A0A061A6S5_ONCMY Loading...

Transmembrane protein 267

AlphaFold DB , UniProt , Accession A0A061A6S5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 239 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	40.1	Very low	37.3	Very low	243 Å²	243	165.4 Å²	165.4	100%	1.197	86%	0.858	S	S	*	*				0	141.4	0	-87.4	-176.6	176.5	0	0	109
2	R	37.4	Very low	37.3	Very low	261 Å²	261	161.7 Å²	161.7	99%	0.985	86%	0.857	S	S	*	*			trans	71.6	117	-161.5	-71	-177.2	-178.5	173.4	1	113.4
3	G	34.2	Very low	37.8	Very low	77 Å²	77	158.8 Å²	158.8	79%	0.794	86%	0.858	S	S	*	*			cis	165	118.9	1.2	0	0	0	0	0	107.4
4	Y	33.8	Very low	37.9	Very low	225 Å²	225	154.6 Å²	154.6	88%	0.882	86%	0.856	S	S	*	*			trans	-66.7	139.2	173.8	-93	-103.1	0	0	0	111
5	H	40.8	Very low	37.9	Very low	195 Å²	195	149.3 Å²	149.3	90%	0.903	85%	0.851	S	S	*	*			trans	-141.7	118.3	145.6	-102.3	-68.7	0	0	0	109.2
6	S	38.1	Very low	37.8	Very low	98 Å²	98	144.8 Å²	144.8	69%	0.685	85%	0.847	S	S	*	*			trans	-82.3	149.5	165.6	61.6	0	0	0	0	110
7	K	39.6	Very low	38.1	Very low	213 Å²	213	144.5 Å²	144.5	93%	0.926	85%	0.847	S	S	*	*			trans	-149.9	120.7	141.4	-116.8	179	-178.2	-177.7	0	109.3
8	L	39.5	Very low	38.3	Very low	145 Å²	145	140.4 Å²	140.4	76%	0.759	84%	0.841	S	S	*	*			trans	-80.1	161.7	174.8	-86.1	157.9	0	0	0	110.9
9	D	34.3	Very low	38.5	Very low	136 Å²	136	136.5 Å²	136.5	73%	0.727	83%	0.833	S	S	*	*			trans	70.4	114.9	153.5	-52.1	-26.4	0	0	0	119.5
10	S	34.9	Very low	39.4	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	83%	0.831	S	S	*	*				170.4	123.2	89	39	0	0	0	0	112.3
11	S	38.1	Very low	40.2	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	82%	0.815	S	S	*	*			trans	9.4	122.4	148.5	54.4	0	0	0	0	120.3
12	S	37.1	Very low	41.7	Very low	121 Å²	121	126.1 Å²	126.1	85%	0.846	78%	0.783	S	S	*	*				-150.2	115.4	127.1	35.1	0	0	0	0	110.5	A14	S12-A14 PolarHBondContact O-N 3.39Å
13	S	42.9	Very low	43	Very low	125 Å²	125	120.7 Å²	120.7	87%	0.874	77%	0.773	S	S	*	*			trans	-55.6	118.1	166.1	45.6	0	0	0	0	111.6
14	A	39.7	Very low	44.8	Very low	99 Å²	99	120.8 Å²	120.8	82%	0.818	76%	0.762	S	S	*	*			trans	-118	105.1	153	0	0	0	0	0	106.8	S12 G16	S12-A14 PolarHBondContact O-N 3.39Å; A14-G16 PolarHBondContact O-N 3.48Å
15	G	37.3	Very low	46.7	Very low	76 Å²	76	113.8 Å²	113.8	78%	0.784	74%	0.739	S	S	*	*			trans	-62.7	104.1	179.6	0	0	0	0	0	110.9	T17	G15-T17 VanDerWaalsContact C-N 3.34Å; G15-T17 PolarHBondContact O-N 3.09Å
16	G	37	Very low	48.1	Very low	76 Å²	76	106 Å²	106	78%	0.784	71%	0.708	S	S	*	*			trans	-82.1	82.2	159.4	0	0	0	0	0	108.9	A14 G18	A14-G16 PolarHBondContact O-N 3.48Å; G16-G18 PolarHBondContact O-N 3.16Å
17	T	42.5	Very low	49.7	Very low	140 Å²	140	104 Å²	104	86%	0.859	69%	0.692	S	S	*	*			trans	-74.1	66.8	161.8	49.1	0	0	0	0	108.8	G15 G19	G15-T17 VanDerWaalsContact C-N 3.34Å; G15-T17 PolarHBondContact O-N 3.09Å; T17-G19 PolarHBondContact O-N 3.33Å; T17-G19 VanDerWaalsContact O-N 3.08Å
18	G	41.9	Very low	51.3	Low	71 Å²	71	99.5 Å²	99.5	73%	0.732	67%	0.674	S	S	*	*			trans	-76.4	78.9	159	0	0	0	0	0	107.1	G16 S20	G16-G18 PolarHBondContact O-N 3.16Å; G18-S20 PolarHBondContact O-N 3.11Å
19	G	42.8	Very low	52.8	Low	67 Å²	67	95.6 Å²	95.6	69%	0.691	66%	0.657	S	S	*	*			trans	-59.6	102.7	175.1	0	0	0	0	0	108.6	T17 M21	T17-G19 PolarHBondContact O-N 3.33Å; T17-G19 VanDerWaalsContact O-N 3.08Å; G19-M21 PolarHBondContact O-N 3.45Å
20	S	55.5	Low	54.4	Low	113 Å²	113	95.3 Å²	95.3	79%	0.79	65%	0.651	S	S	*	*			trans	-60.9	107.5	162.7	42	0	0	0	0	106.1	G18	G18-S20 PolarHBondContact O-N 3.11Å
21	M	57.2	Low	55.9	Low	103 Å²	103	94.8 Å²	94.8	51%	0.507	64%	0.635	S	S	.	*			trans	-52.7	130	171.6	-80.3	-90.9	-78.1	0	0	107.7	G19 L23 L25 A26 T29	G19-M21 PolarHBondContact O-N 3.45Å; M21-L23 PolarHBondContact O-N 3.49Å; M21-L25 HydrophobicContact CE-CD2 3.21Å; M21-L25 HydrophobicContact CE-CG 4.46Å; M21-L25 HydrophobicContact SD-CD2 3.66Å; M21-A26 HydrophobicContact CB-CB 4.45Å; M21-T29 HydrophobicContact CE-CG2 4.18Å
22	P	70.6	Confident	57.1	Low	81 Å²	81	91.7 Å²	91.7	53%	0.526	62%	0.616	S	S	.	*			trans	-55.6	132.3	175.4	0.1	0.9	0	0	0	108.2	S24 L25 A26	P22-S24 PolarHBondContact O-N 2.98Å; P22-L25 HydrophobicContact CB-CB 4.48Å; P22-L25 HydrophobicContact CG-CB 4.08Å; P22-L25 WeakPolarHBondContact O-CA 3.17Å; P22-L25 WeakPolarHBondContact O-CB 3.44Å; P22-L25 PolarHBondContact O-N 2.83Å; P22-A26 PolarHBondContact O-N 3.44Å
23	L	66.1	Low	58.5	Low	147 Å²	147	90.2 Å²	90.2	77%	0.77	60%	0.596	S	S	*	*	H	α-helix	trans	-49.4	-35.2	-175.4	-172.1	76.5	0	0	0	112.5	M21 V27	M21-L23 PolarHBondContact O-N 3.49Å; L23-V27 WeakPolarHBondContact O-CB 3.32Å; L23-V27 VanDerWaalsContact O-CG2 3.25Å; L23-V27 WeakPolarHBondContact O-CG2 3.49Å; L23-V27 PolarHBondContact O-N 3.38Å
24	S	70.8	Confident	59.5	Low	80 Å²	80	85.3 Å²	85.3	56%	0.559	56%	0.563	S	S	*	*	H	α-helix	trans	-61.5	-42.4	174.7	-169.3	0	0	0	0	113.3	P22 E28	P22-S24 PolarHBondContact O-N 2.98Å; S24-E28 WeakPolarHBondContact O-CB 3.45Å; S24-E28 WeakPolarHBondContact O-CG 3.49Å; S24-E28 PolarHBondContact O-N 3.47Å
25	L	74.2	Confident	60.8	Low	77 Å²	77	83.6 Å²	83.6	40%	0.403	54%	0.539	S	S	.	.	H	α-helix	trans	-76.6	-35.6	-177.4	-153.9	144.4	0	0	0	110.8	M21 P22 E28 T29	M21-L25 HydrophobicContact CE-CD2 3.21Å; M21-L25 HydrophobicContact CE-CG 4.46Å; M21-L25 HydrophobicContact SD-CD2 3.66Å; P22-L25 HydrophobicContact CB-CB 4.48Å; P22-L25 HydrophobicContact CG-CB 4.08Å; P22-L25 WeakPolarHBondContact O-CA 3.17Å; P22-L25 WeakPolarHBondContact O-CB 3.44Å; P22-L25 PolarHBondContact O-N 2.83Å; L25-E28 PolarHBondContact O-N 2.87Å; L25-T29 HydrophobicContact CD2-CG2 4.2Å; L25-T29 WeakPolarHBondContact O-CG2 2.95Å; L25-T29 PolarHBondContact O-N 3.5Å; L25-T29 PolarHBondContact O-OG1 3.14Å; L25-T29 VanDerWaalsContact O-OG1 3.1Å
26	A	70.2	Confident	62.1	Low	31 Å²	31	86 Å²	86	26%	0.256	53%	0.534	S	S	.	.	H	α-helix	trans	-61.2	-47.2	170.9	0	0	0	0	0	111.7	M21 P22 T29 E30	M21-A26 HydrophobicContact CB-CB 4.45Å; P22-A26 PolarHBondContact O-N 3.44Å; A26-T29 WeakPolarHBondContact CA-OG1 3.25Å; A26-T29 PolarHBondContact O-N 3.44Å; A26-T29 PolarHBondContact O-OG1 3.36Å; A26-E30 PolarHBondContact O-N 3.09Å
27	V	71.8	Confident	63.6	Low	56 Å²	56	86.6 Å²	86.6	34%	0.339	52%	0.516	S	S	.	.	H	α-helix	trans	-58.5	-51.2	173.5	169.2	0	0	0	0	109.9	L23 T29 E30 K31	L23-V27 WeakPolarHBondContact O-CB 3.32Å; L23-V27 VanDerWaalsContact O-CG2 3.25Å; L23-V27 WeakPolarHBondContact O-CG2 3.49Å; L23-V27 PolarHBondContact O-N 3.38Å; V27-T29 VanDerWaalsContact C-N 3.28Å; V27-T29 PolarHBondContact O-N 3.37Å; V27-E30 PolarHBondContact O-N 3.3Å; V27-E30 VanDerWaalsContact O-N 3.17Å; V27-K31 HydrophobicContact CG1-CD 4.03Å; V27-K31 VanDerWaalsContact CG1-CE 3.45Å; V27-K31 HydrophobicContact CG1-CG 4.16Å; V27-K31 WeakPolarHBondContact O-CB 3.39Å; V27-K31 WeakPolarHBondContact O-CG 3.47Å; V27-K31 PolarHBondContact O-N 3.18Å
28	E	73.4	Confident	65	Low	119 Å²	119	80.1 Å²	80.1	56%	0.556	48%	0.477	S	S	*	.	H	α-helix	trans	-58.1	-35.4	178.1	-76	178.3	171	0	0	114	S24 L25 K31 A32	S24-E28 WeakPolarHBondContact O-CB 3.45Å; S24-E28 WeakPolarHBondContact O-CG 3.49Å; S24-E28 PolarHBondContact O-N 3.47Å; L25-E28 PolarHBondContact O-N 2.87Å; E28-K31 WeakPolarHBondContact O-CB 3.42Å; E28-K31 PolarHBondContact O-N 2.96Å; E28-A32 WeakPolarHBondContact O-CB 3.24Å; E28-A32 PolarHBondContact O-N 2.94Å
29	T	70.9	Confident	66.9	Low	64 Å²	64	81.6 Å²	81.6	39%	0.393	46%	0.463	S	S	.	.	H	α-helix	trans	-69.6	-41.4	174.9	50.4	0	0	0	0	112.9	M21 L25 A26 V27 K31 A32 Q33	M21-T29 HydrophobicContact CE-CG2 4.18Å; L25-T29 HydrophobicContact CD2-CG2 4.2Å; L25-T29 WeakPolarHBondContact O-CG2 2.95Å; L25-T29 PolarHBondContact O-N 3.5Å; L25-T29 PolarHBondContact O-OG1 3.14Å; L25-T29 VanDerWaalsContact O-OG1 3.1Å; A26-T29 WeakPolarHBondContact CA-OG1 3.25Å; A26-T29 PolarHBondContact O-N 3.44Å; A26-T29 PolarHBondContact O-OG1 3.36Å; V27-T29 VanDerWaalsContact C-N 3.28Å; V27-T29 PolarHBondContact O-N 3.37Å; T29-K31 VanDerWaalsContact C-N 3.3Å; T29-K31 PolarHBondContact O-N 3.35Å; T29-A32 PolarHBondContact O-N 3.48Å; T29-Q33 WeakPolarHBondContact O-CB 3.48Å; T29-Q33 PolarHBondContact O-N 2.65Å
30	E	68.1	Low	69	Low	130 Å²	130	80.6 Å²	80.6	61%	0.607	45%	0.446	S	S	*	.	H	α-helix	trans	-62.7	-41.2	174.1	-71.6	-175.8	156.4	0	0	111.2	A26 V27 Q33 A34	A26-E30 PolarHBondContact O-N 3.09Å; V27-E30 PolarHBondContact O-N 3.3Å; V27-E30 VanDerWaalsContact O-N 3.17Å; E30-Q33 PolarHBondContact O-N 3.32Å; E30-A34 WeakPolarHBondContact O-CB 3.33Å; E30-A34 PolarHBondContact O-N 3.25Å
31	K	65.5	Low	70.6	Confident	100 Å²	100	80.2 Å²	80.2	44%	0.435	44%	0.443	S	S	.	.	H	α-helix	trans	-58.1	-48.7	174.3	-72.3	-165.8	175.5	166.1	0	111.9	V27 E28 T29 L35 Y221	V27-K31 HydrophobicContact CG1-CD 4.03Å; V27-K31 VanDerWaalsContact CG1-CE 3.45Å; V27-K31 HydrophobicContact CG1-CG 4.16Å; V27-K31 WeakPolarHBondContact O-CB 3.39Å; V27-K31 WeakPolarHBondContact O-CG 3.47Å; V27-K31 PolarHBondContact O-N 3.18Å; E28-K31 WeakPolarHBondContact O-CB 3.42Å; E28-K31 PolarHBondContact O-N 2.96Å; T29-K31 VanDerWaalsContact C-N 3.3Å; T29-K31 PolarHBondContact O-N 3.35Å; K31-L35 WeakPolarHBondContact O-CG 2.97Å; K31-L35 PolarHBondContact O-N 3.3Å; K31-Y221 WeakPolarHBondContact CA-OH 3.38Å; K31-Y221 WeakPolarHBondContact CB-OH 2.83Å; K31-Y221 VanDerWaalsContact CD-OH 3.25Å; K31-Y221 WeakPolarHBondContact CD-OH 3.21Å; K31-Y221 HydrophobicContact CG-CE2 4.49Å; K31-Y221 WeakPolarHBondContact CG-OH 2.88Å
32	A	64.4	Low	72.2	Confident	49 Å²	49	78.8 Å²	78.8	41%	0.405	45%	0.447	S	S	.	.	H	α-helix	trans	-63.5	-41.2	176.6	0	0	0	0	0	111.8	E28 T29 L35 L36	E28-A32 WeakPolarHBondContact O-CB 3.24Å; E28-A32 PolarHBondContact O-N 2.94Å; T29-A32 PolarHBondContact O-N 3.48Å; A32-L35 PolarHBondContact O-N 3.11Å; A32-L36 VanDerWaalsContact O-CG 3.3Å; A32-L36 WeakPolarHBondContact O-CG 3.15Å; A32-L36 PolarHBondContact O-N 3.29Å
33	Q	66.6	Low	73.2	Confident	90 Å²	90	75.5 Å²	75.5	42%	0.421	43%	0.426	S	S	.	.	H	α-helix	trans	-67.3	-39.3	179.9	-170.4	151.3	-53	0	0	112.7	T29 E30 L35 L36 Q37	T29-Q33 WeakPolarHBondContact O-CB 3.48Å; T29-Q33 PolarHBondContact O-N 2.65Å; E30-Q33 PolarHBondContact O-N 3.32Å; Q33-L35 VanDerWaalsContact C-N 3.35Å; Q33-L36 PolarHBondContact O-N 3.04Å; Q33-Q37 WeakPolarHBondContact O-CG 3.12Å; Q33-Q37 PolarHBondContact O-N 2.87Å
34	A	63.9	Low	74.5	Confident	22 Å²	22	72.3 Å²	72.3	18%	0.182	41%	0.409	C	S	.	.	H	α-helix	trans	-64.6	-37.8	174.9	0	0	0	0	0	112.5	E30 T38 Y221	E30-A34 WeakPolarHBondContact O-CB 3.33Å; E30-A34 PolarHBondContact O-N 3.25Å; A34-T38 PolarHBondContact O-N 2.85Å; A34-T38 PolarHBondContact O-OG1 3.05Å; A34-T38 VanDerWaalsContact O-OG1 3.06Å; A34-Y221 HydrophobicContact CB-CD2 4.12Å; A34-Y221 HydrophobicContact CB-CE2 4.05Å
35	L	66.3	Low	75.8	Confident	63 Å²	63	74.4 Å²	74.4	33%	0.33	41%	0.414	S	S	.	.	H	α-helix	trans	-67.3	-44	172.7	-70.5	174.5	0	0	0	111.4	K31 A32 Q33 Q37 T38 F39 V218 Y221	K31-L35 WeakPolarHBondContact O-CG 2.97Å; K31-L35 PolarHBondContact O-N 3.3Å; A32-L35 PolarHBondContact O-N 3.11Å; Q33-L35 VanDerWaalsContact C-N 3.35Å; L35-Q37 VanDerWaalsContact C-N 3.3Å; L35-Q37 PolarHBondContact O-N 3.4Å; L35-T38 VanDerWaalsContact O-CB 3.27Å; L35-T38 WeakPolarHBondContact O-CB 3.48Å; L35-T38 PolarHBondContact O-N 3.2Å; L35-T38 VanDerWaalsContact O-N 3.08Å; L35-F39 VanDerWaalsContact O-CD2 3.3Å; L35-F39 WeakPolarHBondContact O-CD2 3.46Å; L35-F39 PolarHBondContact O-N 3.34Å; L35-V218 HydrophobicContact CD2-CG2 4.3Å; L35-Y221 HydrophobicContact CD2-CD1 4.02Å; L35-Y221 HydrophobicContact CD2-CE1 4.19Å; L35-Y221 HydrophobicContact CG-CE1 4.27Å
36	L	65.5	Low	76.8	Confident	127 Å²	127	72 Å²	72	67%	0.665	41%	0.405	S	S	*	.	H	α-helix	trans	-60.9	-37.6	175.7	-73.1	170.5	0	0	0	112.3	A32 Q33 T38 F39 S40	A32-L36 VanDerWaalsContact O-CG 3.3Å; A32-L36 WeakPolarHBondContact O-CG 3.15Å; A32-L36 PolarHBondContact O-N 3.29Å; Q33-L36 PolarHBondContact O-N 3.04Å; L36-T38 VanDerWaalsContact C-N 3.33Å; L36-T38 PolarHBondContact O-N 2.98Å; L36-F39 CarbonylContact O-C 3.46Å; L36-F39 VanDerWaalsContact O-C 3.27Å; L36-F39 PolarHBondContact O-N 3.37Å; L36-S40 PolarHBondContact O-N 3.22Å
37	Q	68.4	Low	78.1	Confident	89 Å²	89	70.8 Å²	70.8	42%	0.416	40%	0.395	S	S	.	.	H	α-helix	trans	-64.3	-37.6	173.9	-75.3	-170.2	-0.2	0	0	112.5	Q33 L35 F39 S40	Q33-Q37 WeakPolarHBondContact O-CG 3.12Å; Q33-Q37 PolarHBondContact O-N 2.87Å; L35-Q37 VanDerWaalsContact C-N 3.3Å; L35-Q37 PolarHBondContact O-N 3.4Å; Q37-F39 PolarHBondContact O-N 3.19Å; Q37-S40 PolarHBondContact O-N 3.48Å; Q37-S40 PolarHBondContact O-OG 3.42Å
38	T	70.6	Confident	79.4	Confident	4 Å²	4	72.8 Å²	72.8	3%	0.025	41%	0.407	C	S	.	.	H	α-helix	trans	-60.1	-35.3	175.4	-60.7	0	0	0	0	112	A34 L35 L36 S43 H214 S217 V218	A34-T38 PolarHBondContact O-N 2.85Å; A34-T38 PolarHBondContact O-OG1 3.05Å; A34-T38 VanDerWaalsContact O-OG1 3.06Å; L35-T38 VanDerWaalsContact O-CB 3.27Å; L35-T38 WeakPolarHBondContact O-CB 3.48Å; L35-T38 PolarHBondContact O-N 3.2Å; L35-T38 VanDerWaalsContact O-N 3.08Å; L36-T38 VanDerWaalsContact C-N 3.33Å; L36-T38 PolarHBondContact O-N 2.98Å; T38-S43 PolarHBondContact O-OG 3.11Å; T38-S43 VanDerWaalsContact O-OG 3.04Å; T38-H214 HydrophobicContact CG2-CB 4.36Å; T38-H214 PolarHBondContact O-CE1 3.1Å; T38-H214 PolarHBondContact O-ND1 3.24Å; T38-S217 VanDerWaalsContact CG2-CB 3.44Å; T38-S217 WeakPolarHBondContact CG2-OG 3.42Å; T38-S217 PolarHBondContact OG1-OG 2.8Å; T38-V218 HydrophobicContact CG2-CG2 4.26Å
39	F	82.1	Confident	80.6	Confident	101 Å²	101	69 Å²	69	44%	0.443	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	28.7	-179.6	-61.9	-75	0	0	0	113	L35 L36 Q37 L44 H214 V218	L35-F39 VanDerWaalsContact O-CD2 3.3Å; L35-F39 WeakPolarHBondContact O-CD2 3.46Å; L35-F39 PolarHBondContact O-N 3.34Å; L36-F39 CarbonylContact O-C 3.46Å; L36-F39 VanDerWaalsContact O-C 3.27Å; L36-F39 PolarHBondContact O-N 3.37Å; Q37-F39 PolarHBondContact O-N 3.19Å; F39-L44 HydrophobicContact CD1-CD2 4.29Å; F39-L44 WeakPolarHBondContact O-CD1 3.16Å; F39-H214 HydrophobicContact CE1-CB 3.86Å; F39-H214 HydrophobicContact CZ-CB 4.31Å; F39-V218 HydrophobicContact CE2-CG2 4.05Å; F39-V218 HydrophobicContact CZ-CG2 4.1Å
40	S	87.5	Confident	81.9	Confident	47 Å²	47	65.9 Å²	65.9	33%	0.329	38%	0.377	S	S	.	.			trans	-60.3	152.8	174.7	62.5	0	0	0	0	111.4	L36 Q37 A42 S43 L44	L36-S40 PolarHBondContact O-N 3.22Å; Q37-S40 PolarHBondContact O-N 3.48Å; Q37-S40 PolarHBondContact O-OG 3.42Å; S40-A42 PolarHBondContact O-N 3.48Å; S40-A42 VanDerWaalsContact O-N 3.16Å; S40-S43 WeakPolarHBondContact O-CA 3.29Å; S40-S43 WeakPolarHBondContact O-CB 3.43Å; S40-S43 PolarHBondContact O-N 3.21Å; S40-S43 VanDerWaalsContact OG-CB 3.3Å; S40-S43 WeakPolarHBondContact OG-CB 3.3Å; S40-S43 PolarHBondContact OG-N 2.92Å; S40-L44 PolarHBondContact O-N 3.45Å
41	S	88.8	Confident	83.3	Confident	105 Å²	105	60 Å²	60	73%	0.734	35%	0.352	S	S	*	.	H	α-helix	trans	-55.7	-35.7	178.7	-48.6	0	0	0	0	112.5	L45	S41-L45 VanDerWaalsContact O-CB 3.25Å; S41-L45 WeakPolarHBondContact O-CB 3.43Å; S41-L45 PolarHBondContact O-N 3.24Å
42	A	89.9	Confident	84.9	Confident	72 Å²	72	58.1 Å²	58.1	60%	0.595	35%	0.354	S	S	*	.	H	α-helix	trans	-66	-43	175.3	0	0	0	0	0	112.2	S40 L45 A46	S40-A42 PolarHBondContact O-N 3.48Å; S40-A42 VanDerWaalsContact O-N 3.16Å; A42-L45 PolarHBondContact O-N 2.95Å; A42-A46 VanDerWaalsContact O-CB 3.28Å; A42-A46 WeakPolarHBondContact O-CB 3.44Å; A42-A46 PolarHBondContact O-N 3.48Å
43	S	91.8	Very high	86.5	Confident	13 Å²	13	57.8 Å²	57.8	9%	0.091	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-44.5	176.8	-171.6	0	0	0	0	111.3	T38 S40 A46 S47 I91 H214	T38-S43 PolarHBondContact O-OG 3.11Å; T38-S43 VanDerWaalsContact O-OG 3.04Å; S40-S43 WeakPolarHBondContact O-CA 3.29Å; S40-S43 WeakPolarHBondContact O-CB 3.43Å; S40-S43 PolarHBondContact O-N 3.21Å; S40-S43 VanDerWaalsContact OG-CB 3.3Å; S40-S43 WeakPolarHBondContact OG-CB 3.3Å; S40-S43 PolarHBondContact OG-N 2.92Å; S43-A46 PolarHBondContact O-N 3.29Å; S43-S47 WeakPolarHBondContact O-CB 3.36Å; S43-S47 PolarHBondContact O-N 3.19Å; S43-S47 PolarHBondContact O-OG 3.39Å; S43-I91 WeakPolarHBondContact OG-CG2 3.4Å; S43-H214 PolarHBondContact OG-CE1 3.48Å; S43-H214 PolarHBondContact OG-ND1 3.03Å
44	L	94.8	Very high	88	Confident	79 Å²	79	53.5 Å²	53.5	41%	0.414	32%	0.324	S	S	.	.	H	α-helix	trans	-64.7	-41.2	176.4	-67.6	174.2	0	0	0	112.6	F39 S40 S47 T48	F39-L44 HydrophobicContact CD1-CD2 4.29Å; F39-L44 WeakPolarHBondContact O-CD1 3.16Å; S40-L44 PolarHBondContact O-N 3.45Å; L44-S47 PolarHBondContact O-N 3.07Å; L44-T48 WeakPolarHBondContact O-CB 3.27Å; L44-T48 PolarHBondContact O-N 3Å; L44-T48 PolarHBondContact O-OG1 2.75Å
45	L	96.6	Very high	89.7	Confident	124 Å²	124	54.1 Å²	54.1	65%	0.649	33%	0.325	S	S	*	.	H	α-helix	trans	-63.5	-45	174.3	180	64.1	0	0	0	110.9	S41 A42 S47 T48 A49	S41-L45 VanDerWaalsContact O-CB 3.25Å; S41-L45 WeakPolarHBondContact O-CB 3.43Å; S41-L45 PolarHBondContact O-N 3.24Å; A42-L45 PolarHBondContact O-N 2.95Å; L45-S47 PolarHBondContact O-N 3.31Å; L45-T48 PolarHBondContact O-N 2.75Å; L45-A49 WeakPolarHBondContact O-CB 3.48Å; L45-A49 PolarHBondContact O-N 2.97Å
46	A	96.6	Very high	91.2	Very high	27 Å²	27	56.4 Å²	56.4	22%	0.223	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-41.8	177.7	0	0	0	0	0	112	A42 S43 A49 L50 I91	A42-A46 VanDerWaalsContact O-CB 3.28Å; A42-A46 WeakPolarHBondContact O-CB 3.44Å; A42-A46 PolarHBondContact O-N 3.48Å; S43-A46 PolarHBondContact O-N 3.29Å; A46-A49 PolarHBondContact O-N 2.94Å; A46-L50 WeakPolarHBondContact O-CB 3.47Å; A46-L50 PolarHBondContact O-N 3.13Å; A46-I91 HydrophobicContact CB-CD1 4.09Å; A46-I91 HydrophobicContact CB-CG1 3.85Å
47	S	97.2	Very high	92.8	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.042	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-38.9	174.6	-70	0	0	0	0	113	S43 L44 L45 L50 G51 A210 H214	S43-S47 WeakPolarHBondContact O-CB 3.36Å; S43-S47 PolarHBondContact O-N 3.19Å; S43-S47 PolarHBondContact O-OG 3.39Å; L44-S47 PolarHBondContact O-N 3.07Å; L45-S47 PolarHBondContact O-N 3.31Å; S47-L50 WeakPolarHBondContact O-CB 3.49Å; S47-L50 PolarHBondContact O-N 3.17Å; S47-G51 PolarHBondContact O-N 3.28Å; S47-A210 VanDerWaalsContact CB-O 3.3Å; S47-A210 WeakPolarHBondContact CB-O 3.46Å; S47-A210 PolarHBondContact OG-O 3.47Å; S47-H214 VanDerWaalsContact CB-NE2 3.32Å; S47-H214 WeakPolarHBondContact CB-NE2 3.32Å; S47-H214 PolarHBondContact OG-CD2 3.49Å; S47-H214 PolarHBondContact OG-CE1 3.4Å; S47-H214 PolarHBondContact OG-NE2 3.25Å
48	T	97.8	Very high	94.1	Very high	98 Å²	98	47.6 Å²	47.6	60%	0.601	30%	0.295	S	S	*	.	H	α-helix	trans	-64.2	-43.1	173.8	-56.8	0	0	0	0	110.7	L44 L45 L50 G51 A52	L44-T48 WeakPolarHBondContact O-CB 3.27Å; L44-T48 PolarHBondContact O-N 3Å; L44-T48 PolarHBondContact O-OG1 2.75Å; L45-T48 PolarHBondContact O-N 2.75Å; T48-L50 VanDerWaalsContact C-N 3.35Å; T48-G51 PolarHBondContact O-N 3.16Å; T48-A52 PolarHBondContact O-N 2.79Å
49	A	98.4	Very high	95.3	Very high	38 Å²	38	52.3 Å²	52.3	31%	0.314	32%	0.316	S	S	.	.	H	α-helix	trans	-64	-37.6	175.1	0	0	0	0	0	112.2	L45 A46 A52 F53 W87	L45-A49 WeakPolarHBondContact O-CB 3.48Å; L45-A49 PolarHBondContact O-N 2.97Å; A46-A49 PolarHBondContact O-N 2.94Å; A49-A52 PolarHBondContact O-N 3.43Å; A49-F53 VanDerWaalsContact O-CB 3.32Å; A49-F53 WeakPolarHBondContact O-CB 3.21Å; A49-F53 PolarHBondContact O-N 2.99Å; A49-W87 HydrophobicContact CB-CH2 4.29Å; A49-W87 HydrophobicContact CB-CZ2 3.85Å
50	L	98.7	Very high	96	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-43.8	173.6	177.4	59.6	0	0	0	111.5	A46 S47 T48 F53 C54 I84 W87 I91 T209 P213	A46-L50 WeakPolarHBondContact O-CB 3.47Å; A46-L50 PolarHBondContact O-N 3.13Å; S47-L50 WeakPolarHBondContact O-CB 3.49Å; S47-L50 PolarHBondContact O-N 3.17Å; T48-L50 VanDerWaalsContact C-N 3.35Å; L50-F53 HydrophobicContact CD1-CD1 4.44Å; L50-F53 WeakPolarHBondContact O-CB 3.35Å; L50-F53 PolarHBondContact O-N 2.68Å; L50-C54 PolarHBondContact O-N 2.92Å; L50-C54 PolarHBondContact O-SG 3.32Å; L50-I84 HydrophobicContact CD1-CG1 4.34Å; L50-W87 HydrophobicContact CB-CD2 4.47Å; L50-W87 HydrophobicContact CD1-CB 4.05Å; L50-W87 HydrophobicContact CD1-CD2 4.11Å; L50-W87 HydrophobicContact CD1-CE3 4.12Å; L50-W87 HydrophobicContact CD1-CG 4.09Å; L50-I91 HydrophobicContact CB-CD1 4.44Å; L50-I91 HydrophobicContact CD2-CD1 4.04Å; L50-T209 HydrophobicContact CD2-CG2 4.4Å; L50-T209 HydrophobicContact CG-CG2 4.42Å; L50-P213 HydrophobicContact CD2-CG 4.34Å
51	G	98.4	Very high	96.4	Very high	7 Å²	7	49.1 Å²	49.1	7%	0.072	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-44.5	173.4	0	0	0	0	0	112.6	S47 T48 F53 C54 V55	S47-G51 PolarHBondContact O-N 3.28Å; T48-G51 PolarHBondContact O-N 3.16Å; G51-F53 VanDerWaalsContact C-N 3.33Å; G51-F53 PolarHBondContact O-N 3.32Å; G51-C54 WeakPolarHBondContact O-CB 3.26Å; G51-C54 PolarHBondContact O-N 3.17Å; G51-V55 PolarHBondContact O-N 3.24Å; G51-V55 VanDerWaalsContact O-N 3.15Å
52	A	98.6	Very high	96.7	Very high	59 Å²	59	49.9 Å²	49.9	49%	0.488	29%	0.294	S	S	.	.	H	α-helix	trans	-63.3	-38.4	175.3	0	0	0	0	0	112.4	T48 A49 V55 L56	T48-A52 PolarHBondContact O-N 2.79Å; A49-A52 PolarHBondContact O-N 3.43Å; A52-V55 PolarHBondContact O-N 3.14Å; A52-L56 PolarHBondContact O-N 3.36Å
53	F	98.7	Very high	96.9	Very high	42 Å²	42	51.1 Å²	51.1	18%	0.184	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-44.9	174	169.8	-100.6	0	0	0	111.5	A49 L50 G51 V55 L56 A57 V80 L83 I84 W87	A49-F53 VanDerWaalsContact O-CB 3.32Å; A49-F53 WeakPolarHBondContact O-CB 3.21Å; A49-F53 PolarHBondContact O-N 2.99Å; L50-F53 HydrophobicContact CD1-CD1 4.44Å; L50-F53 WeakPolarHBondContact O-CB 3.35Å; L50-F53 PolarHBondContact O-N 2.68Å; G51-F53 VanDerWaalsContact C-N 3.33Å; G51-F53 PolarHBondContact O-N 3.32Å; F53-V55 VanDerWaalsContact C-N 3.3Å; F53-V55 PolarHBondContact O-N 3.24Å; F53-L56 PolarHBondContact O-N 3.02Å; F53-A57 HydrophobicContact CE1-CB 4.45Å; F53-A57 HydrophobicContact CE2-CB 4.44Å; F53-A57 HydrophobicContact CZ-CB 4.24Å; F53-A57 VanDerWaalsContact O-CB 3.22Å; F53-A57 WeakPolarHBondContact O-CB 3.44Å; F53-A57 PolarHBondContact O-N 2.97Å; F53-V80 HydrophobicContact CE1-CG1 4.07Å; F53-V80 HydrophobicContact CZ-CG1 4.39Å; F53-V80 HydrophobicContact CZ-CG2 4.47Å; F53-L83 HydrophobicContact CE1-CB 4.07Å; F53-L83 HydrophobicContact CE2-CD1 4.22Å; F53-L83 HydrophobicContact CZ-CB 3.94Å; F53-L83 HydrophobicContact CZ-CD1 3.7Å; F53-L83 HydrophobicContact CZ-CG 4.5Å; F53-I84 HydrophobicContact CD1-CG1 4.37Å; F53-I84 HydrophobicContact CE1-CG1 4.06Å; F53-W87 HydrophobicContact CB-CH2 4.31Å; F53-W87 HydrophobicContact CB-CZ3 3.78Å; F53-W87 HydrophobicContact CD1-CE3 4.39Å; F53-W87 HydrophobicContact CD1-CZ3 4.3Å; F53-W87 HydrophobicContact CD2-CZ3 4.12Å; F53-W87 HydrophobicContact CG-CE3 4.34Å; F53-W87 AromaticContact CG-CZ3 3.79Å; F53-W87 HydrophobicContact CG-CZ3 3.79Å
54	C	98.4	Very high	97	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-54.2	-48.7	174.3	-70.2	0	0	0	0	111	L50 G51 A57 D58 Y205 V206	L50-C54 PolarHBondContact O-N 2.92Å; L50-C54 PolarHBondContact O-SG 3.32Å; G51-C54 WeakPolarHBondContact O-CB 3.26Å; G51-C54 PolarHBondContact O-N 3.17Å; C54-A57 PolarHBondContact O-N 3.09Å; C54-D58 WeakPolarHBondContact O-CB 3.31Å; C54-D58 PolarHBondContact O-N 3.45Å; C54-D58 VanDerWaalsContact O-OD2 3.11Å; C54-Y205 HydrophobicContact CB-CE2 4.41Å; C54-Y205 VanDerWaalsContact CB-OH 3.26Å; C54-Y205 WeakPolarHBondContact CB-OH 3.16Å; C54-V206 HydrophobicContact CB-CG2 4.44Å
55	V	98.6	Very high	96.8	Very high	35 Å²	35	56.7 Å²	56.7	21%	0.212	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-51.1	177.1	177.3	0	0	0	0	111.3	G51 A52 F53 D58 H59 Y202 W203 V206	G51-V55 PolarHBondContact O-N 3.24Å; G51-V55 VanDerWaalsContact O-N 3.15Å; A52-V55 PolarHBondContact O-N 3.14Å; F53-V55 VanDerWaalsContact C-N 3.3Å; F53-V55 PolarHBondContact O-N 3.24Å; V55-D58 PolarHBondContact O-N 2.82Å; V55-H59 PolarHBondContact O-N 3.45Å; V55-H59 VanDerWaalsContact O-N 3.1Å; V55-H59 PolarHBondContact O-ND1 3.26Å; V55-Y202 WeakPolarHBondContact CA-OH 3.38Å; V55-W203 HydrophobicContact CG2-CZ3 4.14Å; V55-V206 HydrophobicContact CG2-CG1 4.23Å; V55-V206 HydrophobicContact CG2-CG2 4.16Å
56	L	98.4	Very high	96.5	Very high	112 Å²	112	51.4 Å²	51.4	59%	0.586	29%	0.294	S	S	*	.	H	α-helix	trans	-61.2	-47.3	-179.3	179.7	64.3	0	0	0	112.2	A52 F53 D58 H59 V60	A52-L56 PolarHBondContact O-N 3.36Å; F53-L56 PolarHBondContact O-N 3.02Å; L56-D58 VanDerWaalsContact C-N 3.33Å; L56-D58 PolarHBondContact O-N 3.39Å; L56-H59 PolarHBondContact O-N 3.06Å; L56-V60 WeakPolarHBondContact O-CG2 3.33Å; L56-V60 PolarHBondContact O-N 3.06Å
57	A	97.8	Very high	96.3	Very high	9 Å²	9	55.1 Å²	55.1	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-44	-179.5	0	0	0	0	0	111.2	F53 C54 H59 V60 M61 V80	F53-A57 HydrophobicContact CE1-CB 4.45Å; F53-A57 HydrophobicContact CE2-CB 4.44Å; F53-A57 HydrophobicContact CZ-CB 4.24Å; F53-A57 VanDerWaalsContact O-CB 3.22Å; F53-A57 WeakPolarHBondContact O-CB 3.44Å; F53-A57 PolarHBondContact O-N 2.97Å; C54-A57 PolarHBondContact O-N 3.09Å; A57-H59 PolarHBondContact O-N 3.27Å; A57-V60 WeakPolarHBondContact O-CB 3.48Å; A57-V60 PolarHBondContact O-N 3.49Å; A57-M61 VanDerWaalsContact O-CG 3.26Å; A57-M61 WeakPolarHBondContact O-CG 3.48Å; A57-M61 PolarHBondContact O-N 2.9Å; A57-V80 HydrophobicContact CB-CG1 3.98Å; A57-V80 HydrophobicContact CB-CG2 3.82Å
58	D	96.9	Very high	96.1	Very high	21 Å²	21	61.8 Å²	61.8	11%	0.112	34%	0.338	C	S	.	.	H	α-helix	trans	-69	-34.3	179.5	-64.7	-27.6	0	0	0	112.4	C54 V55 L56 M61 Q62 R182 Y202 Y205	C54-D58 WeakPolarHBondContact O-CB 3.31Å; C54-D58 PolarHBondContact O-N 3.45Å; C54-D58 VanDerWaalsContact O-OD2 3.11Å; V55-D58 PolarHBondContact O-N 2.82Å; L56-D58 VanDerWaalsContact C-N 3.33Å; L56-D58 PolarHBondContact O-N 3.39Å; D58-M61 PolarHBondContact O-N 3.1Å; D58-Q62 WeakPolarHBondContact O-CG 3.16Å; D58-Q62 PolarHBondContact O-N 2.87Å; D58-R182 IonicContact OD1-NE 3.87Å; D58-R182 IonicContact OD1-NH2 3.57Å; D58-Y202 HydrophobicContact CB-CE2 4.24Å; D58-Y202 WeakPolarHBondContact OD2-CE2 3.46Å; D58-Y202 PolarHBondContact OD2-OH 2.81Å; D58-Y205 WeakPolarHBondContact OD2-CE1 3.43Å; D58-Y205 VanDerWaalsContact OD2-CZ 3.31Å; D58-Y205 PolarHBondContact OD2-OH 2.94Å
59	H	96.4	Very high	95.9	Very high	103 Å²	103	62.1 Å²	62.1	48%	0.477	33%	0.332	S	S	.	.	H	α-helix	trans	-65.4	-42	171.7	-77.2	81	0	0	0	111.6	V55 L56 A57 M61 Q62	V55-H59 PolarHBondContact O-N 3.45Å; V55-H59 VanDerWaalsContact O-N 3.1Å; V55-H59 PolarHBondContact O-ND1 3.26Å; L56-H59 PolarHBondContact O-N 3.06Å; A57-H59 PolarHBondContact O-N 3.27Å; H59-M61 VanDerWaalsContact C-N 3.31Å; H59-M61 PolarHBondContact O-N 3.44Å; H59-Q62 PolarHBondContact O-N 2.89Å; H59-Q62 VanDerWaalsContact O-N 3.14Å
60	V	96.5	Very high	95.7	Very high	61 Å²	61	63.8 Å²	63.8	37%	0.37	34%	0.335	S	S	.	.	H	α-helix	trans	-58.7	-45.7	173.9	168.3	0	0	0	0	110	L56 A57 Q62 L63 L66	L56-V60 WeakPolarHBondContact O-CG2 3.33Å; L56-V60 PolarHBondContact O-N 3.06Å; A57-V60 WeakPolarHBondContact O-CB 3.48Å; A57-V60 PolarHBondContact O-N 3.49Å; V60-Q62 PolarHBondContact O-N 3.42Å; V60-Q62 VanDerWaalsContact O-N 3.1Å; V60-L63 HydrophobicContact CG1-CD1 4.34Å; V60-L63 VanDerWaalsContact O-CB 3.27Å; V60-L63 WeakPolarHBondContact O-CB 3.5Å; V60-L63 WeakPolarHBondContact O-CG 3.27Å; V60-L63 PolarHBondContact O-N 2.69Å; V60-L66 HydrophobicContact CG1-CD1 3.76Å; V60-L66 WeakPolarHBondContact O-CD1 3.07Å
61	M	94.9	Very high	95.4	Very high	21 Å²	21	71.6 Å²	71.6	10%	0.103	37%	0.365	C	S	.	.	H	α-helix	trans	-61.5	-17.7	178.2	-71.6	-61.4	-68	0	0	114.6	A57 D58 H59 L66 R73 L76 D77	A57-M61 VanDerWaalsContact O-CG 3.26Å; A57-M61 WeakPolarHBondContact O-CG 3.48Å; A57-M61 PolarHBondContact O-N 2.9Å; D58-M61 PolarHBondContact O-N 3.1Å; H59-M61 VanDerWaalsContact C-N 3.31Å; H59-M61 PolarHBondContact O-N 3.44Å; M61-L66 HydrophobicContact SD-CD1 4.25Å; M61-R73 HydrophobicContact CE-CG 3.68Å; M61-R73 WeakPolarHBondContact CE-O 3.41Å; M61-L76 HydrophobicContact SD-CB 3.65Å; M61-D77 HydrophobicContact CE-CB 3.74Å
62	Q	95	Very high	95.2	Very high	121 Å²	121	74.6 Å²	74.6	57%	0.565	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-8.4	175.6	-69.3	174	23.7	0	0	113.8	D58 H59 V60 T64	D58-Q62 WeakPolarHBondContact O-CG 3.16Å; D58-Q62 PolarHBondContact O-N 2.87Å; H59-Q62 PolarHBondContact O-N 2.89Å; H59-Q62 VanDerWaalsContact O-N 3.14Å; V60-Q62 PolarHBondContact O-N 3.42Å; V60-Q62 VanDerWaalsContact O-N 3.1Å; Q62-T64 PolarHBondContact O-N 3.21Å
63	L	95.2	Very high	95.1	Very high	98 Å²	98	76.5 Å²	76.5	51%	0.513	37%	0.374	S	S	.	.	S	Bend	trans	-60.7	132.7	177.9	-64.6	174	0	0	0	110.9	V60 L65 L66 Q67	V60-L63 HydrophobicContact CG1-CD1 4.34Å; V60-L63 VanDerWaalsContact O-CB 3.27Å; V60-L63 WeakPolarHBondContact O-CB 3.5Å; V60-L63 WeakPolarHBondContact O-CG 3.27Å; V60-L63 PolarHBondContact O-N 2.69Å; L63-L65 PolarHBondContact O-N 2.95Å; L63-L65 VanDerWaalsContact O-N 3.13Å; L63-L66 HydrophobicContact CB-CG 4.35Å; L63-L66 WeakPolarHBondContact O-CB 3.04Å; L63-L66 PolarHBondContact O-N 3.5Å; L63-Q67 PolarHBondContact O-N 3.38Å; L63-Q67 VanDerWaalsContact O-N 3.09Å
64	T	92.4	Very high	94.9	Very high	96 Å²	96	75.9 Å²	75.9	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-54.1	-38.4	-176.7	-45	0	0	0	0	112.7	Q62 L66 Q67 Q68	Q62-T64 PolarHBondContact O-N 3.21Å; T64-L66 VanDerWaalsContact C-N 3.3Å; T64-L66 PolarHBondContact O-N 3.09Å; T64-Q67 PolarHBondContact O-N 3.44Å; T64-Q68 WeakPolarHBondContact O-CG 3.44Å; T64-Q68 PolarHBondContact O-N 2.87Å; T64-Q68 VanDerWaalsContact O-N 3.07Å
65	L	90.8	Very high	94.8	Very high	113 Å²	113	79.5 Å²	79.5	59%	0.592	40%	0.398	S	S	*	.	H	α-helix	trans	-60	-39.2	177.4	-174.6	141.9	0	0	0	111.9	L63 H69 L72	L63-L65 PolarHBondContact O-N 2.95Å; L63-L65 VanDerWaalsContact O-N 3.13Å; L65-H69 PolarHBondContact O-CD2 2.85Å; L65-L72 HydrophobicContact CD2-CD2 4.2Å
66	L	91.4	Very high	94.7	Very high	12 Å²	12	80.4 Å²	80.4	6%	0.063	40%	0.402	C	S	.	.	H	α-helix	trans	-73.6	-39.1	176.1	-60.8	-166.5	0	0	0	111.7	V60 M61 L63 T64 Q68 H69 L72 L76	V60-L66 HydrophobicContact CG1-CD1 3.76Å; V60-L66 WeakPolarHBondContact O-CD1 3.07Å; M61-L66 HydrophobicContact SD-CD1 4.25Å; L63-L66 HydrophobicContact CB-CG 4.35Å; L63-L66 WeakPolarHBondContact O-CB 3.04Å; L63-L66 PolarHBondContact O-N 3.5Å; T64-L66 VanDerWaalsContact C-N 3.3Å; T64-L66 PolarHBondContact O-N 3.09Å; L66-Q68 PolarHBondContact O-N 3.4Å; L66-H69 PolarHBondContact O-N 2.87Å; L66-L72 HydrophobicContact CD2-CD2 3.27Å; L66-L72 HydrophobicContact CD2-CG 3.66Å; L66-L76 HydrophobicContact CD1-CD1 3.52Å; L66-L76 HydrophobicContact CD2-CD1 3.58Å; L66-L76 HydrophobicContact CG-CD1 4.21Å
67	Q	91.9	Very high	94.6	Very high	106 Å²	106	76.1 Å²	76.1	50%	0.495	38%	0.379	S	S	.	.	H	α-helix	trans	-64.8	-29.3	-179.1	-66.7	-162.2	-17.6	0	0	113.2	L63 T64	L63-Q67 PolarHBondContact O-N 3.38Å; L63-Q67 VanDerWaalsContact O-N 3.09Å; T64-Q67 PolarHBondContact O-N 3.44Å
68	Q	92.8	Very high	94.7	Very high	146 Å²	146	77.7 Å²	77.7	68%	0.682	39%	0.386	S	S	*	.	H	α-helix	trans	-77.1	-21.7	177.2	-70.7	177.7	-8.9	0	0	113.6	T64 L66	T64-Q68 WeakPolarHBondContact O-CG 3.44Å; T64-Q68 PolarHBondContact O-N 2.87Å; T64-Q68 VanDerWaalsContact O-N 3.07Å; L66-Q68 PolarHBondContact O-N 3.4Å
69	H	94	Very high	94.7	Very high	104 Å²	104	79.6 Å²	79.6	48%	0.481	40%	0.399	S	S	.	.			trans	-110.6	96.1	-176	-69.4	-61.2	0	0	0	112	L65 L66 W71 L72 R73	L65-H69 PolarHBondContact O-CD2 2.85Å; L66-H69 PolarHBondContact O-N 2.87Å; H69-W71 VanDerWaalsContact C-N 3.33Å; H69-W71 PolarHBondContact O-N 3.18Å; H69-L72 HydrophobicContact CB-CB 3.87Å; H69-L72 PolarHBondContact O-N 3.34Å; H69-L72 VanDerWaalsContact O-N 3.13Å; H69-R73 PolarHBondContact O-N 3.37Å
70	L	93.3	Very high	94.8	Very high	73 Å²	73	75.3 Å²	75.3	38%	0.382	38%	0.38	S	S	.	.	H	α-helix	trans	-52.2	-46.2	-176.3	-175.7	64.8	0	0	0	113.6	R73 A74 L127 K128 T131	L70-R73 PolarHBondContact O-N 3.08Å; L70-A74 WeakPolarHBondContact O-CB 3.3Å; L70-A74 PolarHBondContact O-N 3.39Å; L70-L127 HydrophobicContact CB-CD2 4.44Å; L70-L127 HydrophobicContact CD2-CB 4.49Å; L70-L127 HydrophobicContact CD2-CD2 4.16Å; L70-L127 HydrophobicContact CD2-CG 4.03Å; L70-L127 HydrophobicContact CG-CD2 3.72Å; L70-L127 HydrophobicContact CG-CG 3.99Å; L70-K128 HydrophobicContact CD2-CB 4.38Å; L70-T131 HydrophobicContact CD1-CG2 4.25Å
71	W	93.7	Very high	94.9	Very high	164 Å²	164	72.4 Å²	72.4	62%	0.621	36%	0.363	S	S	*	.	H	α-helix	trans	-62.3	-48.1	178.5	-86.8	102.6	0	0	0	112.7	H69 R73 A74 V75 L127	H69-W71 VanDerWaalsContact C-N 3.33Å; H69-W71 PolarHBondContact O-N 3.18Å; W71-R73 VanDerWaalsContact C-N 3.31Å; W71-R73 PolarHBondContact O-N 2.98Å; W71-A74 PolarHBondContact O-N 3.28Å; W71-V75 HydrophobicContact CE3-CG2 4.45Å; W71-V75 WeakPolarHBondContact O-CB 3.45Å; W71-V75 VanDerWaalsContact O-CG2 3.3Å; W71-V75 WeakPolarHBondContact O-CG2 3.48Å; W71-V75 PolarHBondContact O-N 2.89Å; W71-L127 VanDerWaalsContact CA-CD2 3.43Å; W71-L127 HydrophobicContact CB-CD2 4.14Å; W71-L127 HydrophobicContact CD2-CB 4.38Å; W71-L127 HydrophobicContact CD2-CD2 3.5Å; W71-L127 HydrophobicContact CE3-CD2 3.81Å; W71-L127 HydrophobicContact CG-CD2 3.66Å; W71-L127 HydrophobicContact CH2-CB 4.29Å; W71-L127 HydrophobicContact CZ2-CB 3.89Å; W71-L127 HydrophobicContact CZ2-CD2 4.49Å; W71-L127 HydrophobicContact CZ3-CD2 4.41Å
72	L	94.5	Very high	95.1	Very high	71 Å²	71	73 Å²	73	37%	0.372	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-42.4	-178.6	-174.6	59.9	0	0	0	110.6	L65 L66 H69 L76	L65-L72 HydrophobicContact CD2-CD2 4.2Å; L66-L72 HydrophobicContact CD2-CD2 3.27Å; L66-L72 HydrophobicContact CD2-CG 3.66Å; H69-L72 HydrophobicContact CB-CB 3.87Å; H69-L72 PolarHBondContact O-N 3.34Å; H69-L72 VanDerWaalsContact O-N 3.13Å; L72-L76 HydrophobicContact CD1-CD1 3.91Å; L72-L76 HydrophobicContact CD1-CG 4.18Å; L72-L76 HydrophobicContact CG-CD1 3.88Å; L72-L76 VanDerWaalsContact O-CB 3.3Å; L72-L76 WeakPolarHBondContact O-CB 3.35Å; L72-L76 VanDerWaalsContact O-CG 3.25Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 2.85Å
73	R	95.3	Very high	95.3	Very high	98 Å²	98	70.5 Å²	70.5	37%	0.37	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-51.5	173.6	-174.6	-179.1	172.8	175.6	-1.3	111.7	M61 H69 L70 W71 V75 L76 D77	M61-R73 HydrophobicContact CE-CG 3.68Å; M61-R73 WeakPolarHBondContact CE-O 3.41Å; H69-R73 PolarHBondContact O-N 3.37Å; L70-R73 PolarHBondContact O-N 3.08Å; W71-R73 VanDerWaalsContact C-N 3.31Å; W71-R73 PolarHBondContact O-N 2.98Å; R73-V75 PolarHBondContact O-N 3.47Å; R73-L76 PolarHBondContact O-N 3.41Å; R73-D77 WeakPolarHBondContact O-CB 3.36Å; R73-D77 PolarHBondContact O-N 3.47Å
74	A	95.4	Very high	95.5	Very high	29 Å²	29	65.9 Å²	65.9	24%	0.24	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-42.8	-177.7	0	0	0	0	0	112.6	L70 W71 D77 N78 L127	L70-A74 WeakPolarHBondContact O-CB 3.3Å; L70-A74 PolarHBondContact O-N 3.39Å; W71-A74 PolarHBondContact O-N 3.28Å; A74-D77 PolarHBondContact O-N 3.47Å; A74-N78 WeakPolarHBondContact O-CB 3.2Å; A74-N78 PolarHBondContact O-N 3.49Å; A74-L127 HydrophobicContact CB-CD1 3.68Å; A74-L127 HydrophobicContact CB-CD2 3.81Å; A74-L127 HydrophobicContact CB-CG 4.32Å
75	V	95.6	Very high	95.8	Very high	77 Å²	77	61.3 Å²	61.3	47%	0.467	31%	0.306	S	S	.	.	H	α-helix	trans	-64.5	-44.5	178	170.4	0	0	0	0	111	W71 R73 T79	W71-V75 HydrophobicContact CE3-CG2 4.45Å; W71-V75 WeakPolarHBondContact O-CB 3.45Å; W71-V75 VanDerWaalsContact O-CG2 3.3Å; W71-V75 WeakPolarHBondContact O-CG2 3.48Å; W71-V75 PolarHBondContact O-N 2.89Å; R73-V75 PolarHBondContact O-N 3.47Å; V75-T79 VanDerWaalsContact O-CB 3.31Å; V75-T79 WeakPolarHBondContact O-CB 3.25Å; V75-T79 PolarHBondContact O-N 3.22Å; V75-T79 PolarHBondContact O-OG1 3.38Å
76	L	97	Very high	96.1	Very high	54 Å²	54	58.4 Å²	58.4	28%	0.283	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-41	178	-72.4	172.5	0	0	0	111.9	M61 L66 L72 R73 N78 T79 V80	M61-L76 HydrophobicContact SD-CB 3.65Å; L66-L76 HydrophobicContact CD1-CD1 3.52Å; L66-L76 HydrophobicContact CD2-CD1 3.58Å; L66-L76 HydrophobicContact CG-CD1 4.21Å; L72-L76 HydrophobicContact CD1-CD1 3.91Å; L72-L76 HydrophobicContact CD1-CG 4.18Å; L72-L76 HydrophobicContact CG-CD1 3.88Å; L72-L76 VanDerWaalsContact O-CB 3.3Å; L72-L76 WeakPolarHBondContact O-CB 3.35Å; L72-L76 VanDerWaalsContact O-CG 3.25Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 2.85Å; R73-L76 PolarHBondContact O-N 3.41Å; L76-N78 PolarHBondContact O-N 2.88Å; L76-T79 WeakPolarHBondContact O-CB 3.47Å; L76-T79 PolarHBondContact O-N 2.9Å; L76-V80 WeakPolarHBondContact O-CG2 3.39Å; L76-V80 PolarHBondContact O-N 2.8Å
77	D	96.8	Very high	96.4	Very high	22 Å²	22	61.8 Å²	61.8	12%	0.118	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-49.6	178.1	-155.7	29.6	0	0	0	111.2	M61 R73 A74 T79 V80 H81 R182 R186	M61-D77 HydrophobicContact CE-CB 3.74Å; R73-D77 WeakPolarHBondContact O-CB 3.36Å; R73-D77 PolarHBondContact O-N 3.47Å; A74-D77 PolarHBondContact O-N 3.47Å; D77-T79 VanDerWaalsContact C-N 3.33Å; D77-T79 PolarHBondContact O-N 3.22Å; D77-V80 PolarHBondContact O-N 2.99Å; D77-V80 VanDerWaalsContact O-N 3.16Å; D77-H81 PolarHBondContact O-CD2 2.94Å; D77-H81 PolarHBondContact O-N 3.19Å; D77-H81 VanDerWaalsContact O-N 3.09Å; D77-R182 PolarHBondContact O-NH1 3.49Å; D77-R182 IonicContact OD1-CZ 3.9Å; D77-R182 VanDerWaalsContact OD1-CZ 3.24Å; D77-R182 IonicContact OD1-NH1 2.97Å; D77-R182 PolarHBondContact OD1-NH1 3.41Å; D77-R182 VanDerWaalsContact OD1-NH1 3.15Å; D77-R182 IonicContact OD1-NH2 2.82Å; D77-R182 PolarHBondContact OD1-NH2 3.08Å; D77-R186 IonicContact OD1-NH2 3.57Å; D77-R186 IonicContact OD2-CZ 3.24Å; D77-R186 IonicContact OD2-NH1 3.89Å; D77-R186 IonicContact OD2-NH2 3.99Å; D77-R186 PolarHBondContact OD2-NH2 3.37Å
78	N	98.1	Very high	96.8	Very high	41 Å²	41	56.8 Å²	56.8	22%	0.219	28%	0.279	C	S	.	.	H	α-helix	trans	-64.9	-35.7	176.8	-170	10	0	0	0	112.2	A74 L76 V80 H81 C82 S112 D115	A74-N78 WeakPolarHBondContact O-CB 3.2Å; A74-N78 PolarHBondContact O-N 3.49Å; L76-N78 PolarHBondContact O-N 2.88Å; N78-V80 VanDerWaalsContact C-N 3.31Å; N78-V80 PolarHBondContact O-N 3.41Å; N78-H81 WeakPolarHBondContact O-CB 3.33Å; N78-H81 PolarHBondContact O-N 3.12Å; N78-C82 PolarHBondContact O-N 2.89Å; N78-S112 PolarHBondContact O-OG 3.1Å; N78-S112 VanDerWaalsContact O-OG 3.06Å; N78-S112 WeakPolarHBondContact OD1-CA 3.47Å; N78-S112 WeakPolarHBondContact OD1-CB 3.36Å; N78-S112 PolarHBondContact OD1-O 3.22Å; N78-S112 PolarHBondContact OD1-OG 3.14Å; N78-D115 WeakPolarHBondContact CB-OD2 3.5Å; N78-D115 PolarHBondContact OD1-OD2 2.87Å
79	T	98.4	Very high	97	Very high	61 Å²	61	49.8 Å²	49.8	37%	0.374	25%	0.247	S	C	.	.	H	α-helix	trans	-62.7	-39.1	174	-60.4	0	0	0	0	111.3	V75 L76 D77 C82 L83	V75-T79 VanDerWaalsContact O-CB 3.31Å; V75-T79 WeakPolarHBondContact O-CB 3.25Å; V75-T79 PolarHBondContact O-N 3.22Å; V75-T79 PolarHBondContact O-OG1 3.38Å; L76-T79 WeakPolarHBondContact O-CB 3.47Å; L76-T79 PolarHBondContact O-N 2.9Å; D77-T79 VanDerWaalsContact C-N 3.33Å; D77-T79 PolarHBondContact O-N 3.22Å; T79-C82 VanDerWaalsContact O-CB 3.27Å; T79-C82 WeakPolarHBondContact O-CB 3.35Å; T79-C82 PolarHBondContact O-N 2.89Å; T79-L83 HydrophobicContact CG2-CD1 4.1Å; T79-L83 HydrophobicContact CG2-CG 4.39Å; T79-L83 VanDerWaalsContact O-CG 3.32Å; T79-L83 WeakPolarHBondContact O-CG 3.44Å; T79-L83 PolarHBondContact O-N 3Å
80	V	98.5	Very high	97.1	Very high	13 Å²	13	45.6 Å²	45.6	8%	0.079	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-38.9	175.7	175.2	0	0	0	0	110.7	F53 A57 L76 D77 N78 C82 L83 I84 R182	F53-V80 HydrophobicContact CE1-CG1 4.07Å; F53-V80 HydrophobicContact CZ-CG1 4.39Å; F53-V80 HydrophobicContact CZ-CG2 4.47Å; A57-V80 HydrophobicContact CB-CG1 3.98Å; A57-V80 HydrophobicContact CB-CG2 3.82Å; L76-V80 WeakPolarHBondContact O-CG2 3.39Å; L76-V80 PolarHBondContact O-N 2.8Å; D77-V80 PolarHBondContact O-N 2.99Å; D77-V80 VanDerWaalsContact O-N 3.16Å; N78-V80 VanDerWaalsContact C-N 3.31Å; N78-V80 PolarHBondContact O-N 3.41Å; V80-C82 VanDerWaalsContact C-N 3.34Å; V80-C82 PolarHBondContact O-N 3.15Å; V80-L83 PolarHBondContact O-N 3.35Å; V80-I84 HydrophobicContact CG1-CD1 3.74Å; V80-I84 HydrophobicContact CG1-CG1 4.24Å; V80-I84 WeakPolarHBondContact O-CB 3.33Å; V80-I84 VanDerWaalsContact O-CG1 3.29Å; V80-I84 WeakPolarHBondContact O-CG1 3.4Å; V80-I84 PolarHBondContact O-N 3.28Å; V80-R182 VanDerWaalsContact CB-NH1 3.33Å
81	H	98.6	Very high	97.2	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-44.9	171.2	-70.5	-71.2	0	0	0	112.1	D77 N78 L83 I84 G85 A111 D115 H179 R182 D183	D77-H81 PolarHBondContact O-CD2 2.94Å; D77-H81 PolarHBondContact O-N 3.19Å; D77-H81 VanDerWaalsContact O-N 3.09Å; N78-H81 WeakPolarHBondContact O-CB 3.33Å; N78-H81 PolarHBondContact O-N 3.12Å; H81-L83 PolarHBondContact O-N 3.21Å; H81-I84 PolarHBondContact O-N 3.48Å; H81-G85 PolarHBondContact O-N 2.81Å; H81-A111 WeakPolarHBondContact O-CB 3.47Å; H81-D115 IonicContact CD2-OD2 3.61Å; H81-H179 AromaticContact CG-CE1 3.93Å; H81-H179 AromaticContact CG-ND1 3.61Å; H81-H179 AromaticContact ND1-CE1 3.93Å; H81-H179 AromaticContact ND1-CG 3.74Å; H81-H179 AromaticContact ND1-ND1 3.51Å; H81-R182 PolarHBondContact CD2-NH1 2.87Å; H81-R182 PolarHBondContact NE2-NH1 3.32Å; H81-R182 VanDerWaalsContact NE2-NH1 3.11Å; H81-D183 IonicContact CE1-OD1 3.66Å; H81-D183 IonicContact NE2-OD1 3.65Å
82	C	98.7	Very high	97.2	Very high	33 Å²	33	35.3 Å²	35.3	22%	0.223	19%	0.187	C	C	.	.	H	α-helix	trans	-54.4	-54	174.1	-169.2	0	0	0	0	111.5	N78 T79 V80 I84 G85 L86 G108 S112	N78-C82 PolarHBondContact O-N 2.89Å; T79-C82 VanDerWaalsContact O-CB 3.27Å; T79-C82 WeakPolarHBondContact O-CB 3.35Å; T79-C82 PolarHBondContact O-N 2.89Å; V80-C82 VanDerWaalsContact C-N 3.34Å; V80-C82 PolarHBondContact O-N 3.15Å; C82-I84 PolarHBondContact O-N 3.1Å; C82-G85 PolarHBondContact O-N 3.02Å; C82-L86 VanDerWaalsContact O-CB 3.26Å; C82-L86 WeakPolarHBondContact O-CB 3.49Å; C82-L86 PolarHBondContact O-N 2.97Å; C82-G108 WeakPolarHBondContact O-CA 3.29Å; C82-G108 VanDerWaalsContact SG-C 3.59Å; C82-S112 WeakPolarHBondContact CA-OG 3.38Å; C82-S112 WeakPolarHBondContact CB-OG 3.33Å; C82-S112 PolarHBondContact N-OG 2.92Å
83	L	98.7	Very high	96.9	Very high	69 Å²	69	33.5 Å²	33.5	36%	0.361	18%	0.178	S	C	.	.	H	α-helix	trans	-65.6	-39.8	-174.4	-70.1	175.1	0	0	0	111.7	F53 T79 V80 H81 W87	F53-L83 HydrophobicContact CE1-CB 4.07Å; F53-L83 HydrophobicContact CE2-CD1 4.22Å; F53-L83 HydrophobicContact CZ-CB 3.94Å; F53-L83 HydrophobicContact CZ-CD1 3.7Å; F53-L83 HydrophobicContact CZ-CG 4.5Å; T79-L83 HydrophobicContact CG2-CD1 4.1Å; T79-L83 HydrophobicContact CG2-CG 4.39Å; T79-L83 VanDerWaalsContact O-CG 3.32Å; T79-L83 WeakPolarHBondContact O-CG 3.44Å; T79-L83 PolarHBondContact O-N 3Å; V80-L83 PolarHBondContact O-N 3.35Å; H81-L83 PolarHBondContact O-N 3.21Å; L83-W87 WeakPolarHBondContact O-CB 3.49Å; L83-W87 PolarHBondContact O-N 2.85Å
84	I	98.8	Very high	96.6	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-47.1	175.9	-69	171.3	0	0	0	110.5	L50 F53 V80 H81 C82 W87 S88 T209	L50-I84 HydrophobicContact CD1-CG1 4.34Å; F53-I84 HydrophobicContact CD1-CG1 4.37Å; F53-I84 HydrophobicContact CE1-CG1 4.06Å; V80-I84 HydrophobicContact CG1-CD1 3.74Å; V80-I84 HydrophobicContact CG1-CG1 4.24Å; V80-I84 WeakPolarHBondContact O-CB 3.33Å; V80-I84 VanDerWaalsContact O-CG1 3.29Å; V80-I84 WeakPolarHBondContact O-CG1 3.4Å; V80-I84 PolarHBondContact O-N 3.28Å; H81-I84 PolarHBondContact O-N 3.48Å; C82-I84 PolarHBondContact O-N 3.1Å; I84-W87 PolarHBondContact O-N 2.93Å; I84-S88 WeakPolarHBondContact O-CB 3.49Å; I84-S88 PolarHBondContact O-N 3.41Å; I84-S88 PolarHBondContact O-OG 3.47Å; I84-T209 HydrophobicContact CG2-CG2 3.62Å
85	G	98.6	Very high	96.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-46.1	179.2	0	0	0	0	0	112.2	H81 C82 S88 W89	H81-G85 PolarHBondContact O-N 2.81Å; C82-G85 PolarHBondContact O-N 3.02Å; G85-S88 PolarHBondContact O-N 3.01Å; G85-W89 PolarHBondContact O-N 3.37Å
86	L	98.3	Very high	95.5	Very high	51 Å²	51	36.4 Å²	36.4	27%	0.267	20%	0.195	S	C	.	.	H	α-helix	trans	-58.4	-52.7	177	-174	150.5	0	0	0	111.5	C82 W89 A90 V104	C82-L86 VanDerWaalsContact O-CB 3.26Å; C82-L86 WeakPolarHBondContact O-CB 3.49Å; C82-L86 PolarHBondContact O-N 2.97Å; L86-W89 PolarHBondContact O-N 3.24Å; L86-A90 PolarHBondContact O-N 3.08Å; L86-V104 HydrophobicContact CD1-CG1 4.2Å; L86-V104 HydrophobicContact CD2-CG1 3.41Å; L86-V104 VanDerWaalsContact CD2-CG1 3.41Å; L86-V104 HydrophobicContact CG-CG1 3.39Å; L86-V104 WeakPolarHBondContact CG-O 3.36Å
87	W	98.5	Very high	94.9	Very high	84 Å²	84	37.8 Å²	37.8	32%	0.318	20%	0.199	S	C	.	.	H	α-helix	trans	-66.8	-40.9	-177.2	-158.4	-23.1	0	0	0	111.3	A49 L50 F53 L83 I84 W89 A90 I91	A49-W87 HydrophobicContact CB-CH2 4.29Å; A49-W87 HydrophobicContact CB-CZ2 3.85Å; L50-W87 HydrophobicContact CB-CD2 4.47Å; L50-W87 HydrophobicContact CD1-CB 4.05Å; L50-W87 HydrophobicContact CD1-CD2 4.11Å; L50-W87 HydrophobicContact CD1-CE3 4.12Å; L50-W87 HydrophobicContact CD1-CG 4.09Å; F53-W87 HydrophobicContact CB-CH2 4.31Å; F53-W87 HydrophobicContact CB-CZ3 3.78Å; F53-W87 HydrophobicContact CD1-CE3 4.39Å; F53-W87 HydrophobicContact CD1-CZ3 4.3Å; F53-W87 HydrophobicContact CD2-CZ3 4.12Å; F53-W87 HydrophobicContact CG-CE3 4.34Å; F53-W87 AromaticContact CG-CZ3 3.79Å; F53-W87 HydrophobicContact CG-CZ3 3.79Å; L83-W87 WeakPolarHBondContact O-CB 3.49Å; L83-W87 PolarHBondContact O-N 2.85Å; I84-W87 PolarHBondContact O-N 2.93Å; W87-W89 VanDerWaalsContact C-N 3.35Å; W87-W89 PolarHBondContact O-N 3.37Å; W87-A90 WeakPolarHBondContact O-CB 3.46Å; W87-A90 PolarHBondContact O-N 2.68Å; W87-I91 WeakPolarHBondContact O-CG1 3.5Å; W87-I91 PolarHBondContact O-N 2.82Å; W87-I91 VanDerWaalsContact O-N 3.09Å
88	S	98.4	Very high	94.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-46.6	176.2	-63.2	0	0	0	0	111.4	I84 G85 I91 V92	I84-S88 WeakPolarHBondContact O-CB 3.49Å; I84-S88 PolarHBondContact O-N 3.41Å; I84-S88 PolarHBondContact O-OG 3.47Å; G85-S88 PolarHBondContact O-N 3.01Å; S88-I91 PolarHBondContact O-N 3.25Å; S88-V92 WeakPolarHBondContact O-CG2 3.39Å; S88-V92 PolarHBondContact O-N 3.11Å; S88-V92 VanDerWaalsContact O-N 3.11Å
89	W	97.7	Very high	93.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-38.2	178.1	-169.1	-114.4	0	0	0	112.7	G85 L86 W87 I91 V92 I93 E103 A107 W170 L171 I174 M220	G85-W89 PolarHBondContact O-N 3.37Å; L86-W89 PolarHBondContact O-N 3.24Å; W87-W89 VanDerWaalsContact C-N 3.35Å; W87-W89 PolarHBondContact O-N 3.37Å; W89-I91 PolarHBondContact O-N 3.34Å; W89-V92 HydrophobicContact CE3-CB 3.95Å; W89-V92 HydrophobicContact CE3-CG1 3.96Å; W89-V92 HydrophobicContact CE3-CG2 4.19Å; W89-V92 HydrophobicContact CH2-CG1 4.34Å; W89-V92 HydrophobicContact CZ3-CB 4.26Å; W89-V92 HydrophobicContact CZ3-CG1 3.74Å; W89-V92 WeakPolarHBondContact O-CB 3.3Å; W89-V92 PolarHBondContact O-N 3.32Å; W89-V92 VanDerWaalsContact O-N 3.07Å; W89-I93 HydrophobicContact CD2-CG2 4.07Å; W89-I93 VanDerWaalsContact CE2-CG2 3.48Å; W89-I93 HydrophobicContact CH2-CG2 4.18Å; W89-I93 HydrophobicContact CZ2-CG2 3.55Å; W89-I93 WeakPolarHBondContact O-CG1 3.44Å; W89-I93 PolarHBondContact O-N 3.1Å; W89-I93 VanDerWaalsContact O-N 3.07Å; W89-E103 VanDerWaalsContact NE1-CB 3.34Å; W89-E103 PolarHBondContact NE1-OE2 3.44Å; W89-A107 HydrophobicContact CB-CB 3.47Å; W89-A107 VanDerWaalsContact CB-CB 3.47Å; W89-A107 HydrophobicContact CG-CB 3.84Å; W89-W170 HydrophobicContact CH2-CB 3.93Å; W89-W170 VanDerWaalsContact CZ3-C 3.5Å; W89-W170 HydrophobicContact CZ3-CB 3.89Å; W89-L171 HydrophobicContact CD2-CB 4.18Å; W89-L171 HydrophobicContact CD2-CD1 4.42Å; W89-L171 HydrophobicContact CD2-CG 4Å; W89-L171 HydrophobicContact CE3-CB 4.22Å; W89-L171 HydrophobicContact CE3-CG 4.46Å; W89-L171 HydrophobicContact CG-CG 4.35Å; W89-L171 HydrophobicContact CH2-CB 3.78Å; W89-L171 HydrophobicContact CZ2-CB 3.75Å; W89-L171 HydrophobicContact CZ2-CD1 4.07Å; W89-L171 HydrophobicContact CZ2-CG 4.14Å; W89-L171 HydrophobicContact CZ3-CB 4.02Å; W89-L171 VanDerWaalsContact CZ3-N 3.34Å; W89-I174 HydrophobicContact CB-CG2 4.1Å; W89-I174 HydrophobicContact CD2-CG2 4.31Å; W89-I174 HydrophobicContact CE3-CB 4.35Å; W89-I174 HydrophobicContact CE3-CG2 3.64Å; W89-I174 HydrophobicContact CZ3-CG2 4.46Å; W89-M220 HydrophobicContact CH2-CE 4.18Å; W89-M220 HydrophobicContact CH2-SD 4.24Å; W89-M220 HydrophobicContact CZ3-SD 4.26Å
90	A	95.9	Very high	93	Very high	16 Å²	16	44.2 Å²	44.2	13%	0.132	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-37.3	175.6	0	0	0	0	0	112.2	L86 W87 G94 L95 V104	L86-A90 PolarHBondContact O-N 3.08Å; W87-A90 WeakPolarHBondContact O-CB 3.46Å; W87-A90 PolarHBondContact O-N 2.68Å; A90-G94 WeakPolarHBondContact O-CA 3.49Å; A90-G94 PolarHBondContact O-N 3.27Å; A90-L95 HydrophobicContact CB-CD1 4.27Å; A90-L95 HydrophobicContact CB-CG 4.3Å; A90-V104 HydrophobicContact CB-CG1 4.16Å; A90-V104 HydrophobicContact CB-CG2 3.82Å
91	I	95.1	Very high	92.6	Very high	19 Å²	19	49.2 Å²	49.2	10%	0.097	25%	0.247	C	C	.	.	H	α-helix	trans	-68.4	-42.9	174.2	-64.3	164	0	0	0	111	S43 A46 L50 W87 S88 W89 I93 P213	S43-I91 WeakPolarHBondContact OG-CG2 3.4Å; A46-I91 HydrophobicContact CB-CD1 4.09Å; A46-I91 HydrophobicContact CB-CG1 3.85Å; L50-I91 HydrophobicContact CB-CD1 4.44Å; L50-I91 HydrophobicContact CD2-CD1 4.04Å; W87-I91 WeakPolarHBondContact O-CG1 3.5Å; W87-I91 PolarHBondContact O-N 2.82Å; W87-I91 VanDerWaalsContact O-N 3.09Å; S88-I91 PolarHBondContact O-N 3.25Å; W89-I91 PolarHBondContact O-N 3.34Å; I91-I93 PolarHBondContact O-N 2.81Å; I91-P213 HydrophobicContact CB-CB 3.77Å; I91-P213 HydrophobicContact CB-CG 4.33Å; I91-P213 HydrophobicContact CD1-CG 4.24Å; I91-P213 HydrophobicContact CG2-CB 3.55Å; I91-P213 HydrophobicContact CG2-CG 4.36Å
92	V	93.6	Very high	92.4	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-49	-179.5	172.1	0	0	0	0	112	S88 W89 I174 P213 C216 M220 R226	S88-V92 WeakPolarHBondContact O-CG2 3.39Å; S88-V92 PolarHBondContact O-N 3.11Å; S88-V92 VanDerWaalsContact O-N 3.11Å; W89-V92 HydrophobicContact CE3-CB 3.95Å; W89-V92 HydrophobicContact CE3-CG1 3.96Å; W89-V92 HydrophobicContact CE3-CG2 4.19Å; W89-V92 HydrophobicContact CH2-CG1 4.34Å; W89-V92 HydrophobicContact CZ3-CB 4.26Å; W89-V92 HydrophobicContact CZ3-CG1 3.74Å; W89-V92 WeakPolarHBondContact O-CB 3.3Å; W89-V92 PolarHBondContact O-N 3.32Å; W89-V92 VanDerWaalsContact O-N 3.07Å; V92-I174 HydrophobicContact CG2-CD1 4.41Å; V92-P213 HydrophobicContact CG2-CB 3.95Å; V92-P213 WeakPolarHBondContact CG2-O 3.48Å; V92-C216 HydrophobicContact CG2-CB 4.02Å; V92-M220 HydrophobicContact CG1-CE 4.44Å; V92-M220 HydrophobicContact CG1-SD 3.42Å; V92-M220 WeakPolarHBondContact CG1-SD 3.13Å; V92-R226 PolarHBondContact O-NH1 3.16Å
93	I	90	Very high	92.2	Very high	34 Å²	34	58.2 Å²	58.2	17%	0.174	28%	0.28	C	S	.	.	H	α-helix	trans	-88.4	-27.4	-173.1	69.7	-178.2	0	0	0	112.8	W89 I91 L95 D100 V104	W89-I93 HydrophobicContact CD2-CG2 4.07Å; W89-I93 VanDerWaalsContact CE2-CG2 3.48Å; W89-I93 HydrophobicContact CH2-CG2 4.18Å; W89-I93 HydrophobicContact CZ2-CG2 3.55Å; W89-I93 WeakPolarHBondContact O-CG1 3.44Å; W89-I93 PolarHBondContact O-N 3.1Å; W89-I93 VanDerWaalsContact O-N 3.07Å; I91-I93 PolarHBondContact O-N 2.81Å; I93-L95 HydrophobicContact CD1-CD2 4.34Å; I93-D100 HydrophobicContact CD1-CB 3.71Å; I93-V104 HydrophobicContact CD1-CG2 3.81Å
94	G	88.6	Confident	92.1	Very high	34 Å²	34	55.1 Å²	55.1	35%	0.351	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	89.9	-172.8	0	0	0	0	0	111.1	A90 K96	A90-G94 WeakPolarHBondContact O-CA 3.49Å; A90-G94 PolarHBondContact O-N 3.27Å; G94-K96 WeakPolarHBondContact O-CG 3.44Å; G94-K96 PolarHBondContact O-N 3.27Å
95	L	84.6	Confident	92	Very high	96 Å²	96	57.9 Å²	57.9	50%	0.503	28%	0.278	S	S	.	.			trans	-45.7	116.8	-175.8	-68.5	174.1	0	0	0	113.1	A90 I93 D100 V104	A90-L95 HydrophobicContact CB-CD1 4.27Å; A90-L95 HydrophobicContact CB-CG 4.3Å; I93-L95 HydrophobicContact CD1-CD2 4.34Å; L95-D100 HydrophobicContact CD2-CB 3.73Å; L95-V104 HydrophobicContact CD2-CG2 3.76Å
96	K	82.4	Confident	92	Very high	134 Å²	134	61 Å²	61	58%	0.583	29%	0.294	S	S	*	.			trans	-126.4	-29.4	176.4	-72.9	170.6	-169.8	-176.5	0	112.6	G94 D100	G94-K96 WeakPolarHBondContact O-CG 3.44Å; G94-K96 PolarHBondContact O-N 3.27Å; K96-D100 PolarHBondContact N-OD2 3.09Å
97	K	85.4	Confident	92	Very high	83 Å²	83	58.5 Å²	58.5	36%	0.361	28%	0.281	S	S	.	.	S	Bend	trans	-129.3	162.8	-171.9	-57.4	-178.3	-177.7	-171.4	0	111.6	S99 D100 H233	K97-S99 VanDerWaalsContact C-N 3.29Å; K97-S99 PolarHBondContact O-N 3.31Å; K97-D100 PolarHBondContact N-OD2 3.41Å; K97-D100 VanDerWaalsContact O-CB 3.31Å; K97-D100 WeakPolarHBondContact O-CB 3.41Å; K97-D100 PolarHBondContact O-N 3.36Å; K97-H233 PolarHBondContact NZ-O 2.92Å
98	K	82.9	Confident	92	Very high	188 Å²	188	54.5 Å²	54.5	82%	0.817	27%	0.266	S	S	*	.	H	α-helix	trans	-64.3	-32.4	175.9	-66.9	-169.6	-179.7	-177.4	0	112.9	D100 F101	K98-D100 PolarHBondContact O-N 3.16Å; K98-F101 VanDerWaalsContact O-CB 3.3Å; K98-F101 WeakPolarHBondContact O-CB 3.41Å; K98-F101 PolarHBondContact O-N 2.87Å
99	S	81.8	Confident	92	Very high	54 Å²	54	58.6 Å²	58.6	38%	0.378	29%	0.287	S	S	.	.	H	α-helix	trans	-58.1	-39.1	175.6	45.5	0	0	0	0	112.2	K97 F101 Y102 E103	K97-S99 VanDerWaalsContact C-N 3.29Å; K97-S99 PolarHBondContact O-N 3.31Å; S99-F101 PolarHBondContact O-N 3.09Å; S99-Y102 PolarHBondContact O-N 2.88Å; S99-E103 PolarHBondContact O-N 3.33Å
100	D	88.1	Confident	92	Very high	18 Å²	18	60.9 Å²	60.9	10%	0.096	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-31.3	-178.1	-51.2	-5.7	0	0	0	111.2	I93 L95 K96 K97 K98 Y102 E103 V104	I93-D100 HydrophobicContact CD1-CB 3.71Å; L95-D100 HydrophobicContact CD2-CB 3.73Å; K96-D100 PolarHBondContact N-OD2 3.09Å; K97-D100 PolarHBondContact N-OD2 3.41Å; K97-D100 VanDerWaalsContact O-CB 3.31Å; K97-D100 WeakPolarHBondContact O-CB 3.41Å; K97-D100 PolarHBondContact O-N 3.36Å; K98-D100 PolarHBondContact O-N 3.16Å; D100-Y102 VanDerWaalsContact C-N 3.33Å; D100-Y102 PolarHBondContact O-N 3.28Å; D100-E103 PolarHBondContact O-N 2.94Å; D100-V104 WeakPolarHBondContact O-CB 3.5Å; D100-V104 WeakPolarHBondContact O-CG2 3.47Å; D100-V104 PolarHBondContact O-N 3.25Å
101	F	91.1	Very high	92.1	Very high	117 Å²	117	60.1 Å²	60.1	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-63	-38	176.7	-174.2	-109.2	0	0	0	112.4	K98 S99 V104 I105	K98-F101 VanDerWaalsContact O-CB 3.3Å; K98-F101 WeakPolarHBondContact O-CB 3.41Å; K98-F101 PolarHBondContact O-N 2.87Å; S99-F101 PolarHBondContact O-N 3.09Å; F101-V104 PolarHBondContact O-N 3.16Å; F101-I105 HydrophobicContact CD1-CD1 3.73Å; F101-I105 HydrophobicContact CE1-CD1 3.23Å; F101-I105 HydrophobicContact CE1-CG1 4.21Å; F101-I105 HydrophobicContact CE2-CD1 4.36Å; F101-I105 HydrophobicContact CG-CD1 4.5Å; F101-I105 HydrophobicContact CZ-CD1 3.59Å; F101-I105 HydrophobicContact CZ-CG1 4.24Å; F101-I105 WeakPolarHBondContact O-CG1 3.23Å; F101-I105 PolarHBondContact O-N 3.46Å
102	Y	93.4	Very high	92.3	Very high	172 Å²	172	60.1 Å²	60.1	68%	0.675	29%	0.294	S	S	*	.	H	α-helix	trans	-68.6	-38.3	176.8	-62.5	-69.3	0	0	0	111.8	S99 D100 V104 I105 L106	S99-Y102 PolarHBondContact O-N 2.88Å; D100-Y102 VanDerWaalsContact C-N 3.33Å; D100-Y102 PolarHBondContact O-N 3.28Å; Y102-V104 VanDerWaalsContact C-N 3.33Å; Y102-I105 PolarHBondContact O-N 3.28Å; Y102-L106 VanDerWaalsContact O-CB 3.29Å; Y102-L106 WeakPolarHBondContact O-CB 3.49Å; Y102-L106 PolarHBondContact O-N 2.93Å
103	E	94.3	Very high	92.5	Very high	51 Å²	51	63.2 Å²	63.2	24%	0.238	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-40.2	174.9	-62.4	-170.2	-154.2	0	0	111.4	W89 S99 D100 L106 A107 S167 L171	W89-E103 VanDerWaalsContact NE1-CB 3.34Å; W89-E103 PolarHBondContact NE1-OE2 3.44Å; S99-E103 PolarHBondContact O-N 3.33Å; D100-E103 PolarHBondContact O-N 2.94Å; E103-L106 PolarHBondContact O-N 3.04Å; E103-A107 PolarHBondContact O-N 3.48Å; E103-S167 PolarHBondContact OE2-OG 3.38Å; E103-L171 HydrophobicContact CB-CD1 3.91Å; E103-L171 HydrophobicContact CG-CD1 4.48Å
104	V	96.6	Very high	92.8	Very high	4 Å²	4	62 Å²	62	2%	0.024	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-45.3	176.5	163.7	0	0	0	0	111.7	L86 A90 I93 L95 D100 F101 Y102 L106 A107 G108	L86-V104 HydrophobicContact CD1-CG1 4.2Å; L86-V104 HydrophobicContact CD2-CG1 3.41Å; L86-V104 VanDerWaalsContact CD2-CG1 3.41Å; L86-V104 HydrophobicContact CG-CG1 3.39Å; L86-V104 WeakPolarHBondContact CG-O 3.36Å; A90-V104 HydrophobicContact CB-CG1 4.16Å; A90-V104 HydrophobicContact CB-CG2 3.82Å; I93-V104 HydrophobicContact CD1-CG2 3.81Å; L95-V104 HydrophobicContact CD2-CG2 3.76Å; D100-V104 WeakPolarHBondContact O-CB 3.5Å; D100-V104 WeakPolarHBondContact O-CG2 3.47Å; D100-V104 PolarHBondContact O-N 3.25Å; F101-V104 PolarHBondContact O-N 3.16Å; Y102-V104 VanDerWaalsContact C-N 3.33Å; V104-L106 PolarHBondContact O-N 3.06Å; V104-A107 PolarHBondContact O-N 3.49Å; V104-G108 PolarHBondContact O-N 3.22Å
105	I	97.6	Very high	93.2	Very high	59 Å²	59	61.5 Å²	61.5	30%	0.303	30%	0.296	S	S	.	.	H	α-helix	trans	-61.1	-45.4	172.4	-72.2	175.1	0	0	0	111.1	F101 Y102 A107 G108 I109	F101-I105 HydrophobicContact CD1-CD1 3.73Å; F101-I105 HydrophobicContact CE1-CD1 3.23Å; F101-I105 HydrophobicContact CE1-CG1 4.21Å; F101-I105 HydrophobicContact CE2-CD1 4.36Å; F101-I105 HydrophobicContact CG-CD1 4.5Å; F101-I105 HydrophobicContact CZ-CD1 3.59Å; F101-I105 HydrophobicContact CZ-CG1 4.24Å; F101-I105 WeakPolarHBondContact O-CG1 3.23Å; F101-I105 PolarHBondContact O-N 3.46Å; Y102-I105 PolarHBondContact O-N 3.28Å; I105-A107 VanDerWaalsContact C-N 3.27Å; I105-A107 PolarHBondContact O-N 3.11Å; I105-G108 PolarHBondContact O-N 2.89Å; I105-G108 VanDerWaalsContact O-N 3.16Å; I105-I109 HydrophobicContact CG2-CD1 3.67Å; I105-I109 HydrophobicContact CG2-CG1 4.23Å; I105-I109 WeakPolarHBondContact O-CG1 3.29Å; I105-I109 PolarHBondContact O-N 3.22Å
106	L	97.6	Very high	93.8	Very high	65 Å²	65	61.4 Å²	61.4	34%	0.34	30%	0.296	S	S	.	.	H	α-helix	trans	-59.3	-40.6	179.4	-180	61.9	0	0	0	111.3	Y102 E103 V104 G108 I109 L110 L168 L171	Y102-L106 VanDerWaalsContact O-CB 3.29Å; Y102-L106 WeakPolarHBondContact O-CB 3.49Å; Y102-L106 PolarHBondContact O-N 2.93Å; E103-L106 PolarHBondContact O-N 3.04Å; V104-L106 PolarHBondContact O-N 3.06Å; L106-G108 VanDerWaalsContact C-N 3.33Å; L106-G108 PolarHBondContact O-N 3.15Å; L106-I109 PolarHBondContact O-N 3.09Å; L106-L110 HydrophobicContact CD1-CD1 4.38Å; L106-L110 HydrophobicContact CD1-CG 4.13Å; L106-L110 HydrophobicContact CG-CD1 4.17Å; L106-L110 HydrophobicContact CG-CG 4.34Å; L106-L110 WeakPolarHBondContact O-CB 3.47Å; L106-L110 WeakPolarHBondContact O-CG 3.49Å; L106-L110 PolarHBondContact O-N 2.78Å; L106-L168 HydrophobicContact CD2-CD2 4.23Å; L106-L171 HydrophobicContact CD2-CD1 4.2Å; L106-L171 HydrophobicContact CD2-CD2 4.37Å; L106-L171 HydrophobicContact CG-CD2 4.13Å
107	A	98.3	Very high	94.5	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.7	-41.9	177	0	0	0	0	0	112.2	W89 E103 V104 I105 A111 L171 S175	W89-A107 HydrophobicContact CB-CB 3.47Å; W89-A107 VanDerWaalsContact CB-CB 3.47Å; W89-A107 HydrophobicContact CG-CB 3.84Å; E103-A107 PolarHBondContact O-N 3.48Å; V104-A107 PolarHBondContact O-N 3.49Å; I105-A107 VanDerWaalsContact C-N 3.27Å; I105-A107 PolarHBondContact O-N 3.11Å; A107-A111 WeakPolarHBondContact O-CB 3.46Å; A107-A111 PolarHBondContact O-N 2.92Å; A107-A111 VanDerWaalsContact O-N 3.09Å; A107-L171 HydrophobicContact CB-CD2 3.95Å; A107-L171 HydrophobicContact CB-CG 4.05Å; A107-S175 VanDerWaalsContact CA-OG 3.28Å; A107-S175 WeakPolarHBondContact CA-OG 3.35Å; A107-S175 WeakPolarHBondContact O-CB 3.46Å; A107-S175 PolarHBondContact O-OG 3.47Å
108	G	98.5	Very high	95	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65	-46.3	174.1	0	0	0	0	0	112.7	C82 V104 I105 L106 L110 A111 S112	C82-G108 WeakPolarHBondContact O-CA 3.29Å; C82-G108 VanDerWaalsContact SG-C 3.59Å; V104-G108 PolarHBondContact O-N 3.22Å; I105-G108 PolarHBondContact O-N 2.89Å; I105-G108 VanDerWaalsContact O-N 3.16Å; L106-G108 VanDerWaalsContact C-N 3.33Å; L106-G108 PolarHBondContact O-N 3.15Å; G108-L110 VanDerWaalsContact C-N 3.35Å; G108-L110 PolarHBondContact O-N 2.89Å; G108-A111 WeakPolarHBondContact O-CB 3.41Å; G108-A111 PolarHBondContact O-N 2.95Å; G108-A111 VanDerWaalsContact O-N 3.16Å; G108-S112 PolarHBondContact O-N 3.09Å
109	I	98.5	Very high	95.7	Very high	85 Å²	85	47 Å²	47	44%	0.436	23%	0.234	S	C	.	.	H	α-helix	trans	-58.5	-47	177.4	-68.4	172.3	0	0	0	110.8	I105 L106 A111 S112 V113	I105-I109 HydrophobicContact CG2-CD1 3.67Å; I105-I109 HydrophobicContact CG2-CG1 4.23Å; I105-I109 WeakPolarHBondContact O-CG1 3.29Å; I105-I109 PolarHBondContact O-N 3.22Å; L106-I109 PolarHBondContact O-N 3.09Å; I109-A111 VanDerWaalsContact C-N 3.29Å; I109-A111 PolarHBondContact O-N 3.44Å; I109-S112 PolarHBondContact O-N 3.16Å; I109-S112 VanDerWaalsContact O-N 3.1Å; I109-V113 HydrophobicContact CG2-CG2 3.94Å; I109-V113 VanDerWaalsContact O-CG2 3.27Å; I109-V113 WeakPolarHBondContact O-CG2 3.49Å; I109-V113 PolarHBondContact O-N 3.44Å
110	L	98.4	Very high	96.4	Very high	49 Å²	49	53.3 Å²	53.3	26%	0.257	25%	0.251	S	S	.	.	H	α-helix	trans	-62.4	-37.3	178.6	-71.5	178.5	0	0	0	112.1	L106 G108 S112 I114 L171 L172	L106-L110 HydrophobicContact CD1-CD1 4.38Å; L106-L110 HydrophobicContact CD1-CG 4.13Å; L106-L110 HydrophobicContact CG-CD1 4.17Å; L106-L110 HydrophobicContact CG-CG 4.34Å; L106-L110 WeakPolarHBondContact O-CB 3.47Å; L106-L110 WeakPolarHBondContact O-CG 3.49Å; L106-L110 PolarHBondContact O-N 2.78Å; G108-L110 VanDerWaalsContact C-N 3.35Å; G108-L110 PolarHBondContact O-N 2.89Å; L110-S112 VanDerWaalsContact C-N 3.28Å; L110-S112 PolarHBondContact O-N 3.5Å; L110-I114 WeakPolarHBondContact O-CG1 3.28Å; L110-L171 HydrophobicContact CD1-CD2 3.43Å; L110-L171 VanDerWaalsContact CD1-CD2 3.43Å; L110-L172 HydrophobicContact CD1-CD1 4.16Å
111	A	98.3	Very high	96.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-32.3	175.4	0	0	0	0	0	112.1	H81 A107 G108 I109 H179	H81-A111 WeakPolarHBondContact O-CB 3.47Å; A107-A111 WeakPolarHBondContact O-CB 3.46Å; A107-A111 PolarHBondContact O-N 2.92Å; A107-A111 VanDerWaalsContact O-N 3.09Å; G108-A111 WeakPolarHBondContact O-CB 3.41Å; G108-A111 PolarHBondContact O-N 2.95Å; G108-A111 VanDerWaalsContact O-N 3.16Å; I109-A111 VanDerWaalsContact C-N 3.29Å; I109-A111 PolarHBondContact O-N 3.44Å; A111-H179 PolarHBondContact O-ND1 3.25Å
112	S	97.9	Very high	97	Very high	18 Å²	18	51.3 Å²	51.3	13%	0.126	25%	0.248	C	C	.	.	H	α-helix	trans	-84.5	-31	178.8	-79.9	0	0	0	0	115.5	N78 C82 G108 I109 L110 I114 D115	N78-S112 PolarHBondContact O-OG 3.1Å; N78-S112 VanDerWaalsContact O-OG 3.06Å; N78-S112 WeakPolarHBondContact OD1-CA 3.47Å; N78-S112 WeakPolarHBondContact OD1-CB 3.36Å; N78-S112 PolarHBondContact OD1-O 3.22Å; N78-S112 PolarHBondContact OD1-OG 3.14Å; C82-S112 WeakPolarHBondContact CA-OG 3.38Å; C82-S112 WeakPolarHBondContact CB-OG 3.33Å; C82-S112 PolarHBondContact N-OG 2.92Å; G108-S112 PolarHBondContact O-N 3.09Å; I109-S112 PolarHBondContact O-N 3.16Å; I109-S112 VanDerWaalsContact O-N 3.1Å; L110-S112 VanDerWaalsContact C-N 3.28Å; L110-S112 PolarHBondContact O-N 3.5Å; S112-I114 PolarHBondContact O-N 2.99Å; S112-D115 PolarHBondContact O-N 3.39Å
113	V	97.4	Very high	97.1	Very high	67 Å²	67	46.5 Å²	46.5	41%	0.406	25%	0.251	S	S	.	.	H	α-helix	trans	-66.1	-21.6	-178.8	165.5	0	0	0	0	111.6	I109 D115 L116	I109-V113 HydrophobicContact CG2-CG2 3.94Å; I109-V113 VanDerWaalsContact O-CG2 3.27Å; I109-V113 WeakPolarHBondContact O-CG2 3.49Å; I109-V113 PolarHBondContact O-N 3.44Å; V113-D115 VanDerWaalsContact C-N 3.28Å; V113-D115 PolarHBondContact O-N 3.45Å; V113-L116 HydrophobicContact CG1-CD1 4.32Å; V113-L116 HydrophobicContact CG2-CD1 4.36Å; V113-L116 VanDerWaalsContact O-CB 3.29Å; V113-L116 WeakPolarHBondContact O-CB 3.29Å; V113-L116 PolarHBondContact O-N 2.91Å
114	I	97.2	Very high	97.2	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.036	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-44.4	175.9	-64.8	163.9	0	0	0	110.8	L110 S112 L116 D117 L139 L176 H179	L110-I114 WeakPolarHBondContact O-CG1 3.28Å; S112-I114 PolarHBondContact O-N 2.99Å; I114-L116 PolarHBondContact O-N 3.13Å; I114-L116 VanDerWaalsContact O-N 3.1Å; I114-D117 WeakPolarHBondContact O-CB 3.38Å; I114-D117 PolarHBondContact O-N 3.47Å; I114-D117 VanDerWaalsContact O-N 3.11Å; I114-L139 HydrophobicContact CG2-CB 4.11Å; I114-L176 HydrophobicContact CD1-CB 4.29Å; I114-L176 HydrophobicContact CD1-CD1 4Å; I114-L176 HydrophobicContact CD1-CG 3.79Å; I114-L176 HydrophobicContact CG1-CG 4.44Å; I114-H179 HydrophobicContact CD1-CB 3.66Å; I114-H179 WeakPolarHBondContact CG2-NE2 3.2Å
115	D	97.2	Very high	97	Very high	25 Å²	25	53.1 Å²	53.1	13%	0.134	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.9	179.8	-77	-27.9	0	0	0	114	N78 H81 S112 V113 D117 H118 H140 H179	N78-D115 WeakPolarHBondContact CB-OD2 3.5Å; N78-D115 PolarHBondContact OD1-OD2 2.87Å; H81-D115 IonicContact CD2-OD2 3.61Å; S112-D115 PolarHBondContact O-N 3.39Å; V113-D115 VanDerWaalsContact C-N 3.28Å; V113-D115 PolarHBondContact O-N 3.45Å; D115-D117 PolarHBondContact O-N 3.22Å; D115-H118 WeakPolarHBondContact O-CB 3.27Å; D115-H118 PolarHBondContact O-N 2.96Å; D115-H118 PolarHBondContact O-ND1 3.32Å; D115-H140 IonicContact OD1-CE1 3.72Å; D115-H140 IonicContact OD1-NE2 3.62Å; D115-H179 IonicContact OD1-CE1 3.09Å; D115-H179 PolarHBondContact OD1-CE1 2.92Å; D115-H179 VanDerWaalsContact OD1-CE1 3.24Å; D115-H179 IonicContact OD1-NE2 2.98Å; D115-H179 IonicContact OD2-CE1 3.55Å
116	L	96.2	Very high	96.9	Very high	93 Å²	93	53.1 Å²	53.1	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-67.6	-18.1	177	-59.8	-176.6	0	0	0	112.4	V113 I114 H118 F119 Y120	V113-L116 HydrophobicContact CG1-CD1 4.32Å; V113-L116 HydrophobicContact CG2-CD1 4.36Å; V113-L116 VanDerWaalsContact O-CB 3.29Å; V113-L116 WeakPolarHBondContact O-CB 3.29Å; V113-L116 PolarHBondContact O-N 2.91Å; I114-L116 PolarHBondContact O-N 3.13Å; I114-L116 VanDerWaalsContact O-N 3.1Å; L116-H118 PolarHBondContact O-N 3.47Å; L116-F119 HydrophobicContact CD2-CD2 4.29Å; L116-F119 PolarHBondContact O-N 2.88Å; L116-Y120 PolarHBondContact O-N 2.84Å; L116-Y120 VanDerWaalsContact O-N 3.09Å
117	D	97	Very high	96.8	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-22.4	175.2	74.8	-7.4	0	0	0	113.2	I114 D115 Y120 M121 P137 L139 H140	I114-D117 WeakPolarHBondContact O-CB 3.38Å; I114-D117 PolarHBondContact O-N 3.47Å; I114-D117 VanDerWaalsContact O-N 3.11Å; D115-D117 PolarHBondContact O-N 3.22Å; D117-Y120 PolarHBondContact O-N 3.46Å; D117-M121 WeakPolarHBondContact O-CB 3.32Å; D117-M121 PolarHBondContact O-N 2.87Å; D117-P137 HydrophobicContact CB-CB 4.01Å; D117-P137 WeakPolarHBondContact OD1-CB 3.06Å; D117-P137 WeakPolarHBondContact OD2-CB 3.47Å; D117-L139 HydrophobicContact CB-CB 4.11Å; D117-L139 HydrophobicContact CB-CD1 3.85Å; D117-L139 HydrophobicContact CB-CG 3.77Å; D117-L139 WeakPolarHBondContact OD2-CA 3.37Å; D117-L139 WeakPolarHBondContact OD2-CB 3.42Å; D117-L139 PolarHBondContact OD2-N 3.47Å; D117-H140 VanDerWaalsContact CG-ND1 3.32Å; D117-H140 IonicContact OD1-CE1 3.15Å; D117-H140 PolarHBondContact OD1-CE1 3.02Å; D117-H140 IonicContact OD1-ND1 2.85Å; D117-H140 PolarHBondContact OD1-ND1 3.05Å; D117-H140 VanDerWaalsContact OD1-ND1 3.09Å; D117-H140 IonicContact OD2-CE1 3.6Å; D117-H140 PolarHBondContact OD2-N 3.32Å; D117-H140 IonicContact OD2-ND1 3.66Å; D117-H140 PolarHBondContact OD2-ND1 3.06Å
118	H	97.3	Very high	96.6	Very high	47 Å²	47	57.7 Å²	57.7	22%	0.218	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-43.2	173.3	-72.3	70.8	0	0	0	110.6	D115 L116 M121 A122 A130 L133 P137 H140	D115-H118 WeakPolarHBondContact O-CB 3.27Å; D115-H118 PolarHBondContact O-N 2.96Å; D115-H118 PolarHBondContact O-ND1 3.32Å; L116-H118 PolarHBondContact O-N 3.47Å; H118-M121 PolarHBondContact O-N 3.39Å; H118-A122 WeakPolarHBondContact O-CB 3.34Å; H118-A122 PolarHBondContact O-N 3.46Å; H118-A130 HydrophobicContact CB-CB 4Å; H118-A130 PolarHBondContact CD2-O 3.49Å; H118-L133 HydrophobicContact CB-CD1 4.01Å; H118-L133 WeakPolarHBondContact O-CD1 3.5Å; H118-P137 HydrophobicContact CB-CG 4.32Å; H118-H140 AromaticContact CE1-CE1 3.19Å; H118-H140 PolarHBondContact CE1-CE1 2.93Å; H118-H140 AromaticContact CE1-ND1 3.84Å; H118-H140 AromaticContact CE1-NE2 3.37Å; H118-H140 PolarHBondContact CE1-NE2 3.42Å; H118-H140 AromaticContact ND1-CE1 3.42Å; H118-H140 PolarHBondContact ND1-CE1 3.01Å; H118-H140 AromaticContact ND1-NE2 4Å
119	F	96.9	Very high	96.4	Very high	49 Å²	49	59.4 Å²	59.4	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-68.9	-40.2	175.9	-65.7	-81.2	0	0	0	111.7	L116 A122 G123 S124 L125 L127 A130	L116-F119 HydrophobicContact CD2-CD2 4.29Å; L116-F119 PolarHBondContact O-N 2.88Å; F119-A122 PolarHBondContact O-N 3.49Å; F119-G123 PolarHBondContact O-N 3.04Å; F119-G123 VanDerWaalsContact O-N 3.11Å; F119-S124 WeakPolarHBondContact CD1-O 3.17Å; F119-S124 PolarHBondContact O-N 3.31Å; F119-L125 HydrophobicContact CD1-CD2 4.5Å; F119-L127 HydrophobicContact CE1-CD1 4.35Å; F119-L127 HydrophobicContact CZ-CD1 3.84Å; F119-A130 HydrophobicContact CD1-CB 3.76Å; F119-A130 HydrophobicContact CD2-CB 4.49Å; F119-A130 HydrophobicContact CE1-CB 3.86Å; F119-A130 HydrophobicContact CG-CB 4.13Å; F119-A130 HydrophobicContact CZ-CB 4.27Å
120	Y	95.9	Very high	96.3	Very high	187 Å²	187	55.5 Å²	55.5	73%	0.733	31%	0.308	S	S	*	.	H	α-helix	trans	-58.4	-49.7	173.7	174.2	-101.3	0	0	0	111.3	L116 D117 A122 G123	L116-Y120 PolarHBondContact O-N 2.84Å; L116-Y120 VanDerWaalsContact O-N 3.09Å; D117-Y120 PolarHBondContact O-N 3.46Å; Y120-A122 VanDerWaalsContact C-N 3.34Å; Y120-A122 PolarHBondContact O-N 3.33Å; Y120-G123 PolarHBondContact O-N 3.37Å; Y120-G123 VanDerWaalsContact O-N 3.09Å
121	M	96.4	Very high	96	Very high	65 Å²	65	56.6 Å²	56.6	32%	0.32	32%	0.317	S	S	.	.	H	α-helix	trans	-72.2	-27.8	-179.4	-168.1	161.5	74.2	0	0	112.9	D117 H118 G123 L133 H135 P137	D117-M121 WeakPolarHBondContact O-CB 3.32Å; D117-M121 PolarHBondContact O-N 2.87Å; H118-M121 PolarHBondContact O-N 3.39Å; M121-G123 PolarHBondContact O-N 3.02Å; M121-L133 HydrophobicContact CB-CD1 4.25Å; M121-L133 HydrophobicContact CB-CD2 4.38Å; M121-L133 HydrophobicContact CE-CB 4.06Å; M121-L133 HydrophobicContact CE-CD1 3.72Å; M121-L133 HydrophobicContact CE-CD2 4.29Å; M121-L133 HydrophobicContact CE-CG 4.24Å; M121-L133 HydrophobicContact CG-CD2 4.31Å; M121-H135 HydrophobicContact CE-CB 4.4Å; M121-H135 WeakPolarHBondContact CE-O 3.48Å; M121-P137 VanDerWaalsContact CE-CA 3.42Å; M121-P137 HydrophobicContact CE-CB 4Å; M121-P137 HydrophobicContact CE-CG 3.67Å; M121-P137 VanDerWaalsContact CE-N 3.27Å
122	A	96.4	Very high	95.9	Very high	27 Å²	27	60.6 Å²	60.6	22%	0.223	34%	0.344	C	S	.	.	H	α-helix	trans	-71.5	-14.8	171.2	0	0	0	0	0	113	H118 F119 Y120 S124 A129 A130 L133	H118-A122 WeakPolarHBondContact O-CB 3.34Å; H118-A122 PolarHBondContact O-N 3.46Å; F119-A122 PolarHBondContact O-N 3.49Å; Y120-A122 VanDerWaalsContact C-N 3.34Å; Y120-A122 PolarHBondContact O-N 3.33Å; A122-S124 PolarHBondContact O-N 2.88Å; A122-S124 VanDerWaalsContact O-N 3.16Å; A122-A129 HydrophobicContact CB-CB 4.01Å; A122-A130 HydrophobicContact CB-CB 4.49Å; A122-L133 HydrophobicContact CB-CD2 3.91Å
123	G	95.9	Very high	95.7	Very high	71 Å²	71	61.6 Å²	61.6	73%	0.732	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	22.5	-173.1	0	0	0	0	0	113.2	F119 Y120 M121	F119-G123 PolarHBondContact O-N 3.04Å; F119-G123 VanDerWaalsContact O-N 3.11Å; Y120-G123 PolarHBondContact O-N 3.37Å; Y120-G123 VanDerWaalsContact O-N 3.09Å; M121-G123 PolarHBondContact O-N 3.02Å
124	S	95.7	Very high	95.4	Very high	46 Å²	46	63.6 Å²	63.6	32%	0.322	36%	0.363	S	S	.	.	S	Bend	trans	-157.9	158	-176.5	72.9	0	0	0	0	112.1	F119 A122 S126 A129	F119-S124 WeakPolarHBondContact CD1-O 3.17Å; F119-S124 PolarHBondContact O-N 3.31Å; A122-S124 PolarHBondContact O-N 2.88Å; A122-S124 VanDerWaalsContact O-N 3.16Å; S124-S126 PolarHBondContact O-N 3.09Å; S124-S126 PolarHBondContact OG-N 2.86Å; S124-A129 WeakPolarHBondContact OG-CB 3.27Å
125	L	93.4	Very high	95.1	Very high	149 Å²	149	70.1 Å²	70.1	78%	0.78	39%	0.393	S	S	*	.	S	Bend	trans	-85	10.3	171	-60.6	-179.7	0	0	0	112.9	F119 L127	F119-L125 HydrophobicContact CD1-CD2 4.5Å; L125-L127 PolarHBondContact O-N 3.3Å
126	S	95.4	Very high	94.8	Very high	59 Å²	59	71.4 Å²	71.4	41%	0.413	40%	0.396	S	S	.	.			trans	-75.3	113.9	177.6	176.1	0	0	0	0	109.6	S124 K128 A129 A130	S124-S126 PolarHBondContact O-N 3.09Å; S124-S126 PolarHBondContact OG-N 2.86Å; S126-K128 PolarHBondContact O-N 3.11Å; S126-A129 WeakPolarHBondContact O-CB 3.26Å; S126-A129 PolarHBondContact O-N 2.96Å; S126-A129 PolarHBondContact OG-N 3.22Å; S126-A130 PolarHBondContact O-N 2.92Å
127	L	94	Very high	94.8	Very high	10 Å²	10	67.2 Å²	67.2	5%	0.052	37%	0.374	C	S	.	.	H	α-helix	trans	-58.1	-37.3	178.1	-175	63.6	0	0	0	112	L70 W71 A74 F119 L125 A129 A130 T131	L70-L127 HydrophobicContact CB-CD2 4.44Å; L70-L127 HydrophobicContact CD2-CB 4.49Å; L70-L127 HydrophobicContact CD2-CD2 4.16Å; L70-L127 HydrophobicContact CD2-CG 4.03Å; L70-L127 HydrophobicContact CG-CD2 3.72Å; L70-L127 HydrophobicContact CG-CG 3.99Å; W71-L127 VanDerWaalsContact CA-CD2 3.43Å; W71-L127 HydrophobicContact CB-CD2 4.14Å; W71-L127 HydrophobicContact CD2-CB 4.38Å; W71-L127 HydrophobicContact CD2-CD2 3.5Å; W71-L127 HydrophobicContact CE3-CD2 3.81Å; W71-L127 HydrophobicContact CG-CD2 3.66Å; W71-L127 HydrophobicContact CH2-CB 4.29Å; W71-L127 HydrophobicContact CZ2-CB 3.89Å; W71-L127 HydrophobicContact CZ2-CD2 4.49Å; W71-L127 HydrophobicContact CZ3-CD2 4.41Å; A74-L127 HydrophobicContact CB-CD1 3.68Å; A74-L127 HydrophobicContact CB-CD2 3.81Å; A74-L127 HydrophobicContact CB-CG 4.32Å; F119-L127 HydrophobicContact CE1-CD1 4.35Å; F119-L127 HydrophobicContact CZ-CD1 3.84Å; L125-L127 PolarHBondContact O-N 3.3Å; L127-A129 VanDerWaalsContact C-N 3.28Å; L127-A129 PolarHBondContact O-N 3.27Å; L127-A130 PolarHBondContact O-N 3.05Å; L127-T131 HydrophobicContact CD1-CG2 4.07Å; L127-T131 HydrophobicContact CG-CG2 4.36Å; L127-T131 WeakPolarHBondContact O-CG2 3.26Å; L127-T131 PolarHBondContact O-N 3.3Å; L127-T131 PolarHBondContact O-OG1 2.87Å; L127-T131 VanDerWaalsContact O-OG1 3.11Å
128	K	94.6	Very high	94.7	Very high	151 Å²	151	69.5 Å²	69.5	66%	0.657	39%	0.389	S	S	*	.	H	α-helix	trans	-61	-38.5	175.4	-173.9	178.6	-179.6	-178.7	0	111.8	L70 S126 T131 S132	L70-K128 HydrophobicContact CD2-CB 4.38Å; S126-K128 PolarHBondContact O-N 3.11Å; K128-T131 PolarHBondContact O-OG1 3.37Å; K128-S132 VanDerWaalsContact O-CB 3.25Å; K128-S132 WeakPolarHBondContact O-CB 3.17Å; K128-S132 PolarHBondContact O-N 2.88Å; K128-S132 PolarHBondContact O-OG 2.96Å
129	A	95.1	Very high	94.6	Very high	36 Å²	36	70.8 Å²	70.8	30%	0.298	40%	0.397	S	S	.	.	H	α-helix	trans	-71.1	-45.1	176.8	0	0	0	0	0	111.2	A122 S124 S126 L127 T131 S132	A122-A129 HydrophobicContact CB-CB 4.01Å; S124-A129 WeakPolarHBondContact OG-CB 3.27Å; S126-A129 WeakPolarHBondContact O-CB 3.26Å; S126-A129 PolarHBondContact O-N 2.96Å; S126-A129 PolarHBondContact OG-N 3.22Å; L127-A129 VanDerWaalsContact C-N 3.28Å; L127-A129 PolarHBondContact O-N 3.27Å; A129-T131 VanDerWaalsContact C-N 3.28Å; A129-T131 PolarHBondContact O-N 2.68Å; A129-S132 PolarHBondContact O-N 3.5Å; A129-S132 VanDerWaalsContact O-N 3.14Å
130	A	95.4	Very high	94.6	Very high	2 Å²	2	68.5 Å²	68.5	2%	0.017	39%	0.387	C	S	.	.	H	α-helix	trans	-58	-37.1	177.5	0	0	0	0	0	112.7	H118 F119 A122 S126 L127 L133	H118-A130 HydrophobicContact CB-CB 4Å; H118-A130 PolarHBondContact CD2-O 3.49Å; F119-A130 HydrophobicContact CD1-CB 3.76Å; F119-A130 HydrophobicContact CD2-CB 4.49Å; F119-A130 HydrophobicContact CE1-CB 3.86Å; F119-A130 HydrophobicContact CG-CB 4.13Å; F119-A130 HydrophobicContact CZ-CB 4.27Å; A122-A130 HydrophobicContact CB-CB 4.49Å; S126-A130 PolarHBondContact O-N 2.92Å; L127-A130 PolarHBondContact O-N 3.05Å; A130-L133 VanDerWaalsContact O-CD1 3.24Å; A130-L133 WeakPolarHBondContact O-CD1 3.36Å; A130-L133 WeakPolarHBondContact O-CG 3.29Å
131	T	93.3	Very high	94.7	Very high	73 Å²	73	60 Å²	60	45%	0.448	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-0.6	179.5	63.6	0	0	0	0	114.6	L70 L127 K128 A129	L70-T131 HydrophobicContact CD1-CG2 4.25Å; L127-T131 HydrophobicContact CD1-CG2 4.07Å; L127-T131 HydrophobicContact CG-CG2 4.36Å; L127-T131 WeakPolarHBondContact O-CG2 3.26Å; L127-T131 PolarHBondContact O-N 3.3Å; L127-T131 PolarHBondContact O-OG1 2.87Å; L127-T131 VanDerWaalsContact O-OG1 3.11Å; K128-T131 PolarHBondContact O-OG1 3.37Å; A129-T131 VanDerWaalsContact C-N 3.28Å; A129-T131 PolarHBondContact O-N 2.68Å
132	S	94.4	Very high	94.7	Very high	83 Å²	83	57.7 Å²	57.7	58%	0.58	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	26.9	-176.7	-49.6	0	0	0	0	112.3	K128 A129	K128-S132 VanDerWaalsContact O-CB 3.25Å; K128-S132 WeakPolarHBondContact O-CB 3.17Å; K128-S132 PolarHBondContact O-N 2.88Å; K128-S132 PolarHBondContact O-OG 2.96Å; A129-S132 PolarHBondContact O-N 3.5Å; A129-S132 VanDerWaalsContact O-N 3.14Å
133	L	93.9	Very high	94.7	Very high	39 Å²	39	57.8 Å²	57.8	20%	0.204	34%	0.344	C	S	.	.			trans	-66.8	141.6	-176.3	-68.4	167.2	0	0	0	111.7	H118 M121 A122 A130 H135 P137	H118-L133 HydrophobicContact CB-CD1 4.01Å; H118-L133 WeakPolarHBondContact O-CD1 3.5Å; M121-L133 HydrophobicContact CB-CD1 4.25Å; M121-L133 HydrophobicContact CB-CD2 4.38Å; M121-L133 HydrophobicContact CE-CB 4.06Å; M121-L133 HydrophobicContact CE-CD1 3.72Å; M121-L133 HydrophobicContact CE-CD2 4.29Å; M121-L133 HydrophobicContact CE-CG 4.24Å; M121-L133 HydrophobicContact CG-CD2 4.31Å; A122-L133 HydrophobicContact CB-CD2 3.91Å; A130-L133 VanDerWaalsContact O-CD1 3.24Å; A130-L133 WeakPolarHBondContact O-CD1 3.36Å; A130-L133 WeakPolarHBondContact O-CG 3.29Å; L133-H135 VanDerWaalsContact C-N 3.28Å; L133-H135 WeakPolarHBondContact CB-O 3.09Å; L133-H135 PolarHBondContact O-N 3.46Å; L133-P137 HydrophobicContact CD1-CG 3.77Å
134	P	92.2	Very high	94.7	Very high	110 Å²	110	57.2 Å²	57.2	71%	0.714	32%	0.324	S	S	*	.	S	Bend	trans	-74.2	-21.9	178.9	30.1	-35.3	0	0	0	112.9
135	H	90	Very high	94.8	Very high	143 Å²	143	55.7 Å²	55.7	66%	0.662	31%	0.312	S	S	*	.	S	Bend	trans	-130.6	162.8	-178.3	-60.1	-48.9	0	0	0	110	M121 L133	M121-H135 HydrophobicContact CE-CB 4.4Å; M121-H135 WeakPolarHBondContact CE-O 3.48Å; L133-H135 VanDerWaalsContact C-N 3.28Å; L133-H135 WeakPolarHBondContact CB-O 3.09Å; L133-H135 PolarHBondContact O-N 3.46Å
136	R	91.6	Very high	95	Very high	53 Å²	53	52.4 Å²	52.4	20%	0.2	30%	0.3	C	S	.	.			trans	-77.5	129.9	176.1	-168.7	173.7	-172.2	-177.7	-2.2	109.8	H140 G188 W190	R136-H140 HydrophobicContact CG-CB 3.87Å; R136-H140 VanDerWaalsContact CZ-O 3.31Å; R136-H140 VanDerWaalsContact NE-CB 3.26Å; R136-H140 PolarHBondContact NE-O 3.22Å; R136-G188 PolarHBondContact NH1-O 2.92Å; R136-W190 HydrophobicContact CB-CE3 4.2Å; R136-W190 HydrophobicContact CB-CZ3 4.35Å; R136-W190 HydrophobicContact CG-CE3 4.15Å
137	P	95.4	Very high	95	Very high	4 Å²	4	53.4 Å²	53.4	3%	0.026	30%	0.303	C	S	.	.			trans	-57.5	150.7	177.4	-26.6	33.2	0	0	0	113.7	D117 H118 M121 L133 L139 H140 W190	D117-P137 HydrophobicContact CB-CB 4.01Å; D117-P137 WeakPolarHBondContact OD1-CB 3.06Å; D117-P137 WeakPolarHBondContact OD2-CB 3.47Å; H118-P137 HydrophobicContact CB-CG 4.32Å; M121-P137 VanDerWaalsContact CE-CA 3.42Å; M121-P137 HydrophobicContact CE-CB 4Å; M121-P137 HydrophobicContact CE-CG 3.67Å; M121-P137 VanDerWaalsContact CE-N 3.27Å; L133-P137 HydrophobicContact CD1-CG 3.77Å; P137-L139 PolarHBondContact O-N 3.03Å; P137-H140 WeakPolarHBondContact O-CB 3.48Å; P137-H140 PolarHBondContact O-N 3.3Å; P137-W190 WeakPolarHBondContact O-CZ3 3.32Å
138	P	94.8	Very high	95.2	Very high	56 Å²	56	56.3 Å²	56.3	36%	0.364	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-66.7	-33.6	-169.5	25.3	-34.3	0	0	0	114.2	H140 C141 L144	P138-H140 PolarHBondContact O-N 2.69Å; P138-C141 WeakPolarHBondContact O-CB 3.28Å; P138-C141 PolarHBondContact O-N 3.34Å; P138-L144 WeakPolarHBondContact O-CD1 3.19Å
139	L	96.2	Very high	95.3	Very high	73 Å²	73	49.9 Å²	49.9	38%	0.382	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-68.2	-19.5	179.9	-56.3	-176.4	0	0	0	111.6	I114 D117 P137 C141 H180	I114-L139 HydrophobicContact CG2-CB 4.11Å; D117-L139 HydrophobicContact CB-CB 4.11Å; D117-L139 HydrophobicContact CB-CD1 3.85Å; D117-L139 HydrophobicContact CB-CG 3.77Å; D117-L139 WeakPolarHBondContact OD2-CA 3.37Å; D117-L139 WeakPolarHBondContact OD2-CB 3.42Å; D117-L139 PolarHBondContact OD2-N 3.47Å; P137-L139 PolarHBondContact O-N 3.03Å; L139-C141 PolarHBondContact O-N 3.47Å; L139-H180 PolarHBondContact O-CE1 3.27Å; L139-H180 PolarHBondContact O-NE2 3.36Å
140	H	96.7	Very high	95.3	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.009	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-82.2	9.2	173.7	-62	69.7	0	0	0	113.8	D115 D117 H118 R136 P137 P138 S142 H179 D183	D115-H140 IonicContact OD1-CE1 3.72Å; D115-H140 IonicContact OD1-NE2 3.62Å; D117-H140 VanDerWaalsContact CG-ND1 3.32Å; D117-H140 IonicContact OD1-CE1 3.15Å; D117-H140 PolarHBondContact OD1-CE1 3.02Å; D117-H140 IonicContact OD1-ND1 2.85Å; D117-H140 PolarHBondContact OD1-ND1 3.05Å; D117-H140 VanDerWaalsContact OD1-ND1 3.09Å; D117-H140 IonicContact OD2-CE1 3.6Å; D117-H140 PolarHBondContact OD2-N 3.32Å; D117-H140 IonicContact OD2-ND1 3.66Å; D117-H140 PolarHBondContact OD2-ND1 3.06Å; H118-H140 AromaticContact CE1-CE1 3.19Å; H118-H140 PolarHBondContact CE1-CE1 2.93Å; H118-H140 AromaticContact CE1-ND1 3.84Å; H118-H140 AromaticContact CE1-NE2 3.37Å; H118-H140 PolarHBondContact CE1-NE2 3.42Å; H118-H140 AromaticContact ND1-CE1 3.42Å; H118-H140 PolarHBondContact ND1-CE1 3.01Å; H118-H140 AromaticContact ND1-NE2 4Å; R136-H140 HydrophobicContact CG-CB 3.87Å; R136-H140 VanDerWaalsContact CZ-O 3.31Å; R136-H140 VanDerWaalsContact NE-CB 3.26Å; R136-H140 PolarHBondContact NE-O 3.22Å; P137-H140 WeakPolarHBondContact O-CB 3.48Å; P137-H140 PolarHBondContact O-N 3.3Å; P138-H140 PolarHBondContact O-N 2.69Å; H140-S142 PolarHBondContact O-N 3.46Å; H140-H179 AromaticContact CD2-NE2 3.6Å; H140-H179 AromaticContact NE2-CE1 3.95Å; H140-H179 AromaticContact NE2-NE2 3.14Å; H140-H179 PolarHBondContact NE2-NE2 3.46Å; H140-H179 VanDerWaalsContact NE2-NE2 3.14Å; H140-D183 IonicContact CD2-OD2 3.54Å; H140-D183 IonicContact NE2-OD2 2.78Å
141	C	97	Very high	95.4	Very high	8 Å²	8	57.2 Å²	57.2	5%	0.054	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-78.5	106	168.6	-172.5	0	0	0	0	110.2	P138 L139 S143 L144 W190 C192	P138-C141 WeakPolarHBondContact O-CB 3.28Å; P138-C141 PolarHBondContact O-N 3.34Å; L139-C141 PolarHBondContact O-N 3.47Å; C141-S143 PolarHBondContact O-N 2.96Å; C141-S143 VanDerWaalsContact O-N 3.16Å; C141-L144 HydrophobicContact CB-CD1 3.98Å; C141-L144 HydrophobicContact CB-CG 3.93Å; C141-L144 VanDerWaalsContact O-CB 3.31Å; C141-L144 WeakPolarHBondContact O-CB 3.39Å; C141-L144 PolarHBondContact O-N 3.44Å; C141-W190 VanDerWaalsContact CA-CE3 3.42Å; C141-W190 HydrophobicContact CB-CD2 3.9Å; C141-W190 HydrophobicContact CB-CE3 3.47Å; C141-W190 VanDerWaalsContact CB-CE3 3.47Å; C141-W190 HydrophobicContact CB-CH2 4.23Å; C141-W190 HydrophobicContact CB-CZ3 3.66Å; C141-C192 WeakPolarHBondContact SG-CB 3.28Å
142	S	97.4	Very high	95.5	Very high	17 Å²	17	56 Å²	56	12%	0.119	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.2	-178.6	-56.2	0	0	0	0	113.5	H140 L144 I145 P146 H180 W190	H140-S142 PolarHBondContact O-N 3.46Å; S142-L144 PolarHBondContact O-N 2.89Å; S142-I145 WeakPolarHBondContact O-CB 3.19Å; S142-I145 WeakPolarHBondContact O-CG1 3.31Å; S142-I145 PolarHBondContact O-N 2.8Å; S142-P146 WeakPolarHBondContact O-CD 3.29Å; S142-H180 WeakPolarHBondContact CA-ND1 3.38Å; S142-H180 PolarHBondContact OG-ND1 2.98Å; S142-W190 WeakPolarHBondContact CA-O 3.5Å; S142-W190 WeakPolarHBondContact CB-O 3.49Å; S142-W190 PolarHBondContact N-O 3.39Å
143	S	96.4	Very high	95.5	Very high	28 Å²	28	57.3 Å²	57.3	20%	0.196	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.5	172.4	-62	0	0	0	0	113.4	C141 I145 P146 V147 W190 V191 C192	C141-S143 PolarHBondContact O-N 2.96Å; C141-S143 VanDerWaalsContact O-N 3.16Å; S143-I145 VanDerWaalsContact C-N 3.32Å; S143-P146 WeakPolarHBondContact O-CD 3.28Å; S143-P146 WeakPolarHBondContact O-CG 3.17Å; S143-V147 WeakPolarHBondContact O-CG2 3.49Å; S143-W190 PolarHBondContact N-O 3.28Å; S143-V191 VanDerWaalsContact OG-C 3.31Å; S143-V191 WeakPolarHBondContact OG-CA 3.12Å; S143-C192 WeakPolarHBondContact CB-O 3.47Å; S143-C192 PolarHBondContact OG-N 2.94Å; S143-C192 PolarHBondContact OG-O 3.33Å
144	L	96.6	Very high	95.5	Very high	60 Å²	60	59.1 Å²	59.1	31%	0.314	32%	0.316	S	S	.	.	H	α-helix	trans	-72.1	-25.5	177.1	-67.8	179.3	0	0	0	112.6	P138 C141 S142 V147 L148	P138-L144 WeakPolarHBondContact O-CD1 3.19Å; C141-L144 HydrophobicContact CB-CD1 3.98Å; C141-L144 HydrophobicContact CB-CG 3.93Å; C141-L144 VanDerWaalsContact O-CB 3.31Å; C141-L144 WeakPolarHBondContact O-CB 3.39Å; C141-L144 PolarHBondContact O-N 3.44Å; S142-L144 PolarHBondContact O-N 2.89Å; L144-V147 PolarHBondContact O-N 2.95Å; L144-L148 HydrophobicContact CB-CD1 4.26Å; L144-L148 HydrophobicContact CB-CG 4.46Å; L144-L148 WeakPolarHBondContact O-CB 3.26Å; L144-L148 VanDerWaalsContact O-CG 3.26Å; L144-L148 WeakPolarHBondContact O-CG 3.45Å; L144-L148 PolarHBondContact O-N 3.26Å
145	I	97.4	Very high	95.7	Very high	13 Å²	13	58.2 Å²	58.2	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-55.3	-58.8	-177.6	-55.5	-179.6	0	0	0	111.6	S142 S143 V147 L148 C149 F173 L176 H180	S142-I145 WeakPolarHBondContact O-CB 3.19Å; S142-I145 WeakPolarHBondContact O-CG1 3.31Å; S142-I145 PolarHBondContact O-N 2.8Å; S143-I145 VanDerWaalsContact C-N 3.32Å; I145-V147 VanDerWaalsContact C-N 3.28Å; I145-V147 PolarHBondContact O-N 3.49Å; I145-L148 PolarHBondContact O-N 3.1Å; I145-C149 WeakPolarHBondContact O-CB 3.38Å; I145-C149 PolarHBondContact O-N 3.43Å; I145-C149 PolarHBondContact O-SG 3.25Å; I145-F173 HydrophobicContact CG2-CD2 3.83Å; I145-F173 HydrophobicContact CG2-CE2 4.35Å; I145-L176 HydrophobicContact CD1-CB 4.05Å; I145-L176 HydrophobicContact CG1-CB 3.93Å; I145-L176 HydrophobicContact CG1-CD2 4.21Å; I145-L176 HydrophobicContact CG2-CB 4.25Å; I145-H180 HydrophobicContact CD1-CB 4.25Å
146	P	96.6	Very high	95.8	Very high	81 Å²	81	52 Å²	52	53%	0.526	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-34.6	178.7	24.9	-35	0	0	0	112.5	S142 S143 F150	S142-P146 WeakPolarHBondContact O-CD 3.29Å; S143-P146 WeakPolarHBondContact O-CD 3.28Å; S143-P146 WeakPolarHBondContact O-CG 3.17Å; P146-F150 WeakPolarHBondContact O-CB 3.4Å; P146-F150 PolarHBondContact O-N 3.42Å
147	V	96.8	Very high	95.8	Very high	80 Å²	80	57.3 Å²	57.3	49%	0.485	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-49.1	178.1	175	0	0	0	0	110.9	S143 L144 I145 S151	S143-V147 WeakPolarHBondContact O-CG2 3.49Å; L144-V147 PolarHBondContact O-N 2.95Å; I145-V147 VanDerWaalsContact C-N 3.28Å; I145-V147 PolarHBondContact O-N 3.49Å; V147-S151 WeakPolarHBondContact O-CB 3.17Å; V147-S151 PolarHBondContact O-N 3.1Å; V147-S151 PolarHBondContact O-OG 2.85Å
148	L	97.2	Very high	95.7	Very high	71 Å²	71	62.5 Å²	62.5	37%	0.372	33%	0.327	S	S	.	.	H	α-helix	trans	-65.9	-44.1	179.6	-68.4	174.4	0	0	0	111.3	L144 I145 S151 L152 L172 L176	L144-L148 HydrophobicContact CB-CD1 4.26Å; L144-L148 HydrophobicContact CB-CG 4.46Å; L144-L148 WeakPolarHBondContact O-CB 3.26Å; L144-L148 VanDerWaalsContact O-CG 3.26Å; L144-L148 WeakPolarHBondContact O-CG 3.45Å; L144-L148 PolarHBondContact O-N 3.26Å; I145-L148 PolarHBondContact O-N 3.1Å; L148-S151 PolarHBondContact O-N 3.38Å; L148-L152 VanDerWaalsContact O-CB 3.3Å; L148-L152 WeakPolarHBondContact O-CB 3.46Å; L148-L152 PolarHBondContact O-N 3.17Å; L148-L172 HydrophobicContact CB-CD2 3.96Å; L148-L176 HydrophobicContact CD1-CD2 3.81Å
149	C	96.9	Very high	95.5	Very high	16 Å²	16	61.9 Å²	61.9	11%	0.108	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-44.3	178.5	-63.6	0	0	0	0	111.7	I145 R153	I145-C149 WeakPolarHBondContact O-CB 3.38Å; I145-C149 PolarHBondContact O-N 3.43Å; I145-C149 PolarHBondContact O-SG 3.25Å; C149-R153 WeakPolarHBondContact O-CB 3.47Å; C149-R153 PolarHBondContact O-N 3.43Å
150	F	95.9	Very high	95.1	Very high	139 Å²	139	69.3 Å²	69.3	61%	0.61	35%	0.354	S	S	*	.	H	α-helix	trans	-67.5	-43.1	177.5	-175.3	-96.4	0	0	0	112	P146 L152 R153 L154	P146-F150 WeakPolarHBondContact O-CB 3.4Å; P146-F150 PolarHBondContact O-N 3.42Å; F150-L152 PolarHBondContact O-N 3Å; F150-R153 WeakPolarHBondContact O-CB 3.26Å; F150-R153 PolarHBondContact O-N 3.34Å; F150-L154 WeakPolarHBondContact O-CB 3.47Å; F150-L154 PolarHBondContact O-N 2.8Å
151	S	96.6	Very high	94.5	Very high	53 Å²	53	73.2 Å²	73.2	37%	0.371	38%	0.375	S	S	.	.	H	α-helix	trans	-61.3	-45.1	177.2	-59.8	0	0	0	0	111.3	V147 L148 R153 L154 V155	V147-S151 WeakPolarHBondContact O-CB 3.17Å; V147-S151 PolarHBondContact O-N 3.1Å; V147-S151 PolarHBondContact O-OG 2.85Å; L148-S151 PolarHBondContact O-N 3.38Å; S151-R153 VanDerWaalsContact C-N 3.34Å; S151-R153 PolarHBondContact O-N 2.99Å; S151-L154 WeakPolarHBondContact O-CB 3.4Å; S151-L154 PolarHBondContact O-N 3.39Å; S151-V155 WeakPolarHBondContact O-CG2 3.33Å; S151-V155 PolarHBondContact O-N 3.33Å
152	L	96.1	Very high	93.5	Very high	48 Å²	48	77.2 Å²	77.2	25%	0.251	39%	0.392	S	S	.	.	H	α-helix	trans	-61.1	-44.3	175.2	-179	56.6	0	0	0	111.2	L148 F150 L154 V155 L156 L168 P169 L172	L148-L152 VanDerWaalsContact O-CB 3.3Å; L148-L152 WeakPolarHBondContact O-CB 3.46Å; L148-L152 PolarHBondContact O-N 3.17Å; F150-L152 PolarHBondContact O-N 3Å; L152-L154 VanDerWaalsContact C-N 3.31Å; L152-L154 PolarHBondContact O-N 2.86Å; L152-V155 PolarHBondContact O-N 2.78Å; L152-L156 HydrophobicContact CD1-CG 4.33Å; L152-L156 HydrophobicContact CG-CD1 4.37Å; L152-L156 VanDerWaalsContact O-CG 3.29Å; L152-L156 WeakPolarHBondContact O-CG 3.4Å; L152-L156 PolarHBondContact O-N 2.95Å; L152-L168 HydrophobicContact CD2-CB 4.05Å; L152-P169 HydrophobicContact CD2-CG 4.39Å; L152-P169 HydrophobicContact CG-CG 4.21Å; L152-L172 HydrophobicContact CD2-CB 4.48Å; L152-L172 HydrophobicContact CD2-CD2 4.08Å
153	R	93.6	Very high	92.5	Very high	109 Å²	109	81.1 Å²	81.1	41%	0.411	41%	0.411	S	S	.	.	H	α-helix	trans	-60.5	-41	175.9	-170.9	173.8	-172.3	-148.2	3.7	112.2	C149 F150 S151 L156 W157 P169	C149-R153 WeakPolarHBondContact O-CB 3.47Å; C149-R153 PolarHBondContact O-N 3.43Å; F150-R153 WeakPolarHBondContact O-CB 3.26Å; F150-R153 PolarHBondContact O-N 3.34Å; S151-R153 VanDerWaalsContact C-N 3.34Å; S151-R153 PolarHBondContact O-N 2.99Å; R153-L156 PolarHBondContact O-N 3.29Å; R153-W157 WeakPolarHBondContact O-CB 3.22Å; R153-W157 PolarHBondContact O-N 3.5Å; R153-P169 HydrophobicContact CB-CB 4.4Å; R153-P169 HydrophobicContact CB-CG 4.01Å
154	L	94.5	Very high	91.6	Very high	77 Å²	77	82.9 Å²	82.9	40%	0.403	42%	0.423	S	S	.	.	H	α-helix	trans	-64.2	-45.4	176.3	179.6	62.9	0	0	0	111.3	F150 S151 L152 L156 W157 L158	F150-L154 WeakPolarHBondContact O-CB 3.47Å; F150-L154 PolarHBondContact O-N 2.8Å; S151-L154 WeakPolarHBondContact O-CB 3.4Å; S151-L154 PolarHBondContact O-N 3.39Å; L152-L154 VanDerWaalsContact C-N 3.31Å; L152-L154 PolarHBondContact O-N 2.86Å; L154-L156 PolarHBondContact O-N 3.11Å; L154-W157 HydrophobicContact CD1-CE3 4.15Å; L154-W157 WeakPolarHBondContact O-CB 3.3Å; L154-W157 PolarHBondContact O-N 3.4Å; L154-L158 HydrophobicContact CD1-CD1 4.22Å; L154-L158 HydrophobicContact CD1-CG 4.18Å; L154-L158 HydrophobicContact CG-CD1 4Å; L154-L158 HydrophobicContact CG-CG 4.38Å; L154-L158 WeakPolarHBondContact O-CB 3.29Å; L154-L158 WeakPolarHBondContact O-CG 3.42Å; L154-L158 PolarHBondContact O-N 3.07Å
155	V	95.1	Very high	91	Very high	92 Å²	92	86.4 Å²	86.4	56%	0.558	43%	0.433	S	S	*	.	H	α-helix	trans	-59.2	-46.2	176.1	169.2	0	0	0	0	111.1	S151 L152 W157 L158 G159	S151-V155 WeakPolarHBondContact O-CG2 3.33Å; S151-V155 PolarHBondContact O-N 3.33Å; L152-V155 PolarHBondContact O-N 2.78Å; V155-W157 VanDerWaalsContact C-N 3.28Å; V155-W157 PolarHBondContact O-N 3.23Å; V155-L158 PolarHBondContact O-N 3.29Å; V155-G159 PolarHBondContact O-N 3.43Å
156	L	92.9	Very high	90.4	Very high	13 Å²	13	86.6 Å²	86.6	7%	0.068	44%	0.435	C	S	.	.	H	α-helix	trans	-63	-36.3	177.2	-68.3	177.2	0	0	0	112.3	L152 R153 L154 R160 L161 K162 W165 L168 P169	L152-L156 HydrophobicContact CD1-CG 4.33Å; L152-L156 HydrophobicContact CG-CD1 4.37Å; L152-L156 VanDerWaalsContact O-CG 3.29Å; L152-L156 WeakPolarHBondContact O-CG 3.4Å; L152-L156 PolarHBondContact O-N 2.95Å; R153-L156 PolarHBondContact O-N 3.29Å; L154-L156 PolarHBondContact O-N 3.11Å; L156-R160 PolarHBondContact O-N 3.11Å; L156-L161 HydrophobicContact CD2-CB 3.93Å; L156-L161 HydrophobicContact CD2-CD1 4.49Å; L156-L161 PolarHBondContact O-N 3.29Å; L156-K162 PolarHBondContact O-N 3.14Å; L156-K162 VanDerWaalsContact O-N 3.1Å; L156-W165 HydrophobicContact CD1-CB 4.16Å; L156-W165 VanDerWaalsContact CD1-O 3.29Å; L156-W165 WeakPolarHBondContact CD1-O 3.26Å; L156-W165 HydrophobicContact CD2-CB 3.87Å; L156-L168 HydrophobicContact CD1-CB 4.42Å; L156-P169 HydrophobicContact CD1-CG 3.98Å
157	W	91.6	Very high	90.1	Very high	163 Å²	163	83.2 Å²	83.2	62%	0.617	41%	0.413	S	S	*	.	H	α-helix	trans	-68.2	-49.5	175.7	-177.8	77.3	0	0	0	111.8	R153 L154 V155 G159 R160	R153-W157 WeakPolarHBondContact O-CB 3.22Å; R153-W157 PolarHBondContact O-N 3.5Å; L154-W157 HydrophobicContact CD1-CE3 4.15Å; L154-W157 WeakPolarHBondContact O-CB 3.3Å; L154-W157 PolarHBondContact O-N 3.4Å; V155-W157 VanDerWaalsContact C-N 3.28Å; V155-W157 PolarHBondContact O-N 3.23Å; W157-G159 VanDerWaalsContact C-N 3.31Å; W157-G159 PolarHBondContact O-N 3.38Å; W157-R160 PolarHBondContact O-N 3.04Å; W157-R160 VanDerWaalsContact O-N 3.08Å
158	L	93.1	Very high	90	Very high	113 Å²	113	81.1 Å²	81.1	59%	0.592	40%	0.399	S	S	*	.	H	α-helix	trans	-60.7	-39.8	177.5	-70.1	173.3	0	0	0	112	L154 V155 R160	L154-L158 HydrophobicContact CD1-CD1 4.22Å; L154-L158 HydrophobicContact CD1-CG 4.18Å; L154-L158 HydrophobicContact CG-CD1 4Å; L154-L158 HydrophobicContact CG-CG 4.38Å; L154-L158 WeakPolarHBondContact O-CB 3.29Å; L154-L158 WeakPolarHBondContact O-CG 3.42Å; L154-L158 PolarHBondContact O-N 3.07Å; V155-L158 PolarHBondContact O-N 3.29Å; L158-R160 PolarHBondContact O-N 3.07Å
159	G	90	Very high	89.9	Confident	44 Å²	44	78.1 Å²	78.1	45%	0.454	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-0.7	177.3	0	0	0	0	0	114.8	V155 W157 L161	V155-G159 PolarHBondContact O-N 3.43Å; W157-G159 VanDerWaalsContact C-N 3.31Å; W157-G159 PolarHBondContact O-N 3.38Å; G159-L161 PolarHBondContact O-N 3.09Å; G159-L161 VanDerWaalsContact O-N 3.15Å
160	R	87.8	Confident	89.9	Confident	228 Å²	228	79.1 Å²	79.1	86%	0.86	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	28.1	-173.1	-54.2	-178.1	178.2	-173.1	-1.1	113.3	L156 W157 L158	L156-R160 PolarHBondContact O-N 3.11Å; W157-R160 PolarHBondContact O-N 3.04Å; W157-R160 VanDerWaalsContact O-N 3.08Å; L158-R160 PolarHBondContact O-N 3.07Å
161	L	85.4	Confident	90	Very high	85 Å²	85	72.5 Å²	72.5	45%	0.445	36%	0.357	S	S	.	.			trans	-97	-0.5	177.8	-62.6	179.7	0	0	0	112.5	L156 G159 D163 S164 W165	L156-L161 HydrophobicContact CD2-CB 3.93Å; L156-L161 HydrophobicContact CD2-CD1 4.49Å; L156-L161 PolarHBondContact O-N 3.29Å; G159-L161 PolarHBondContact O-N 3.09Å; G159-L161 VanDerWaalsContact O-N 3.15Å; L161-D163 VanDerWaalsContact C-N 3.29Å; L161-D163 PolarHBondContact O-N 3.39Å; L161-S164 PolarHBondContact O-N 3.19Å; L161-W165 PolarHBondContact O-N 3.34Å
162	K	75.7	Confident	90	Very high	92 Å²	92	71.4 Å²	71.4	40%	0.4	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48	-49.2	-176.1	-179.4	-174.2	167.9	-165.5	0	111.9	L156 S164 C166	L156-K162 PolarHBondContact O-N 3.14Å; L156-K162 VanDerWaalsContact O-N 3.1Å; K162-S164 PolarHBondContact O-N 2.97Å; K162-C166 VanDerWaalsContact O-CA 3.26Å; K162-C166 WeakPolarHBondContact O-CA 3.16Å; K162-C166 WeakPolarHBondContact O-CB 3.35Å; K162-C166 PolarHBondContact O-N 3.15Å
163	D	75.9	Confident	90.1	Very high	98 Å²	98	71.6 Å²	71.6	52%	0.524	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-24.7	-175.3	-55.7	-33.2	0	0	0	112.4	L161 V228 K232	L161-D163 VanDerWaalsContact C-N 3.29Å; L161-D163 PolarHBondContact O-N 3.39Å; D163-V228 HydrophobicContact CB-CG1 4.28Å; D163-K232 WeakPolarHBondContact O-CD 3.48Å
164	S	77.8	Confident	90.4	Very high	65 Å²	65	66.4 Å²	66.4	46%	0.455	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-30.3	-177.7	-79.3	0	0	0	0	115.2	L161 K162 K232	L161-S164 PolarHBondContact O-N 3.19Å; K162-S164 PolarHBondContact O-N 2.97Å; S164-K232 PolarHBondContact O-NZ 3.3Å; S164-K232 PolarHBondContact OG-NZ 3.28Å
165	W	84.3	Confident	90.5	Very high	134 Å²	134	62.7 Å²	62.7	51%	0.508	31%	0.306	S	S	.	.	S	Bend	trans	-130.5	27.5	-172.8	-60.5	81.3	0	0	0	111.6	L156 L161 S167 L168	L156-W165 HydrophobicContact CD1-CB 4.16Å; L156-W165 VanDerWaalsContact CD1-O 3.29Å; L156-W165 WeakPolarHBondContact CD1-O 3.26Å; L156-W165 HydrophobicContact CD2-CB 3.87Å; L161-W165 PolarHBondContact O-N 3.34Å; W165-S167 PolarHBondContact O-N 3.46Å; W165-S167 VanDerWaalsContact O-N 3.09Å; W165-L168 HydrophobicContact CB-CD1 3.97Å; W165-L168 HydrophobicContact CB-CG 4.08Å; W165-L168 HydrophobicContact CD2-CD1 4.04Å; W165-L168 HydrophobicContact CE3-CD1 3.32Å; W165-L168 HydrophobicContact CE3-CD2 4.06Å; W165-L168 HydrophobicContact CE3-CG 3.7Å; W165-L168 HydrophobicContact CG-CD1 4.36Å; W165-L168 HydrophobicContact CZ3-CD1 4.02Å; W165-L168 HydrophobicContact CZ3-CD2 4.48Å; W165-L168 WeakPolarHBondContact O-CB 3.37Å; W165-L168 PolarHBondContact O-N 3.41Å
166	C	85.8	Confident	90.7	Very high	17 Å²	17	59 Å²	59	12%	0.115	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.1	-176.4	56	0	0	0	0	113.7	K162 T225 V228 I229	K162-C166 VanDerWaalsContact O-CA 3.26Å; K162-C166 WeakPolarHBondContact O-CA 3.16Å; K162-C166 WeakPolarHBondContact O-CB 3.35Å; K162-C166 PolarHBondContact O-N 3.15Å; C166-T225 HydrophobicContact CB-CG2 3.94Å; C166-T225 WeakPolarHBondContact O-CG2 3.5Å; C166-V228 HydrophobicContact CB-CG1 4.45Å; C166-I229 VanDerWaalsContact SG-CG1 3.58Å
167	S	90.3	Very high	90.9	Very high	11 Å²	11	58.7 Å²	58.7	8%	0.077	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-23.7	177.8	62.3	0	0	0	0	113.6	E103 W165 W170 L171	E103-S167 PolarHBondContact OE2-OG 3.38Å; W165-S167 PolarHBondContact O-N 3.46Å; W165-S167 VanDerWaalsContact O-N 3.09Å; S167-W170 WeakPolarHBondContact O-CA 3.37Å; S167-W170 WeakPolarHBondContact O-CB 3.47Å; S167-W170 PolarHBondContact O-N 3.24Å; S167-L171 PolarHBondContact O-N 3.26Å
168	L	93.4	Very high	91.3	Very high	35 Å²	35	51 Å²	51	18%	0.183	25%	0.254	C	S	.	.	H	α-helix	trans	-58	-43.7	-173.1	-76.1	-171.1	0	0	0	114.9	L106 L152 L156 W165 W170 L171 L172	L106-L168 HydrophobicContact CD2-CD2 4.23Å; L152-L168 HydrophobicContact CD2-CB 4.05Å; L156-L168 HydrophobicContact CD1-CB 4.42Å; W165-L168 HydrophobicContact CB-CD1 3.97Å; W165-L168 HydrophobicContact CB-CG 4.08Å; W165-L168 HydrophobicContact CD2-CD1 4.04Å; W165-L168 HydrophobicContact CE3-CD1 3.32Å; W165-L168 HydrophobicContact CE3-CD2 4.06Å; W165-L168 HydrophobicContact CE3-CG 3.7Å; W165-L168 HydrophobicContact CG-CD1 4.36Å; W165-L168 HydrophobicContact CZ3-CD1 4.02Å; W165-L168 HydrophobicContact CZ3-CD2 4.48Å; W165-L168 WeakPolarHBondContact O-CB 3.37Å; W165-L168 PolarHBondContact O-N 3.41Å; L168-W170 PolarHBondContact O-N 2.79Å; L168-L171 PolarHBondContact O-N 2.73Å; L168-L172 WeakPolarHBondContact O-CB 3.45Å; L168-L172 PolarHBondContact O-N 2.95Å
169	P	95.9	Very high	91.5	Very high	9 Å²	9	45.6 Å²	45.6	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-33.4	176.2	-24.1	35.4	0	0	0	112.9	L152 R153 L156 F173	L152-P169 HydrophobicContact CD2-CG 4.39Å; L152-P169 HydrophobicContact CG-CG 4.21Å; R153-P169 HydrophobicContact CB-CB 4.4Å; R153-P169 HydrophobicContact CB-CG 4.01Å; L156-P169 HydrophobicContact CD1-CG 3.98Å; P169-F173 WeakPolarHBondContact O-CB 3.09Å; P169-F173 PolarHBondContact O-N 3.24Å
170	W	96.5	Very high	91.9	Very high	37 Å²	37	43.6 Å²	43.6	14%	0.14	21%	0.205	C	C	.	.	H	α-helix	trans	-77.5	-36.2	178.4	-63.1	104	0	0	0	112.3	W89 S167 L168 F173 I174 L219 M220 T223 T225	W89-W170 HydrophobicContact CH2-CB 3.93Å; W89-W170 VanDerWaalsContact CZ3-C 3.5Å; W89-W170 HydrophobicContact CZ3-CB 3.89Å; S167-W170 WeakPolarHBondContact O-CA 3.37Å; S167-W170 WeakPolarHBondContact O-CB 3.47Å; S167-W170 PolarHBondContact O-N 3.24Å; L168-W170 PolarHBondContact O-N 2.79Å; W170-F173 WeakPolarHBondContact O-CB 3.42Å; W170-F173 PolarHBondContact O-N 2.85Å; W170-I174 PolarHBondContact O-N 2.92Å; W170-L219 HydrophobicContact CH2-CB 3.55Å; W170-L219 HydrophobicContact CZ3-CB 3.58Å; W170-L219 HydrophobicContact CZ3-CD1 4.25Å; W170-M220 HydrophobicContact CB-CE 4.3Å; W170-M220 HydrophobicContact CB-CG 3.93Å; W170-M220 HydrophobicContact CB-SD 3.75Å; W170-M220 HydrophobicContact CD2-CB 4.5Å; W170-M220 HydrophobicContact CD2-CG 3.31Å; W170-M220 HydrophobicContact CD2-SD 4.33Å; W170-M220 HydrophobicContact CE3-CG 3.82Å; W170-M220 HydrophobicContact CG-CE 4.31Å; W170-M220 HydrophobicContact CG-CG 3.35Å; W170-M220 HydrophobicContact CG-SD 3.86Å; W170-M220 HydrophobicContact CZ2-CG 4.34Å; W170-T223 HydrophobicContact CH2-CG2 4.28Å; W170-T223 HydrophobicContact CZ2-CG2 3.89Å; W170-T223 VanDerWaalsContact CZ2-OG1 3.28Å; W170-T223 WeakPolarHBondContact CZ2-OG1 3.45Å; W170-T225 PolarHBondContact NE1-OG1 2.76Å; W170-T225 VanDerWaalsContact NE1-OG1 3.1Å
171	L	97.1	Very high	92.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.3	-46.8	171.8	-168.4	163.6	0	0	0	109.9	W89 E103 L106 A107 L110 S167 L168 F173 I174 S175	W89-L171 HydrophobicContact CD2-CB 4.18Å; W89-L171 HydrophobicContact CD2-CD1 4.42Å; W89-L171 HydrophobicContact CD2-CG 4Å; W89-L171 HydrophobicContact CE3-CB 4.22Å; W89-L171 HydrophobicContact CE3-CG 4.46Å; W89-L171 HydrophobicContact CG-CG 4.35Å; W89-L171 HydrophobicContact CH2-CB 3.78Å; W89-L171 HydrophobicContact CZ2-CB 3.75Å; W89-L171 HydrophobicContact CZ2-CD1 4.07Å; W89-L171 HydrophobicContact CZ2-CG 4.14Å; W89-L171 HydrophobicContact CZ3-CB 4.02Å; W89-L171 VanDerWaalsContact CZ3-N 3.34Å; E103-L171 HydrophobicContact CB-CD1 3.91Å; E103-L171 HydrophobicContact CG-CD1 4.48Å; L106-L171 HydrophobicContact CD2-CD1 4.2Å; L106-L171 HydrophobicContact CD2-CD2 4.37Å; L106-L171 HydrophobicContact CG-CD2 4.13Å; A107-L171 HydrophobicContact CB-CD2 3.95Å; A107-L171 HydrophobicContact CB-CG 4.05Å; L110-L171 HydrophobicContact CD1-CD2 3.43Å; L110-L171 VanDerWaalsContact CD1-CD2 3.43Å; S167-L171 PolarHBondContact O-N 3.26Å; L168-L171 PolarHBondContact O-N 2.73Å; L171-F173 PolarHBondContact O-N 3.31Å; L171-I174 VanDerWaalsContact O-CG2 3.31Å; L171-I174 WeakPolarHBondContact O-CG2 3.38Å; L171-I174 PolarHBondContact O-N 2.91Å; L171-S175 WeakPolarHBondContact O-CB 3.17Å; L171-S175 PolarHBondContact O-N 3.37Å; L171-S175 VanDerWaalsContact O-N 3.11Å; L171-S175 PolarHBondContact O-OG 3.42Å; L171-S175 VanDerWaalsContact O-OG 3.08Å
172	L	98.1	Very high	93	Very high	29 Å²	29	30 Å²	30	15%	0.152	15%	0.149	C	C	.	.	H	α-helix	trans	-60.3	-45.9	173.7	-172.6	70.5	0	0	0	111.2	L110 L148 L152 L168 I174 S175 L176	L110-L172 HydrophobicContact CD1-CD1 4.16Å; L148-L172 HydrophobicContact CB-CD2 3.96Å; L152-L172 HydrophobicContact CD2-CB 4.48Å; L152-L172 HydrophobicContact CD2-CD2 4.08Å; L168-L172 WeakPolarHBondContact O-CB 3.45Å; L168-L172 PolarHBondContact O-N 2.95Å; L172-I174 PolarHBondContact O-N 3.48Å; L172-S175 PolarHBondContact O-N 3.14Å; L172-L176 HydrophobicContact CD1-CD1 3.49Å; L172-L176 VanDerWaalsContact CD1-CD1 3.49Å; L172-L176 HydrophobicContact CD1-CD2 4.48Å; L172-L176 HydrophobicContact CG-CD1 3.98Å; L172-L176 HydrophobicContact CG-CD2 4.46Å; L172-L176 VanDerWaalsContact O-CD1 3.29Å; L172-L176 WeakPolarHBondContact O-CD1 3.31Å; L172-L176 PolarHBondContact O-N 3.02Å
173	F	98.3	Very high	94	Very high	52 Å²	52	26.4 Å²	26.4	23%	0.228	13%	0.134	C	C	.	.	H	α-helix	trans	-56.4	-50.8	176.9	172.6	-102	0	0	0	111.8	I145 P169 W170 L171 S175 L176 A177 L212	I145-F173 HydrophobicContact CG2-CD2 3.83Å; I145-F173 HydrophobicContact CG2-CE2 4.35Å; P169-F173 WeakPolarHBondContact O-CB 3.09Å; P169-F173 PolarHBondContact O-N 3.24Å; W170-F173 WeakPolarHBondContact O-CB 3.42Å; W170-F173 PolarHBondContact O-N 2.85Å; L171-F173 PolarHBondContact O-N 3.31Å; F173-S175 VanDerWaalsContact C-N 3.33Å; F173-S175 PolarHBondContact O-N 3.12Å; F173-L176 PolarHBondContact O-N 3.02Å; F173-A177 HydrophobicContact CD2-CB 4.44Å; F173-A177 HydrophobicContact CE1-CB 4.49Å; F173-A177 HydrophobicContact CE2-CB 4.13Å; F173-A177 HydrophobicContact CZ-CB 4.16Å; F173-A177 WeakPolarHBondContact O-CB 3.44Å; F173-A177 PolarHBondContact O-N 3.32Å; F173-L212 HydrophobicContact CE1-CD1 4.11Å; F173-L212 HydrophobicContact CZ-CD1 4.27Å
174	I	98.2	Very high	95	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.4	-43.7	-176.6	-156.3	72	0	0	0	110.8	W89 V92 W170 L171 L172 S178 L212 C216	W89-I174 HydrophobicContact CB-CG2 4.1Å; W89-I174 HydrophobicContact CD2-CG2 4.31Å; W89-I174 HydrophobicContact CE3-CB 4.35Å; W89-I174 HydrophobicContact CE3-CG2 3.64Å; W89-I174 HydrophobicContact CZ3-CG2 4.46Å; V92-I174 HydrophobicContact CG2-CD1 4.41Å; W170-I174 PolarHBondContact O-N 2.92Å; L171-I174 VanDerWaalsContact O-CG2 3.31Å; L171-I174 WeakPolarHBondContact O-CG2 3.38Å; L171-I174 PolarHBondContact O-N 2.91Å; L172-I174 PolarHBondContact O-N 3.48Å; I174-S178 VanDerWaalsContact O-CB 3.28Å; I174-S178 WeakPolarHBondContact O-CB 3.46Å; I174-S178 PolarHBondContact O-N 3.01Å; I174-S178 PolarHBondContact O-OG 3.38Å; I174-L212 HydrophobicContact CD1-CB 4.46Å; I174-L212 HydrophobicContact CD1-CD2 3.7Å; I174-L212 HydrophobicContact CD1-CG 3.59Å; I174-C216 HydrophobicContact CD1-CB 3.98Å
175	S	98.3	Very high	95.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.5	-49.6	-178.9	-65.3	0	0	0	0	112.2	A107 L171 L172 F173 S178 H179	A107-S175 VanDerWaalsContact CA-OG 3.28Å; A107-S175 WeakPolarHBondContact CA-OG 3.35Å; A107-S175 WeakPolarHBondContact O-CB 3.46Å; A107-S175 PolarHBondContact O-OG 3.47Å; L171-S175 WeakPolarHBondContact O-CB 3.17Å; L171-S175 PolarHBondContact O-N 3.37Å; L171-S175 VanDerWaalsContact O-N 3.11Å; L171-S175 PolarHBondContact O-OG 3.42Å; L171-S175 VanDerWaalsContact O-OG 3.08Å; L172-S175 PolarHBondContact O-N 3.14Å; F173-S175 VanDerWaalsContact C-N 3.33Å; F173-S175 PolarHBondContact O-N 3.12Å; S175-S178 PolarHBondContact O-OG 3.37Å; S175-H179 WeakPolarHBondContact O-CB 3.48Å; S175-H179 PolarHBondContact O-N 3.37Å
176	L	98.4	Very high	96.3	Very high	13 Å²	13	19.5 Å²	19.5	7%	0.068	10%	0.095	C	C	.	.	H	α-helix	trans	-71.9	-44.1	-178.8	-84.5	64.3	0	0	0	111.2	I114 I145 L148 L172 F173 H179 H180	I114-L176 HydrophobicContact CD1-CB 4.29Å; I114-L176 HydrophobicContact CD1-CD1 4Å; I114-L176 HydrophobicContact CD1-CG 3.79Å; I114-L176 HydrophobicContact CG1-CG 4.44Å; I145-L176 HydrophobicContact CD1-CB 4.05Å; I145-L176 HydrophobicContact CG1-CB 3.93Å; I145-L176 HydrophobicContact CG1-CD2 4.21Å; I145-L176 HydrophobicContact CG2-CB 4.25Å; L148-L176 HydrophobicContact CD1-CD2 3.81Å; L172-L176 HydrophobicContact CD1-CD1 3.49Å; L172-L176 VanDerWaalsContact CD1-CD1 3.49Å; L172-L176 HydrophobicContact CD1-CD2 4.48Å; L172-L176 HydrophobicContact CG-CD1 3.98Å; L172-L176 HydrophobicContact CG-CD2 4.46Å; L172-L176 VanDerWaalsContact O-CD1 3.29Å; L172-L176 WeakPolarHBondContact O-CD1 3.31Å; L172-L176 PolarHBondContact O-N 3.02Å; F173-L176 PolarHBondContact O-N 3.02Å; L176-H179 PolarHBondContact O-N 3.17Å; L176-H180 PolarHBondContact O-CD2 3.42Å; L176-H180 PolarHBondContact O-N 3.04Å
177	A	98.3	Very high	96.5	Very high	8 Å²	8	24.9 Å²	24.9	7%	0.066	12%	0.118	C	C	.	.	H	α-helix	trans	-62.6	-48.1	-178.9	0	0	0	0	0	111.1	F173 H179 H180 I181 L212	F173-A177 HydrophobicContact CD2-CB 4.44Å; F173-A177 HydrophobicContact CE1-CB 4.49Å; F173-A177 HydrophobicContact CE2-CB 4.13Å; F173-A177 HydrophobicContact CZ-CB 4.16Å; F173-A177 WeakPolarHBondContact O-CB 3.44Å; F173-A177 PolarHBondContact O-N 3.32Å; A177-H179 VanDerWaalsContact C-N 3.29Å; A177-H179 PolarHBondContact O-N 2.84Å; A177-H180 PolarHBondContact O-N 3.23Å; A177-I181 HydrophobicContact CB-CD1 4.38Å; A177-I181 WeakPolarHBondContact O-CB 3.36Å; A177-I181 VanDerWaalsContact O-CD1 3.28Å; A177-I181 WeakPolarHBondContact O-CD1 3.49Å; A177-I181 WeakPolarHBondContact O-CG1 3.36Å; A177-I181 PolarHBondContact O-N 3.25Å; A177-L212 HydrophobicContact CB-CD2 4.04Å
178	S	98.4	Very high	96.8	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.007	12%	0.115	C	C	.	.	H	α-helix	trans	-62.2	-38.9	179.9	67.2	0	0	0	0	112.2	I174 S175 R182	I174-S178 VanDerWaalsContact O-CB 3.28Å; I174-S178 WeakPolarHBondContact O-CB 3.46Å; I174-S178 PolarHBondContact O-N 3.01Å; I174-S178 PolarHBondContact O-OG 3.38Å; S175-S178 PolarHBondContact O-OG 3.37Å; S178-R182 PolarHBondContact O-N 2.89Å
179	H	98.3	Very high	97	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.5	-53.9	174.2	-178.4	112.3	0	0	0	111.1	H81 A111 I114 D115 H140 S175 L176 A177 I181 R182 D183	H81-H179 AromaticContact CG-CE1 3.93Å; H81-H179 AromaticContact CG-ND1 3.61Å; H81-H179 AromaticContact ND1-CE1 3.93Å; H81-H179 AromaticContact ND1-CG 3.74Å; H81-H179 AromaticContact ND1-ND1 3.51Å; A111-H179 PolarHBondContact O-ND1 3.25Å; I114-H179 HydrophobicContact CD1-CB 3.66Å; I114-H179 WeakPolarHBondContact CG2-NE2 3.2Å; D115-H179 IonicContact OD1-CE1 3.09Å; D115-H179 PolarHBondContact OD1-CE1 2.92Å; D115-H179 VanDerWaalsContact OD1-CE1 3.24Å; D115-H179 IonicContact OD1-NE2 2.98Å; D115-H179 IonicContact OD2-CE1 3.55Å; H140-H179 AromaticContact CD2-NE2 3.6Å; H140-H179 AromaticContact NE2-CE1 3.95Å; H140-H179 AromaticContact NE2-NE2 3.14Å; H140-H179 PolarHBondContact NE2-NE2 3.46Å; H140-H179 VanDerWaalsContact NE2-NE2 3.14Å; S175-H179 WeakPolarHBondContact O-CB 3.48Å; S175-H179 PolarHBondContact O-N 3.37Å; L176-H179 PolarHBondContact O-N 3.17Å; A177-H179 VanDerWaalsContact C-N 3.29Å; A177-H179 PolarHBondContact O-N 2.84Å; H179-I181 VanDerWaalsContact C-N 3.34Å; H179-I181 PolarHBondContact O-N 3.26Å; H179-R182 PolarHBondContact O-N 2.84Å; H179-D183 IonicContact NE2-OD2 3.24Å; H179-D183 PolarHBondContact O-N 3.5Å; H179-D183 VanDerWaalsContact O-N 3.09Å
180	H	98.4	Very high	97	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	13%	0.126	C	C	.	.	H	α-helix	trans	-66.1	-34.3	-177.3	-74.9	-135.4	0	0	0	113	L139 S142 I145 L176 A177 G184 L189	L139-H180 PolarHBondContact O-CE1 3.27Å; L139-H180 PolarHBondContact O-NE2 3.36Å; S142-H180 WeakPolarHBondContact CA-ND1 3.38Å; S142-H180 PolarHBondContact OG-ND1 2.98Å; I145-H180 HydrophobicContact CD1-CB 4.25Å; L176-H180 PolarHBondContact O-CD2 3.42Å; L176-H180 PolarHBondContact O-N 3.04Å; A177-H180 PolarHBondContact O-N 3.23Å; H180-G184 WeakPolarHBondContact O-CA 3.38Å; H180-G184 PolarHBondContact O-N 2.92Å; H180-L189 HydrophobicContact CB-CD2 4.07Å; H180-L189 WeakPolarHBondContact O-CD2 3.4Å
181	I	98.4	Very high	97	Very high	17 Å²	17	28.2 Å²	28.2	9%	0.087	13%	0.134	C	C	.	.	H	α-helix	trans	-63.8	-45.3	177.4	-73.5	157.6	0	0	0	110.4	A177 H179 G184 Y205 I208 L212	A177-I181 HydrophobicContact CB-CD1 4.38Å; A177-I181 WeakPolarHBondContact O-CB 3.36Å; A177-I181 VanDerWaalsContact O-CD1 3.28Å; A177-I181 WeakPolarHBondContact O-CD1 3.49Å; A177-I181 WeakPolarHBondContact O-CG1 3.36Å; A177-I181 PolarHBondContact O-N 3.25Å; H179-I181 VanDerWaalsContact C-N 3.34Å; H179-I181 PolarHBondContact O-N 3.26Å; I181-G184 PolarHBondContact O-N 3.1Å; I181-Y205 HydrophobicContact CG2-CD2 4.2Å; I181-I208 HydrophobicContact CD1-CG2 3.39Å; I181-I208 HydrophobicContact CG1-CG2 4.03Å; I181-I208 HydrophobicContact CG2-CB 4.14Å; I181-I208 HydrophobicContact CG2-CG2 3.95Å; I181-L212 HydrophobicContact CD1-CD1 4.39Å; I181-L212 HydrophobicContact CD1-CD2 3.83Å
182	R	97.8	Very high	96.8	Very high	11 Å²	11	31.1 Å²	31.1	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-47	177.4	178.7	164.9	179	-113.7	-3.5	111.7	D58 D77 V80 H81 S178 H179 G184 V185 Y205	D58-R182 IonicContact OD1-NE 3.87Å; D58-R182 IonicContact OD1-NH2 3.57Å; D77-R182 PolarHBondContact O-NH1 3.49Å; D77-R182 IonicContact OD1-CZ 3.9Å; D77-R182 VanDerWaalsContact OD1-CZ 3.24Å; D77-R182 IonicContact OD1-NH1 2.97Å; D77-R182 PolarHBondContact OD1-NH1 3.41Å; D77-R182 VanDerWaalsContact OD1-NH1 3.15Å; D77-R182 IonicContact OD1-NH2 2.82Å; D77-R182 PolarHBondContact OD1-NH2 3.08Å; V80-R182 VanDerWaalsContact CB-NH1 3.33Å; H81-R182 PolarHBondContact CD2-NH1 2.87Å; H81-R182 PolarHBondContact NE2-NH1 3.32Å; H81-R182 VanDerWaalsContact NE2-NH1 3.11Å; S178-R182 PolarHBondContact O-N 2.89Å; H179-R182 PolarHBondContact O-N 2.84Å; R182-G184 PolarHBondContact O-N 2.72Å; R182-V185 WeakPolarHBondContact O-CB 3.49Å; R182-V185 WeakPolarHBondContact O-CG2 3.47Å; R182-V185 PolarHBondContact O-N 3.01Å; R182-Y205 HydrophobicContact CB-CD2 4.31Å; R182-Y205 HydrophobicContact CB-CE2 3.98Å; R182-Y205 HydrophobicContact CG-CE2 4.04Å
183	D	97.1	Very high	96.6	Very high	16 Å²	16	35 Å²	35	9%	0.086	18%	0.181	C	C	.	.	H	α-helix	trans	-68	-25.3	178.1	-98.7	5.1	0	0	0	113.9	H81 H140 H179 V185 R186	H81-D183 IonicContact CE1-OD1 3.66Å; H81-D183 IonicContact NE2-OD1 3.65Å; H140-D183 IonicContact CD2-OD2 3.54Å; H140-D183 IonicContact NE2-OD2 2.78Å; H179-D183 IonicContact NE2-OD2 3.24Å; H179-D183 PolarHBondContact O-N 3.5Å; H179-D183 VanDerWaalsContact O-N 3.09Å; D183-V185 PolarHBondContact O-N 2.89Å; D183-V185 VanDerWaalsContact O-N 3.11Å; D183-R186 PolarHBondContact O-N 3.41Å; D183-R186 VanDerWaalsContact O-N 3.1Å; D183-R186 IonicContact OD1-CZ 3.66Å; D183-R186 IonicContact OD1-NH2 3.86Å; D183-R186 PolarHBondContact OD1-NH2 3.11Å
184	G	96.8	Very high	96.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-18.9	174.8	0	0	0	0	0	113.7	H180 I181 R182 R186 G188 P199 I200	H180-G184 WeakPolarHBondContact O-CA 3.38Å; H180-G184 PolarHBondContact O-N 2.92Å; I181-G184 PolarHBondContact O-N 3.1Å; R182-G184 PolarHBondContact O-N 2.72Å; G184-R186 VanDerWaalsContact C-N 3.26Å; G184-R186 PolarHBondContact O-N 3.3Å; G184-G188 VanDerWaalsContact O-CA 3.23Å; G184-G188 WeakPolarHBondContact O-CA 3.45Å; G184-G188 PolarHBondContact O-N 3.25Å; G184-P199 WeakPolarHBondContact O-CA 3.46Å; G184-I200 PolarHBondContact O-N 3.37Å
185	V	96.8	Very high	96.2	Very high	45 Å²	45	42.5 Å²	42.5	27%	0.273	22%	0.222	S	C	.	.	H	α-helix	trans	-62.9	-33	174.7	179.2	0	0	0	0	112	R182 D183 P199 Y205	R182-V185 WeakPolarHBondContact O-CB 3.49Å; R182-V185 WeakPolarHBondContact O-CG2 3.47Å; R182-V185 PolarHBondContact O-N 3.01Å; D183-V185 PolarHBondContact O-N 2.89Å; D183-V185 VanDerWaalsContact O-N 3.11Å; V185-P199 WeakPolarHBondContact O-CB 3.35Å; V185-Y205 VanDerWaalsContact CG2-CB 3.45Å; V185-Y205 HydrophobicContact CG2-CD1 3.62Å; V185-Y205 HydrophobicContact CG2-CD2 4.4Å; V185-Y205 HydrophobicContact CG2-CE1 4.47Å; V185-Y205 HydrophobicContact CG2-CG 3.56Å
186	R	92.5	Very high	96	Very high	107 Å²	107	47.4 Å²	47.4	40%	0.404	25%	0.248	S	C	.	.	H	α-helix	trans	-88.2	-44.7	-177.8	-68.8	-178.9	-88.5	-160	-9.2	112.6	D77 D183 G184	D77-R186 IonicContact OD1-NH2 3.57Å; D77-R186 IonicContact OD2-CZ 3.24Å; D77-R186 IonicContact OD2-NH1 3.89Å; D77-R186 IonicContact OD2-NH2 3.99Å; D77-R186 PolarHBondContact OD2-NH2 3.37Å; D183-R186 PolarHBondContact O-N 3.41Å; D183-R186 VanDerWaalsContact O-N 3.1Å; D183-R186 IonicContact OD1-CZ 3.66Å; D183-R186 IonicContact OD1-NH2 3.86Å; D183-R186 PolarHBondContact OD1-NH2 3.11Å; G184-R186 VanDerWaalsContact C-N 3.26Å; G184-R186 PolarHBondContact O-N 3.3Å
187	H	90.1	Very high	95.9	Very high	130 Å²	130	49.7 Å²	49.7	60%	0.602	26%	0.262	S	S	*	.	H	α-helix	trans	-127.9	0.7	-166.7	-60.1	-63.1	0	0	0	114.5
188	G	96.3	Very high	95.8	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.			trans	71	-179.2	-170.1	0	0	0	0	0	113	R136 G184 A198	R136-G188 PolarHBondContact NH1-O 2.92Å; G184-G188 VanDerWaalsContact O-CA 3.23Å; G184-G188 WeakPolarHBondContact O-CA 3.45Å; G184-G188 PolarHBondContact O-N 3.25Å; G188-A198 WeakPolarHBondContact CA-O 3.35Å
189	L	97.2	Very high	95.8	Very high	47 Å²	47	56.9 Å²	56.9	25%	0.246	32%	0.315	C	S	.	.			trans	-86.1	134.3	175.7	-60.2	178	0	0	0	109.5	H180 V191 N196 T197 I200	H180-L189 HydrophobicContact CB-CD2 4.07Å; H180-L189 WeakPolarHBondContact O-CD2 3.4Å; L189-V191 HydrophobicContact CB-CG2 4.39Å; L189-V191 PolarHBondContact O-N 2.73Å; L189-N196 CarbonylContact O-C 3.27Å; L189-N196 WeakPolarHBondContact O-CA 3.4Å; L189-T197 HydrophobicContact CB-CG2 4.11Å; L189-T197 PolarHBondContact N-OG1 3.34Å; L189-T197 PolarHBondContact O-N 2.82Å; L189-I200 HydrophobicContact CD1-CD1 4.4Å; L189-I200 HydrophobicContact CD2-CD1 4.11Å; L189-I200 HydrophobicContact CG-CD1 4.06Å
190	W	96.9	Very high	95.7	Very high	64 Å²	64	57.7 Å²	57.7	24%	0.242	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	105	174.8	178	24.6	0	0	0	110	R136 P137 C141 S142 S143 N196	R136-W190 HydrophobicContact CB-CE3 4.2Å; R136-W190 HydrophobicContact CB-CZ3 4.35Å; R136-W190 HydrophobicContact CG-CE3 4.15Å; P137-W190 WeakPolarHBondContact O-CZ3 3.32Å; C141-W190 VanDerWaalsContact CA-CE3 3.42Å; C141-W190 HydrophobicContact CB-CD2 3.9Å; C141-W190 HydrophobicContact CB-CE3 3.47Å; C141-W190 VanDerWaalsContact CB-CE3 3.47Å; C141-W190 HydrophobicContact CB-CH2 4.23Å; C141-W190 HydrophobicContact CB-CZ3 3.66Å; S142-W190 WeakPolarHBondContact CA-O 3.5Å; S142-W190 WeakPolarHBondContact CB-O 3.49Å; S142-W190 PolarHBondContact N-O 3.39Å; S143-W190 PolarHBondContact N-O 3.28Å; W190-N196 WeakPolarHBondContact CA-OD1 3.31Å; W190-N196 WeakPolarHBondContact CB-OD1 3.36Å
191	V	95.9	Very high	95.7	Very high	50 Å²	50	61.1 Å²	61.1	30%	0.303	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	81.5	-179.2	-167.1	0	0	0	0	109	S143 L189 F194 G195 T197	S143-V191 VanDerWaalsContact OG-C 3.31Å; S143-V191 WeakPolarHBondContact OG-CA 3.12Å; L189-V191 HydrophobicContact CB-CG2 4.39Å; L189-V191 PolarHBondContact O-N 2.73Å; V191-F194 HydrophobicContact CG1-CD2 4.03Å; V191-F194 CarbonylContact O-C 3.57Å; V191-F194 VanDerWaalsContact O-CA 3.27Å; V191-F194 WeakPolarHBondContact O-CA 3.29Å; V191-F194 WeakPolarHBondContact O-CB 3.47Å; V191-F194 PolarHBondContact O-N 2.82Å; V191-G195 CarbonylContact C-O 3.44Å; V191-G195 WeakPolarHBondContact CA-O 3.32Å; V191-G195 PolarHBondContact N-O 3Å; V191-G195 PolarHBondContact O-N 3.24Å; V191-T197 HydrophobicContact CG2-CG2 4Å
192	C	93.4	Very high	95.7	Very high	61 Å²	61	63.3 Å²	63.3	41%	0.412	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	139.1	174	-175.4	0	0	0	0	111.1	C141 S143	C141-C192 WeakPolarHBondContact SG-CB 3.28Å; S143-C192 WeakPolarHBondContact CB-O 3.47Å; S143-C192 PolarHBondContact OG-N 2.94Å; S143-C192 PolarHBondContact OG-O 3.33Å
193	P	93.9	Very high	95.7	Very high	111 Å²	111	71.1 Å²	71.1	72%	0.721	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.2	6.6	-1.6	36.3	-36.2	0	0	0	114.7	G195	P193-G195 VanDerWaalsContact C-N 3.31Å; P193-G195 PolarHBondContact O-N 2.7Å
194	F	93.9	Very high	95.7	Very high	182 Å²	182	74.6 Å²	74.6	80%	0.798	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-9.8	-174.4	-52.6	-74.8	0	0	0	115.1	V191	V191-F194 HydrophobicContact CG1-CD2 4.03Å; V191-F194 CarbonylContact O-C 3.57Å; V191-F194 VanDerWaalsContact O-CA 3.27Å; V191-F194 WeakPolarHBondContact O-CA 3.29Å; V191-F194 WeakPolarHBondContact O-CB 3.47Å; V191-F194 PolarHBondContact O-N 2.82Å
195	G	93.1	Very high	95.8	Very high	28 Å²	28	74.6 Å²	74.6	29%	0.289	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	99.2	-150.9	176.7	0	0	0	0	0	113.2	V191 P193	V191-G195 CarbonylContact C-O 3.44Å; V191-G195 WeakPolarHBondContact CA-O 3.32Å; V191-G195 PolarHBondContact N-O 3Å; V191-G195 PolarHBondContact O-N 3.24Å; P193-G195 VanDerWaalsContact C-N 3.31Å; P193-G195 PolarHBondContact O-N 2.7Å
196	N	94.1	Very high	95.8	Very high	103 Å²	103	73.1 Å²	73.1	55%	0.551	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	142.9	179.9	-62.8	-64.3	0	0	0	110.9	L189 W190	L189-N196 CarbonylContact O-C 3.27Å; L189-N196 WeakPolarHBondContact O-CA 3.4Å; W190-N196 WeakPolarHBondContact CA-OD1 3.31Å; W190-N196 WeakPolarHBondContact CB-OD1 3.36Å
197	T	96.3	Very high	96.1	Very high	60 Å²	60	71.2 Å²	71.2	37%	0.368	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-71.8	169.1	165.3	70.7	0	0	0	0	110.4	L189 V191	L189-T197 HydrophobicContact CB-CG2 4.11Å; L189-T197 PolarHBondContact N-OG1 3.34Å; L189-T197 PolarHBondContact O-N 2.82Å; V191-T197 HydrophobicContact CG2-CG2 4Å
198	A	96.7	Very high	96.5	Very high	78 Å²	78	67.5 Å²	67.5	65%	0.645	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-58.5	152.5	163.2	0	0	0	0	0	110.7	G188 I200	G188-A198 WeakPolarHBondContact CA-O 3.35Å; A198-I200 PolarHBondContact O-N 3.07Å
199	P	97.6	Very high	96.6	Very high	82 Å²	82	67.5 Å²	67.5	53%	0.532	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-52.7	137.2	170.6	-26.2	35.1	0	0	0	111.7	G184 V185 S201	G184-P199 WeakPolarHBondContact O-CA 3.46Å; V185-P199 WeakPolarHBondContact O-CB 3.35Å; P199-S201 PolarHBondContact O-N 3.25Å
200	I	97.4	Very high	96.6	Very high	18 Å²	18	66 Å²	66	9%	0.092	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-70.3	130	179.3	-57.5	179.7	0	0	0	108	G184 L189 A198 L204	G184-I200 PolarHBondContact O-N 3.37Å; L189-I200 HydrophobicContact CD1-CD1 4.4Å; L189-I200 HydrophobicContact CD2-CD1 4.11Å; L189-I200 HydrophobicContact CG-CD1 4.06Å; A198-I200 PolarHBondContact O-N 3.07Å; I200-L204 HydrophobicContact CG2-CB 4.05Å; I200-L204 HydrophobicContact CG2-CD2 4.05Å; I200-L204 HydrophobicContact CG2-CG 3.98Å
201	S	97.6	Very high	96.7	Very high	74 Å²	74	67 Å²	67	52%	0.517	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-62.3	143.6	175.6	69.3	0	0	0	0	110.3	P199 W203 L204 Y205	P199-S201 PolarHBondContact O-N 3.25Å; S201-W203 PolarHBondContact O-N 2.73Å; S201-L204 WeakPolarHBondContact O-CA 3.39Å; S201-L204 WeakPolarHBondContact O-CB 3.42Å; S201-L204 PolarHBondContact O-N 3.18Å; S201-L204 WeakPolarHBondContact OG-CB 3.37Å; S201-Y205 PolarHBondContact O-N 3.49Å
202	Y	97.6	Very high	96.7	Very high	63 Å²	63	65.1 Å²	65.1	25%	0.247	37%	0.372	C	S	.	.	H	α-helix	trans	-53.7	-51.4	-170.9	-177.5	-105.2	0	0	0	112.9	V55 D58 L204 Y205 V206	V55-Y202 WeakPolarHBondContact CA-OH 3.38Å; D58-Y202 HydrophobicContact CB-CE2 4.24Å; D58-Y202 WeakPolarHBondContact OD2-CE2 3.46Å; D58-Y202 PolarHBondContact OD2-OH 2.81Å; Y202-L204 VanDerWaalsContact C-N 3.28Å; Y202-L204 PolarHBondContact O-N 2.89Å; Y202-Y205 AromaticContact CD2-CD1 3.97Å; Y202-Y205 HydrophobicContact CD2-CD1 3.97Å; Y202-Y205 HydrophobicContact CD2-CE1 4.09Å; Y202-Y205 HydrophobicContact CE2-CD1 4.06Å; Y202-Y205 AromaticContact CE2-CE1 3.69Å; Y202-Y205 HydrophobicContact CE2-CE1 3.69Å; Y202-Y205 WeakPolarHBondContact O-CB 3.48Å; Y202-Y205 WeakPolarHBondContact O-CD1 3.41Å; Y202-Y205 PolarHBondContact O-N 3.29Å; Y202-V206 HydrophobicContact CE1-CG2 4.17Å; Y202-V206 PolarHBondContact O-N 3.32Å; Y202-V206 VanDerWaalsContact O-N 3.14Å
203	W	98	Very high	96.9	Very high	175 Å²	175	62.2 Å²	62.2	66%	0.663	35%	0.353	S	S	*	.	H	α-helix	trans	-65.6	-31.8	179	-63.4	115.8	0	0	0	113	V55 S201 V206 S207	V55-W203 HydrophobicContact CG2-CZ3 4.14Å; S201-W203 PolarHBondContact O-N 2.73Å; W203-V206 PolarHBondContact O-N 2.99Å; W203-S207 WeakPolarHBondContact O-CB 3.3Å; W203-S207 PolarHBondContact O-N 3.48Å; W203-S207 PolarHBondContact O-OG 2.76Å
204	L	97.8	Very high	97	Very high	88 Å²	88	57.5 Å²	57.5	46%	0.461	32%	0.321	S	S	.	.	H	α-helix	trans	-65.3	-41.5	174.4	-179.1	61.5	0	0	0	111.2	I200 S201 Y202 S207 I208	I200-L204 HydrophobicContact CG2-CB 4.05Å; I200-L204 HydrophobicContact CG2-CD2 4.05Å; I200-L204 HydrophobicContact CG2-CG 3.98Å; S201-L204 WeakPolarHBondContact O-CA 3.39Å; S201-L204 WeakPolarHBondContact O-CB 3.42Å; S201-L204 PolarHBondContact O-N 3.18Å; S201-L204 WeakPolarHBondContact OG-CB 3.37Å; Y202-L204 VanDerWaalsContact C-N 3.28Å; Y202-L204 PolarHBondContact O-N 2.89Å; L204-S207 PolarHBondContact O-N 3.47Å; L204-I208 HydrophobicContact CD1-CD1 3.79Å; L204-I208 HydrophobicContact CD1-CG1 3.97Å; L204-I208 HydrophobicContact CD2-CD1 4.43Å; L204-I208 HydrophobicContact CG-CD1 3.69Å; L204-I208 HydrophobicContact CG-CG1 4.29Å; L204-I208 WeakPolarHBondContact O-CB 3.35Å; L204-I208 WeakPolarHBondContact O-CG1 3.44Å; L204-I208 PolarHBondContact O-N 2.83Å
205	Y	97.9	Very high	97	Very high	1 Å²	1	53.3 Å²	53.3	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-59	-48	173.7	129.6	-108.6	0	0	0	111.6	C54 D58 I181 R182 V185 S201 Y202 S207 I208 T209	C54-Y205 HydrophobicContact CB-CE2 4.41Å; C54-Y205 VanDerWaalsContact CB-OH 3.26Å; C54-Y205 WeakPolarHBondContact CB-OH 3.16Å; D58-Y205 WeakPolarHBondContact OD2-CE1 3.43Å; D58-Y205 VanDerWaalsContact OD2-CZ 3.31Å; D58-Y205 PolarHBondContact OD2-OH 2.94Å; I181-Y205 HydrophobicContact CG2-CD2 4.2Å; R182-Y205 HydrophobicContact CB-CD2 4.31Å; R182-Y205 HydrophobicContact CB-CE2 3.98Å; R182-Y205 HydrophobicContact CG-CE2 4.04Å; V185-Y205 VanDerWaalsContact CG2-CB 3.45Å; V185-Y205 HydrophobicContact CG2-CD1 3.62Å; V185-Y205 HydrophobicContact CG2-CD2 4.4Å; V185-Y205 HydrophobicContact CG2-CE1 4.47Å; V185-Y205 HydrophobicContact CG2-CG 3.56Å; S201-Y205 PolarHBondContact O-N 3.49Å; Y202-Y205 AromaticContact CD2-CD1 3.97Å; Y202-Y205 HydrophobicContact CD2-CD1 3.97Å; Y202-Y205 HydrophobicContact CD2-CE1 4.09Å; Y202-Y205 HydrophobicContact CE2-CD1 4.06Å; Y202-Y205 AromaticContact CE2-CE1 3.69Å; Y202-Y205 HydrophobicContact CE2-CE1 3.69Å; Y202-Y205 WeakPolarHBondContact O-CB 3.48Å; Y202-Y205 WeakPolarHBondContact O-CD1 3.41Å; Y202-Y205 PolarHBondContact O-N 3.29Å; Y205-S207 PolarHBondContact O-N 3.01Å; Y205-I208 PolarHBondContact O-N 2.85Å; Y205-T209 WeakPolarHBondContact CD2-OG1 3.34Å; Y205-T209 WeakPolarHBondContact O-CB 3.4Å; Y205-T209 PolarHBondContact O-N 2.85Å; Y205-T209 PolarHBondContact O-OG1 3.19Å
206	V	98.5	Very high	97.1	Very high	13 Å²	13	52 Å²	52	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-62.5	-46.2	-179.3	177.1	0	0	0	0	110.1	C54 V55 Y202 W203 T209 A210	C54-V206 HydrophobicContact CB-CG2 4.44Å; V55-V206 HydrophobicContact CG2-CG1 4.23Å; V55-V206 HydrophobicContact CG2-CG2 4.16Å; Y202-V206 HydrophobicContact CE1-CG2 4.17Å; Y202-V206 PolarHBondContact O-N 3.32Å; Y202-V206 VanDerWaalsContact O-N 3.14Å; W203-V206 PolarHBondContact O-N 2.99Å; V206-T209 PolarHBondContact O-N 3.06Å; V206-A210 WeakPolarHBondContact O-CB 3.4Å; V206-A210 PolarHBondContact O-N 3.32Å
207	S	98.3	Very high	96.9	Very high	68 Å²	68	47.2 Å²	47.2	48%	0.476	27%	0.267	S	S	.	.	H	α-helix	trans	-63.1	-43.8	177.9	-63.8	0	0	0	0	112.5	W203 L204 Y205 T211	W203-S207 WeakPolarHBondContact O-CB 3.3Å; W203-S207 PolarHBondContact O-N 3.48Å; W203-S207 PolarHBondContact O-OG 2.76Å; L204-S207 PolarHBondContact O-N 3.47Å; Y205-S207 PolarHBondContact O-N 3.01Å; S207-T211 WeakPolarHBondContact O-CB 3.4Å; S207-T211 WeakPolarHBondContact O-CG2 3.28Å; S207-T211 PolarHBondContact O-N 3.08Å; S207-T211 PolarHBondContact O-OG1 3.44Å
208	I	98.2	Very high	96.6	Very high	52 Å²	52	46 Å²	46	27%	0.267	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-49.3	176.4	-67.3	168.3	0	0	0	109.4	I181 L204 Y205 A210 T211 L212	I181-I208 HydrophobicContact CD1-CG2 3.39Å; I181-I208 HydrophobicContact CG1-CG2 4.03Å; I181-I208 HydrophobicContact CG2-CB 4.14Å; I181-I208 HydrophobicContact CG2-CG2 3.95Å; L204-I208 HydrophobicContact CD1-CD1 3.79Å; L204-I208 HydrophobicContact CD1-CG1 3.97Å; L204-I208 HydrophobicContact CD2-CD1 4.43Å; L204-I208 HydrophobicContact CG-CD1 3.69Å; L204-I208 HydrophobicContact CG-CG1 4.29Å; L204-I208 WeakPolarHBondContact O-CB 3.35Å; L204-I208 WeakPolarHBondContact O-CG1 3.44Å; L204-I208 PolarHBondContact O-N 2.83Å; Y205-I208 PolarHBondContact O-N 2.85Å; I208-A210 VanDerWaalsContact C-N 3.31Å; I208-A210 PolarHBondContact O-N 3.18Å; I208-T211 PolarHBondContact O-N 2.85Å; I208-T211 VanDerWaalsContact O-N 3.11Å; I208-T211 PolarHBondContact O-OG1 2.95Å; I208-L212 WeakPolarHBondContact O-CB 3.39Å; I208-L212 PolarHBondContact O-N 3.34Å
209	T	98.3	Very high	96.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-41.6	-178.7	-55.5	0	0	0	0	112.1	L50 I84 Y205 V206 P213	L50-T209 HydrophobicContact CD2-CG2 4.4Å; L50-T209 HydrophobicContact CG-CG2 4.42Å; I84-T209 HydrophobicContact CG2-CG2 3.62Å; Y205-T209 WeakPolarHBondContact CD2-OG1 3.34Å; Y205-T209 WeakPolarHBondContact O-CB 3.4Å; Y205-T209 PolarHBondContact O-N 2.85Å; Y205-T209 PolarHBondContact O-OG1 3.19Å; V206-T209 PolarHBondContact O-N 3.06Å; T209-P213 WeakPolarHBondContact O-CD 3.49Å
210	A	98	Very high	95.9	Very high	16 Å²	16	41.3 Å²	41.3	13%	0.132	22%	0.219	C	C	.	.	H	α-helix	trans	-68.9	-31.4	177.4	0	0	0	0	0	113.3	S47 V206 I208	S47-A210 VanDerWaalsContact CB-O 3.3Å; S47-A210 WeakPolarHBondContact CB-O 3.46Å; S47-A210 PolarHBondContact OG-O 3.47Å; V206-A210 WeakPolarHBondContact O-CB 3.4Å; V206-A210 PolarHBondContact O-N 3.32Å; I208-A210 VanDerWaalsContact C-N 3.31Å; I208-A210 PolarHBondContact O-N 3.18Å
211	T	97.4	Very high	95.3	Very high	84 Å²	84	41.7 Å²	41.7	52%	0.515	22%	0.22	S	C	.	.	H	α-helix	trans	-96.4	-20.3	-176.1	55.9	0	0	0	0	114	S207 I208 P213 H214 L215	S207-T211 WeakPolarHBondContact O-CB 3.4Å; S207-T211 WeakPolarHBondContact O-CG2 3.28Å; S207-T211 PolarHBondContact O-N 3.08Å; S207-T211 PolarHBondContact O-OG1 3.44Å; I208-T211 PolarHBondContact O-N 2.85Å; I208-T211 VanDerWaalsContact O-N 3.11Å; I208-T211 PolarHBondContact O-OG1 2.95Å; T211-P213 VanDerWaalsContact C-CD 3.45Å; T211-H214 PolarHBondContact O-N 3.04Å; T211-H214 VanDerWaalsContact O-N 3.1Å; T211-L215 PolarHBondContact O-N 3.17Å; T211-L215 VanDerWaalsContact O-N 3.08Å
212	L	97.6	Very high	94.7	Very high	10 Å²	10	44.1 Å²	44.1	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-54.4	-41.4	-178.1	-176.7	71.8	0	0	0	113.6	F173 I174 A177 I181 I208 H214 L215 C216	F173-L212 HydrophobicContact CE1-CD1 4.11Å; F173-L212 HydrophobicContact CZ-CD1 4.27Å; I174-L212 HydrophobicContact CD1-CB 4.46Å; I174-L212 HydrophobicContact CD1-CD2 3.7Å; I174-L212 HydrophobicContact CD1-CG 3.59Å; A177-L212 HydrophobicContact CB-CD2 4.04Å; I181-L212 HydrophobicContact CD1-CD1 4.39Å; I181-L212 HydrophobicContact CD1-CD2 3.83Å; I208-L212 WeakPolarHBondContact O-CB 3.39Å; I208-L212 PolarHBondContact O-N 3.34Å; L212-H214 VanDerWaalsContact C-N 3.34Å; L212-H214 PolarHBondContact O-N 2.7Å; L212-L215 PolarHBondContact O-N 3.33Å; L212-C216 WeakPolarHBondContact O-CB 3.3Å; L212-C216 PolarHBondContact O-N 2.98Å
213	P	97.1	Very high	94	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60	-41.6	176.4	-26	36.4	0	0	0	113.1	L50 I91 V92 T209 T211 C216 S217	L50-P213 HydrophobicContact CD2-CG 4.34Å; I91-P213 HydrophobicContact CB-CB 3.77Å; I91-P213 HydrophobicContact CB-CG 4.33Å; I91-P213 HydrophobicContact CD1-CG 4.24Å; I91-P213 HydrophobicContact CG2-CB 3.55Å; I91-P213 HydrophobicContact CG2-CG 4.36Å; V92-P213 HydrophobicContact CG2-CB 3.95Å; V92-P213 WeakPolarHBondContact CG2-O 3.48Å; T209-P213 WeakPolarHBondContact O-CD 3.49Å; T211-P213 VanDerWaalsContact C-CD 3.45Å; P213-C216 PolarHBondContact O-N 3.24Å; P213-S217 WeakPolarHBondContact O-CB 3.4Å; P213-S217 PolarHBondContact O-N 3.46Å
214	H	94.8	Very high	93.1	Very high	13 Å²	13	36.6 Å²	36.6	6%	0.06	21%	0.211	C	C	.	.	H	α-helix	trans	-69.2	-41.6	178.6	-59.1	-73.6	0	0	0	111.4	T38 F39 S43 S47 T211 L212 C216 S217 V218	T38-H214 HydrophobicContact CG2-CB 4.36Å; T38-H214 PolarHBondContact O-CE1 3.1Å; T38-H214 PolarHBondContact O-ND1 3.24Å; F39-H214 HydrophobicContact CE1-CB 3.86Å; F39-H214 HydrophobicContact CZ-CB 4.31Å; S43-H214 PolarHBondContact OG-CE1 3.48Å; S43-H214 PolarHBondContact OG-ND1 3.03Å; S47-H214 VanDerWaalsContact CB-NE2 3.32Å; S47-H214 WeakPolarHBondContact CB-NE2 3.32Å; S47-H214 PolarHBondContact OG-CD2 3.49Å; S47-H214 PolarHBondContact OG-CE1 3.4Å; S47-H214 PolarHBondContact OG-NE2 3.25Å; T211-H214 PolarHBondContact O-N 3.04Å; T211-H214 VanDerWaalsContact O-N 3.1Å; L212-H214 VanDerWaalsContact C-N 3.34Å; L212-H214 PolarHBondContact O-N 2.7Å; H214-C216 VanDerWaalsContact C-N 3.34Å; H214-C216 PolarHBondContact O-N 3.29Å; H214-S217 WeakPolarHBondContact O-CB 3.34Å; H214-S217 PolarHBondContact O-N 2.91Å; H214-V218 WeakPolarHBondContact O-CG2 3.27Å; H214-V218 PolarHBondContact O-N 2.93Å
215	L	94.7	Very high	92.2	Very high	94 Å²	94	32.9 Å²	32.9	49%	0.492	19%	0.192	S	C	.	.	H	α-helix	trans	-59.1	-47.5	173.8	177.8	61.3	0	0	0	110.8	T211 L212 S217 V218 L219	T211-L215 PolarHBondContact O-N 3.17Å; T211-L215 VanDerWaalsContact O-N 3.08Å; L212-L215 PolarHBondContact O-N 3.33Å; L215-S217 VanDerWaalsContact C-N 3.32Å; L215-S217 PolarHBondContact O-N 3.31Å; L215-V218 PolarHBondContact O-N 3.28Å; L215-L219 HydrophobicContact CD1-CD1 4.22Å; L215-L219 HydrophobicContact CD1-CG 4.22Å; L215-L219 HydrophobicContact CG-CD1 4.08Å; L215-L219 HydrophobicContact CG-CG 4.49Å; L215-L219 VanDerWaalsContact O-CG 3.29Å; L215-L219 WeakPolarHBondContact O-CG 3.25Å; L215-L219 PolarHBondContact O-N 2.89Å
216	C	94.9	Very high	90.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58	-45.4	176.1	-175.7	0	0	0	0	111.4	V92 I174 L212 P213 H214 V218 L219 M220	V92-C216 HydrophobicContact CG2-CB 4.02Å; I174-C216 HydrophobicContact CD1-CB 3.98Å; L212-C216 WeakPolarHBondContact O-CB 3.3Å; L212-C216 PolarHBondContact O-N 2.98Å; P213-C216 PolarHBondContact O-N 3.24Å; H214-C216 VanDerWaalsContact C-N 3.34Å; H214-C216 PolarHBondContact O-N 3.29Å; C216-V218 PolarHBondContact O-N 2.91Å; C216-L219 PolarHBondContact O-N 3.17Å; C216-M220 WeakPolarHBondContact O-CB 3.47Å; C216-M220 VanDerWaalsContact O-CG 3.29Å; C216-M220 WeakPolarHBondContact O-CG 3.25Å; C216-M220 PolarHBondContact O-N 2.94Å
217	S	90.9	Very high	89.2	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-57.6	-47.1	175.4	178.6	0	0	0	0	112.7	T38 P213 H214 L215 L219 M220 Y221 R226	T38-S217 VanDerWaalsContact CG2-CB 3.44Å; T38-S217 WeakPolarHBondContact CG2-OG 3.42Å; T38-S217 PolarHBondContact OG1-OG 2.8Å; P213-S217 WeakPolarHBondContact O-CB 3.4Å; P213-S217 PolarHBondContact O-N 3.46Å; H214-S217 WeakPolarHBondContact O-CB 3.34Å; H214-S217 PolarHBondContact O-N 2.91Å; L215-S217 VanDerWaalsContact C-N 3.32Å; L215-S217 PolarHBondContact O-N 3.31Å; S217-L219 PolarHBondContact O-N 3.26Å; S217-M220 PolarHBondContact O-N 3.31Å; S217-Y221 WeakPolarHBondContact O-CB 3.5Å; S217-Y221 PolarHBondContact O-N 3.49Å; S217-R226 PolarHBondContact OG-NH1 2.98Å
218	V	89.4	Confident	87.5	Confident	34 Å²	34	36.6 Å²	36.6	21%	0.206	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-42.3	177	170.9	0	0	0	0	111.1	L35 T38 F39 H214 L215 C216 Y221 L222	L35-V218 HydrophobicContact CD2-CG2 4.3Å; T38-V218 HydrophobicContact CG2-CG2 4.26Å; F39-V218 HydrophobicContact CE2-CG2 4.05Å; F39-V218 HydrophobicContact CZ-CG2 4.1Å; H214-V218 WeakPolarHBondContact O-CG2 3.27Å; H214-V218 PolarHBondContact O-N 2.93Å; L215-V218 PolarHBondContact O-N 3.28Å; C216-V218 PolarHBondContact O-N 2.91Å; V218-Y221 WeakPolarHBondContact O-CB 3.25Å; V218-Y221 PolarHBondContact O-N 3.46Å; V218-L222 HydrophobicContact CG1-CD1 4.12Å; V218-L222 HydrophobicContact CG1-CG 4.39Å; V218-L222 WeakPolarHBondContact O-CG 3.21Å; V218-L222 PolarHBondContact O-N 3.22Å
219	L	90.5	Very high	86	Confident	61 Å²	61	36.5 Å²	36.5	32%	0.319	20%	0.204	S	C	.	.	H	α-helix	trans	-67.9	-39.4	178	-66.7	174	0	0	0	112.5	W170 L215 C216 S217 Y221 L222 T223	W170-L219 HydrophobicContact CH2-CB 3.55Å; W170-L219 HydrophobicContact CZ3-CB 3.58Å; W170-L219 HydrophobicContact CZ3-CD1 4.25Å; L215-L219 HydrophobicContact CD1-CD1 4.22Å; L215-L219 HydrophobicContact CD1-CG 4.22Å; L215-L219 HydrophobicContact CG-CD1 4.08Å; L215-L219 HydrophobicContact CG-CG 4.49Å; L215-L219 VanDerWaalsContact O-CG 3.29Å; L215-L219 WeakPolarHBondContact O-CG 3.25Å; L215-L219 PolarHBondContact O-N 2.89Å; C216-L219 PolarHBondContact O-N 3.17Å; S217-L219 PolarHBondContact O-N 3.26Å; L219-Y221 PolarHBondContact O-N 2.92Å; L219-L222 PolarHBondContact O-N 2.89Å; L219-T223 WeakPolarHBondContact O-CB 3.41Å; L219-T223 WeakPolarHBondContact O-CG2 3.42Å; L219-T223 PolarHBondContact O-N 3.28Å; L219-T223 PolarHBondContact O-OG1 3.31Å
220	M	89.8	Confident	84.1	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-38.2	172.4	-76.2	177.2	72.2	0	0	111.5	W89 V92 W170 C216 S217 T223 G224 T225 R226 I229	W89-M220 HydrophobicContact CH2-CE 4.18Å; W89-M220 HydrophobicContact CH2-SD 4.24Å; W89-M220 HydrophobicContact CZ3-SD 4.26Å; V92-M220 HydrophobicContact CG1-CE 4.44Å; V92-M220 HydrophobicContact CG1-SD 3.42Å; V92-M220 WeakPolarHBondContact CG1-SD 3.13Å; W170-M220 HydrophobicContact CB-CE 4.3Å; W170-M220 HydrophobicContact CB-CG 3.93Å; W170-M220 HydrophobicContact CB-SD 3.75Å; W170-M220 HydrophobicContact CD2-CB 4.5Å; W170-M220 HydrophobicContact CD2-CG 3.31Å; W170-M220 HydrophobicContact CD2-SD 4.33Å; W170-M220 HydrophobicContact CE3-CG 3.82Å; W170-M220 HydrophobicContact CG-CE 4.31Å; W170-M220 HydrophobicContact CG-CG 3.35Å; W170-M220 HydrophobicContact CG-SD 3.86Å; W170-M220 HydrophobicContact CZ2-CG 4.34Å; C216-M220 WeakPolarHBondContact O-CB 3.47Å; C216-M220 VanDerWaalsContact O-CG 3.29Å; C216-M220 WeakPolarHBondContact O-CG 3.25Å; C216-M220 PolarHBondContact O-N 2.94Å; S217-M220 PolarHBondContact O-N 3.31Å; M220-T223 PolarHBondContact O-OG1 2.91Å; M220-T223 VanDerWaalsContact O-OG1 3.14Å; M220-G224 PolarHBondContact O-N 3.24Å; M220-T225 HydrophobicContact CE-CG2 3.95Å; M220-T225 WeakPolarHBondContact O-CA 3.46Å; M220-T225 VanDerWaalsContact O-CB 3.26Å; M220-T225 WeakPolarHBondContact O-CB 3.3Å; M220-T225 PolarHBondContact O-N 3.34Å; M220-R226 HydrophobicContact CB-CG 3.9Å; M220-R226 PolarHBondContact O-N 3.32Å; M220-I229 HydrophobicContact CE-CD1 3.47Å; M220-I229 VanDerWaalsContact CE-CD1 3.47Å
221	Y	84	Confident	82	Confident	27 Å²	27	43.5 Å²	43.5	11%	0.106	25%	0.247	C	C	.	.	H	α-helix	trans	-67	-51.5	175.2	171.1	-104.4	0	0	0	111.8	K31 A34 L35 S217 V218 L219 T223 G224	K31-Y221 WeakPolarHBondContact CA-OH 3.38Å; K31-Y221 WeakPolarHBondContact CB-OH 2.83Å; K31-Y221 VanDerWaalsContact CD-OH 3.25Å; K31-Y221 WeakPolarHBondContact CD-OH 3.21Å; K31-Y221 HydrophobicContact CG-CE2 4.49Å; K31-Y221 WeakPolarHBondContact CG-OH 2.88Å; A34-Y221 HydrophobicContact CB-CD2 4.12Å; A34-Y221 HydrophobicContact CB-CE2 4.05Å; L35-Y221 HydrophobicContact CD2-CD1 4.02Å; L35-Y221 HydrophobicContact CD2-CE1 4.19Å; L35-Y221 HydrophobicContact CG-CE1 4.27Å; S217-Y221 WeakPolarHBondContact O-CB 3.5Å; S217-Y221 PolarHBondContact O-N 3.49Å; V218-Y221 WeakPolarHBondContact O-CB 3.25Å; V218-Y221 PolarHBondContact O-N 3.46Å; L219-Y221 PolarHBondContact O-N 2.92Å; Y221-T223 PolarHBondContact O-N 2.92Å; Y221-T223 VanDerWaalsContact O-N 3.12Å; Y221-G224 PolarHBondContact O-N 3.2Å
222	L	84.3	Confident	79.8	Confident	125 Å²	125	44.8 Å²	44.8	65%	0.654	25%	0.246	S	C	*	.	H	α-helix	trans	-60.5	-26.4	179.5	-68.7	176.2	0	0	0	113.5	V218 L219	V218-L222 HydrophobicContact CG1-CD1 4.12Å; V218-L222 HydrophobicContact CG1-CG 4.39Å; V218-L222 WeakPolarHBondContact O-CG 3.21Å; V218-L222 PolarHBondContact O-N 3.22Å; L219-L222 PolarHBondContact O-N 2.89Å
223	T	84.4	Confident	77.5	Confident	56 Å²	56	47.5 Å²	47.5	34%	0.344	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	4	177.6	56.6	0	0	0	0	114	W170 L219 M220 Y221 T225	W170-T223 HydrophobicContact CH2-CG2 4.28Å; W170-T223 HydrophobicContact CZ2-CG2 3.89Å; W170-T223 VanDerWaalsContact CZ2-OG1 3.28Å; W170-T223 WeakPolarHBondContact CZ2-OG1 3.45Å; L219-T223 WeakPolarHBondContact O-CB 3.41Å; L219-T223 WeakPolarHBondContact O-CG2 3.42Å; L219-T223 PolarHBondContact O-N 3.28Å; L219-T223 PolarHBondContact O-OG1 3.31Å; M220-T223 PolarHBondContact O-OG1 2.91Å; M220-T223 VanDerWaalsContact O-OG1 3.14Å; Y221-T223 PolarHBondContact O-N 2.92Å; Y221-T223 VanDerWaalsContact O-N 3.12Å; T223-T225 PolarHBondContact O-N 3.36Å; T223-T225 PolarHBondContact OG1-OG1 3.35Å
224	G	79.1	Confident	74.7	Confident	24 Å²	24	50.8 Å²	50.8	25%	0.247	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	8.5	-177.8	0	0	0	0	0	114.1	M220 Y221 D227 V228	M220-G224 PolarHBondContact O-N 3.24Å; Y221-G224 PolarHBondContact O-N 3.2Å; G224-D227 PolarHBondContact O-N 3Å; G224-V228 WeakPolarHBondContact O-CG2 3.36Å; G224-V228 PolarHBondContact O-N 2.94Å
225	T	77.8	Confident	72.1	Confident	9 Å²	9	53.8 Å²	53.8	6%	0.055	31%	0.307	C	S	.	.	H	α-helix	trans	-67.9	-40.6	179.4	-51.7	0	0	0	0	110.5	C166 W170 M220 T223 D227 V228 I229	C166-T225 HydrophobicContact CB-CG2 3.94Å; C166-T225 WeakPolarHBondContact O-CG2 3.5Å; W170-T225 PolarHBondContact NE1-OG1 2.76Å; W170-T225 VanDerWaalsContact NE1-OG1 3.1Å; M220-T225 HydrophobicContact CE-CG2 3.95Å; M220-T225 WeakPolarHBondContact O-CA 3.46Å; M220-T225 VanDerWaalsContact O-CB 3.26Å; M220-T225 WeakPolarHBondContact O-CB 3.3Å; M220-T225 PolarHBondContact O-N 3.34Å; T223-T225 PolarHBondContact O-N 3.36Å; T223-T225 PolarHBondContact OG1-OG1 3.35Å; T225-D227 VanDerWaalsContact C-N 3.31Å; T225-D227 PolarHBondContact O-N 2.77Å; T225-V228 PolarHBondContact O-N 2.71Å; T225-I229 HydrophobicContact CG2-CD1 4.04Å; T225-I229 WeakPolarHBondContact O-CG1 3.3Å; T225-I229 PolarHBondContact O-N 3Å
226	R	69.1	Low	69.3	Low	42 Å²	42	53 Å²	53	16%	0.158	32%	0.315	C	S	.	.	H	α-helix	trans	-63.1	-36.6	177.4	-73.9	-170.8	94.9	83.4	-7.2	112.5	V92 S217 M220 I229 S230	V92-R226 PolarHBondContact O-NH1 3.16Å; S217-R226 PolarHBondContact OG-NH1 2.98Å; M220-R226 HydrophobicContact CB-CG 3.9Å; M220-R226 PolarHBondContact O-N 3.32Å; R226-I229 PolarHBondContact O-N 3.1Å; R226-S230 WeakPolarHBondContact O-CB 3.32Å; R226-S230 PolarHBondContact O-N 3.36Å
227	D	65.8	Low	66.7	Low	84 Å²	84	56.8 Å²	56.8	45%	0.449	33%	0.334	S	S	.	.	H	α-helix	trans	-66.7	-40.6	-179.5	-56.2	-24.4	0	0	0	111	G224 T225 S230 T231	G224-D227 PolarHBondContact O-N 3Å; T225-D227 VanDerWaalsContact C-N 3.31Å; T225-D227 PolarHBondContact O-N 2.77Å; D227-S230 PolarHBondContact O-N 3.02Å; D227-T231 WeakPolarHBondContact O-CB 3.34Å; D227-T231 WeakPolarHBondContact O-CG2 3.48Å; D227-T231 PolarHBondContact O-N 3.26Å; D227-T231 PolarHBondContact O-OG1 2.89Å
228	V	62.1	Low	63.7	Low	35 Å²	35	63.7 Å²	63.7	21%	0.212	37%	0.371	C	S	.	.	H	α-helix	trans	-64.7	-40.8	173.7	177.5	0	0	0	0	111.2	D163 C166 G224 T225 T231 K232	D163-V228 HydrophobicContact CB-CG1 4.28Å; C166-V228 HydrophobicContact CB-CG1 4.45Å; G224-V228 WeakPolarHBondContact O-CG2 3.36Å; G224-V228 PolarHBondContact O-N 2.94Å; T225-V228 PolarHBondContact O-N 2.71Å; V228-T231 WeakPolarHBondContact CA-OG1 3.44Å; V228-T231 PolarHBondContact O-OG1 2.91Å; V228-K232 VanDerWaalsContact O-CB 3.31Å; V228-K232 WeakPolarHBondContact O-CB 3.36Å; V228-K232 PolarHBondContact O-N 3.24Å; V228-K232 VanDerWaalsContact O-N 3.11Å
229	I	65.1	Low	61.1	Low	49 Å²	49	73.1 Å²	73.1	25%	0.251	42%	0.418	S	S	.	.	H	α-helix	trans	-64.8	-41.7	175.4	-66.8	169.2	0	0	0	110.8	C166 M220 T225 R226 H233	C166-I229 VanDerWaalsContact SG-CG1 3.58Å; M220-I229 HydrophobicContact CE-CD1 3.47Å; M220-I229 VanDerWaalsContact CE-CD1 3.47Å; T225-I229 HydrophobicContact CG2-CD1 4.04Å; T225-I229 WeakPolarHBondContact O-CG1 3.3Å; T225-I229 PolarHBondContact O-N 3Å; R226-I229 PolarHBondContact O-N 3.1Å; I229-H233 WeakPolarHBondContact O-CB 3.46Å; I229-H233 PolarHBondContact O-ND1 3.08Å
230	S	59.4	Low	59.6	Low	52 Å²	52	73.8 Å²	73.8	36%	0.364	42%	0.423	S	S	.	.	H	α-helix	trans	-66.8	-47.2	-179.7	-164.2	0	0	0	0	112	R226 D227 H233	R226-S230 WeakPolarHBondContact O-CB 3.32Å; R226-S230 PolarHBondContact O-N 3.36Å; D227-S230 PolarHBondContact O-N 3.02Å; S230-H233 PolarHBondContact O-N 3.07Å
231	T	54.7	Low	58	Low	112 Å²	112	77.6 Å²	77.6	69%	0.687	45%	0.445	S	S	*	.	H	α-helix	trans	-70.1	-39.2	-176.2	49.7	0	0	0	0	113.7	D227 V228 H233	D227-T231 WeakPolarHBondContact O-CB 3.34Å; D227-T231 WeakPolarHBondContact O-CG2 3.48Å; D227-T231 PolarHBondContact O-N 3.26Å; D227-T231 PolarHBondContact O-OG1 2.89Å; V228-T231 WeakPolarHBondContact CA-OG1 3.44Å; V228-T231 PolarHBondContact O-OG1 2.91Å; T231-H233 PolarHBondContact O-N 2.98Å
232	K	50.2	Low	56.6	Low	111 Å²	111	80.4 Å²	80.4	48%	0.483	46%	0.463	S	S	.	.	H	α-helix	trans	-66.3	-21.3	177.3	-173.5	176.1	171.3	-172.1	0	113.1	D163 S164 V228	D163-K232 WeakPolarHBondContact O-CD 3.48Å; S164-K232 PolarHBondContact O-NZ 3.3Å; S164-K232 PolarHBondContact OG-NZ 3.28Å; V228-K232 VanDerWaalsContact O-CB 3.31Å; V228-K232 WeakPolarHBondContact O-CB 3.36Å; V228-K232 PolarHBondContact O-N 3.24Å; V228-K232 VanDerWaalsContact O-N 3.11Å
233	H	48.6	Very low	55	Low	67 Å²	67	77.8 Å²	77.8	31%	0.31	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	11.8	-170.9	-75	102.7	0	0	0	114.8	K97 I229 S230 T231 I235	K97-H233 PolarHBondContact NZ-O 2.92Å; I229-H233 WeakPolarHBondContact O-CB 3.46Å; I229-H233 PolarHBondContact O-ND1 3.08Å; S230-H233 PolarHBondContact O-N 3.07Å; T231-H233 PolarHBondContact O-N 2.98Å; H233-I235 PolarHBondContact O-N 3.04Å
234	G	40.3	Very low	53.1	Low	69 Å²	69	79.1 Å²	79.1	71%	0.711	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	33.1	168.7	0	0	0	0	0	113.4
235	I	39.6	Very low	51.4	Low	75 Å²	75	82.8 Å²	82.8	39%	0.385	47%	0.473	S	S	.	.			trans	-100.3	87.7	158.8	-56.4	-178.6	0	0	0	104.5	H233 I237	H233-I235 PolarHBondContact O-N 3.04Å; I235-I237 VanDerWaalsContact C-N 3.3Å; I235-I237 HydrophobicContact CG2-CG1 3.94Å; I235-I237 PolarHBondContact O-N 2.9Å; I235-I237 VanDerWaalsContact O-N 3.17Å
236	A	35	Very low	49.5	Very low	78 Å²	78	88.1 Å²	88.1	65%	0.645	50%	0.503	S	S	*	.			trans	-50.7	116.7	133.5	0	0	0	0	0	103.9	D238	A236-D238 PolarHBondContact O-N 3.28Å
237	I	40.4	Very low	48	Very low	79 Å²	79	91.6 Å²	91.6	41%	0.405	53%	0.529	S	S	.	.			trans	-67	85.4	162.8	-58.1	176.2	0	0	0	102.6	I235 I239	I235-I237 VanDerWaalsContact C-N 3.3Å; I235-I237 HydrophobicContact CG2-CG1 3.94Å; I235-I237 PolarHBondContact O-N 2.9Å; I235-I237 VanDerWaalsContact O-N 3.17Å; I237-I239 PolarHBondContact O-N 3.45Å
238	D	28.8	Very low	46.5	Very low	147 Å²	147	92.3 Å²	92.3	79%	0.786	54%	0.536	S	S	*	.			trans	-60.8	126.2	165.8	-103.6	-15.8	0	0	0	105.8	A236	A236-D238 PolarHBondContact O-N 3.28Å
239	I	34	Very low	45.1	Very low	233 Å²	233	97.5 Å²	97.5	100%	1.195	57%	0.566	S	S	*	*			trans	-61.5	0	171.6	-62.3	171	0	0	0	108.8	I237	I237-I239 PolarHBondContact O-N 3.45Å

Retrieved 239 of 239 residues in 255.2 ms (Link to these results)

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