HydrophobicContact CZ-CD1 3.72Å; F140-L187 HydrophobicContact CB-CB 4.15Å; F140-L187 WeakPolarHBondContact CD2-O 3.49Å; F140-L187 PolarHBondContact N-O 3.03Å; F140-L187 WeakPolarHBondContact O-CB 3.02Å; F140-L187 VanDerWaalsContact O-CD1 3.32Å; F140-L187 WeakPolarHBondContact O-CD1 3.4Å; F140-Y189 AromaticContact CD2-CD2 3.96Å; F140-Y189 HydrophobicContact CD2-CD2 3.96Å; F140-Y189 AromaticContact CD2-CE2 3.78Å; F140-Y189 HydrophobicContact CD2-CE2 3.78Å; F140-Y189 AromaticContact CE2-CD2 3.52Å; F140-Y189 HydrophobicContact CE2-CD2 3.52Å; F140-Y189 AromaticContact CE2-CE2 3.47Å; F140-Y189 HydrophobicContact CE2-CE2 3.47Å; F140-Y189 VanDerWaalsContact CE2-CE2 3.47Å
141	I	98.6	Very high	98	Very high	40 Å²	40	52.6 Å²	52.6	21%	0.205	29%	0.288	C	S	.	.			trans	-76.7	118.4	174.6	-54.7	-58.8	0	0	0	109	D126 S127 Q129 H139 K143 N144 K145	D126-I141 VanDerWaalsContact O-CB 3.26Å; D126-I141 WeakPolarHBondContact O-CB 3.45Å; D126-I141 WeakPolarHBondContact O-CG1 3.46Å; D126-I141 WeakPolarHBondContact O-CG2 3.44Å; S127-I141 PolarHBondContact O-N 3.41Å; Q129-I141 HydrophobicContact CG-CD1 4.14Å; Q129-I141 HydrophobicContact CG-CG1 4.38Å; H139-I141 VanDerWaalsContact NE2-CD1 3.33Å; H139-I141 WeakPolarHBondContact NE2-CD1 3.48Å; I141-K143 PolarHBondContact O-N 2.93Å; I141-N144 PolarHBondContact O-N 3.43Å; I141-K145 WeakPolarHBondContact O-CB 3.38Å; I141-K145 PolarHBondContact O-N 3.46Å
142	S	98.4	Very high	98	Very high	62 Å²	62	49.4 Å²	49.4	43%	0.434	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-36.8	-169.8	-172.4	0	0	0	0	114.3	F140 K145	F140-S142 PolarHBondContact O-N 3.45Å; S142-K145 PolarHBondContact O-NZ 3.45Å; S142-K145 VanDerWaalsContact O-NZ 3.15Å
143	K	98.3	Very high	98	Very high	189 Å²	189	46.6 Å²	46.6	82%	0.822	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-37.5	-178.9	-173.3	179.1	179.1	-178.4	0	112.8	I141	I141-K143 PolarHBondContact O-N 2.93Å
144	N	98.3	Very high	98.1	Very high	22 Å²	22	49.8 Å²	49.8	12%	0.118	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	3.2	-169.6	-71.4	-30.4	0	0	0	114	D126 I141 E146 K147 L148	D126-N144 VanDerWaalsContact CG-ND2 3.34Å; D126-N144 WeakPolarHBondContact O-CB 3.29Å; D126-N144 PolarHBondContact O-ND2 2.97Å; D126-N144 PolarHBondContact OD2-ND2 3.07Å; I141-N144 PolarHBondContact O-N 3.43Å; N144-E146 PolarHBondContact O-N 3.46Å; N144-E146 VanDerWaalsContact O-N 3.11Å; N144-K147 HydrophobicContact CB-CD 4.37Å; N144-K147 WeakPolarHBondContact O-CB 3.49Å; N144-K147 PolarHBondContact O-N 2.99Å; N144-K147 PolarHBondContact OD1-NZ 2.76Å; N144-L148 PolarHBondContact O-N 3.3Å
145	K	98.4	Very high	98.2	Very high	41 Å²	41	51.4 Å²	51.4	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-27.5	178.4	72.3	-173.1	-173.5	-48.7	0	114.3	F140 I141 S142 A149 Y164 L187	F140-K145 HydrophobicContact CB-CB 3.97Å; I141-K145 WeakPolarHBondContact O-CB 3.38Å; I141-K145 PolarHBondContact O-N 3.46Å; S142-K145 PolarHBondContact O-NZ 3.45Å; S142-K145 VanDerWaalsContact O-NZ 3.15Å; K145-A149 PolarHBondContact O-N 3.44Å; K145-Y164 HydrophobicContact CB-CD2 3.83Å; K145-Y164 HydrophobicContact CB-CE2 4.31Å; K145-Y164 HydrophobicContact CB-CG 4.24Å; K145-Y164 HydrophobicContact CD-CD1 3.74Å; K145-Y164 HydrophobicContact CD-CD2 4.02Å; K145-Y164 HydrophobicContact CD-CE1 4.12Å; K145-Y164 HydrophobicContact CD-CE2 4.39Å; K145-Y164 HydrophobicContact CD-CG 3.7Å; K145-Y164 HydrophobicContact CG-CD1 4.41Å; K145-Y164 HydrophobicContact CG-CD2 3.99Å; K145-Y164 HydrophobicContact CG-CG 3.87Å; K145-L187 HydrophobicContact CD-CD1 4.09Å; K145-L187 HydrophobicContact CD-CD2 3.96Å
146	E	98.6	Very high	98.1	Very high	66 Å²	66	52.5 Å²	52.5	31%	0.308	25%	0.249	S	C	.	.	H	α-helix	trans	-70.3	-41.4	176.3	-58.9	-49.7	138.3	0	0	111	N144 L148 A149 E150 Y164	N144-E146 PolarHBondContact O-N 3.46Å; N144-E146 VanDerWaalsContact O-N 3.11Å; E146-L148 VanDerWaalsContact C-N 3.3Å; E146-L148 PolarHBondContact O-N 3.18Å; E146-A149 WeakPolarHBondContact O-CA 3.25Å; E146-A149 WeakPolarHBondContact O-CB 3.44Å; E146-A149 PolarHBondContact O-N 3.3Å; E146-E150 WeakPolarHBondContact O-CG 3.43Å; E146-E150 PolarHBondContact O-N 3.47Å; E146-Y164 WeakPolarHBondContact OE1-CB 3.49Å; E146-Y164 WeakPolarHBondContact OE2-CB 3.39Å; E146-Y164 PolarHBondContact OE2-N 3.01Å
147	K	98.3	Very high	98	Very high	111 Å²	111	55.4 Å²	55.4	48%	0.483	28%	0.279	S	S	.	.	H	α-helix	trans	-57	-45.1	177.3	-62.1	-177.8	179.3	176	0	111.5	N144 A149 E150 C151	N144-K147 HydrophobicContact CB-CD 4.37Å; N144-K147 WeakPolarHBondContact O-CB 3.49Å; N144-K147 PolarHBondContact O-N 2.99Å; N144-K147 PolarHBondContact OD1-NZ 2.76Å; K147-A149 VanDerWaalsContact C-N 3.32Å; K147-A149 PolarHBondContact O-N 3.27Å; K147-E150 PolarHBondContact O-N 3.17Å; K147-C151 PolarHBondContact O-N 3.26Å; K147-C151 PolarHBondContact O-SG 3.09Å
148	L	98.6	Very high	97.9	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-41.9	175.8	-176.7	75.8	0	0	0	112.1	Y114 L115 A118 M124 I128 F140 N144 E146 C151 W152 M167	Y114-L148 HydrophobicContact CE1-CD1 4.01Å; Y114-L148 HydrophobicContact CE1-CG 4.34Å; L115-L148 HydrophobicContact CD2-CD2 4.09Å; A118-L148 HydrophobicContact CB-CD1 4.03Å; M124-L148 HydrophobicContact CE-CD1 3.2Å; I128-L148 HydrophobicContact CB-CD2 3.93Å; I128-L148 HydrophobicContact CD1-CD2 4.12Å; I128-L148 HydrophobicContact CG2-CD1 4.14Å; I128-L148 HydrophobicContact CG2-CD2 4.17Å; F140-L148 HydrophobicContact CD1-CD2 3.43Å; F140-L148 VanDerWaalsContact CD1-CD2 3.43Å; F140-L148 HydrophobicContact CE1-CD2 3.35Å; N144-L148 PolarHBondContact O-N 3.3Å; E146-L148 VanDerWaalsContact C-N 3.3Å; E146-L148 PolarHBondContact O-N 3.18Å; L148-C151 PolarHBondContact O-N 2.9Å; L148-W152 PolarHBondContact O-N 3.44Å; L148-M167 HydrophobicContact CD2-CE 4.29Å
149	A	98.7	Very high	97.8	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65.1	-40.8	177.8	0	0	0	0	0	111.4	K145 E146 K147 W152 G153 M162 T163 M167	K145-A149 PolarHBondContact O-N 3.44Å; E146-A149 WeakPolarHBondContact O-CA 3.25Å; E146-A149 WeakPolarHBondContact O-CB 3.44Å; E146-A149 PolarHBondContact O-N 3.3Å; K147-A149 VanDerWaalsContact C-N 3.32Å; K147-A149 PolarHBondContact O-N 3.27Å; A149-W152 WeakPolarHBondContact O-CB 3.43Å; A149-W152 PolarHBondContact O-N 3.43Å; A149-G153 PolarHBondContact O-N 3.2Å; A149-M162 CarbonylContact C-O 3.13Å; A149-M162 HydrophobicContact CB-CG 4.22Å; A149-M162 WeakPolarHBondContact O-CB 3.47Å; A149-M162 WeakPolarHBondContact O-CG 3.46Å; A149-T163 VanDerWaalsContact CB-C 3.46Å; A149-M167 HydrophobicContact CB-CE 4.13Å; A149-M167 HydrophobicContact CB-SD 4.25Å
150	E	98.6	Very high	97.8	Very high	87 Å²	87	76.1 Å²	76.1	41%	0.407	36%	0.363	S	S	.	.	H	α-helix	trans	-62	-47.7	174.7	-70.4	171.9	-171.5	0	0	111.6	E146 K147 W152 G153 Q154 T161	E146-E150 WeakPolarHBondContact O-CG 3.43Å; E146-E150 PolarHBondContact O-N 3.47Å; K147-E150 PolarHBondContact O-N 3.17Å; E150-W152 VanDerWaalsContact C-N 3.28Å; E150-W152 PolarHBondContact O-N 3.48Å; E150-G153 CarbonylContact O-C 3.58Å; E150-G153 WeakPolarHBondContact O-CA 3.19Å; E150-G153 PolarHBondContact O-N 3.39Å; E150-Q154 WeakPolarHBondContact O-CG 3.36Å; E150-Q154 PolarHBondContact O-N 3.23Å; E150-T161 HydrophobicContact CG-CG2 3.9Å
151	C	98.1	Very high	97.7	Very high	55 Å²	55	80.3 Å²	80.3	37%	0.372	39%	0.389	S	S	.	.	H	α-helix	trans	-56.8	-40.8	174.5	-70.6	0	0	0	0	111.9	Y114 K147 L148 Q154 R155	Y114-C151 VanDerWaalsContact OH-CB 3.25Å; Y114-C151 WeakPolarHBondContact OH-CB 3.29Å; K147-C151 PolarHBondContact O-N 3.26Å; K147-C151 PolarHBondContact O-SG 3.09Å; L148-C151 PolarHBondContact O-N 2.9Å; C151-Q154 PolarHBondContact O-N 3.34Å; C151-R155 WeakPolarHBondContact O-CB 3.34Å; C151-R155 PolarHBondContact O-N 3.33Å
152	W	98.4	Very high	97.7	Very high	16 Å²	16	79.8 Å²	79.8	6%	0.061	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-44.6	172	171.1	-127.1	0	0	0	112	L109 L111 Y114 L148 A149 E150 Q154 R155 K156	L109-W152 HydrophobicContact CD2-CZ3 4.08Å; L109-W152 HydrophobicContact CG-CZ3 4.36Å; L109-W152 WeakPolarHBondContact O-CH2 3.15Å; L111-W152 HydrophobicContact CB-CH2 4.24Å; L111-W152 HydrophobicContact CB-CZ2 3.72Å; L111-W152 HydrophobicContact CD1-CD2 3.94Å; L111-W152 HydrophobicContact CD1-CG 3.96Å; L111-W152 HydrophobicContact CD1-CZ2 4.37Å; Y114-W152 HydrophobicContact CD1-CB 3.96Å; Y114-W152 HydrophobicContact CD1-CD2 4.1Å; Y114-W152 AromaticContact CD1-CE3 3.64Å; Y114-W152 HydrophobicContact CD1-CE3 3.64Å; Y114-W152 HydrophobicContact CD1-CG 4.26Å; Y114-W152 HydrophobicContact CD1-CZ3 4.38Å; Y114-W152 HydrophobicContact CD2-CE3 4.16Å; Y114-W152 HydrophobicContact CE1-CB 3.63Å; Y114-W152 HydrophobicContact CE1-CE3 4.32Å; Y114-W152 HydrophobicContact CE1-CG 4.41Å; Y114-W152 HydrophobicContact CG-CD2 4.42Å; Y114-W152 AromaticContact CG-CE3 3.52Å; Y114-W152 HydrophobicContact CG-CE3 3.52Å; Y114-W152 AromaticContact CG-CZ3 3.91Å; Y114-W152 HydrophobicContact CG-CZ3 3.91Å; L148-W152 PolarHBondContact O-N 3.44Å; A149-W152 WeakPolarHBondContact O-CB 3.43Å; A149-W152 PolarHBondContact O-N 3.43Å; E150-W152 VanDerWaalsContact C-N 3.28Å; E150-W152 PolarHBondContact O-N 3.48Å; W152-Q154 VanDerWaalsContact C-N 3.33Å; W152-Q154 PolarHBondContact O-N 2.98Å; W152-R155 HydrophobicContact CE3-CB 4.42Å; W152-R155 PolarHBondContact O-N 3.45Å; W152-K156 HydrophobicContact CD2-CG 3.8Å; W152-K156 HydrophobicContact CE3-CD 4.3Å; W152-K156 HydrophobicContact CE3-CG 3.85Å; W152-K156 HydrophobicContact CH2-CD 3.34Å; W152-K156 HydrophobicContact CH2-CG 3.66Å; W152-K156 HydrophobicContact CZ2-CD 3.58Å; W152-K156 HydrophobicContact CZ2-CG 3.52Å; W152-K156 HydrophobicContact CZ3-CD 3.71Å; W152-K156 HydrophobicContact CZ3-CG 3.79Å; W152-K156 WeakPolarHBondContact O-CG 3.33Å; W152-K156 PolarHBondContact O-N 2.98Å
153	G	98	Very high	97.7	Very high	4 Å²	4	78.9 Å²	78.9	4%	0.041	38%	0.378	C	S	.	.	H	α-helix	trans	-58.7	-44.1	176.6	0	0	0	0	0	112.9	A149 E150 K156 G157 N158	A149-G153 PolarHBondContact O-N 3.2Å; E150-G153 CarbonylContact O-C 3.58Å; E150-G153 WeakPolarHBondContact O-CA 3.19Å; E150-G153 PolarHBondContact O-N 3.39Å; G153-K156 CarbonylContact O-C 3.59Å; G153-K156 PolarHBondContact O-N 3.19Å; G153-G157 PolarHBondContact O-N 2.96Å; G153-G157 VanDerWaalsContact O-N 3.12Å; G153-N158 WeakPolarHBondContact CA-ND2 3.5Å; G153-N158 PolarHBondContact O-N 3.43Å
154	Q	97.3	Very high	97.8	Very high	147 Å²	147	70.9 Å²	70.9	69%	0.687	34%	0.343	S	S	*	.	H	α-helix	trans	-63	-47	175	-68.9	174.7	-1.3	0	0	111.4	E150 C151 W152 K156 G157	E150-Q154 WeakPolarHBondContact O-CG 3.36Å; E150-Q154 PolarHBondContact O-N 3.23Å; C151-Q154 PolarHBondContact O-N 3.34Å; W152-Q154 VanDerWaalsContact C-N 3.33Å; W152-Q154 PolarHBondContact O-N 2.98Å; Q154-K156 PolarHBondContact O-N 3.24Å; Q154-K156 VanDerWaalsContact O-N 3.12Å; Q154-G157 PolarHBondContact O-N 3.29Å
155	R	95.8	Very high	97.8	Very high	138 Å²	138	77.1 Å²	77.1	52%	0.521	37%	0.371	S	S	.	.	H	α-helix	trans	-58.6	-26.8	176	-174.3	159.8	-69.6	178.8	6.5	112.6	L109 Y114 E117 C151 W152	L109-R155 HydrophobicContact CD2-CG 4.11Å; Y114-R155 VanDerWaalsContact CD2-NH1 3.29Å; E117-R155 IonicContact OE2-CZ 3.98Å; E117-R155 IonicContact OE2-NH1 2.79Å; E117-R155 PolarHBondContact OE2-NH1 3.47Å; C151-R155 WeakPolarHBondContact O-CB 3.34Å; C151-R155 PolarHBondContact O-N 3.33Å; W152-R155 HydrophobicContact CE3-CB 4.42Å; W152-R155 PolarHBondContact O-N 3.45Å
156	K	95.3	Very high	97.8	Very high	58 Å²	58	80.3 Å²	80.3	25%	0.252	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-7.4	176.1	-65.2	-65.3	-81.8	-163.6	0	115.1	K108 L109 W152 G153 Q154 N158	K108-K156 VanDerWaalsContact CE-NZ 3.32Å; K108-K156 VanDerWaalsContact CG-NZ 3.31Å; L109-K156 PolarHBondContact O-NZ 3.47Å; W152-K156 HydrophobicContact CD2-CG 3.8Å; W152-K156 HydrophobicContact CE3-CD 4.3Å; W152-K156 HydrophobicContact CE3-CG 3.85Å; W152-K156 HydrophobicContact CH2-CD 3.34Å; W152-K156 HydrophobicContact CH2-CG 3.66Å; W152-K156 HydrophobicContact CZ2-CD 3.58Å; W152-K156 HydrophobicContact CZ2-CG 3.52Å; W152-K156 HydrophobicContact CZ3-CD 3.71Å; W152-K156 HydrophobicContact CZ3-CG 3.79Å; W152-K156 WeakPolarHBondContact O-CG 3.33Å; W152-K156 PolarHBondContact O-N 2.98Å; G153-K156 CarbonylContact O-C 3.59Å; G153-K156 PolarHBondContact O-N 3.19Å; Q154-K156 PolarHBondContact O-N 3.24Å; Q154-K156 VanDerWaalsContact O-N 3.12Å; K156-N158 VanDerWaalsContact C-N 3.26Å; K156-N158 WeakPolarHBondContact CB-OD1 3.48Å; K156-N158 PolarHBondContact O-N 3.09Å
157	G	96.1	Very high	97.8	Very high	63 Å²	63	77.2 Å²	77.2	65%	0.649	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	33.7	-173.3	0	0	0	0	0	112.4	G153 Q154 R159	G153-G157 PolarHBondContact O-N 2.96Å; G153-G157 VanDerWaalsContact O-N 3.12Å; Q154-G157 PolarHBondContact O-N 3.29Å; G157-R159 PolarHBondContact O-N 3.4Å
158	N	95.8	Very high	97.8	Very high	67 Å²	67	72.4 Å²	72.4	36%	0.358	35%	0.352	S	S	.	.			trans	-66	130.1	179.3	-69.7	-15.9	0	0	0	110.1	G153 K156 K160 M162	G153-N158 WeakPolarHBondContact CA-ND2 3.5Å; G153-N158 PolarHBondContact O-N 3.43Å; K156-N158 VanDerWaalsContact C-N 3.26Å; K156-N158 WeakPolarHBondContact CB-OD1 3.48Å; K156-N158 PolarHBondContact O-N 3.09Å; N158-K160 WeakPolarHBondContact CB-O 3.27Å; N158-K160 PolarHBondContact O-N 3.21Å; N158-M162 VanDerWaalsContact ND2-CE 3.26Å; N158-M162 WeakPolarHBondContact ND2-CE 3.32Å
159	R	97.4	Very high	97.8	Very high	260 Å²	260	78.9 Å²	78.9	98%	0.981	38%	0.376	S	S	*	.	S	Bend	trans	-65.2	-28.8	175.1	-63.1	-176.2	-179.8	-176.8	-0.9	113.2	G157	G157-R159 PolarHBondContact O-N 3.4Å
160	K	97.8	Very high	97.8	Very high	169 Å²	169	80.3 Å²	80.3	74%	0.735	39%	0.388	S	S	*	.	S	Bend	trans	-110.2	147	178	-64.5	-173.2	179.3	-176.2	0	109.8	N158 M162	N158-K160 WeakPolarHBondContact CB-O 3.27Å; N158-K160 PolarHBondContact O-N 3.21Å; K160-M162 PolarHBondContact O-N 2.75Å
161	T	97.8	Very high	97.8	Very high	91 Å²	91	76.1 Å²	76.1	56%	0.558	37%	0.368	S	S	*	.			trans	-54.1	127.6	175.7	-48.8	0	0	0	0	111.1	E150 K166	E150-T161 HydrophobicContact CG-CG2 3.9Å; T161-K166 PolarHBondContact O-NZ 3.13Å
162	M	98.5	Very high	97.8	Very high	29 Å²	29	79.5 Å²	79.5	14%	0.143	37%	0.373	C	S	.	.			trans	-80.9	128.7	169.3	175.7	63.1	67	0	0	107.9	A149 N158 K160 K166 M167	A149-M162 CarbonylContact C-O 3.13Å; A149-M162 HydrophobicContact CB-CG 4.22Å; A149-M162 WeakPolarHBondContact O-CB 3.47Å; A149-M162 WeakPolarHBondContact O-CG 3.46Å; N158-M162 VanDerWaalsContact ND2-CE 3.26Å; N158-M162 WeakPolarHBondContact ND2-CE 3.32Å; K160-M162 PolarHBondContact O-N 2.75Å; M162-K166 HydrophobicContact SD-CB 3.69Å; M162-M167 HydrophobicContact SD-CB 4.28Å
163	T	98.8	Very high	97.8	Very high	43 Å²	43	81.9 Å²	81.9	26%	0.264	39%	0.387	S	S	.	.			trans	-113.2	159.1	179.2	64.5	0	0	0	0	109.6	A149 Q165 K166 M167	A149-T163 VanDerWaalsContact CB-C 3.46Å; T163-Q165 PolarHBondContact O-N 3.4Å; T163-K166 PolarHBondContact O-N 3.15Å; T163-K166 VanDerWaalsContact O-N 3.09Å; T163-K166 PolarHBondContact OG1-N 3.39Å; T163-M167 PolarHBondContact O-N 3Å
164	Y	98.8	Very high	97.8	Very high	20 Å²	20	83.3 Å²	83.3	8%	0.078	39%	0.392	C	S	.	.	H	α-helix	trans	-56.1	-38.1	176.3	-178.5	-101	0	0	0	111.7	F140 K145 E146 K166 M167 A168 L187 Y189	F140-Y164 HydrophobicContact CB-CE2 4.19Å; F140-Y164 HydrophobicContact CD1-CE2 4.03Å; F140-Y164 AromaticContact CD2-CE2 3.62Å; F140-Y164 HydrophobicContact CD2-CE2 3.62Å; F140-Y164 AromaticContact CD2-CZ 3.99Å; F140-Y164 WeakPolarHBondContact CD2-OH 3.27Å; F140-Y164 HydrophobicContact CE1-CE2 4.31Å; F140-Y164 AromaticContact CE2-CE2 3.95Å; F140-Y164 HydrophobicContact CE2-CE2 3.95Å; F140-Y164 AromaticContact CG-CE2 3.67Å; F140-Y164 HydrophobicContact CG-CE2 3.67Å; F140-Y164 HydrophobicContact CZ-CE2 4.28Å; K145-Y164 HydrophobicContact CB-CD2 3.83Å; K145-Y164 HydrophobicContact CB-CE2 4.31Å; K145-Y164 HydrophobicContact CB-CG 4.24Å; K145-Y164 HydrophobicContact CD-CD1 3.74Å; K145-Y164 HydrophobicContact CD-CD2 4.02Å; K145-Y164 HydrophobicContact CD-CE1 4.12Å; K145-Y164 HydrophobicContact CD-CE2 4.39Å; K145-Y164 HydrophobicContact CD-CG 3.7Å; K145-Y164 HydrophobicContact CG-CD1 4.41Å; K145-Y164 HydrophobicContact CG-CD2 3.99Å; K145-Y164 HydrophobicContact CG-CG 3.87Å; E146-Y164 WeakPolarHBondContact OE1-CB 3.49Å; E146-Y164 WeakPolarHBondContact OE2-CB 3.39Å; E146-Y164 PolarHBondContact OE2-N 3.01Å; Y164-K166 PolarHBondContact O-N 3.32Å; Y164-M167 HydrophobicContact CD2-CE 3.61Å; Y164-M167 HydrophobicContact CE2-CE 3.92Å; Y164-M167 PolarHBondContact O-N 3.38Å; Y164-A168 HydrophobicContact CE1-CB 4.16Å; Y164-A168 VanDerWaalsContact O-CB 3.25Å; Y164-A168 WeakPolarHBondContact O-CB 3.4Å; Y164-A168 PolarHBondContact O-N 3.18Å; Y164-L187 HydrophobicContact CD1-CD2 4.39Å; Y164-L187 HydrophobicContact CE1-CD2 3.42Å; Y164-L187 VanDerWaalsContact CE1-CD2 3.42Å; Y164-L187 HydrophobicContact CE2-CD2 4.3Å; Y164-L187 WeakPolarHBondContact OH-CD2 3.38Å; Y164-Y189 PolarHBondContact OH-OH 2.7Å
165	Q	98.8	Very high	97.8	Very high	153 Å²	153	78.3 Å²	78.3	72%	0.715	37%	0.373	S	S	*	.	H	α-helix	trans	-59.1	-43.2	177.5	-177.1	-179.5	-18.2	0	0	112.8	T163 R169	T163-Q165 PolarHBondContact O-N 3.4Å; Q165-R169 PolarHBondContact O-N 3.35Å
166	K	98.6	Very high	97.8	Very high	108 Å²	108	81.6 Å²	81.6	47%	0.47	39%	0.385	S	S	.	.	H	α-helix	trans	-69.6	-41.6	176.5	-68.5	175.6	-172	169.3	0	111.1	T161 M162 T163 Y164 A168 R169 A170	T161-K166 PolarHBondContact O-NZ 3.13Å; M162-K166 HydrophobicContact SD-CB 3.69Å; T163-K166 PolarHBondContact O-N 3.15Å; T163-K166 VanDerWaalsContact O-N 3.09Å; T163-K166 PolarHBondContact OG1-N 3.39Å; Y164-K166 PolarHBondContact O-N 3.32Å; K166-A168 VanDerWaalsContact C-N 3.34Å; K166-A168 PolarHBondContact O-N 3.24Å; K166-R169 VanDerWaalsContact O-CB 3.29Å; K166-R169 WeakPolarHBondContact O-CB 3.47Å; K166-R169 PolarHBondContact O-N 2.76Å; K166-R169 VanDerWaalsContact O-N 3.13Å; K166-A170 PolarHBondContact O-N 3.49Å
167	M	98.7	Very high	97.8	Very high	1 Å²	1	83.3 Å²	83.3	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-62.1	-42.2	175.9	-170.6	172	68.9	0	0	111.7	L111 F140 L148 A149 M162 T163 Y164 R169 A170 L171	L111-M167 HydrophobicContact CD1-CG 3.86Å; L111-M167 HydrophobicContact CD1-SD 3.78Å; L111-M167 HydrophobicContact CD2-CG 3.57Å; L111-M167 HydrophobicContact CG-CG 4.37Å; F140-M167 HydrophobicContact CD1-CE 4.2Å; F140-M167 HydrophobicContact CE1-CE 3.58Å; F140-M167 HydrophobicContact CZ-CE 4Å; L148-M167 HydrophobicContact CD2-CE 4.29Å; A149-M167 HydrophobicContact CB-CE 4.13Å; A149-M167 HydrophobicContact CB-SD 4.25Å; M162-M167 HydrophobicContact SD-CB 4.28Å; T163-M167 PolarHBondContact O-N 3Å; Y164-M167 HydrophobicContact CD2-CE 3.61Å; Y164-M167 HydrophobicContact CE2-CE 3.92Å; Y164-M167 PolarHBondContact O-N 3.38Å; M167-R169 PolarHBondContact O-N 2.98Å; M167-A170 WeakPolarHBondContact O-CA 3.14Å; M167-A170 WeakPolarHBondContact O-CB 3.32Å; M167-A170 PolarHBondContact O-N 3.17Å; M167-L171 PolarHBondContact O-N 2.88Å
168	A	98.7	Very high	97.9	Very high	10 Å²	10	81.5 Å²	81.5	8%	0.083	38%	0.382	C	S	.	.	H	α-helix	trans	-62.7	-28.6	175.4	0	0	0	0	0	112.3	Y164 K166 A170 L171 R172	Y164-A168 HydrophobicContact CE1-CB 4.16Å; Y164-A168 VanDerWaalsContact O-CB 3.25Å; Y164-A168 WeakPolarHBondContact O-CB 3.4Å; Y164-A168 PolarHBondContact O-N 3.18Å; K166-A168 VanDerWaalsContact C-N 3.34Å; K166-A168 PolarHBondContact O-N 3.24Å; A168-A170 VanDerWaalsContact C-N 3.35Å; A168-L171 PolarHBondContact O-N 3.37Å; A168-R172 WeakPolarHBondContact O-CG 3.16Å; A168-R172 PolarHBondContact O-N 2.79Å
169	R	98.7	Very high	98	Very high	137 Å²	137	79.6 Å²	79.6	52%	0.517	37%	0.371	S	S	.	.	H	α-helix	trans	-61.7	-42.9	169.5	-179.7	58.1	-178.9	-179.1	2	111.7	Q165 K166 M167 R172 N173	Q165-R169 PolarHBondContact O-N 3.35Å; K166-R169 VanDerWaalsContact O-CB 3.29Å; K166-R169 WeakPolarHBondContact O-CB 3.47Å; K166-R169 PolarHBondContact O-N 2.76Å; K166-R169 VanDerWaalsContact O-N 3.13Å; M167-R169 PolarHBondContact O-N 2.98Å; R169-R172 PolarHBondContact O-N 3.31Å; R169-N173 PolarHBondContact O-N 3.32Å
170	A	98	Very high	98.1	Very high	30 Å²	30	67.2 Å²	67.2	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-66.7	-40.3	175.7	0	0	0	0	0	112.1	L111 K166 M167 A168 R172 N173 Y174	L111-A170 HydrophobicContact CD2-CB 3.75Å; K166-A170 PolarHBondContact O-N 3.49Å; M167-A170 WeakPolarHBondContact O-CA 3.14Å; M167-A170 WeakPolarHBondContact O-CB 3.32Å; M167-A170 PolarHBondContact O-N 3.17Å; A168-A170 VanDerWaalsContact C-N 3.35Å; A170-R172 VanDerWaalsContact C-N 3.29Å; A170-R172 PolarHBondContact O-N 3.48Å; A170-N173 WeakPolarHBondContact O-CA 3.47Å; A170-N173 WeakPolarHBondContact O-CB 3.33Å; A170-N173 PolarHBondContact O-N 2.7Å; A170-Y174 PolarHBondContact O-N 3.12Å; A170-Y174 VanDerWaalsContact O-N 3.09Å
171	L	98.6	Very high	98.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.9	-39.6	175.7	-69.4	176.8	0	0	0	112.8	L111 L115 F140 M167 A168 N173 Y174 S175 I180 Y189	L111-L171 HydrophobicContact CD2-CD2 4.24Å; L111-L171 HydrophobicContact CD2-CG 4.35Å; L115-L171 HydrophobicContact CD1-CD2 3.68Å; F140-L171 HydrophobicContact CE2-CD1 3.61Å; F140-L171 HydrophobicContact CZ-CD1 3.72Å; M167-L171 PolarHBondContact O-N 2.88Å; A168-L171 PolarHBondContact O-N 3.37Å; L171-N173 PolarHBondContact O-N 3.19Å; L171-Y174 HydrophobicContact CD2-CD2 4.15Å; L171-Y174 PolarHBondContact O-N 3.38Å; L171-Y174 VanDerWaalsContact O-N 3.12Å; L171-S175 PolarHBondContact O-N 3.43Å; L171-S175 VanDerWaalsContact O-N 3.12Å; L171-S175 PolarHBondContact O-OG 3.39Å; L171-I180 HydrophobicContact CD2-CD1 3.91Å; L171-I180 HydrophobicContact CD2-CG2 4.36Å; L171-Y189 HydrophobicContact CB-CD1 4.35Å; L171-Y189 HydrophobicContact CB-CE1 3.81Å; L171-Y189 HydrophobicContact CD1-CD1 4.26Å; L171-Y189 HydrophobicContact CD1-CD2 4.27Å; L171-Y189 HydrophobicContact CD1-CE1 3.81Å; L171-Y189 HydrophobicContact CD1-CE2 3.86Å; L171-Y189 HydrophobicContact CD1-CG 4.47Å; L171-Y189 HydrophobicContact CG-CE1 4.38Å
172	R	98.4	Very high	98.1	Very high	125 Å²	125	62.4 Å²	62.4	47%	0.472	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-32	174	-73.6	-179.2	-67.8	-131.9	-1.6	112.9	A168 R169 A170 S175	A168-R172 WeakPolarHBondContact O-CG 3.16Å; A168-R172 PolarHBondContact O-N 2.79Å; R169-R172 PolarHBondContact O-N 3.31Å; A170-R172 VanDerWaalsContact C-N 3.29Å; A170-R172 PolarHBondContact O-N 3.48Å; R172-S175 PolarHBondContact O-N 3.03Å
173	N	98.3	Very high	98.1	Very high	67 Å²	67	62.1 Å²	62.1	36%	0.358	30%	0.301	S	S	.	.	H	α-helix	trans	-68.7	-39.8	173.9	-62.2	-17.2	0	0	0	110.4	R169 A170 L171 S175 R176 T177	R169-N173 PolarHBondContact O-N 3.32Å; A170-N173 WeakPolarHBondContact O-CA 3.47Å; A170-N173 WeakPolarHBondContact O-CB 3.33Å; A170-N173 PolarHBondContact O-N 2.7Å; L171-N173 PolarHBondContact O-N 3.19Å; N173-S175 PolarHBondContact O-N 3.14Å; N173-R176 WeakPolarHBondContact O-CB 3.46Å; N173-R176 PolarHBondContact O-N 3.02Å; N173-T177 PolarHBondContact O-N 3.28Å; N173-T177 PolarHBondContact O-OG1 3.33Å
174	Y	98.3	Very high	98	Very high	34 Å²	34	72.1 Å²	72.1	13%	0.133	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-26.1	175.4	-63	-39.5	0	0	0	114.2	L111 Y112 A170 L171 R176 T177 G178 E179 I180	L111-Y174 HydrophobicContact CB-CE2 3.91Å; L111-Y174 HydrophobicContact CD2-CE2 4.12Å; L111-Y174 HydrophobicContact CG-CE2 4.21Å; L111-Y174 PolarHBondContact N-OH 2.97Å; Y112-Y174 HydrophobicContact CD1-CE1 4.04Å; Y112-Y174 HydrophobicContact CD1-CE2 4.38Å; Y112-Y174 AromaticContact CD1-CZ 3.91Å; A170-Y174 PolarHBondContact O-N 3.12Å; A170-Y174 VanDerWaalsContact O-N 3.09Å; L171-Y174 HydrophobicContact CD2-CD2 4.15Å; L171-Y174 PolarHBondContact O-N 3.38Å; L171-Y174 VanDerWaalsContact O-N 3.12Å; Y174-R176 PolarHBondContact O-N 3.42Å; Y174-T177 VanDerWaalsContact CA-OG1 3.32Å; Y174-T177 WeakPolarHBondContact CA-OG1 3.33Å; Y174-T177 PolarHBondContact O-N 2.86Å; Y174-G178 WeakPolarHBondContact O-CA 3.48Å; Y174-G178 PolarHBondContact O-N 2.95Å; Y174-E179 PolarHBondContact O-N 3.31Å; Y174-I180 CarbonylContact C-O 3.51Å; Y174-I180 HydrophobicContact CD2-CD1 4.21Å
175	S	96.3	Very high	98	Very high	42 Å²	42	79.5 Å²	79.5	29%	0.294	36%	0.362	S	S	.	.	H	α-helix	trans	-67.3	-22.7	172.6	-55.5	0	0	0	0	112.7	L171 R172 N173 I180 K182	L171-S175 PolarHBondContact O-N 3.43Å; L171-S175 VanDerWaalsContact O-N 3.12Å; L171-S175 PolarHBondContact O-OG 3.39Å; R172-S175 PolarHBondContact O-N 3.03Å; N173-S175 PolarHBondContact O-N 3.14Å; S175-I180 WeakPolarHBondContact CA-O 3.16Å; S175-I180 PolarHBondContact N-O 3.34Å; S175-I180 PolarHBondContact OG-O 3.04Å; S175-I180 VanDerWaalsContact OG-O 3.09Å; S175-K182 PolarHBondContact OG-N 2.88Å
176	R	95.6	Very high	98	Very high	206 Å²	206	80.3 Å²	80.3	78%	0.777	36%	0.363	S	S	*	.	H	α-helix	trans	-84.5	-40.9	173.8	-59.7	177.9	177	-176.9	-5.8	112	N173 Y174 G178	N173-R176 WeakPolarHBondContact O-CB 3.46Å; N173-R176 PolarHBondContact O-N 3.02Å; Y174-R176 PolarHBondContact O-N 3.42Å; R176-G178 VanDerWaalsContact C-N 3.35Å
177	T	96.9	Very high	98	Very high	95 Å²	95	76.2 Å²	76.2	58%	0.583	35%	0.346	S	S	*	.	H	α-helix	trans	-82.8	-14.4	-178.5	47.1	0	0	0	0	113.2	N173 Y174 E179	N173-T177 PolarHBondContact O-N 3.28Å; N173-T177 PolarHBondContact O-OG1 3.33Å; Y174-T177 VanDerWaalsContact CA-OG1 3.32Å; Y174-T177 WeakPolarHBondContact CA-OG1 3.33Å; Y174-T177 PolarHBondContact O-N 2.86Å; T177-E179 WeakPolarHBondContact CB-OE2 3.46Å; T177-E179 PolarHBondContact OG1-OE2 3.44Å
178	G	97.3	Very high	98	Very high	25 Å²	25	76.8 Å²	76.8	26%	0.258	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-0.3	169.1	0	0	0	0	0	115.1	Y174 R176 N192	Y174-G178 WeakPolarHBondContact O-CA 3.48Å; Y174-G178 PolarHBondContact O-N 2.95Å; R176-G178 VanDerWaalsContact C-N 3.35Å; G178-N192 WeakPolarHBondContact O-CB 3.48Å; G178-N192 PolarHBondContact O-ND2 2.95Å
179	E	98.3	Very high	98	Very high	27 Å²	27	76.9 Å²	76.9	13%	0.126	35%	0.348	C	S	.	.	S	Bend	trans	-72.9	-36.8	180	-58.2	93.1	149.5	0	0	113.1	Y112 Y174 T177 N192 I195	Y112-E179 HydrophobicContact CD1-CB 4.28Å; Y112-E179 HydrophobicContact CD1-CG 4.23Å; Y112-E179 HydrophobicContact CE1-CG 4.21Å; Y112-E179 HydrophobicContact CG-CB 4.37Å; Y174-E179 PolarHBondContact O-N 3.31Å; T177-E179 WeakPolarHBondContact CB-OE2 3.46Å; T177-E179 PolarHBondContact OG1-OE2 3.44Å; E179-N192 PolarHBondContact O-N 3.49Å; E179-I195 HydrophobicContact CB-CG1 4.16Å; E179-I195 HydrophobicContact CB-CG2 4.44Å; E179-I195 HydrophobicContact CG-CD1 4.03Å; E179-I195 HydrophobicContact CG-CG1 4.16Å
180	I	98.6	Very high	98	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	121.3	178.7	-63.2	176.7	0	0	0	109.3	L115 F138 L171 Y174 S175 Y189 Q190 F191	L115-I180 HydrophobicContact CD1-CD1 4.01Å; F138-I180 HydrophobicContact CE1-CG2 4.27Å; F138-I180 HydrophobicContact CZ-CD1 4.23Å; F138-I180 HydrophobicContact CZ-CG2 4.21Å; L171-I180 HydrophobicContact CD2-CD1 3.91Å; L171-I180 HydrophobicContact CD2-CG2 4.36Å; Y174-I180 CarbonylContact C-O 3.51Å; Y174-I180 HydrophobicContact CD2-CD1 4.21Å; S175-I180 WeakPolarHBondContact CA-O 3.16Å; S175-I180 PolarHBondContact N-O 3.34Å; S175-I180 PolarHBondContact OG-O 3.04Å; S175-I180 VanDerWaalsContact OG-O 3.09Å; I180-Y189 HydrophobicContact CG2-CD1 4.08Å; I180-Y189 HydrophobicContact CG2-CG 4.25Å; I180-Q190 CarbonylContact C-O 3.6Å; I180-Q190 VanDerWaalsContact CA-O 3.29Å; I180-Q190 WeakPolarHBondContact CA-O 3.34Å; I180-F191 HydrophobicContact CD1-CD1 4.26Å; I180-F191 HydrophobicContact CD1-CE1 3.75Å; I180-F191 HydrophobicContact CD1-CZ 3.96Å; I180-F191 HydrophobicContact CG1-CD1 3.8Å; I180-F191 HydrophobicContact CG1-CE1 3.8Å; I180-F191 HydrophobicContact CG1-CG 4.4Å; I180-F191 HydrophobicContact CG1-CZ 4.38Å
181	V	98.3	Very high	98	Very high	70 Å²	70	72.1 Å²	72.1	42%	0.424	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	142.5	178.3	-178	0	0	0	0	110.6	V183 Y189 Q190	V181-V183 PolarHBondContact O-N 2.87Å; V181-Y189 WeakPolarHBondContact O-CA 3.26Å; V181-Q190 PolarHBondContact N-O 3.18Å; V181-Q190 PolarHBondContact O-N 2.89Å
182	K	98	Very high	98	Very high	88 Å²	88	74.6 Å²	74.6	38%	0.383	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	120.6	172.6	-177.5	72.7	-169.3	88.8	0	110.1	S175 R185 T188 Y189	S175-K182 PolarHBondContact OG-N 2.88Å; K182-R185 PolarHBondContact NZ-O 2.93Å; K182-T188 PolarHBondContact NZ-O 3.06Å; K182-Y189 HydrophobicContact CD-CD1 3.8Å; K182-Y189 HydrophobicContact CD-CE1 3.3Å
183	V	98.3	Very high	97.9	Very high	23 Å²	23	73 Å²	73	14%	0.139	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-82.9	144	169.9	177.5	0	0	0	0	109.5	V181 R185 T188 Q190	V181-V183 PolarHBondContact O-N 2.87Å; V183-R185 HydrophobicContact CG1-CB 4.2Å; V183-R185 HydrophobicContact CG1-CG 4.18Å; V183-R185 PolarHBondContact O-N 3.06Å; V183-T188 HydrophobicContact CB-CG2 3.93Å; V183-T188 HydrophobicContact CG1-CG2 4.02Å; V183-T188 HydrophobicContact CG2-CG2 4.25Å; V183-T188 PolarHBondContact N-O 3.4Å; V183-Q190 HydrophobicContact CG2-CB 3.84Å
184	R	97.4	Very high	97.8	Very high	253 Å²	253	75.3 Å²	75.3	96%	0.955	36%	0.358	S	S	*	.	S	Bend	trans	-73.1	50.1	176.5	-158.6	177.5	82.6	136	-1.3	112.8
185	R	98.1	Very high	97.7	Very high	175 Å²	175	74.8 Å²	74.8	66%	0.66	36%	0.357	S	S	*	.	S	Bend	trans	-141	149.5	175.2	-67.4	-175	-178.6	107	0.1	109.2	K182 V183 L187 T188	K182-R185 PolarHBondContact NZ-O 2.93Å; V183-R185 HydrophobicContact CG1-CB 4.2Å; V183-R185 HydrophobicContact CG1-CG 4.18Å; V183-R185 PolarHBondContact O-N 3.06Å; R185-L187 PolarHBondContact O-N 3.11Å; R185-T188 HydrophobicContact CB-CG2 4.4Å; R185-T188 VanDerWaalsContact CB-OG1 3.32Å; R185-T188 WeakPolarHBondContact CB-OG1 3.48Å; R185-T188 PolarHBondContact O-N 2.88Å
186	K	98.1	Very high	97.7	Very high	170 Å²	170	74.4 Å²	74.4	74%	0.739	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	131.3	-175.1	175.1	168.1	176.9	-175.7	0	110	T188	K186-T188 PolarHBondContact O-N 3.04Å; K186-T188 PolarHBondContact O-OG1 2.85Å; K186-T188 VanDerWaalsContact O-OG1 3.09Å
187	L	98.5	Very high	97.6	Very high	22 Å²	22	71.2 Å²	71.2	12%	0.115	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	9.8	179.7	-55.5	174.4	0	0	0	115.3	H139 F140 K145 Y164 R185 Y189	H139-L187 VanDerWaalsContact CA-O 3.29Å; H139-L187 WeakPolarHBondContact CA-O 3.17Å; F140-L187 HydrophobicContact CB-CB 4.15Å; F140-L187 WeakPolarHBondContact CD2-O 3.49Å; F140-L187 PolarHBondContact N-O 3.03Å; F140-L187 WeakPolarHBondContact O-CB 3.02Å; F140-L187 VanDerWaalsContact O-CD1 3.32Å; F140-L187 WeakPolarHBondContact O-CD1 3.4Å; K145-L187 HydrophobicContact CD-CD1 4.09Å; K145-L187 HydrophobicContact CD-CD2 3.96Å; Y164-L187 HydrophobicContact CD1-CD2 4.39Å; Y164-L187 HydrophobicContact CE1-CD2 3.42Å; Y164-L187 VanDerWaalsContact CE1-CD2 3.42Å; Y164-L187 HydrophobicContact CE2-CD2 4.3Å; Y164-L187 WeakPolarHBondContact OH-CD2 3.38Å; R185-L187 PolarHBondContact O-N 3.11Å; L187-Y189 WeakPolarHBondContact O-CD2 3.4Å
188	T	98.8	Very high	97.5	Very high	13 Å²	13	72.6 Å²	72.6	8%	0.08	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138.8	-177.9	-43.5	0	0	0	0	111.5	T137 F138 H139 K182 V183 R185 K186	T137-T188 HydrophobicContact CG2-CG2 3.69Å; F138-T188 CarbonylContact O-C 3.56Å; F138-T188 WeakPolarHBondContact O-CA 3.46Å; F138-T188 WeakPolarHBondContact O-CG2 3.4Å; H139-T188 HydrophobicContact CB-CG2 4.49Å; K182-T188 PolarHBondContact NZ-O 3.06Å; V183-T188 HydrophobicContact CB-CG2 3.93Å; V183-T188 HydrophobicContact CG1-CG2 4.02Å; V183-T188 HydrophobicContact CG2-CG2 4.25Å; V183-T188 PolarHBondContact N-O 3.4Å; R185-T188 HydrophobicContact CB-CG2 4.4Å; R185-T188 VanDerWaalsContact CB-OG1 3.32Å; R185-T188 WeakPolarHBondContact CB-OG1 3.48Å; R185-T188 PolarHBondContact O-N 2.88Å; K186-T188 PolarHBondContact O-N 3.04Å; K186-T188 PolarHBondContact O-OG1 2.85Å; K186-T188 VanDerWaalsContact O-OG1 3.09Å
189	Y	98.8	Very high	97.3	Very high	12 Å²	12	72.4 Å²	72.4	5%	0.047	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	164.3	-179.8	-61	-96.2	0	0	0	109.1	F138 F140 Y164 L171 I180 V181 K182 L187	F138-Y189 WeakPolarHBondContact CD1-O 3.42Å; F138-Y189 HydrophobicContact CE2-CD2 4.4Å; F138-Y189 HydrophobicContact CZ-CG 4.34Å; F138-Y189 PolarHBondContact N-O 3.3Å; F138-Y189 PolarHBondContact O-N 2.7Å; F140-Y189 AromaticContact CD2-CD2 3.96Å; F140-Y189 HydrophobicContact CD2-CD2 3.96Å; F140-Y189 AromaticContact CD2-CE2 3.78Å; F140-Y189 HydrophobicContact CD2-CE2 3.78Å; F140-Y189 AromaticContact CE2-CD2 3.52Å; F140-Y189 HydrophobicContact CE2-CD2 3.52Å; F140-Y189 AromaticContact CE2-CE2 3.47Å; F140-Y189 HydrophobicContact CE2-CE2 3.47Å; F140-Y189 VanDerWaalsContact CE2-CE2 3.47Å; Y164-Y189 PolarHBondContact OH-OH 2.7Å; L171-Y189 HydrophobicContact CB-CD1 4.35Å; L171-Y189 HydrophobicContact CB-CE1 3.81Å; L171-Y189 HydrophobicContact CD1-CD1 4.26Å; L171-Y189 HydrophobicContact CD1-CD2 4.27Å; L171-Y189 HydrophobicContact CD1-CE1 3.81Å; L171-Y189 HydrophobicContact CD1-CE2 3.86Å; L171-Y189 HydrophobicContact CD1-CG 4.47Å; L171-Y189 HydrophobicContact CG-CE1 4.38Å; I180-Y189 HydrophobicContact CG2-CD1 4.08Å; I180-Y189 HydrophobicContact CG2-CG 4.25Å; V181-Y189 WeakPolarHBondContact O-CA 3.26Å; K182-Y189 HydrophobicContact CD-CD1 3.8Å; K182-Y189 HydrophobicContact CD-CE1 3.3Å; L187-Y189 WeakPolarHBondContact O-CD2 3.4Å
190	Q	98.7	Very high	96.8	Very high	65 Å²	65	73 Å²	73	30%	0.304	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.2	-179	-172.3	175.9	25.9	0	0	109.8	S135 G136 I180 V181 V183	S135-Q190 WeakPolarHBondContact O-CG 3.38Å; S135-Q190 PolarHBondContact O-NE2 3.14Å; G136-Q190 WeakPolarHBondContact O-CA 3.21Å; I180-Q190 CarbonylContact C-O 3.6Å; I180-Q190 VanDerWaalsContact CA-O 3.29Å; I180-Q190 WeakPolarHBondContact CA-O 3.34Å; V181-Q190 PolarHBondContact N-O 3.18Å; V181-Q190 PolarHBondContact O-N 2.89Å; V183-Q190 HydrophobicContact CG2-CB 3.84Å
191	F	98.7	Very high	95.6	Very high	2 Å²	2	76.2 Å²	76.2	1%	0.009	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	145	169.1	-81.3	-83.1	0	0	0	110.4	Y112 L115 H116 L119 W130 G136 F138 I180 I195 L196 L199	Y112-F191 WeakPolarHBondContact O-CZ 3.26Å; L115-F191 HydrophobicContact CB-CZ 4.16Å; H116-F191 HydrophobicContact CB-CZ 4.06Å; L119-F191 HydrophobicContact CD1-CE2 3.72Å; W130-F191 AromaticContact CH2-CD2 3.89Å; W130-F191 HydrophobicContact CH2-CD2 3.89Å; W130-F191 HydrophobicContact CH2-CE2 4.12Å; W130-F191 HydrophobicContact CZ3-CD2 4.02Å; W130-F191 HydrophobicContact CZ3-CE2 4.47Å; G136-F191 PolarHBondContact O-N 3.4Å; F138-F191 AromaticContact CD1-CD2 3.59Å; F138-F191 HydrophobicContact CD1-CD2 3.59Å; F138-F191 AromaticContact CD1-CE2 3.64Å; F138-F191 HydrophobicContact CD1-CE2 3.64Å; F138-F191 AromaticContact CE1-CD2 3.43Å; F138-F191 HydrophobicContact CE1-CD2 3.43Å; F138-F191 VanDerWaalsContact CE1-CD2 3.43Å; F138-F191 AromaticContact CE1-CE2 3.32Å; F138-F191 HydrophobicContact CE1-CE2 3.32Å; F138-F191 HydrophobicContact CE1-CG 4.33Å; F138-F191 HydrophobicContact CE1-CZ 4.17Å; F138-F191 HydrophobicContact CZ-CE2 4.03Å; I180-F191 HydrophobicContact CD1-CD1 4.26Å; I180-F191 HydrophobicContact CD1-CE1 3.75Å; I180-F191 HydrophobicContact CD1-CZ 3.96Å; I180-F191 HydrophobicContact CG1-CD1 3.8Å; I180-F191 HydrophobicContact CG1-CE1 3.8Å; I180-F191 HydrophobicContact CG1-CG 4.4Å; I180-F191 HydrophobicContact CG1-CZ 4.38Å; F191-I195 HydrophobicContact CD1-CG2 4.4Å; F191-L196 HydrophobicContact CB-CB 4.37Å; F191-L199 HydrophobicContact CE1-CD1 4.29Å
192	N	97.9	Very high	93.9	Very high	52 Å²	52	76.6 Å²	76.6	28%	0.278	38%	0.38	S	S	.	.			trans	-66.7	133	164	178.1	-39.3	0	0	0	109.6	G178 E179 D194 I195 L196	G178-N192 WeakPolarHBondContact O-CB 3.48Å; G178-N192 PolarHBondContact O-ND2 2.95Å; E179-N192 PolarHBondContact O-N 3.49Å; N192-D194 VanDerWaalsContact C-N 3.27Å; N192-D194 PolarHBondContact O-N 3.12Å; N192-D194 WeakPolarHBondContact OD1-CB 3.39Å; N192-D194 PolarHBondContact OD1-N 3.12Å; N192-I195 HydrophobicContact CB-CB 4.43Å; N192-I195 HydrophobicContact CB-CG1 3.97Å; N192-I195 WeakPolarHBondContact O-CB 3.41Å; N192-I195 PolarHBondContact O-N 3.28Å; N192-L196 PolarHBondContact O-N 3.28Å
193	P	96.4	Very high	91.7	Very high	92 Å²	92	78.9 Å²	78.9	60%	0.597	39%	0.392	S	S	*	.	H	α-helix	trans	-51.1	-40.6	179.6	-28.5	35.2	0	0	0	114.3	I195 L196 H197	P193-I195 VanDerWaalsContact C-N 3.31Å; P193-I195 PolarHBondContact O-N 2.9Å; P193-L196 PolarHBondContact O-N 2.94Å; P193-H197 WeakPolarHBondContact O-CB 3.25Å; P193-H197 PolarHBondContact O-N 3.24Å
194	D	96.2	Very high	89.1	Confident	116 Å²	116	82 Å²	82	62%	0.62	41%	0.411	S	S	*	.	H	α-helix	trans	-65.5	-37.7	-179.4	-63.7	-30.4	0	0	0	111.7	N192 R198	N192-D194 VanDerWaalsContact C-N 3.27Å; N192-D194 PolarHBondContact O-N 3.12Å; N192-D194 WeakPolarHBondContact OD1-CB 3.39Å; N192-D194 PolarHBondContact OD1-N 3.12Å; D194-R198 WeakPolarHBondContact O-CB 3.31Å; D194-R198 VanDerWaalsContact O-CG 3.31Å; D194-R198 WeakPolarHBondContact O-CG 3.4Å; D194-R198 PolarHBondContact O-N 3.02Å; D194-R198 VanDerWaalsContact O-N 3.1Å
195	I	96.8	Very high	86.6	Confident	23 Å²	23	75.4 Å²	75.4	12%	0.118	40%	0.4	C	S	.	.	H	α-helix	trans	-68.8	-42.9	176	-57.3	-59.2	0	0	0	110	Y112 E179 F191 N192 P193 R198 L199	Y112-I195 HydrophobicContact CD2-CG2 3.96Å; Y112-I195 HydrophobicContact CE2-CG2 3.97Å; E179-I195 HydrophobicContact CB-CG1 4.16Å; E179-I195 HydrophobicContact CB-CG2 4.44Å; E179-I195 HydrophobicContact CG-CD1 4.03Å; E179-I195 HydrophobicContact CG-CG1 4.16Å; F191-I195 HydrophobicContact CD1-CG2 4.4Å; N192-I195 HydrophobicContact CB-CB 4.43Å; N192-I195 HydrophobicContact CB-CG1 3.97Å; N192-I195 WeakPolarHBondContact O-CB 3.41Å; N192-I195 PolarHBondContact O-N 3.28Å; P193-I195 VanDerWaalsContact C-N 3.31Å; P193-I195 PolarHBondContact O-N 2.9Å; I195-R198 PolarHBondContact O-N 3.45Å; I195-L199 HydrophobicContact CG2-CD1 3.8Å; I195-L199 HydrophobicContact CG2-CG 4.42Å; I195-L199 VanDerWaalsContact O-CG 3.24Å; I195-L199 WeakPolarHBondContact O-CG 3.38Å; I195-L199 PolarHBondContact O-N 3.36Å
196	L	95.4	Very high	84.1	Confident	33 Å²	33	75.4 Å²	75.4	17%	0.173	41%	0.41	C	S	.	.	H	α-helix	trans	-63.4	-44.5	178.9	-170.2	60.3	0	0	0	111.3	H116 W130 F191 N192 P193 R198 L199 G200	H116-L196 VanDerWaalsContact CD2-CD1 3.44Å; H116-L196 WeakPolarHBondContact CD2-CD1 3.45Å; W130-L196 HydrophobicContact CH2-CD1 3.9Å; W130-L196 HydrophobicContact CZ2-CD1 4.47Å; F191-L196 HydrophobicContact CB-CB 4.37Å; N192-L196 PolarHBondContact O-N 3.28Å; P193-L196 PolarHBondContact O-N 2.94Å; L196-R198 VanDerWaalsContact C-N 3.34Å; L196-R198 PolarHBondContact O-N 2.91Å; L196-L199 PolarHBondContact O-N 3.26Å; L196-L199 VanDerWaalsContact O-N 3.12Å; L196-G200 PolarHBondContact O-N 3.4Å
197	H	94.8	Very high	81.9	Confident	139 Å²	139	75.2 Å²	75.2	64%	0.644	41%	0.412	S	S	*	.	H	α-helix	trans	-59.8	-43.3	175.5	-177.4	-99.9	0	0	0	112	P193 L199 G200 S201	P193-H197 WeakPolarHBondContact O-CB 3.25Å; P193-H197 PolarHBondContact O-N 3.24Å; H197-L199 VanDerWaalsContact C-N 3.31Å; H197-L199 PolarHBondContact O-N 2.87Å; H197-G200 PolarHBondContact O-N 2.97Å; H197-S201 WeakPolarHBondContact O-CB 3.35Å; H197-S201 PolarHBondContact O-N 3.34Å; H197-S201 PolarHBondContact O-OG 3.27Å
198	R	94.4	Very high	79.7	Confident	125 Å²	125	80.7 Å²	80.7	47%	0.472	44%	0.44	S	S	.	.	H	α-helix	trans	-63.4	-34.2	174.8	-78.8	176.7	47.1	-101.4	-11.8	113.5	D194 I195 L196 S201 A202	D194-R198 WeakPolarHBondContact O-CB 3.31Å; D194-R198 VanDerWaalsContact O-CG 3.31Å; D194-R198 WeakPolarHBondContact O-CG 3.4Å; D194-R198 PolarHBondContact O-N 3.02Å; D194-R198 VanDerWaalsContact O-N 3.1Å; I195-R198 PolarHBondContact O-N 3.45Å; L196-R198 VanDerWaalsContact C-N 3.34Å; L196-R198 PolarHBondContact O-N 2.91Å; R198-S201 WeakPolarHBondContact CA-OG 3.14Å; R198-S201 PolarHBondContact O-OG 3.36Å; R198-A202 PolarHBondContact O-N 3.42Å
199	L	93.5	Very high	76.6	Confident	20 Å²	20	89 Å²	89	11%	0.105	48%	0.478	C	S	.	.	H	α-helix	trans	-78.4	-32.7	178.8	-69.5	166.8	0	0	0	112.4	Y112 E113 H116 F191 I195 L196 H197	Y112-L199 HydrophobicContact CD2-CD1 3.98Å; Y112-L199 HydrophobicContact CE2-CD1 4.16Å; Y112-L199 HydrophobicContact CE2-CD2 4.2Å; E113-L199 HydrophobicContact CB-CD2 4.44Å; E113-L199 HydrophobicContact CG-CD2 4.08Å; H116-L199 HydrophobicContact CB-CD1 3.86Å; F191-L199 HydrophobicContact CE1-CD1 4.29Å; I195-L199 HydrophobicContact CG2-CD1 3.8Å; I195-L199 HydrophobicContact CG2-CG 4.42Å; I195-L199 VanDerWaalsContact O-CG 3.24Å; I195-L199 WeakPolarHBondContact O-CG 3.38Å; I195-L199 PolarHBondContact O-N 3.36Å; L196-L199 PolarHBondContact O-N 3.26Å; L196-L199 VanDerWaalsContact O-N 3.12Å; H197-L199 VanDerWaalsContact C-N 3.31Å; H197-L199 PolarHBondContact O-N 2.87Å
200	G	87	Confident	73.5	Confident	41 Å²	41	99.1 Å²	99.1	42%	0.423	52%	0.516	S	S	.	.	H	α-helix	trans	-72	-40.4	174.3	0	0	0	0	0	113.2	L196 H197 A202 Q203	L196-G200 PolarHBondContact O-N 3.4Å; H197-G200 PolarHBondContact O-N 2.97Å; G200-A202 VanDerWaalsContact C-N 3.34Å; G200-A202 PolarHBondContact O-N 2.9Å; G200-Q203 PolarHBondContact O-N 2.99Å
201	S	73.8	Confident	70.8	Confident	66 Å²	66	101.9 Å²	101.9	46%	0.462	54%	0.54	S	S	.	.	H	α-helix	trans	-71.1	-25.4	179.4	49.9	0	0	0	0	114	H197 R198 Q203 V204	H197-S201 WeakPolarHBondContact O-CB 3.35Å; H197-S201 PolarHBondContact O-N 3.34Å; H197-S201 PolarHBondContact O-OG 3.27Å; R198-S201 WeakPolarHBondContact CA-OG 3.14Å; R198-S201 PolarHBondContact O-OG 3.36Å; S201-Q203 PolarHBondContact O-N 2.9Å; S201-V204 PolarHBondContact O-N 2.92Å
202	A	62.6	Low	67.7	Low	79 Å²	79	107 Å²	107	65%	0.653	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-10	178.8	0	0	0	0	0	114.4	R198 G200	R198-A202 PolarHBondContact O-N 3.42Å; G200-A202 VanDerWaalsContact C-N 3.34Å; G200-A202 PolarHBondContact O-N 2.9Å
203	Q	51.4	Low	65.4	Low	136 Å²	136	108.4 Å²	108.4	64%	0.636	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	6.4	-178.9	-64.5	-67.8	-20.6	0	0	113.8	G200 S201 P205	G200-Q203 PolarHBondContact O-N 2.99Å; S201-Q203 PolarHBondContact O-N 2.9Å; Q203-P205 WeakPolarHBondContact O-CD 3.46Å
204	V	44.5	Very low	62.8	Low	89 Å²	89	112.4 Å²	112.4	54%	0.539	61%	0.605	S	S	.	*			trans	-104.6	94.9	171.4	-166.9	0	0	0	0	109.6	S201 M206	S201-V204 PolarHBondContact O-N 2.92Å; V204-M206 HydrophobicContact CG1-CE 3.47Å; V204-M206 VanDerWaalsContact CG1-CE 3.47Å; V204-M206 PolarHBondContact O-N 2.8Å
205	P	44.5	Very low	60.2	Low	113 Å²	113	112.4 Å²	112.4	73%	0.734	61%	0.605	S	S	*	*			trans	-60.3	105.6	156.4	-11.5	25.1	0	0	0	106.9	Q203 H207	Q203-P205 WeakPolarHBondContact O-CD 3.46Å; P205-H207 PolarHBondContact O-N 2.98Å
206	M	45.1	Very low	57.4	Low	175 Å²	175	118.4 Å²	118.4	86%	0.862	64%	0.638	S	S	*	*			trans	-64	78.2	165.7	-76.5	-84.1	111.4	0	0	108.6	V204	V204-M206 HydrophobicContact CG1-CE 3.47Å; V204-M206 VanDerWaalsContact CG1-CE 3.47Å; V204-M206 PolarHBondContact O-N 2.8Å
207	H	53	Low	54.8	Low	167 Å²	167	120.1 Å²	120.1	77%	0.773	66%	0.657	S	S	*	*			trans	-93.3	118.3	156.9	-170.4	68.3	0	0	0	107.7	P205	P205-H207 PolarHBondContact O-N 2.98Å
208	L	52.4	Low	52.1	Low	136 Å²	136	122.1 Å²	122.1	71%	0.712	67%	0.666	S	S	*	*			trans	84.5	94.3	164.8	-150.1	76.4	0	0	0	117.6
209	Q	32.9	Very low	49.2	Very low	189 Å²	189	121.4 Å²	121.4	88%	0.883	68%	0.68	S	S	*	*				-163.8	103.4	116.9	-105.1	159.7	13.5	0	0	110.2
210	R	32.7	Very low	46.3	Very low	223 Å²	223	131.3 Å²	131.3	84%	0.842	72%	0.716	S	S	*	*			trans	-81.6	119.4	164.8	-178.3	-178.7	-169.8	174.6	2.2	106.5	S212	R210-S212 PolarHBondContact O-N 2.81Å
211	P	43.3	Very low	43.7	Very low	124 Å²	124	137.3 Å²	137.3	81%	0.805	73%	0.733	S	S	*	*			trans	-76.4	102.8	165	0.3	17.2	0	0	0	106.7	A213	P211-A213 PolarHBondContact O-N 3Å
212	S	33.6	Very low	41.7	Very low	110 Å²	110	142.7 Å²	142.7	77%	0.769	75%	0.751	S	S	*	*			trans	-79.5	102.5	161.7	47.5	0	0	0	0	107.6	R210	R210-S212 PolarHBondContact O-N 2.81Å
213	A	50.3	Low	40.1	Very low	81 Å²	81	144.1 Å²	144.1	67%	0.669	76%	0.756	S	S	*	*			trans	-83.1	156.5	162.5	0	0	0	0	0	110.2	P211	P211-A213 PolarHBondContact O-N 3Å
214	Q	39.8	Very low	39.7	Very low	176 Å²	176	143.2 Å²	143.2	82%	0.822	76%	0.762	S	S	*	*			trans	89.2	133.7	168.2	-54.6	-168.2	-84.6	0	0	116
215	D	41.8	Very low	39.2	Very low	115 Å²	115	144.3 Å²	144.3	62%	0.615	77%	0.773	S	S	*	*			cis	-168.8	163.1	-0.3	-118.7	-37.5	0	0	0	108.9
216	D	38.7	Very low	38.8	Very low	149 Å²	149	146.7 Å²	146.7	80%	0.797	78%	0.775	S	S	*	*			trans	70.4	146.5	157.2	-59.8	-46.8	0	0	0	121.2
217	A	39.8	Very low	38.3	Very low	70 Å²	70	146.1 Å²	146.1	58%	0.579	77%	0.77	S	S	*	*			cis	-175.6	155.4	-22.8	0	0	0	0	0	107.7
218	H	39	Very low	37.3	Very low	181 Å²	181	144 Å²	144	84%	0.838	77%	0.774	S	S	*	*			trans	70.1	124.5	164.5	-69.2	78.7	0	0	0	118.2
219	S	33.7	Very low	36.5	Very low	109 Å²	109	148 Å²	148	76%	0.762	78%	0.781	S	S	*	*			cis	-160.8	132.3	48.3	-60.4	0	0	0	0	113.6
220	R	33.2	Very low	37.3	Very low	229 Å²	229	145.1 Å²	145.1	86%	0.864	78%	0.779	S	S	*	*				42.5	118.4	124.9	-161.4	179.4	169.6	-172.8	-4.3	119.7
221	Q	31.1	Very low	37.3	Very low	166 Å²	166	138 Å²	138	78%	0.776	78%	0.775	S	S	*	*				169.7	148.6	102.7	-155.9	162.1	-27.9	0	0	113
222	E	32	Very low	36.9	Very low	180 Å²	180	137.3 Å²	137.3	84%	0.841	77%	0.773	S	S	*	*			trans	-58.9	154.6	-170.2	-65.4	172.7	78.7	0	0	119
223	S	29.1	Very low	37.2	Very low	109 Å²	109	138.6 Å²	138.6	76%	0.762	78%	0.776	S	S	*	*				173.5	143.3	110	-169	0	0	0	0	112.1
224	P	43	Very low	36.5	Very low	116 Å²	116	139.8 Å²	139.8	75%	0.753	79%	0.786	S	S	*	*			trans	-103.4	128.1	177.3	35	-24.4	0	0	0	112.9
225	S	33.7	Very low	36.9	Very low	112 Å²	112	136.4 Å²	136.4	78%	0.783	79%	0.788	S	S	*	*			trans	-163.7	108	157.8	43.5	0	0	0	0	112
226	E	37.6	Very low	36.7	Very low	164 Å²	164	135.5 Å²	135.5	77%	0.766	80%	0.797	S	S	*	*			trans	41.8	136	135.1	-75.9	-162.1	94.7	0	0	124
227	Q	34.5	Very low	37.1	Very low	162 Å²	162	133.3 Å²	133.3	76%	0.757	80%	0.799	S	S	*	*			trans	84.8	104.8	144.1	-69.7	164.2	32.1	0	0	119.7
228	S	30.7	Very low	37.4	Very low	124 Å²	124	134.1 Å²	134.1	87%	0.867	81%	0.806	S	S	*	*				152.1	132.6	107.8	-153.2	0	0	0	0	112.1
229	Y	36.8	Very low	37.6	Very low	219 Å²	219	131.3 Å²	131.3	86%	0.859	80%	0.797	S	S	*	*			trans	-68.1	171.7	176.6	-82.9	-84.6	0	0	0	112.2
230	P	48.4	Very low	37.9	Very low	128 Å²	128	136.4 Å²	136.4	83%	0.831	80%	0.8	S	S	*	*			cis	-145.2	169.9	25.3	38.4	-16.6	0	0	0	118.2
231	G	32.6	Very low	38.6	Very low	73 Å²	73	133.4 Å²	133.4	75%	0.753	80%	0.795	S	S	*	*			trans	128.3	141.8	143.4	0	0	0	0	0	118
232	S	36.4	Very low	39.2	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	79%	0.794	S	S	*	*			trans	103.2	89.2	155.6	-133.9	0	0	0	0	118.4
233	V	39.2	Very low	39.7	Very low	137 Å²	137	132.7 Å²	132.7	83%	0.83	79%	0.794	S	S	*	*			trans	41.2	93	137.3	-60.9	0	0	0	0	119
234	A	35.5	Very low	40.5	Very low	105 Å²	105	138.6 Å²	138.6	87%	0.868	80%	0.801	S	S	*	*			trans	-82.2	126.4	155.6	0	0	0	0	0	109.8	A236	A234-A236 PolarHBondContact O-N 2.8Å
235	A	47.8	Very low	40.7	Very low	106 Å²	106	136.1 Å²	136.1	88%	0.876	80%	0.796	S	S	*	*			trans	-56.8	123.4	175.4	0	0	0	0	0	111.8
236	A	38	Very low	41	Very low	96 Å²	96	137.9 Å²	137.9	79%	0.793	79%	0.792	S	S	*	*			trans	-102.5	115.1	156.8	0	0	0	0	0	107.2	A234 A238	A234-A236 PolarHBondContact O-N 2.8Å; A236-A238 PolarHBondContact O-N 3.38Å
237	A	47.8	Very low	41.1	Very low	102 Å²	102	141.6 Å²	141.6	84%	0.843	80%	0.801	S	S	*	*			trans	-53.5	117.6	170.6	0	0	0	0	0	109.2	D239	A237-D239 PolarHBondContact O-N 2.95Å; A237-D239 VanDerWaalsContact O-N 3.15Å
238	A	45.6	Very low	41.3	Very low	87 Å²	87	140.8 Å²	140.8	72%	0.719	80%	0.797	S	S	*	*			trans	-73.6	107	169.8	0	0	0	0	0	108.2	A236 W240	A236-A238 PolarHBondContact O-N 3.38Å; A238-W240 PolarHBondContact O-N 2.77Å
239	D	42.9	Very low	41.9	Very low	122 Å²	122	141 Å²	141	65%	0.652	79%	0.787	S	S	*	*			trans	-49.6	116.3	174.2	-170.4	9.7	0	0	0	112.2	A237 H241	A237-D239 PolarHBondContact O-N 2.95Å; A237-D239 VanDerWaalsContact O-N 3.15Å; D239-H241 PolarHBondContact O-N 2.81Å; D239-H241 IonicContact OD1-CD2 3.35Å; D239-H241 PolarHBondContact OD1-CD2 2.85Å; D239-H241 IonicContact OD1-CG 3.87Å
240	W	41	Very low	41.7	Very low	217 Å²	217	139 Å²	139	82%	0.822	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	8.2	-177.8	-85.7	93.7	0	0	0	113.9	A238	A238-W240 PolarHBondContact O-N 2.77Å
241	H	47.6	Very low	41.5	Very low	165 Å²	165	140.1 Å²	140.1	76%	0.764	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	1.2	-175.4	-71.1	-68.7	0	0	0	115.5	D239	D239-H241 PolarHBondContact O-N 2.81Å; D239-H241 IonicContact OD1-CD2 3.35Å; D239-H241 PolarHBondContact OD1-CD2 2.85Å; D239-H241 IonicContact OD1-CG 3.87Å
242	S	44.3	Very low	41.7	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-89.5	1.4	-176.4	-138.8	0	0	0	0	116
243	W	42.1	Very low	41.8	Very low	225 Å²	225	149.5 Å²	149.5	85%	0.852	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-89.7	-2.9	-174.2	-87.8	63.5	0	0	0	116
244	Y	45.6	Very low	42.1	Very low	233 Å²	233	150.1 Å²	150.1	91%	0.914	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-109.5	10.8	-173.5	-108	-79.6	0	0	0	116.2
245	G	47.2	Very low	42.3	Very low	63 Å²	63	153 Å²	153	65%	0.649	79%	0.787	S	S	*	*	S	Bend	trans	-141.7	55.6	-168.3	0	0	0	0	0	116.2
246	H	38.8	Very low	41.9	Very low	150 Å²	150	152.1 Å²	152.1	69%	0.694	78%	0.779	S	S	*	*			trans	-162.6	67.3	156.7	-136.7	-99.3	0	0	0	113.5	Q248	H246-Q248 VanDerWaalsContact C-N 3.35Å; H246-Q248 PolarHBondContact CE1-OE1 2.8Å; H246-Q248 PolarHBondContact NE2-OE1 3.42Å; H246-Q248 PolarHBondContact O-N 2.7Å
247	Y	40.9	Very low	42.2	Very low	242 Å²	242	152.3 Å²	152.3	95%	0.949	78%	0.781	S	S	*	*			trans	-88.9	83.6	152.3	-76.3	-78.8	0	0	0	107.4	L249	Y247-L249 PolarHBondContact O-N 2.78Å
248	Q	38.3	Very low	42.1	Very low	144 Å²	144	153.6 Å²	153.6	67%	0.673	78%	0.783	S	S	*	*			trans	-86.2	107.3	166.6	-162.9	138.4	19.1	0	0	108	H246 Q250	H246-Q248 VanDerWaalsContact C-N 3.35Å; H246-Q248 PolarHBondContact CE1-OE1 2.8Å; H246-Q248 PolarHBondContact NE2-OE1 3.42Å; H246-Q248 PolarHBondContact O-N 2.7Å; Q248-Q250 PolarHBondContact O-N 3.43Å
249	L	43.1	Very low	41.9	Very low	128 Å²	128	158 Å²	158	67%	0.67	79%	0.787	S	S	*	*			trans	-50.8	112.9	169.3	-134.3	107.8	0	0	0	108.8	Y247 E251	Y247-L249 PolarHBondContact O-N 2.78Å; L249-E251 VanDerWaalsContact C-N 3.32Å; L249-E251 HydrophobicContact CD2-CB 4.07Å; L249-E251 HydrophobicContact CD2-CG 3.51Å; L249-E251 WeakPolarHBondContact CD2-OE2 3.43Å; L249-E251 HydrophobicContact CG-CG 4.46Å; L249-E251 PolarHBondContact O-N 3.07Å
250	Q	32.8	Very low	42.2	Very low	177 Å²	177	158.7 Å²	158.7	83%	0.827	80%	0.795	S	S	*	*			trans	-93	74.3	165.1	-170.3	79.6	34.4	0	0	107.3	Q248	Q248-Q250 PolarHBondContact O-N 3.43Å
251	E	44.4	Very low	42.2	Very low	153 Å²	153	152.3 Å²	152.3	72%	0.715	78%	0.784	S	S	*	*			trans	-89.9	108.8	157	-82	-179.6	173.7	0	0	106.7	L249	L249-E251 VanDerWaalsContact C-N 3.32Å; L249-E251 HydrophobicContact CD2-CB 4.07Å; L249-E251 HydrophobicContact CD2-CG 3.51Å; L249-E251 WeakPolarHBondContact CD2-OE2 3.43Å; L249-E251 HydrophobicContact CG-CG 4.46Å; L249-E251 PolarHBondContact O-N 3.07Å
252	D	36.1	Very low	42.3	Very low	137 Å²	137	153.5 Å²	153.5	73%	0.733	79%	0.79	S	S	*	*			trans	-177.9	95.5	152.8	-94.2	-37.9	0	0	0	107.6
253	Y	39.6	Very low	42.4	Very low	243 Å²	243	153.7 Å²	153.7	95%	0.953	79%	0.791	S	S	*	*			trans	-140.1	87.7	155.6	-102.8	-78.9	0	0	0	107.7
254	D	44.6	Very low	42.5	Very low	151 Å²	151	148.7 Å²	148.7	81%	0.807	79%	0.79	S	S	*	*			trans	-140	151.5	160.1	-122.7	-37.2	0	0	0	110.3
255	L	40	Very low	42.8	Very low	166 Å²	166	142.1 Å²	142.1	87%	0.869	78%	0.784	S	S	*	*			trans	83.9	133	-178.8	-60.1	140	0	0	0	116.3
256	A	38.7	Very low	43.2	Very low	87 Å²	87	149.1 Å²	149.1	72%	0.719	80%	0.797	S	S	*	*			cis	-169.2	164.1	-9	0	0	0	0	0	108
257	A	45.5	Very low	43.8	Very low	100 Å²	100	153.7 Å²	153.7	83%	0.826	83%	0.825	S	S	*	*			trans	-31.3	142.9	171	0	0	0	0	0	117.9
258	S	44.5	Very low	43.9	Very low	128 Å²	128	149.3 Å²	149.3	90%	0.895	82%	0.818	S	S	*	*			trans	-148.4	135.2	132.9	36	0	0	0	0	111.4
259	F	41.6	Very low	44.2	Very low	181 Å²	181	149.5 Å²	149.5	79%	0.794	83%	0.826	S	S	*	*			trans	-99.2	130	-170.8	-170.9	-84.3	0	0	0	107.7
260	T	49.3	Very low	44.3	Very low	135 Å²	135	150.7 Å²	150.7	83%	0.828	84%	0.835	S	S	*	*			trans	-151.6	114	150.4	40.2	0	0	0	0	111
261	S	42.1	Very low	45	Very low	84 Å²	84	149.2 Å²	149.2	59%	0.587	84%	0.835	S	S	*	*			trans	-58.4	142.6	166	-61.1	0	0	0	0	112.2
262	H	48.9	Very low	45	Very low	190 Å²	190	148.9 Å²	148.9	88%	0.88	84%	0.843	S	S	*	*			trans	-143.9	118.3	138.4	-82.1	-69.8	0	0	0	110.9
263	S	46.5	Very low	45.6	Very low	111 Å²	111	149.7 Å²	149.7	78%	0.776	85%	0.85	S	S	*	*			trans	-70.6	141.2	165.8	177.6	0	0	0	0	109.9
264	S	45	Very low	46	Very low	120 Å²	120	143.1 Å²	143.1	84%	0.839	84%	0.843	S	S	*	*			trans	-150.5	116.5	157.5	-71.1	0	0	0	0	109.4
265	A	51.2	Low	46.1	Very low	94 Å²	94	142.5 Å²	142.5	78%	0.777	85%	0.845	S	S	*	*			trans	-62.1	155.1	177	0	0	0	0	0	112.6
266	K	56.2	Low	46.6	Very low	211 Å²	211	140.5 Å²	140.5	92%	0.917	84%	0.844	S	S	*	*			trans	-136.8	123.1	152.8	-122.3	171.2	-177.6	173.1	0	109.6
267	L	50.1	Low	47.3	Very low	245 Å²	245	145.4 Å²	145.4	100%	1.283	86%	0.855	S	S	*	*			trans	-54.6	0	166.6	-73.6	154.7	0	0	0	111.6

Retrieved 267 of 267 residues in 98.2 ms (Link to these results)

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