A0A060WEF5_ONCMY Loading...

Torsin family 3, member A

AlphaFold DB , UniProt , Accession A0A060WEF5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110521568, Length 367 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	33.7	Very low	30.7	Very low	234 Å²	234	167.9 Å²	167.9	100%	1.153	80%	0.802	S	S	*	*				0	77.4	0	-141	161.9	94	0	0	105.9
2	F	29.1	Very low	30.6	Very low	178 Å²	178	160.9 Å²	160.9	78%	0.781	79%	0.793	S	S	*	*				61	123.4	103.9	-88.2	-64.8	0	0	0	111.8
3	L	29.2	Very low	30.3	Very low	142 Å²	142	159.3 Å²	159.3	74%	0.743	80%	0.797	S	S	*	*			cis	-161.3	133.4	36.4	-117.1	100.2	0	0	0	108.2
4	Y	28.6	Very low	30.1	Very low	173 Å²	173	154.5 Å²	154.5	68%	0.678	79%	0.786	S	S	*	*				87.4	116.3	100.5	-96.8	-102	0	0	0	119.4
5	Q	33.7	Very low	30	Very low	153 Å²	153	151.3 Å²	151.3	72%	0.715	79%	0.793	S	S	*	*			trans	40.2	131.3	135.5	-64	-179.3	-26.3	0	0	122.2
6	L	28.8	Very low	29.9	Very low	165 Å²	165	150.9 Å²	150.9	86%	0.864	79%	0.792	S	S	*	*				172.4	128.4	108.5	-92	153.7	0	0	0	112.4
7	L	32.7	Very low	30.1	Very low	151 Å²	151	147.8 Å²	147.8	79%	0.791	79%	0.792	S	S	*	*			trans	-102.6	149.5	153.8	-109.7	153.7	0	0	0	105.7
8	P	40.2	Very low	29.9	Very low	108 Å²	108	148.5 Å²	148.5	70%	0.701	80%	0.796	S	S	*	*				-156.5	163	83.2	39.3	-18.3	0	0	0	118.1
9	F	29	Very low	30	Very low	163 Å²	163	150.1 Å²	150.1	72%	0.715	80%	0.795	S	S	*	*			trans	31.1	130.4	139.8	-83.3	-101.5	0	0	0	123.6	W11	F9-W11 AromaticContact CD1-CD1 3.84Å; F9-W11 AromaticContact CD1-NE1 3.93Å; F9-W11 AromaticContact CE1-NE1 3.91Å
10	L	27	Very low	30.1	Very low	168 Å²	168	149.8 Å²	149.8	88%	0.88	79%	0.787	S	S	*	*			trans	-173.2	98.5	131.7	-96.5	155.8	0	0	0	108.4
11	W	25.3	Very low	30.1	Very low	212 Å²	212	151.2 Å²	151.2	80%	0.803	79%	0.79	S	S	*	*				46.2	106.3	105.5	-79.6	65	0	0	0	117.8	F9	F9-W11 AromaticContact CD1-CD1 3.84Å; F9-W11 AromaticContact CD1-NE1 3.93Å; F9-W11 AromaticContact CE1-NE1 3.91Å
12	A	30	Very low	30.3	Very low	84 Å²	84	147 Å²	147	69%	0.694	77%	0.765	S	S	*	*			trans	47.5	115.8	131	0	0	0	0	0	121.2
13	V	26.7	Very low	30.6	Very low	140 Å²	140	145.1 Å²	145.1	85%	0.848	76%	0.763	S	S	*	*			trans	-153.2	122.6	130.3	179.2	0	0	0	0	110.2
14	S	27.8	Very low	31.4	Very low	92 Å²	92	145.2 Å²	145.2	64%	0.643	77%	0.77	S	S	*	*			trans	11.5	113.5	148.2	162	0	0	0	0	119.1
15	A	28.5	Very low	32.1	Very low	107 Å²	107	141.4 Å²	141.4	88%	0.884	76%	0.761	S	S	*	*			trans	-90.1	100.4	158.6	0	0	0	0	0	109.6
16	N	27.5	Very low	33.2	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	75%	0.753	S	S	*	*			trans	-77.6	142.3	157.2	-92.4	-17.1	0	0	0	108.4	D18	N16-D18 PolarHBondContact O-N 3.41Å
17	A	33.5	Very low	34.2	Very low	97 Å²	97	137 Å²	137	80%	0.802	75%	0.749	S	S	*	*			trans	-69.9	117.1	178.4	0	0	0	0	0	111
18	D	27.7	Very low	34.8	Very low	161 Å²	161	132.9 Å²	132.9	86%	0.861	74%	0.737	S	S	*	*			trans	-129	100.4	156.5	-81.3	-39.4	0	0	0	106.7	N16	N16-D18 PolarHBondContact O-N 3.41Å
19	F	31	Very low	35.3	Very low	178 Å²	178	130 Å²	130	78%	0.781	72%	0.719	S	S	*	*			trans	-116.3	112.5	175.5	-147.7	-115.7	0	0	0	108.5
20	F	31.3	Very low	36.3	Very low	144 Å²	144	125.2 Å²	125.2	63%	0.632	70%	0.703	S	S	*	*			trans	85.4	98.8	173.5	-61.1	-65	0	0	0	119.3	F22	F20-F22 HydrophobicContact CB-CD2 3.83Å; F20-F22 HydrophobicContact CB-CE2 3.78Å; F20-F22 HydrophobicContact CD1-CD2 4.32Å; F20-F22 AromaticContact CD1-CE2 3.53Å; F20-F22 HydrophobicContact CD1-CE2 3.53Å; F20-F22 HydrophobicContact CD1-CZ 4.01Å; F20-F22 HydrophobicContact CE1-CE2 4.25Å; F20-F22 HydrophobicContact CE1-CZ 4.39Å; F20-F22 HydrophobicContact CG-CD2 4.31Å; F20-F22 AromaticContact CG-CE2 3.73Å; F20-F22 HydrophobicContact CG-CE2 3.73Å
21	Q	31.5	Very low	37.7	Very low	180 Å²	180	124.7 Å²	124.7	84%	0.841	69%	0.691	S	S	*	*			trans	-90.7	111.7	156.8	-133.1	172.5	-10.6	0	0	107.9
22	F	36.3	Very low	39.2	Very low	145 Å²	145	121.1 Å²	121.1	64%	0.636	68%	0.678	S	S	*	*			trans	-113.8	76.1	174.5	-85.2	-75.1	0	0	0	110.6	F20 T24 I25	F20-F22 HydrophobicContact CB-CD2 3.83Å; F20-F22 HydrophobicContact CB-CE2 3.78Å; F20-F22 HydrophobicContact CD1-CD2 4.32Å; F20-F22 AromaticContact CD1-CE2 3.53Å; F20-F22 HydrophobicContact CD1-CE2 3.53Å; F20-F22 HydrophobicContact CD1-CZ 4.01Å; F20-F22 HydrophobicContact CE1-CE2 4.25Å; F20-F22 HydrophobicContact CE1-CZ 4.39Å; F20-F22 HydrophobicContact CG-CD2 4.31Å; F20-F22 AromaticContact CG-CE2 3.73Å; F20-F22 HydrophobicContact CG-CE2 3.73Å; F22-T24 PolarHBondContact O-N 3.42Å; F22-I25 HydrophobicContact CB-CD1 4.16Å; F22-I25 HydrophobicContact CB-CG1 4.47Å
23	D	37.4	Very low	40.4	Very low	139 Å²	139	124.1 Å²	124.1	74%	0.743	68%	0.676	S	S	*	*			trans	-83.3	83.3	165.2	-77.1	-34.8	0	0	0	109.4
24	T	44.7	Very low	41.6	Very low	144 Å²	144	121.8 Å²	121.8	88%	0.883	66%	0.658	S	S	*	*			trans	163.5	72	149.6	33.4	0	0	0	0	109.5	F22	F22-T24 PolarHBondContact O-N 3.42Å
25	I	43.9	Very low	43.1	Very low	94 Å²	94	123.6 Å²	123.6	48%	0.482	65%	0.652	S	S	.	*			trans	-108.5	119.7	167.8	-63.3	-176.2	0	0	0	106.3	F22 S29	F22-I25 HydrophobicContact CB-CD1 4.16Å; F22-I25 HydrophobicContact CB-CG1 4.47Å; I25-S29 WeakPolarHBondContact CG2-OG 3.48Å
26	S	55.7	Low	44.2	Very low	78 Å²	78	122.8 Å²	122.8	55%	0.545	63%	0.632	S	S	.	*			trans	-60.7	153.9	178.5	74.8	0	0	0	0	111	A28 S29 T30	S26-A28 PolarHBondContact O-N 2.85Å; S26-S29 PolarHBondContact N-OG 3.41Å; S26-S29 VanDerWaalsContact N-OG 3.08Å; S26-S29 PolarHBondContact O-N 2.85Å; S26-S29 PolarHBondContact O-OG 3.35Å; S26-S29 PolarHBondContact OG-OG 3.28Å; S26-T30 PolarHBondContact O-N 2.78Å; S26-T30 PolarHBondContact O-OG1 2.8Å
27	N	50.4	Low	45.3	Very low	148 Å²	148	122 Å²	122	79%	0.791	62%	0.619	S	S	*	*	H	α-helix	trans	-53.2	-30.9	-179.2	-95.5	-5.9	0	0	0	114	T30 Y31	N27-T30 PolarHBondContact O-N 3.3Å; N27-Y31 PolarHBondContact O-N 3.37Å; N27-Y31 VanDerWaalsContact O-N 3.15Å
28	A	45.5	Very low	46.1	Very low	64 Å²	64	119.9 Å²	119.9	53%	0.529	60%	0.598	S	S	.	*	H	α-helix	trans	-66.5	-39	176.5	0	0	0	0	0	112.5	S26 Y31 Y32	S26-A28 PolarHBondContact O-N 2.85Å; A28-Y31 PolarHBondContact O-N 3.19Å; A28-Y32 WeakPolarHBondContact O-CD2 3.09Å; A28-Y32 PolarHBondContact O-N 3.41Å; A28-Y32 VanDerWaalsContact O-N 3.11Å
29	S	50.8	Low	47.1	Very low	48 Å²	48	117.3 Å²	117.3	34%	0.336	58%	0.584	S	S	.	*	H	α-helix	trans	-72.5	-32.2	177.7	27.2	0	0	0	0	112.6	I25 S26 F33	I25-S29 WeakPolarHBondContact CG2-OG 3.48Å; S26-S29 PolarHBondContact N-OG 3.41Å; S26-S29 VanDerWaalsContact N-OG 3.08Å; S26-S29 PolarHBondContact O-N 2.85Å; S26-S29 PolarHBondContact O-OG 3.35Å; S26-S29 PolarHBondContact OG-OG 3.28Å; S29-F33 VanDerWaalsContact O-CB 3.26Å; S29-F33 WeakPolarHBondContact O-CB 3.42Å; S29-F33 PolarHBondContact O-N 3.33Å
30	T	50.1	Low	47.9	Very low	61 Å²	61	114.6 Å²	114.6	37%	0.374	58%	0.576	S	S	.	*	H	α-helix	trans	-67.6	-37.7	172.5	-43	0	0	0	0	111.7	S26 N27 N34	S26-T30 PolarHBondContact O-N 2.78Å; S26-T30 PolarHBondContact O-OG1 2.8Å; N27-T30 PolarHBondContact O-N 3.3Å; T30-N34 WeakPolarHBondContact O-CB 3.27Å; T30-N34 PolarHBondContact O-N 3.39Å
31	Y	56.5	Low	48.3	Very low	157 Å²	157	116.1 Å²	116.1	62%	0.616	58%	0.578	S	S	*	*	H	α-helix	trans	-65.9	-47.3	175.7	-178.9	-93.1	0	0	0	112.4	N27 A28 F33 N34 Y35	N27-Y31 PolarHBondContact O-N 3.37Å; N27-Y31 VanDerWaalsContact O-N 3.15Å; A28-Y31 PolarHBondContact O-N 3.19Å; Y31-F33 VanDerWaalsContact C-N 3.32Å; Y31-F33 PolarHBondContact O-N 3.07Å; Y31-N34 PolarHBondContact O-N 3.06Å; Y31-Y35 WeakPolarHBondContact O-CB 3.45Å; Y31-Y35 PolarHBondContact O-N 3.46Å
32	Y	55.9	Low	48.7	Very low	137 Å²	137	117.9 Å²	117.9	54%	0.537	59%	0.586	S	S	.	*	H	α-helix	trans	-65.5	-35.9	176.9	-91.6	-82.8	0	0	0	112.3	A28 Y35 I36	A28-Y32 WeakPolarHBondContact O-CD2 3.09Å; A28-Y32 PolarHBondContact O-N 3.41Å; A28-Y32 VanDerWaalsContact O-N 3.11Å; Y32-Y35 PolarHBondContact O-N 3.01Å; Y32-I36 WeakPolarHBondContact O-CB 3.49Å; Y32-I36 VanDerWaalsContact O-CG1 3.24Å; Y32-I36 WeakPolarHBondContact O-CG1 3.15Å; Y32-I36 PolarHBondContact O-N 3.44Å
33	F	56.6	Low	48.9	Very low	147 Å²	147	112.8 Å²	112.8	65%	0.645	57%	0.574	S	S	*	*	H	α-helix	trans	-64.3	-45.5	175	-159.7	-90.1	0	0	0	111.5	S29 Y31 I36 Y37	S29-F33 VanDerWaalsContact O-CB 3.26Å; S29-F33 WeakPolarHBondContact O-CB 3.42Å; S29-F33 PolarHBondContact O-N 3.33Å; Y31-F33 VanDerWaalsContact C-N 3.32Å; Y31-F33 PolarHBondContact O-N 3.07Å; F33-I36 PolarHBondContact O-N 3.3Å; F33-Y37 VanDerWaalsContact O-CB 3.24Å; F33-Y37 WeakPolarHBondContact O-CB 3.41Å; F33-Y37 PolarHBondContact O-N 2.84Å
34	N	51	Low	48.9	Very low	91 Å²	91	115.9 Å²	115.9	49%	0.487	58%	0.584	S	S	.	*	H	α-helix	trans	-65.2	-37.6	175.1	-80.3	-19.7	0	0	0	112.8	T30 Y31 Y37 C38	T30-N34 WeakPolarHBondContact O-CB 3.27Å; T30-N34 PolarHBondContact O-N 3.39Å; Y31-N34 PolarHBondContact O-N 3.06Å; N34-Y37 PolarHBondContact O-N 3.37Å; N34-C38 WeakPolarHBondContact O-CB 3.49Å; N34-C38 PolarHBondContact O-N 3Å; N34-C38 PolarHBondContact O-SG 3.23Å; N34-C38 VanDerWaalsContact O-SG 3.32Å
35	Y	58.8	Low	49.1	Very low	130 Å²	130	112.3 Å²	112.3	51%	0.51	57%	0.565	S	S	.	*	H	α-helix	trans	-65.7	-39	176.9	-177	-93.9	0	0	0	112.5	Y31 Y32 N39	Y31-Y35 WeakPolarHBondContact O-CB 3.45Å; Y31-Y35 PolarHBondContact O-N 3.46Å; Y32-Y35 PolarHBondContact O-N 3.01Å; Y35-N39 WeakPolarHBondContact CE1-ND2 3.38Å; Y35-N39 WeakPolarHBondContact CE2-ND2 3.49Å; Y35-N39 VanDerWaalsContact CZ-ND2 3.26Å; Y35-N39 WeakPolarHBondContact O-CB 3.39Å; Y35-N39 PolarHBondContact O-N 3.31Å; Y35-N39 PolarHBondContact O-ND2 3.17Å
36	I	53	Low	48.9	Very low	91 Å²	91	116.9 Å²	116.9	47%	0.467	58%	0.584	S	S	.	*	H	α-helix	trans	-72	-42.2	176.1	-69.1	170.9	0	0	0	110.2	Y32 F33 N39 I40	Y32-I36 WeakPolarHBondContact O-CB 3.49Å; Y32-I36 VanDerWaalsContact O-CG1 3.24Å; Y32-I36 WeakPolarHBondContact O-CG1 3.15Å; Y32-I36 PolarHBondContact O-N 3.44Å; F33-I36 PolarHBondContact O-N 3.3Å; I36-N39 PolarHBondContact O-N 3.22Å; I36-I40 HydrophobicContact CG2-CD1 3.63Å; I36-I40 HydrophobicContact CG2-CG1 4.42Å; I36-I40 WeakPolarHBondContact O-CB 3.47Å; I36-I40 WeakPolarHBondContact O-CG1 3.34Å; I36-I40 PolarHBondContact O-N 3.22Å; I36-I40 VanDerWaalsContact O-N 3.1Å
37	Y	48.8	Very low	47.9	Very low	128 Å²	128	118.6 Å²	118.6	50%	0.502	59%	0.593	S	S	.	*	H	α-helix	trans	-61.6	-48	178.4	-171.1	-97.4	0	0	0	112.1	F33 N34 N39 W41	F33-Y37 VanDerWaalsContact O-CB 3.24Å; F33-Y37 WeakPolarHBondContact O-CB 3.41Å; F33-Y37 PolarHBondContact O-N 2.84Å; N34-Y37 PolarHBondContact O-N 3.37Å; Y37-N39 PolarHBondContact O-N 2.87Å; Y37-W41 PolarHBondContact O-N 2.98Å
38	C	50.5	Low	47.3	Very low	52 Å²	52	119.6 Å²	119.6	35%	0.351	60%	0.599	S	S	.	*	H	α-helix	trans	-71.7	-23.7	-179.5	-63.9	0	0	0	0	114.2	N34 C45	N34-C38 WeakPolarHBondContact O-CB 3.49Å; N34-C38 PolarHBondContact O-N 3Å; N34-C38 PolarHBondContact O-SG 3.23Å; N34-C38 VanDerWaalsContact O-SG 3.32Å; C38-C45 HydrophobicContact CB-CB 4.26Å; C38-C45 WeakPolarHBondContact CB-SG 3.33Å; C38-C45 WeakPolarHBondContact SG-CB 3.16Å; C38-C45 CovalentContact SG-SG 2.06Å; C38-C45 PolarHBondContact SG-SG 3.13Å
39	N	49.8	Very low	47.1	Very low	107 Å²	107	124.9 Å²	124.9	57%	0.572	61%	0.612	S	S	*	*	H	α-helix	trans	-92.5	-19.3	179.7	-80.3	-52.9	0	0	0	113.9	Y35 I36 Y37	Y35-N39 WeakPolarHBondContact CE1-ND2 3.38Å; Y35-N39 WeakPolarHBondContact CE2-ND2 3.49Å; Y35-N39 VanDerWaalsContact CZ-ND2 3.26Å; Y35-N39 WeakPolarHBondContact O-CB 3.39Å; Y35-N39 PolarHBondContact O-N 3.31Å; Y35-N39 PolarHBondContact O-ND2 3.17Å; I36-N39 PolarHBondContact O-N 3.22Å; Y37-N39 PolarHBondContact O-N 2.87Å
40	I	47.5	Very low	46.3	Very low	122 Å²	122	130.3 Å²	130.3	63%	0.626	64%	0.638	S	S	*	*	H	α-helix	trans	-103.1	-28.2	-178.3	-61.6	-177.5	0	0	0	111.5	I36	I36-I40 HydrophobicContact CG2-CD1 3.63Å; I36-I40 HydrophobicContact CG2-CG1 4.42Å; I36-I40 WeakPolarHBondContact O-CB 3.47Å; I36-I40 WeakPolarHBondContact O-CG1 3.34Å; I36-I40 PolarHBondContact O-N 3.22Å; I36-I40 VanDerWaalsContact O-N 3.1Å
41	W	40.4	Very low	45.4	Very low	176 Å²	176	134.3 Å²	134.3	67%	0.667	66%	0.657	S	S	*	*	S	Bend	trans	-123.4	125.9	179.3	-72.3	68.2	0	0	0	110	Y37 G43	Y37-W41 PolarHBondContact O-N 2.98Å; W41-G43 PolarHBondContact O-N 2.76Å
42	E	39	Very low	44.4	Very low	216 Å²	216	133.7 Å²	133.7	100%	1.009	67%	0.67	S	S	*	*			trans	-71.4	69.8	176.6	-74	-174.3	158.2	0	0	111.7
43	G	41.2	Very low	43.6	Very low	38 Å²	38	133 Å²	133	39%	0.392	68%	0.68	S	S	.	*			trans	-104.2	147	167.4	0	0	0	0	0	111.5	W41 C45	W41-G43 PolarHBondContact O-N 2.76Å; G43-C45 PolarHBondContact O-N 3.23Å
44	E	37	Very low	42.5	Very low	204 Å²	204	134.7 Å²	134.7	95%	0.953	69%	0.69	S	S	*	*			trans	-62.6	107.8	177.6	-68.1	-172.5	167.8	0	0	111.4
45	C	48.9	Very low	41.7	Very low	70 Å²	70	139.9 Å²	139.9	47%	0.473	71%	0.711	S	S	.	*			trans	-98.5	111.9	174.4	-62.1	0	0	0	0	110.1	C38 G43	C38-C45 HydrophobicContact CB-CB 4.26Å; C38-C45 WeakPolarHBondContact CB-SG 3.33Å; C38-C45 WeakPolarHBondContact SG-CB 3.16Å; C38-C45 CovalentContact SG-SG 2.06Å; C38-C45 PolarHBondContact SG-SG 3.13Å; G43-C45 PolarHBondContact O-N 3.23Å
46	Q	38.8	Very low	40.4	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	72%	0.722	S	S	*	*			trans	-84.5	129.3	168.5	-87.7	176	-22.6	0	0	110.5	N48	Q46-N48 PolarHBondContact O-N 3.1Å
47	P	36.3	Very low	39.4	Very low	114 Å²	114	140.4 Å²	140.4	74%	0.74	73%	0.734	S	S	*	*			trans	-84.4	116	178.3	31.5	-28.8	0	0	0	110	Q49	P47-Q49 PolarHBondContact O-N 3.25Å
48	N	36	Very low	38.8	Very low	169 Å²	169	141.4 Å²	141.4	90%	0.904	75%	0.753	S	S	*	*			trans	-74	106.4	160	-84.4	-20	0	0	0	108.3	Q46 D50	Q46-N48 PolarHBondContact O-N 3.1Å; N48-D50 PolarHBondContact O-N 2.5Å
49	Q	41.7	Very low	38.1	Very low	175 Å²	175	149 Å²	149	82%	0.818	77%	0.774	S	S	*	*			trans	-67.3	113.8	160.9	-78.1	175.8	-27	0	0	107.9	P47	P47-Q49 PolarHBondContact O-N 3.25Å
50	D	33.9	Very low	37.8	Very low	162 Å²	162	150.6 Å²	150.6	87%	0.866	78%	0.783	S	S	*	*			trans	170.5	83.6	141.8	-86.4	-17.7	0	0	0	109.2	N48	N48-D50 PolarHBondContact O-N 2.5Å
51	D	32.6	Very low	37.3	Very low	146 Å²	146	150.6 Å²	150.6	78%	0.781	78%	0.784	S	S	*	*			trans	-171.4	71.7	139.1	-135.7	-18.1	0	0	0	110.9	T53	D51-T53 VanDerWaalsContact C-N 3.27Å; D51-T53 PolarHBondContact O-N 3.09Å; D51-T53 VanDerWaalsContact O-N 3.07Å
52	T	35.4	Very low	37.4	Very low	144 Å²	144	152.1 Å²	152.1	88%	0.883	79%	0.79	S	S	*	*			trans	-81.9	64.4	175.3	48	0	0	0	0	111.4
53	T	37.9	Very low	37.4	Very low	123 Å²	123	146.1 Å²	146.1	76%	0.755	78%	0.777	S	S	*	*			trans	-154.7	42.8	167.2	24.9	0	0	0	0	114.8	D51	D51-T53 VanDerWaalsContact C-N 3.27Å; D51-T53 PolarHBondContact O-N 3.09Å; D51-T53 VanDerWaalsContact O-N 3.07Å
54	Q	34	Very low	37.5	Very low	182 Å²	182	147.3 Å²	147.3	85%	0.85	79%	0.79	S	S	*	*			trans	-128.3	103.1	159.9	-79.3	-176.8	-9.4	0	0	110.5	V56	Q54-V56 PolarHBondContact O-N 3.38Å; Q54-V56 VanDerWaalsContact O-N 3.08Å
55	Q	33.5	Very low	37.9	Very low	200 Å²	200	144.5 Å²	144.5	94%	0.935	78%	0.775	S	S	*	*			trans	-64.7	105	167.7	-75.2	178.2	-19.3	0	0	108.5
56	V	32.9	Very low	38	Very low	122 Å²	122	144.7 Å²	144.7	74%	0.739	78%	0.775	S	S	*	*			trans	-73.3	128	169.2	-172.8	0	0	0	0	107.5	Q54 T58	Q54-V56 PolarHBondContact O-N 3.38Å; Q54-V56 VanDerWaalsContact O-N 3.08Å; V56-T58 PolarHBondContact O-N 3.37Å; V56-T58 VanDerWaalsContact O-N 3.14Å
57	P	30.9	Very low	38.8	Very low	109 Å²	109	143.9 Å²	143.9	71%	0.708	77%	0.771	S	S	*	*			trans	-62.4	119.5	173.8	-11.2	24	0	0	0	108.6	R59	P57-R59 PolarHBondContact O-N 2.91Å
58	T	37.1	Very low	39.7	Very low	149 Å²	149	143.7 Å²	143.7	91%	0.914	76%	0.764	S	S	*	*			trans	-70.1	80.1	166.2	49.9	0	0	0	0	108.4	V56	V56-T58 PolarHBondContact O-N 3.37Å; V56-T58 VanDerWaalsContact O-N 3.14Å
59	R	35.4	Very low	41	Very low	211 Å²	211	142.9 Å²	142.9	80%	0.796	75%	0.749	S	S	*	*			trans	-110.5	117.7	158.5	-154.2	176.9	-174.6	171.7	1.1	105.3	P57 L61	P57-R59 PolarHBondContact O-N 2.91Å; R59-L61 VanDerWaalsContact C-N 3.27Å; R59-L61 PolarHBondContact O-N 3.05Å
60	D	42.8	Very low	41.9	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	74%	0.741	S	S	*	*			trans	-52.3	91.6	174.5	-69.9	-46.1	0	0	0	110.1	W62 A63	D60-W62 PolarHBondContact O-N 3.06Å; D60-A63 HydrophobicContact CB-CB 4.2Å
61	L	37.3	Very low	43	Very low	122 Å²	122	135.5 Å²	135.5	64%	0.639	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-6.7	175.7	-82.7	158.1	0	0	0	111.5	R59 F65	R59-L61 VanDerWaalsContact C-N 3.27Å; R59-L61 PolarHBondContact O-N 3.05Å; L61-F65 WeakPolarHBondContact O-CE2 3.08Å
62	W	43.4	Very low	44.6	Very low	207 Å²	207	133.5 Å²	133.5	78%	0.784	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	4.1	-176.8	-57.2	105.8	0	0	0	114.1	D60 G64 F65	D60-W62 PolarHBondContact O-N 3.06Å; W62-G64 VanDerWaalsContact C-N 3.26Å; W62-G64 PolarHBondContact O-N 3.2Å; W62-F65 HydrophobicContact CE3-CD2 4.11Å; W62-F65 HydrophobicContact CZ3-CD2 4.39Å
63	A	38.3	Very low	45.9	Very low	91 Å²	91	131.5 Å²	131.5	75%	0.752	69%	0.69	S	S	*	*	S	Bend	trans	-85.2	9.8	177	0	0	0	0	0	113.9	D60	D60-A63 HydrophobicContact CB-CB 4.2Å
64	G	43.9	Very low	46.9	Very low	63 Å²	63	128.4 Å²	128.4	65%	0.649	67%	0.673	S	S	*	*	S	Bend	trans	-147	14.1	-169.8	0	0	0	0	0	116.9	W62 P66	W62-G64 VanDerWaalsContact C-N 3.26Å; W62-G64 PolarHBondContact O-N 3.2Å; G64-P66 WeakPolarHBondContact O-CD 3.49Å
65	F	46	Very low	48.3	Very low	145 Å²	145	126.4 Å²	126.4	64%	0.636	66%	0.664	S	S	*	*			trans	-91.4	116.3	170.9	-77.9	-77.1	0	0	0	109.7	L61 W62 Q67	L61-F65 WeakPolarHBondContact O-CE2 3.08Å; W62-F65 HydrophobicContact CE3-CD2 4.11Å; W62-F65 HydrophobicContact CZ3-CD2 4.39Å; F65-Q67 PolarHBondContact O-N 3.48Å
66	P	50.8	Low	50.1	Low	74 Å²	74	124.5 Å²	124.5	48%	0.481	65%	0.649	S	S	.	*			trans	-60.4	136.2	176.3	-18.8	31.3	0	0	0	109.7	G64 D68 Y69	G64-P66 WeakPolarHBondContact O-CD 3.49Å; P66-D68 HydrophobicContact CB-CB 4.39Å; P66-D68 PolarHBondContact O-N 3.45Å; P66-Y69 PolarHBondContact O-N 3.31Å; P66-Y69 VanDerWaalsContact O-N 3.08Å
67	Q	55.1	Low	51.5	Low	171 Å²	171	126.3 Å²	126.3	80%	0.799	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.6	-26.1	172.1	-82.1	-100.6	-30	0	0	113.2	F65 Y69 I70	F65-Q67 PolarHBondContact O-N 3.48Å; Q67-Y69 VanDerWaalsContact C-N 3.31Å; Q67-Y69 PolarHBondContact O-N 2.85Å; Q67-I70 PolarHBondContact O-N 3.24Å
68	D	55.7	Low	52.9	Low	110 Å²	110	123.5 Å²	123.5	59%	0.588	63%	0.626	S	S	*	*	H	α-helix	trans	-63.3	-24.6	180	-61.5	-29.3	0	0	0	115.1	P66 S71 L72	P66-D68 HydrophobicContact CB-CB 4.39Å; P66-D68 PolarHBondContact O-N 3.45Å; D68-S71 PolarHBondContact O-OG 3.15Å; D68-L72 PolarHBondContact O-N 3.18Å
69	Y	62.8	Low	54.1	Low	153 Å²	153	120.6 Å²	120.6	60%	0.6	61%	0.612	S	S	*	*	H	α-helix	trans	-79.7	-31	-178.6	-117.4	-91.7	0	0	0	113	P66 Q67 L73	P66-Y69 PolarHBondContact O-N 3.31Å; P66-Y69 VanDerWaalsContact O-N 3.08Å; Q67-Y69 VanDerWaalsContact C-N 3.31Å; Q67-Y69 PolarHBondContact O-N 2.85Å; Y69-L73 WeakPolarHBondContact O-CB 3.38Å; Y69-L73 WeakPolarHBondContact O-CG 3.4Å; Y69-L73 PolarHBondContact O-N 3.22Å
70	I	59.8	Low	55.4	Low	127 Å²	127	116.4 Å²	116.4	65%	0.651	60%	0.604	S	S	*	*	H	α-helix	trans	-69.1	-40	176.8	-64	-176.7	0	0	0	110	Q67 L73 S74	Q67-I70 PolarHBondContact O-N 3.24Å; I70-L73 PolarHBondContact O-N 3.13Å; I70-S74 WeakPolarHBondContact O-CB 3.48Å; I70-S74 PolarHBondContact O-N 3.16Å; I70-S74 PolarHBondContact O-OG 3.05Å
71	S	58.4	Low	55.9	Low	54 Å²	54	111.2 Å²	111.2	38%	0.378	59%	0.585	S	S	.	*	H	α-helix	trans	-68.2	-36	177.5	61.9	0	0	0	0	112.8	D68 S74 Q75	D68-S71 PolarHBondContact O-OG 3.15Å; S71-S74 VanDerWaalsContact CA-OG 3.31Å; S71-S74 WeakPolarHBondContact CA-OG 3.29Å; S71-S74 PolarHBondContact O-OG 2.84Å; S71-Q75 VanDerWaalsContact O-CB 3.32Å; S71-Q75 WeakPolarHBondContact O-CB 3.28Å; S71-Q75 WeakPolarHBondContact O-CG 3.48Å; S71-Q75 PolarHBondContact O-N 3.17Å
72	L	64.2	Low	56.8	Low	104 Å²	104	112.4 Å²	112.4	55%	0.545	59%	0.587	S	S	.	*	H	α-helix	trans	-66.8	-42.6	173.3	-106.9	140.6	0	0	0	112.3	D68 Q75 W76	D68-L72 PolarHBondContact O-N 3.18Å; L72-Q75 PolarHBondContact O-N 2.77Å; L72-W76 VanDerWaalsContact O-CB 3.31Å; L72-W76 WeakPolarHBondContact O-CB 3.5Å; L72-W76 PolarHBondContact O-N 3.28Å
73	L	62.8	Low	57.5	Low	103 Å²	103	105.5 Å²	105.5	54%	0.539	57%	0.569	S	S	.	*	H	α-helix	trans	-67.6	-40.3	175.4	-76.4	166.8	0	0	0	111.8	Y69 I70 W76 Y77	Y69-L73 WeakPolarHBondContact O-CB 3.38Å; Y69-L73 WeakPolarHBondContact O-CG 3.4Å; Y69-L73 PolarHBondContact O-N 3.22Å; I70-L73 PolarHBondContact O-N 3.13Å; L73-W76 PolarHBondContact O-N 3.16Å; L73-Y77 VanDerWaalsContact O-CB 3.25Å; L73-Y77 WeakPolarHBondContact O-CB 3.18Å; L73-Y77 PolarHBondContact O-N 2.53Å
74	S	59.8	Low	58.9	Low	57 Å²	57	103.6 Å²	103.6	40%	0.399	55%	0.55	S	S	.	.	H	α-helix	trans	-65.6	-43	173.3	63.5	0	0	0	0	111.5	I70 S71 W76 Y77 C78	I70-S74 WeakPolarHBondContact O-CB 3.48Å; I70-S74 PolarHBondContact O-N 3.16Å; I70-S74 PolarHBondContact O-OG 3.05Å; S71-S74 VanDerWaalsContact CA-OG 3.31Å; S71-S74 WeakPolarHBondContact CA-OG 3.29Å; S71-S74 PolarHBondContact O-OG 2.84Å; S74-W76 PolarHBondContact O-N 2.8Å; S74-Y77 PolarHBondContact O-N 3.33Å; S74-C78 WeakPolarHBondContact O-CB 3.27Å; S74-C78 PolarHBondContact O-N 2.9Å; S74-C78 PolarHBondContact O-SG 3.32Å
75	Q	63.6	Low	59.6	Low	140 Å²	140	110.8 Å²	110.8	65%	0.654	57%	0.567	S	S	*	*	H	α-helix	trans	-62.2	-41.5	175.5	-89.9	-179.7	-14.8	0	0	112.3	S71 L72 C78 S79	S71-Q75 VanDerWaalsContact O-CB 3.32Å; S71-Q75 WeakPolarHBondContact O-CB 3.28Å; S71-Q75 WeakPolarHBondContact O-CG 3.48Å; S71-Q75 PolarHBondContact O-N 3.17Å; L72-Q75 PolarHBondContact O-N 2.77Å; Q75-C78 CarbonylContact O-C 3.52Å; Q75-C78 PolarHBondContact O-N 3.08Å; Q75-S79 WeakPolarHBondContact O-CB 3.28Å; Q75-S79 PolarHBondContact O-N 3.07Å
76	W	71.6	Confident	60.3	Low	161 Å²	161	107.2 Å²	107.2	61%	0.61	56%	0.56	S	S	*	*	H	α-helix	trans	-66.8	-44	176.6	-179.6	82.1	0	0	0	111.6	L72 L73 S74 C78 S79 L80	L72-W76 VanDerWaalsContact O-CB 3.31Å; L72-W76 WeakPolarHBondContact O-CB 3.5Å; L72-W76 PolarHBondContact O-N 3.28Å; L73-W76 PolarHBondContact O-N 3.16Å; S74-W76 PolarHBondContact O-N 2.8Å; W76-C78 VanDerWaalsContact C-N 3.34Å; W76-C78 PolarHBondContact O-N 3.4Å; W76-S79 WeakPolarHBondContact O-CB 3.5Å; W76-S79 PolarHBondContact O-N 3.36Å; W76-S79 VanDerWaalsContact O-N 3.09Å; W76-S79 PolarHBondContact O-OG 3.41Å; W76-L80 HydrophobicContact CD2-CD1 3.87Å; W76-L80 VanDerWaalsContact CE2-CD1 3.45Å; W76-L80 HydrophobicContact CE3-CD1 4.06Å; W76-L80 HydrophobicContact CH2-CD1 3.51Å; W76-L80 HydrophobicContact CZ2-CD1 3.28Å; W76-L80 HydrophobicContact CZ3-CD1 3.89Å; W76-L80 PolarHBondContact O-N 3.16Å; W76-L80 VanDerWaalsContact O-N 3.15Å
77	Y	61.8	Low	61.1	Low	159 Å²	159	107.2 Å²	107.2	62%	0.624	57%	0.573	S	S	*	*	H	α-helix	trans	-62.4	-41	174.5	-172.2	-100.3	0	0	0	111.9	L73 S74 S79 L80 G81	L73-Y77 VanDerWaalsContact O-CB 3.25Å; L73-Y77 WeakPolarHBondContact O-CB 3.18Å; L73-Y77 PolarHBondContact O-N 2.53Å; S74-Y77 PolarHBondContact O-N 3.33Å; Y77-S79 VanDerWaalsContact C-N 3.27Å; Y77-S79 PolarHBondContact O-N 2.62Å; Y77-L80 CarbonylContact O-C 3.6Å; Y77-L80 PolarHBondContact O-N 2.81Å; Y77-L80 VanDerWaalsContact O-N 3.15Å; Y77-G81 PolarHBondContact O-N 3.46Å
78	C	60.4	Low	62.2	Low	51 Å²	51	100.1 Å²	100.1	35%	0.345	54%	0.54	S	S	.	.	H	α-helix	trans	-72.2	-15.6	173.5	-66.4	0	0	0	0	114.5	S74 Q75 W76 G81 C83	S74-C78 WeakPolarHBondContact O-CB 3.27Å; S74-C78 PolarHBondContact O-N 2.9Å; S74-C78 PolarHBondContact O-SG 3.32Å; Q75-C78 CarbonylContact O-C 3.52Å; Q75-C78 PolarHBondContact O-N 3.08Å; W76-C78 VanDerWaalsContact C-N 3.34Å; W76-C78 PolarHBondContact O-N 3.4Å; C78-G81 CarbonylContact C-O 3.55Å; C78-C83 WeakPolarHBondContact CA-SG 3.41Å; C78-C83 HydrophobicContact CB-CB 3.31Å; C78-C83 WeakPolarHBondContact CB-SG 3.34Å; C78-C83 WeakPolarHBondContact SG-CB 3.23Å; C78-C83 CovalentContact SG-SG 2.02Å; C78-C83 PolarHBondContact SG-SG 3.45Å
79	S	61.7	Low	63.4	Low	88 Å²	88	95.7 Å²	95.7	62%	0.615	52%	0.518	S	S	*	.	H	α-helix	trans	-82.4	-23.5	169.7	78.6	0	0	0	0	112	Q75 W76 Y77	Q75-S79 WeakPolarHBondContact O-CB 3.28Å; Q75-S79 PolarHBondContact O-N 3.07Å; W76-S79 WeakPolarHBondContact O-CB 3.5Å; W76-S79 PolarHBondContact O-N 3.36Å; W76-S79 VanDerWaalsContact O-N 3.09Å; W76-S79 PolarHBondContact O-OG 3.41Å; Y77-S79 VanDerWaalsContact C-N 3.27Å; Y77-S79 PolarHBondContact O-N 2.62Å
80	L	63	Low	64.7	Low	122 Å²	122	90.7 Å²	90.7	64%	0.639	50%	0.498	S	S	*	.	H	α-helix	trans	-99.5	-20.6	178.7	-66.6	175	0	0	0	113.3	W76 Y77	W76-L80 HydrophobicContact CD2-CD1 3.87Å; W76-L80 VanDerWaalsContact CE2-CD1 3.45Å; W76-L80 HydrophobicContact CE3-CD1 4.06Å; W76-L80 HydrophobicContact CH2-CD1 3.51Å; W76-L80 HydrophobicContact CZ2-CD1 3.28Å; W76-L80 HydrophobicContact CZ3-CD1 3.89Å; W76-L80 PolarHBondContact O-N 3.16Å; W76-L80 VanDerWaalsContact O-N 3.15Å; Y77-L80 CarbonylContact O-C 3.6Å; Y77-L80 PolarHBondContact O-N 2.81Å; Y77-L80 VanDerWaalsContact O-N 3.15Å
81	G	54.6	Low	66.2	Low	34 Å²	34	85.2 Å²	85.2	35%	0.351	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	160.7	176.6	0	0	0	0	0	112.4	Y77 C78 C83	Y77-G81 PolarHBondContact O-N 3.46Å; C78-G81 CarbonylContact C-O 3.55Å; G81-C83 PolarHBondContact O-N 2.85Å
82	Q	56.1	Low	67.7	Low	147 Å²	147	86.3 Å²	86.3	69%	0.687	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	88.1	173.6	-82.7	-174.5	12.6	0	0	109.5	C89 R158	Q82-C89 HydrophobicContact CB-CB 4.08Å; Q82-C89 VanDerWaalsContact CB-SG 3.58Å; Q82-C89 PolarHBondContact O-SG 3.33Å; Q82-R158 VanDerWaalsContact OE1-NH1 3.12Å
83	C	57.2	Low	69.1	Low	61 Å²	61	83 Å²	83	41%	0.412	46%	0.457	S	S	.	.			trans	-89.1	129.2	167.2	-72.2	0	0	0	0	110.4	C78 G81 C89	C78-C83 WeakPolarHBondContact CA-SG 3.41Å; C78-C83 HydrophobicContact CB-CB 3.31Å; C78-C83 WeakPolarHBondContact CB-SG 3.34Å; C78-C83 WeakPolarHBondContact SG-CB 3.23Å; C78-C83 CovalentContact SG-SG 2.02Å; C78-C83 PolarHBondContact SG-SG 3.45Å; G81-C83 PolarHBondContact O-N 2.85Å; C83-C89 VanDerWaalsContact C-SG 3.57Å
84	C	67.3	Low	70.7	Confident	51 Å²	51	81.2 Å²	81.2	35%	0.345	45%	0.448	S	S	.	.			trans	-127.9	149.7	173.1	-65.2	0	0	0	0	109.5	S86 G87 C89	C84-S86 PolarHBondContact O-N 3.35Å; C84-S86 VanDerWaalsContact O-N 3.14Å; C84-G87 PolarHBondContact O-N 3.01Å; C84-C89 HydrophobicContact CB-CB 4.01Å; C84-C89 WeakPolarHBondContact CB-SG 2.99Å; C84-C89 PolarHBondContact N-SG 3.33Å; C84-C89 VanDerWaalsContact N-SG 3.4Å; C84-C89 WeakPolarHBondContact SG-CA 3.35Å; C84-C89 WeakPolarHBondContact SG-CB 3.38Å; C84-C89 CovalentContact SG-SG 2.02Å; C84-C89 PolarHBondContact SG-SG 3.31Å
85	E	58.8	Low	72.4	Confident	215 Å²	215	80 Å²	80	100%	1.005	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.2	-177.4	-64.9	-177	163.8	0	0	112.7
86	S	60.7	Low	74	Confident	70 Å²	70	78.8 Å²	78.8	49%	0.49	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.5	179.5	44.8	0	0	0	0	114.5	C84 D88 I91	C84-S86 PolarHBondContact O-N 3.35Å; C84-S86 VanDerWaalsContact O-N 3.14Å; S86-D88 PolarHBondContact O-N 3.3Å; S86-D88 VanDerWaalsContact O-N 3.14Å; S86-D88 PolarHBondContact OG-O 3.31Å; S86-I91 PolarHBondContact OG-O 3.45Å
87	G	67.4	Low	75.2	Confident	73 Å²	73	71.8 Å²	71.8	75%	0.753	42%	0.417	S	S	*	.	S	Bend	trans	76.2	-17.9	-174.3	0	0	0	0	0	115.1	C84	C84-G87 PolarHBondContact O-N 3.01Å
88	D	77.9	Confident	76.9	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.123	39%	0.388	C	S	.	.			trans	-124.7	112.6	174.5	-174.8	-14	0	0	0	110.8	S86 R90 I91	S86-D88 PolarHBondContact O-N 3.3Å; S86-D88 VanDerWaalsContact O-N 3.14Å; S86-D88 PolarHBondContact OG-O 3.31Å; D88-R90 PolarHBondContact O-N 2.97Å; D88-R90 VanDerWaalsContact O-N 3.14Å; D88-R90 VanDerWaalsContact OD1-CB 3.26Å; D88-R90 WeakPolarHBondContact OD1-CB 3.44Å; D88-R90 WeakPolarHBondContact OD1-CG 3.37Å; D88-R90 IonicContact OD1-CZ 3.86Å; D88-R90 PolarHBondContact OD1-N 3.27Å; D88-R90 IonicContact OD1-NE 2.97Å; D88-R90 PolarHBondContact OD1-NE 3.19Å; D88-R90 IonicContact OD1-NH2 3.4Å; D88-R90 IonicContact OD2-CZ 3.34Å; D88-R90 IonicContact OD2-NE 3.14Å; D88-R90 PolarHBondContact OD2-NE 3.15Å; D88-R90 VanDerWaalsContact OD2-NE 3.14Å; D88-R90 IonicContact OD2-NH2 2.7Å; D88-R90 PolarHBondContact OD2-NH2 3.38Å; D88-I91 HydrophobicContact CB-CD1 4.12Å; D88-I91 PolarHBondContact O-N 2.63Å; D88-I91 VanDerWaalsContact O-N 3.11Å
89	C	82.5	Confident	78.7	Confident	16 Å²	16	63.4 Å²	63.4	11%	0.108	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-3.2	-177.8	-72.3	0	0	0	0	116.2	Q82 C83 C84	Q82-C89 HydrophobicContact CB-CB 4.08Å; Q82-C89 VanDerWaalsContact CB-SG 3.58Å; Q82-C89 PolarHBondContact O-SG 3.33Å; C83-C89 VanDerWaalsContact C-SG 3.57Å; C84-C89 HydrophobicContact CB-CB 4.01Å; C84-C89 WeakPolarHBondContact CB-SG 2.99Å; C84-C89 PolarHBondContact N-SG 3.33Å; C84-C89 VanDerWaalsContact N-SG 3.4Å; C84-C89 WeakPolarHBondContact SG-CA 3.35Å; C84-C89 WeakPolarHBondContact SG-CB 3.38Å; C84-C89 CovalentContact SG-SG 2.02Å; C84-C89 PolarHBondContact SG-SG 3.31Å
90	R	88.9	Confident	80.4	Confident	49 Å²	49	61.7 Å²	61.7	19%	0.185	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-23.7	171	-59.3	173.4	-66.4	178.1	4.5	111.5	D88 Y157 R158 E164 R198	D88-R90 PolarHBondContact O-N 2.97Å; D88-R90 VanDerWaalsContact O-N 3.14Å; D88-R90 VanDerWaalsContact OD1-CB 3.26Å; D88-R90 WeakPolarHBondContact OD1-CB 3.44Å; D88-R90 WeakPolarHBondContact OD1-CG 3.37Å; D88-R90 IonicContact OD1-CZ 3.86Å; D88-R90 PolarHBondContact OD1-N 3.27Å; D88-R90 IonicContact OD1-NE 2.97Å; D88-R90 PolarHBondContact OD1-NE 3.19Å; D88-R90 IonicContact OD1-NH2 3.4Å; D88-R90 IonicContact OD2-CZ 3.34Å; D88-R90 IonicContact OD2-NE 3.14Å; D88-R90 PolarHBondContact OD2-NE 3.15Å; D88-R90 VanDerWaalsContact OD2-NE 3.14Å; D88-R90 IonicContact OD2-NH2 2.7Å; D88-R90 PolarHBondContact OD2-NH2 3.38Å; R90-Y157 VanDerWaalsContact O-CA 3.3Å; R90-Y157 WeakPolarHBondContact O-CA 3.5Å; R90-R158 PolarHBondContact O-N 3.14Å; R90-E164 IonicContact NH1-OE2 2.95Å; R90-E164 PolarHBondContact NH1-OE2 2.79Å; R90-R198 PolarHBondContact NH2-O 3.23Å
91	I	91.4	Very high	82.1	Confident	12 Å²	12	57.4 Å²	57.4	6%	0.062	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-100	119.8	-176.8	-58.4	164.7	0	0	0	109.1	S86 D88 N93 Y157 P200 Q201	S86-I91 PolarHBondContact OG-O 3.45Å; D88-I91 HydrophobicContact CB-CD1 4.12Å; D88-I91 PolarHBondContact O-N 2.63Å; D88-I91 VanDerWaalsContact O-N 3.11Å; I91-N93 WeakPolarHBondContact CG2-ND2 3.39Å; I91-Y157 HydrophobicContact CG1-CD1 4.29Å; I91-Y157 HydrophobicContact CG1-CE1 4.14Å; I91-P200 HydrophobicContact CD1-CG 4.08Å; I91-Q201 HydrophobicContact CD1-CB 3.54Å; I91-Q201 HydrophobicContact CG1-CB 4.26Å
92	T	90.9	Very high	84.1	Confident	77 Å²	77	55.9 Å²	55.9	47%	0.472	33%	0.334	S	S	.	.			trans	-109.7	-36.2	-176.6	-53.6	0	0	0	0	112.6	N94 M156 R158	T92-N94 VanDerWaalsContact C-N 3.34Å; T92-N94 HydrophobicContact CG2-CB 4.26Å; T92-N94 PolarHBondContact O-N 3.34Å; T92-M156 PolarHBondContact N-O 2.92Å; T92-R158 PolarHBondContact OG1-N 2.93Å
93	N	93.5	Very high	86	Confident	34 Å²	34	55.7 Å²	55.7	18%	0.182	33%	0.333	C	S	.	.			trans	49.2	48.3	179.2	-67.6	-24.1	0	0	0	114.2	I91 I95 V124 M156 Q201	I91-N93 WeakPolarHBondContact CG2-ND2 3.39Å; N93-I95 PolarHBondContact O-N 2.96Å; N93-V124 HydrophobicContact CB-CG1 3.92Å; N93-V124 HydrophobicContact CB-CG2 4.14Å; N93-M156 PolarHBondContact N-O 3.49Å; N93-M156 VanDerWaalsContact N-O 3.15Å; N93-Q201 PolarHBondContact ND2-OE1 3.42Å; N93-Q201 VanDerWaalsContact ND2-OE1 3.14Å; N93-Q201 PolarHBondContact OD1-NE2 3.01Å
94	N	95	Very high	87.8	Confident	65 Å²	65	58.2 Å²	58.2	35%	0.348	34%	0.342	S	S	.	.			trans	-77.8	84.7	179.8	-173.1	2.6	0	0	0	112.1	T92 T96 G97 L98 N155	T92-N94 VanDerWaalsContact C-N 3.34Å; T92-N94 HydrophobicContact CG2-CB 4.26Å; T92-N94 PolarHBondContact O-N 3.34Å; N94-T96 PolarHBondContact OD1-OG1 3.44Å; N94-T96 VanDerWaalsContact OD1-OG1 3.06Å; N94-G97 PolarHBondContact O-N 3.42Å; N94-G97 PolarHBondContact OD1-N 3.42Å; N94-L98 WeakPolarHBondContact O-CB 3.26Å; N94-L98 PolarHBondContact O-N 3.45Å; N94-N155 WeakPolarHBondContact CB-O 3.17Å; N94-N155 PolarHBondContact N-O 2.83Å
95	I	96.6	Very high	89.2	Confident	32 Å²	32	60 Å²	60	16%	0.164	34%	0.343	C	S	.	.	H	α-helix	trans	-68.6	-35.8	-178.3	-56.1	-55.1	0	0	0	112.7	N93 L98 A99 L117 V120 Q121 V124	N93-I95 PolarHBondContact O-N 2.96Å; I95-L98 WeakPolarHBondContact O-CB 3.25Å; I95-L98 PolarHBondContact O-N 2.93Å; I95-A99 PolarHBondContact O-N 3.39Å; I95-L117 HydrophobicContact CG2-CD1 4.1Å; I95-V120 HydrophobicContact CD1-CG1 3.95Å; I95-Q121 HydrophobicContact CG2-CB 4.08Å; I95-Q121 HydrophobicContact CG2-CG 4.09Å; I95-V124 HydrophobicContact CD1-CB 4.22Å; I95-V124 HydrophobicContact CD1-CG1 4.48Å; I95-V124 HydrophobicContact CD1-CG2 4.02Å; I95-V124 HydrophobicContact CG1-CG1 4.47Å
96	T	96.9	Very high	91	Very high	115 Å²	115	50 Å²	50	71%	0.706	30%	0.297	S	S	*	.	H	α-helix	trans	-69.4	-40.2	177.8	51.2	0	0	0	0	111.2	N94 A99 S100	N94-T96 PolarHBondContact OD1-OG1 3.44Å; N94-T96 VanDerWaalsContact OD1-OG1 3.06Å; T96-A99 PolarHBondContact O-N 3.39Å; T96-S100 WeakPolarHBondContact O-CB 3.3Å; T96-S100 PolarHBondContact O-N 3.37Å
97	G	96.9	Very high	92.8	Very high	14 Å²	14	47.9 Å²	47.9	14%	0.144	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-45.5	169.8	0	0	0	0	0	112	N94 A99 S100 D101 N155	N94-G97 PolarHBondContact O-N 3.42Å; N94-G97 PolarHBondContact OD1-N 3.42Å; G97-A99 PolarHBondContact O-N 3.15Å; G97-S100 PolarHBondContact O-N 2.8Å; G97-D101 WeakPolarHBondContact O-CB 3.27Å; G97-D101 PolarHBondContact O-N 3.48Å; G97-N155 WeakPolarHBondContact CA-OD1 3.36Å
98	L	97.8	Very high	94.1	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-58.3	-46.5	176.7	177	60.9	0	0	0	111.8	N94 I95 D101 L102 L117 V120 I151 V152 N155	N94-L98 WeakPolarHBondContact O-CB 3.26Å; N94-L98 PolarHBondContact O-N 3.45Å; I95-L98 WeakPolarHBondContact O-CB 3.25Å; I95-L98 PolarHBondContact O-N 2.93Å; L98-D101 PolarHBondContact O-N 2.8Å; L98-L102 HydrophobicContact CD1-CD1 3.82Å; L98-L102 HydrophobicContact CD1-CG 4.01Å; L98-L102 HydrophobicContact CG-CD1 3.95Å; L98-L102 WeakPolarHBondContact O-CB 2.89Å; L98-L102 VanDerWaalsContact O-CG 3.24Å; L98-L102 WeakPolarHBondContact O-CG 3.29Å; L98-L102 PolarHBondContact O-N 2.76Å; L98-L117 HydrophobicContact CD2-CD1 4.34Å; L98-L117 HydrophobicContact CG-CD1 4.32Å; L98-V120 HydrophobicContact CD2-CB 3.85Å; L98-V120 HydrophobicContact CD2-CG1 3.72Å; L98-V120 HydrophobicContact CD2-CG2 4.28Å; L98-I151 HydrophobicContact CD1-CG2 3.72Å; L98-V152 HydrophobicContact CD1-CG2 4.22Å; L98-N155 HydrophobicContact CB-CB 3.95Å; L98-N155 HydrophobicContact CD1-CB 4.46Å; L98-N155 PolarHBondContact N-OD1 3.09Å; L98-N155 VanDerWaalsContact N-OD1 3.1Å
99	A	97.8	Very high	95.1	Very high	32 Å²	32	44 Å²	44	26%	0.264	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-46.5	177.9	0	0	0	0	0	111.9	I95 T96 G97 Q103 L117	I95-A99 PolarHBondContact O-N 3.39Å; T96-A99 PolarHBondContact O-N 3.39Å; G97-A99 PolarHBondContact O-N 3.15Å; A99-Q103 WeakPolarHBondContact O-CB 3.44Å; A99-Q103 PolarHBondContact O-N 3.2Å; A99-L117 HydrophobicContact CB-CD1 3.82Å; A99-L117 HydrophobicContact CB-CD2 3.82Å; A99-L117 HydrophobicContact CB-CG 4.5Å
100	S	97.9	Very high	95.8	Very high	53 Å²	53	45.7 Å²	45.7	37%	0.371	25%	0.251	S	S	.	.	H	α-helix	trans	-62.6	-46.7	178.3	-173.8	0	0	0	0	111.8	T96 G97 L102 Q103 L104	T96-S100 WeakPolarHBondContact O-CB 3.3Å; T96-S100 PolarHBondContact O-N 3.37Å; G97-S100 PolarHBondContact O-N 2.8Å; S100-L102 PolarHBondContact O-N 3.35Å; S100-Q103 PolarHBondContact O-N 3.33Å; S100-L104 WeakPolarHBondContact O-CB 3.15Å; S100-L104 VanDerWaalsContact O-CG 3.32Å; S100-L104 WeakPolarHBondContact O-CG 3.44Å; S100-L104 PolarHBondContact O-N 2.78Å
101	D	97.4	Very high	96.2	Very high	31 Å²	31	43.9 Å²	43.9	17%	0.166	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-41.6	-179.8	-85.9	-3.2	0	0	0	112.3	G97 L98 K105 I151 N155	G97-D101 WeakPolarHBondContact O-CB 3.27Å; G97-D101 PolarHBondContact O-N 3.48Å; L98-D101 PolarHBondContact O-N 2.8Å; D101-K105 HydrophobicContact CB-CD 4.31Å; D101-K105 WeakPolarHBondContact O-CB 3.38Å; D101-K105 WeakPolarHBondContact O-CG 3.36Å; D101-K105 PolarHBondContact O-N 3.15Å; D101-K105 WeakPolarHBondContact OD1-CE 3.22Å; D101-K105 IonicContact OD1-NZ 3.42Å; D101-K105 PolarHBondContact OD1-NZ 3.09Å; D101-K105 IonicContact OD2-NZ 2.59Å; D101-K105 PolarHBondContact OD2-NZ 3.2Å; D101-I151 HydrophobicContact CB-CG2 3.75Å; D101-N155 PolarHBondContact OD2-ND2 3.31Å; D101-N155 VanDerWaalsContact OD2-ND2 3.08Å
102	L	97.7	Very high	96.4	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-43.5	174.2	-73.8	172.2	0	0	0	111.3	L98 S100 L106 Q113 V116 L117 V148 I151	L98-L102 HydrophobicContact CD1-CD1 3.82Å; L98-L102 HydrophobicContact CD1-CG 4.01Å; L98-L102 HydrophobicContact CG-CD1 3.95Å; L98-L102 WeakPolarHBondContact O-CB 2.89Å; L98-L102 VanDerWaalsContact O-CG 3.24Å; L98-L102 WeakPolarHBondContact O-CG 3.29Å; L98-L102 PolarHBondContact O-N 2.76Å; S100-L102 PolarHBondContact O-N 3.35Å; L102-L106 HydrophobicContact CD2-CD2 4.04Å; L102-L106 VanDerWaalsContact O-CB 3.24Å; L102-L106 WeakPolarHBondContact O-CB 3.33Å; L102-L106 PolarHBondContact O-N 2.91Å; L102-Q113 HydrophobicContact CB-CG 4.28Å; L102-Q113 PolarHBondContact O-NE2 2.98Å; L102-V116 HydrophobicContact CD1-CG1 4.34Å; L102-L117 HydrophobicContact CD1-CB 4.17Å; L102-V148 HydrophobicContact CD2-CG1 4.16Å; L102-V148 HydrophobicContact CD2-CG2 4.43Å; L102-I151 HydrophobicContact CD2-CG2 4.27Å; L102-I151 HydrophobicContact CG-CG2 4.32Å
103	Q	96.2	Very high	96.7	Very high	143 Å²	143	42.1 Å²	42.1	67%	0.668	23%	0.231	S	C	*	.	H	α-helix	trans	-69.2	-41.9	-178.7	-174	178.6	8.8	0	0	112.7	A99 S100	A99-Q103 WeakPolarHBondContact O-CB 3.44Å; A99-Q103 PolarHBondContact O-N 3.2Å; S100-Q103 PolarHBondContact O-N 3.33Å
104	L	95.2	Very high	96.8	Very high	114 Å²	114	42.8 Å²	42.8	60%	0.597	24%	0.238	S	C	*	.	H	α-helix	trans	-84.3	-34.4	-173.5	-67.4	174	0	0	0	113.1	S100 H107	S100-L104 WeakPolarHBondContact O-CB 3.15Å; S100-L104 VanDerWaalsContact O-CG 3.32Å; S100-L104 WeakPolarHBondContact O-CG 3.44Å; S100-L104 PolarHBondContact O-N 2.78Å; L104-H107 PolarHBondContact O-CE1 2.83Å
105	K	95.5	Very high	96.9	Very high	87 Å²	87	40.6 Å²	40.6	38%	0.378	23%	0.227	S	C	.	.	H	α-helix	trans	-105.4	-25.6	-170.1	-51	176	-174.5	164.7	0	113.9	D101 F147 I151	D101-K105 HydrophobicContact CB-CD 4.31Å; D101-K105 WeakPolarHBondContact O-CB 3.38Å; D101-K105 WeakPolarHBondContact O-CG 3.36Å; D101-K105 PolarHBondContact O-N 3.15Å; D101-K105 WeakPolarHBondContact OD1-CE 3.22Å; D101-K105 IonicContact OD1-NZ 3.42Å; D101-K105 PolarHBondContact OD1-NZ 3.09Å; D101-K105 IonicContact OD2-NZ 2.59Å; D101-K105 PolarHBondContact OD2-NZ 3.2Å; K105-F147 HydrophobicContact CB-CE1 3.8Å; K105-F147 HydrophobicContact CB-CZ 3.78Å; K105-F147 HydrophobicContact CD-CZ 4.36Å; K105-F147 WeakPolarHBondContact O-CE1 3.5Å; K105-I151 HydrophobicContact CB-CD1 4.37Å
106	L	97.5	Very high	97	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.026	22%	0.22	C	C	.	.			trans	-97.4	99	-175.6	-174.8	67.8	0	0	0	111.6	L102 Q109 A112 Q113 F147 V148	L102-L106 HydrophobicContact CD2-CD2 4.04Å; L102-L106 VanDerWaalsContact O-CB 3.24Å; L102-L106 WeakPolarHBondContact O-CB 3.33Å; L102-L106 PolarHBondContact O-N 2.91Å; L106-Q109 HydrophobicContact CD1-CB 4.35Å; L106-Q109 HydrophobicContact CD1-CG 4.02Å; L106-Q109 HydrophobicContact CD2-CB 3.77Å; L106-Q109 HydrophobicContact CD2-CG 4.34Å; L106-Q109 HydrophobicContact CG-CB 3.86Å; L106-Q109 HydrophobicContact CG-CG 4.05Å; L106-A112 HydrophobicContact CD2-CB 4.46Å; L106-Q113 HydrophobicContact CB-CG 4.49Å; L106-Q113 HydrophobicContact CD2-CG 3.8Å; L106-Q113 HydrophobicContact CG-CG 4.47Å; L106-Q113 PolarHBondContact O-NE2 3.17Å; L106-F147 HydrophobicContact CD1-CD1 4.3Å; L106-V148 HydrophobicContact CD1-CG2 3.55Å; L106-V148 HydrophobicContact CD2-CG2 3.43Å; L106-V148 VanDerWaalsContact CD2-CG2 3.43Å; L106-V148 HydrophobicContact CG-CG2 4.09Å
107	H	97.1	Very high	97	Very high	26 Å²	26	35.8 Å²	35.8	12%	0.12	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	135.1	-176.5	-56.3	-55.3	0	0	0	113.4	L104 Q109 H312 L315 D319	L104-H107 PolarHBondContact O-CE1 2.83Å; H107-Q109 VanDerWaalsContact C-N 3.32Å; H107-Q109 PolarHBondContact O-N 3.44Å; H107-H312 HydrophobicContact CB-CB 4.36Å; H107-L315 HydrophobicContact CB-CB 4.37Å; H107-L315 HydrophobicContact CB-CD1 4.2Å; H107-D319 IonicContact CD2-OD2 2.77Å; H107-D319 IonicContact CE1-OD2 2.68Å; H107-D319 IonicContact NE2-OD2 2.95Å; H107-D319 PolarHBondContact NE2-OD2 3Å
108	G	96.4	Very high	97.1	Very high	15 Å²	15	42.2 Å²	42.2	16%	0.155	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	18	168.6	0	0	0	0	0	115.9	R265 H312	G108-R265 PolarHBondContact O-NE 3.31Å; G108-R265 PolarHBondContact O-NH2 3.35Å; G108-H312 VanDerWaalsContact CA-CD2 3.43Å; G108-H312 WeakPolarHBondContact CA-CD2 3.37Å; G108-H312 VanDerWaalsContact CA-NE2 3.25Å; G108-H312 WeakPolarHBondContact CA-NE2 3.21Å
109	Q	97.8	Very high	97	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.223	C	C	.	.			trans	-123.4	56.9	-178	-55.6	-60.7	-13.2	0	0	112.2	L106 H107 L111 A112 Q113 T143 F305 L306	L106-Q109 HydrophobicContact CD1-CB 4.35Å; L106-Q109 HydrophobicContact CD1-CG 4.02Å; L106-Q109 HydrophobicContact CD2-CB 3.77Å; L106-Q109 HydrophobicContact CD2-CG 4.34Å; L106-Q109 HydrophobicContact CG-CB 3.86Å; L106-Q109 HydrophobicContact CG-CG 4.05Å; H107-Q109 VanDerWaalsContact C-N 3.32Å; H107-Q109 PolarHBondContact O-N 3.44Å; Q109-L111 VanDerWaalsContact C-N 3.3Å; Q109-L111 PolarHBondContact O-N 2.77Å; Q109-A112 HydrophobicContact CB-CB 4Å; Q109-A112 PolarHBondContact O-N 3.12Å; Q109-Q113 VanDerWaalsContact O-CG 3.31Å; Q109-Q113 WeakPolarHBondContact O-CG 3.4Å; Q109-Q113 PolarHBondContact O-N 3.49Å; Q109-T143 PolarHBondContact NE2-O 3.19Å; Q109-T143 VanDerWaalsContact NE2-O 3.11Å; Q109-F305 HydrophobicContact CG-CD1 4.1Å; Q109-L306 PolarHBondContact NE2-O 3.43Å
110	H	97.2	Very high	97	Very high	50 Å²	50	40.9 Å²	40.9	23%	0.231	21%	0.211	C	C	.	.	H	α-helix	trans	-57.9	-40.4	-176.7	63.7	-65.9	0	0	0	112.8	S114 R265 E266 I268	H110-S114 PolarHBondContact O-N 3.15Å; H110-S114 VanDerWaalsContact O-N 3.13Å; H110-S114 PolarHBondContact O-OG 2.64Å; H110-R265 PolarHBondContact CE1-O 2.84Å; H110-R265 VanDerWaalsContact CE1-O 3.22Å; H110-E266 PolarHBondContact NE2-O 3.49Å; H110-I268 PolarHBondContact NE2-O 3.43Å
111	L	96.6	Very high	96.9	Very high	12 Å²	12	42.8 Å²	42.8	6%	0.063	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-52.6	175.4	-65.2	179	0	0	0	111.5	Q109 Q113 S114 V115 I268 M270 L273 P304	Q109-L111 VanDerWaalsContact C-N 3.3Å; Q109-L111 PolarHBondContact O-N 2.77Å; L111-Q113 PolarHBondContact O-N 2.85Å; L111-S114 PolarHBondContact O-N 2.92Å; L111-S114 PolarHBondContact O-OG 2.71Å; L111-V115 WeakPolarHBondContact O-CG2 3.5Å; L111-V115 PolarHBondContact O-N 3.33Å; L111-I268 HydrophobicContact CD1-CG2 4.34Å; L111-I268 WeakPolarHBondContact CD2-O 3.22Å; L111-M270 HydrophobicContact CB-SD 4.34Å; L111-M270 HydrophobicContact CD1-SD 4.32Å; L111-M270 HydrophobicContact CD2-CG 4.21Å; L111-M270 HydrophobicContact CD2-SD 4.33Å; L111-L273 HydrophobicContact CD1-CD1 3.54Å; L111-P304 HydrophobicContact CB-CG 4.23Å; L111-P304 HydrophobicContact CD1-CG 3.87Å
112	A	97.1	Very high	96.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-41.8	-178.9	0	0	0	0	0	112.6	L106 Q109 S114 V116 V303 F305	L106-A112 HydrophobicContact CD2-CB 4.46Å; Q109-A112 HydrophobicContact CB-CB 4Å; Q109-A112 PolarHBondContact O-N 3.12Å; A112-S114 VanDerWaalsContact C-N 3.33Å; A112-S114 PolarHBondContact O-N 3.22Å; A112-V116 VanDerWaalsContact O-CB 3.28Å; A112-V116 WeakPolarHBondContact O-CB 3.47Å; A112-V116 VanDerWaalsContact O-CG2 3.25Å; A112-V116 WeakPolarHBondContact O-CG2 3.3Å; A112-V116 PolarHBondContact O-N 2.68Å; A112-V303 HydrophobicContact CB-CG1 3.67Å; A112-F305 HydrophobicContact CB-CE1 4.14Å; A112-F305 HydrophobicContact CB-CE2 4.16Å; A112-F305 HydrophobicContact CB-CZ 3.94Å
113	Q	97.1	Very high	96.7	Very high	51 Å²	51	43.6 Å²	43.6	24%	0.238	23%	0.227	C	C	.	.	H	α-helix	trans	-56	-49.6	175.2	-68.8	176.6	12.2	0	0	111	L102 L106 Q109 L111 L117	L102-Q113 HydrophobicContact CB-CG 4.28Å; L102-Q113 PolarHBondContact O-NE2 2.98Å; L106-Q113 HydrophobicContact CB-CG 4.49Å; L106-Q113 HydrophobicContact CD2-CG 3.8Å; L106-Q113 HydrophobicContact CG-CG 4.47Å; L106-Q113 PolarHBondContact O-NE2 3.17Å; Q109-Q113 VanDerWaalsContact O-CG 3.31Å; Q109-Q113 WeakPolarHBondContact O-CG 3.4Å; Q109-Q113 PolarHBondContact O-N 3.49Å; L111-Q113 PolarHBondContact O-N 2.85Å; Q113-L117 VanDerWaalsContact O-CB 3.23Å; Q113-L117 WeakPolarHBondContact O-CB 3.44Å; Q113-L117 PolarHBondContact O-N 3.2Å; Q113-L117 VanDerWaalsContact O-N 3.15Å
114	S	95.9	Very high	96.5	Very high	49 Å²	49	38.4 Å²	38.4	34%	0.343	21%	0.205	S	C	.	.	H	α-helix	trans	-67.4	-43.2	-175.5	75.3	0	0	0	0	112.9	H110 L111 A112 K118	H110-S114 PolarHBondContact O-N 3.15Å; H110-S114 VanDerWaalsContact O-N 3.13Å; H110-S114 PolarHBondContact O-OG 2.64Å; L111-S114 PolarHBondContact O-N 2.92Å; L111-S114 PolarHBondContact O-OG 2.71Å; A112-S114 VanDerWaalsContact C-N 3.33Å; A112-S114 PolarHBondContact O-N 3.22Å; S114-K118 WeakPolarHBondContact O-CB 3.49Å; S114-K118 VanDerWaalsContact O-CG 3.26Å; S114-K118 WeakPolarHBondContact O-CG 3.39Å; S114-K118 PolarHBondContact O-N 3.24Å
115	V	96.8	Very high	96.4	Very high	19 Å²	19	37.3 Å²	37.3	12%	0.115	21%	0.207	C	C	.	.	H	α-helix	trans	-72	-48	-176.9	176.1	0	0	0	0	110.5	L111 L117 K118 A119 M270 F301 V303	L111-V115 WeakPolarHBondContact O-CG2 3.5Å; L111-V115 PolarHBondContact O-N 3.33Å; V115-L117 PolarHBondContact O-N 3.11Å; V115-K118 PolarHBondContact O-N 3.28Å; V115-A119 WeakPolarHBondContact O-CB 3.38Å; V115-A119 PolarHBondContact O-N 3.22Å; V115-M270 HydrophobicContact CG2-SD 4.26Å; V115-F301 HydrophobicContact CG1-CB 3.83Å; V115-F301 HydrophobicContact CG1-CD1 4.37Å; V115-F301 HydrophobicContact CG1-CG 4.22Å; V115-V303 HydrophobicContact CG1-CG2 3.83Å
116	V	97.9	Very high	96.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-44.3	-178.4	173.3	0	0	0	0	111	L102 A112 A119 V120 F137 V148 V152 V303	L102-V116 HydrophobicContact CD1-CG1 4.34Å; A112-V116 VanDerWaalsContact O-CB 3.28Å; A112-V116 WeakPolarHBondContact O-CB 3.47Å; A112-V116 VanDerWaalsContact O-CG2 3.25Å; A112-V116 WeakPolarHBondContact O-CG2 3.3Å; A112-V116 PolarHBondContact O-N 2.68Å; V116-A119 PolarHBondContact O-N 2.9Å; V116-V120 HydrophobicContact CG1-CG2 4.25Å; V116-V120 WeakPolarHBondContact O-CB 3.05Å; V116-V120 VanDerWaalsContact O-CG2 3.32Å; V116-V120 WeakPolarHBondContact O-CG2 3.46Å; V116-V120 PolarHBondContact O-N 3.29Å; V116-F137 HydrophobicContact CG2-CE1 3.86Å; V116-F137 HydrophobicContact CG2-CZ 3.75Å; V116-V148 HydrophobicContact CG1-CG1 4.2Å; V116-V148 HydrophobicContact CG2-CG1 4.13Å; V116-V152 HydrophobicContact CG1-CG2 3.63Å; V116-V303 HydrophobicContact CG2-CG1 4.04Å; V116-V303 HydrophobicContact CG2-CG2 4.42Å
117	L	98	Very high	95.5	Very high	45 Å²	45	40.5 Å²	40.5	24%	0.236	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-49.9	178.7	179.5	59.6	0	0	0	111.4	I95 L98 A99 L102 Q113 V115 Q121	I95-L117 HydrophobicContact CG2-CD1 4.1Å; L98-L117 HydrophobicContact CD2-CD1 4.34Å; L98-L117 HydrophobicContact CG-CD1 4.32Å; A99-L117 HydrophobicContact CB-CD1 3.82Å; A99-L117 HydrophobicContact CB-CD2 3.82Å; A99-L117 HydrophobicContact CB-CG 4.5Å; L102-L117 HydrophobicContact CD1-CB 4.17Å; Q113-L117 VanDerWaalsContact O-CB 3.23Å; Q113-L117 WeakPolarHBondContact O-CB 3.44Å; Q113-L117 PolarHBondContact O-N 3.2Å; Q113-L117 VanDerWaalsContact O-N 3.15Å; V115-L117 PolarHBondContact O-N 3.11Å; L117-Q121 WeakPolarHBondContact O-CB 3.4Å; L117-Q121 PolarHBondContact O-N 3.13Å
118	K	97.2	Very high	94.8	Very high	149 Å²	149	46.2 Å²	46.2	65%	0.648	26%	0.259	S	S	*	.	H	α-helix	trans	-63.7	-42.5	179.9	-73	176.3	-178.6	178.3	0	112.3	S114 V115 G122	S114-K118 WeakPolarHBondContact O-CB 3.49Å; S114-K118 VanDerWaalsContact O-CG 3.26Å; S114-K118 WeakPolarHBondContact O-CG 3.39Å; S114-K118 PolarHBondContact O-N 3.24Å; V115-K118 PolarHBondContact O-N 3.28Å; K118-G122 PolarHBondContact O-N 3.31Å
119	A	96.8	Very high	94.3	Very high	5 Å²	5	46.9 Å²	46.9	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-66.7	-47.4	-178.2	0	0	0	0	0	112	V115 V116 G122 F123 L133 L135 F301	V115-A119 WeakPolarHBondContact O-CB 3.38Å; V115-A119 PolarHBondContact O-N 3.22Å; V116-A119 PolarHBondContact O-N 2.9Å; A119-G122 PolarHBondContact O-N 2.68Å; A119-F123 WeakPolarHBondContact O-CB 3.23Å; A119-F123 PolarHBondContact O-N 2.97Å; A119-L133 HydrophobicContact CB-CD1 4.22Å; A119-L135 HydrophobicContact CB-CD1 4.49Å; A119-L135 HydrophobicContact CB-CD2 3.81Å; A119-F301 HydrophobicContact CB-CD2 3.67Å; A119-F301 HydrophobicContact CB-CE2 3.75Å; A119-F301 HydrophobicContact CB-CG 4.4Å
120	V	96.8	Very high	93.8	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-42.2	178	176.1	0	0	0	0	110.8	I95 L98 V116 G122 F123 V124 L133 V152 M156	I95-V120 HydrophobicContact CD1-CG1 3.95Å; L98-V120 HydrophobicContact CD2-CB 3.85Å; L98-V120 HydrophobicContact CD2-CG1 3.72Å; L98-V120 HydrophobicContact CD2-CG2 4.28Å; V116-V120 HydrophobicContact CG1-CG2 4.25Å; V116-V120 WeakPolarHBondContact O-CB 3.05Å; V116-V120 VanDerWaalsContact O-CG2 3.32Å; V116-V120 WeakPolarHBondContact O-CG2 3.46Å; V116-V120 PolarHBondContact O-N 3.29Å; V120-G122 PolarHBondContact O-N 3.03Å; V120-F123 PolarHBondContact O-N 3.39Å; V120-V124 HydrophobicContact CG1-CG2 4.4Å; V120-V124 WeakPolarHBondContact O-CG2 3.38Å; V120-V124 PolarHBondContact O-N 3.14Å; V120-L133 HydrophobicContact CG2-CD2 4.42Å; V120-V152 HydrophobicContact CG2-CG1 4.37Å; V120-M156 HydrophobicContact CG1-CE 4.38Å; V120-M156 HydrophobicContact CG1-CG 4.23Å; V120-M156 HydrophobicContact CG1-SD 3.77Å
121	Q	96.4	Very high	93.4	Very high	92 Å²	92	49.7 Å²	49.7	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-59.4	-47.4	175.1	-177.3	175.9	17.6	0	0	111.4	I95 L117 F123 V124 S125	I95-Q121 HydrophobicContact CG2-CB 4.08Å; I95-Q121 HydrophobicContact CG2-CG 4.09Å; L117-Q121 WeakPolarHBondContact O-CB 3.4Å; L117-Q121 PolarHBondContact O-N 3.13Å; Q121-F123 VanDerWaalsContact C-N 3.35Å; Q121-F123 PolarHBondContact O-N 3.07Å; Q121-V124 PolarHBondContact O-N 3.28Å; Q121-S125 WeakPolarHBondContact O-CB 3.45Å; Q121-S125 PolarHBondContact O-N 3.22Å; Q121-S125 PolarHBondContact O-OG 3.04Å; Q121-S125 VanDerWaalsContact O-OG 3.07Å
122	G	95.4	Very high	93.3	Very high	41 Å²	41	49.2 Å²	49.2	42%	0.423	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-42.7	177.4	0	0	0	0	0	112.9	K118 A119 V120 S125 N126	K118-G122 PolarHBondContact O-N 3.31Å; A119-G122 PolarHBondContact O-N 2.68Å; V120-G122 PolarHBondContact O-N 3.03Å; G122-S125 PolarHBondContact O-N 3.29Å; G122-N126 WeakPolarHBondContact O-CB 3.41Å; G122-N126 PolarHBondContact O-N 2.93Å
123	F	94.9	Very high	93.2	Very high	11 Å²	11	49.8 Å²	49.8	5%	0.048	28%	0.278	C	S	.	.	H	α-helix	trans	-64.8	-39.6	176.5	170.7	-98.5	0	0	0	113.3	A119 V120 Q121 L133 M156 Q201 R237 V239	A119-F123 WeakPolarHBondContact O-CB 3.23Å; A119-F123 PolarHBondContact O-N 2.97Å; V120-F123 PolarHBondContact O-N 3.39Å; Q121-F123 VanDerWaalsContact C-N 3.35Å; Q121-F123 PolarHBondContact O-N 3.07Å; F123-L133 HydrophobicContact CB-CB 4.16Å; F123-L133 HydrophobicContact CB-CD2 3.77Å; F123-L133 HydrophobicContact CB-CG 4.43Å; F123-L133 HydrophobicContact CD2-CB 3.57Å; F123-L133 HydrophobicContact CE2-CB 4.16Å; F123-L133 HydrophobicContact CG-CB 3.91Å; F123-L133 HydrophobicContact CG-CD2 4.07Å; F123-M156 HydrophobicContact CD1-CE 4.28Å; F123-M156 HydrophobicContact CE1-CE 4.14Å; F123-Q201 HydrophobicContact CE1-CG 4.06Å; F123-Q201 HydrophobicContact CZ-CG 4.24Å; F123-R237 WeakPolarHBondContact CZ-O 3.03Å; F123-R237 PolarHBondContact O-NH1 3.11Å; F123-V239 HydrophobicContact CD1-CG2 3.96Å; F123-V239 HydrophobicContact CE1-CG2 3.47Å; F123-V239 VanDerWaalsContact CE1-CG2 3.47Å; F123-V239 HydrophobicContact CE2-CG2 4.17Å; F123-V239 HydrophobicContact CG-CG2 4.5Å; F123-V239 HydrophobicContact CZ-CG2 3.59Å
124	V	93.4	Very high	93.1	Very high	34 Å²	34	47.3 Å²	47.3	21%	0.206	27%	0.267	C	S	.	.	H	α-helix	trans	-71.9	-40.8	177.6	169.9	0	0	0	0	111.1	N93 I95 V120 Q121 N126	N93-V124 HydrophobicContact CB-CG1 3.92Å; N93-V124 HydrophobicContact CB-CG2 4.14Å; I95-V124 HydrophobicContact CD1-CB 4.22Å; I95-V124 HydrophobicContact CD1-CG1 4.48Å; I95-V124 HydrophobicContact CD1-CG2 4.02Å; I95-V124 HydrophobicContact CG1-CG1 4.47Å; V120-V124 HydrophobicContact CG1-CG2 4.4Å; V120-V124 WeakPolarHBondContact O-CG2 3.38Å; V120-V124 PolarHBondContact O-N 3.14Å; Q121-V124 PolarHBondContact O-N 3.28Å; V124-N126 VanDerWaalsContact C-N 3.33Å; V124-N126 PolarHBondContact O-N 3.37Å
125	S	93	Very high	93.1	Very high	90 Å²	90	45 Å²	45	63%	0.629	25%	0.25	S	S	*	.	H	α-helix	trans	-74.3	-19.3	-179.3	-62	0	0	0	0	114.1	Q121 G122 P127	Q121-S125 WeakPolarHBondContact O-CB 3.45Å; Q121-S125 PolarHBondContact O-N 3.22Å; Q121-S125 PolarHBondContact O-OG 3.04Å; Q121-S125 VanDerWaalsContact O-OG 3.07Å; G122-S125 PolarHBondContact O-N 3.29Å; S125-P127 VanDerWaalsContact O-CD 3.31Å; S125-P127 WeakPolarHBondContact O-CD 3.41Å
126	N	91.1	Very high	93	Very high	83 Å²	83	44.3 Å²	44.3	44%	0.444	25%	0.246	S	C	.	.			trans	-115.1	84.2	178.4	-172	14	0	0	0	111.8	G122 V124 E128 S129	G122-N126 WeakPolarHBondContact O-CB 3.41Å; G122-N126 PolarHBondContact O-N 2.93Å; V124-N126 VanDerWaalsContact C-N 3.33Å; V124-N126 PolarHBondContact O-N 3.37Å; N126-E128 PolarHBondContact O-N 3.26Å; N126-S129 PolarHBondContact O-N 3.03Å
127	P	82.4	Confident	92.9	Very high	76 Å²	76	44.3 Å²	44.3	49%	0.494	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-25.9	179.5	26.1	-33.2	0	0	0	113.5	S125 S129	S125-P127 VanDerWaalsContact O-CD 3.31Å; S125-P127 WeakPolarHBondContact O-CD 3.41Å; P127-S129 VanDerWaalsContact C-N 3.25Å; P127-S129 PolarHBondContact O-N 3.21Å
128	E	83.6	Confident	92.6	Very high	146 Å²	146	42.3 Å²	42.3	68%	0.682	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	24.5	-178.7	-62.3	-59.8	146.7	0	0	113.1	N126 N130	N126-E128 PolarHBondContact O-N 3.26Å; E128-N130 PolarHBondContact O-N 2.98Å
129	S	85.6	Confident	92.4	Very high	29 Å²	29	35.2 Å²	35.2	20%	0.203	21%	0.205	C	C	.	.			trans	-58.3	134.5	175.9	-175.4	0	0	0	0	110.9	N126 P127 K131 R236	N126-S129 PolarHBondContact O-N 3.03Å; P127-S129 VanDerWaalsContact C-N 3.25Å; P127-S129 PolarHBondContact O-N 3.21Å; S129-K131 PolarHBondContact O-N 2.96Å; S129-K131 PolarHBondContact OG-N 3.01Å; S129-K131 PolarHBondContact OG-O 3.06Å; S129-R236 WeakPolarHBondContact O-CB 3.44Å; S129-R236 WeakPolarHBondContact O-CD 3.4Å
130	N	85.8	Confident	92.2	Very high	99 Å²	99	38.8 Å²	38.8	53%	0.529	22%	0.217	S	C	.	.	S	Bend	trans	-79.8	-0.7	177.6	-67.4	-28.4	0	0	0	113.3	E128	E128-N130 PolarHBondContact O-N 2.98Å
131	K	90.3	Very high	92	Very high	11 Å²	11	40.5 Å²	40.5	5%	0.048	23%	0.229	C	C	.	.	S	Bend	trans	-146.9	144.3	-177.4	-169.9	-165.1	177.8	-170.8	0	110.5	S129 M224 H297 L298 D300	S129-K131 PolarHBondContact O-N 2.96Å; S129-K131 PolarHBondContact OG-N 3.01Å; S129-K131 PolarHBondContact OG-O 3.06Å; K131-M224 WeakPolarHBondContact CE-O 3.31Å; K131-H297 PolarHBondContact NZ-O 3.32Å; K131-L298 WeakPolarHBondContact CE-O 3.4Å; K131-L298 VanDerWaalsContact NZ-C 3.33Å; K131-L298 PolarHBondContact NZ-O 2.88Å; K131-D300 WeakPolarHBondContact CD-OD1 3.32Å; K131-D300 WeakPolarHBondContact CE-OD1 3.38Å; K131-D300 IonicContact NZ-OD1 2.59Å; K131-D300 PolarHBondContact NZ-OD1 3.1Å; K131-D300 IonicContact NZ-OD2 3.74Å
132	P	93.9	Very high	91.8	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.019	22%	0.221	C	C	.	.			trans	-59.8	150.5	166.6	25.3	-36.1	0	0	0	112.7	T134 Y223 Y235 A238 F240	P132-T134 PolarHBondContact O-N 3.03Å; P132-Y223 WeakPolarHBondContact CG-O 3.41Å; P132-Y235 WeakPolarHBondContact CB-O 3.34Å; P132-A238 WeakPolarHBondContact CA-O 3.24Å; P132-A238 HydrophobicContact CB-CB 4.24Å; P132-A238 WeakPolarHBondContact CB-O 3.41Å; P132-F240 HydrophobicContact CB-CD2 3.98Å; P132-F240 HydrophobicContact CB-CE2 3.92Å; P132-F240 HydrophobicContact CG-CD2 4.33Å; P132-F240 HydrophobicContact CG-CE2 4.12Å
133	L	95.6	Very high	91.9	Very high	11 Å²	11	35.5 Å²	35.5	6%	0.058	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	121.8	173.4	175.3	65.1	0	0	0	110.1	A119 V120 F123 L135 A238 V239 F240 F301	A119-L133 HydrophobicContact CB-CD1 4.22Å; V120-L133 HydrophobicContact CG2-CD2 4.42Å; F123-L133 HydrophobicContact CB-CB 4.16Å; F123-L133 HydrophobicContact CB-CD2 3.77Å; F123-L133 HydrophobicContact CB-CG 4.43Å; F123-L133 HydrophobicContact CD2-CB 3.57Å; F123-L133 HydrophobicContact CE2-CB 4.16Å; F123-L133 HydrophobicContact CG-CB 3.91Å; F123-L133 HydrophobicContact CG-CD2 4.07Å; L133-L135 HydrophobicContact CD1-CD2 3.97Å; L133-L135 HydrophobicContact CD1-CG 4.33Å; L133-L135 HydrophobicContact CD2-CD1 4.37Å; L133-L135 HydrophobicContact CD2-CG 4.4Å; L133-L135 HydrophobicContact CG-CD2 4.4Å; L133-L135 HydrophobicContact CG-CG 4.22Å; L133-A238 PolarHBondContact N-O 3.5Å; L133-A238 VanDerWaalsContact N-O 3.11Å; L133-V239 HydrophobicContact CB-CG1 4.35Å; L133-V239 HydrophobicContact CB-CG2 4.3Å; L133-V239 HydrophobicContact CD2-CG1 4.09Å; L133-V239 HydrophobicContact CG-CG1 4.29Å; L133-V239 CarbonylContact O-C 3.47Å; L133-V239 VanDerWaalsContact O-CA 3.29Å; L133-V239 WeakPolarHBondContact O-CA 3.48Å; L133-F240 PolarHBondContact O-N 3Å; L133-F301 HydrophobicContact CD1-CD2 4.2Å; L133-F301 HydrophobicContact CD1-CE2 4.21Å
134	T	95.3	Very high	91.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	114.6	176.2	-59.3	0	0	0	0	111.1	P132 M224 F240 F242 L298 I299 D300 F301	P132-T134 PolarHBondContact O-N 3.03Å; T134-M224 HydrophobicContact CG2-CE 3.33Å; T134-F240 WeakPolarHBondContact CA-O 3.22Å; T134-F240 HydrophobicContact CG2-CB 4.32Å; T134-F242 HydrophobicContact CG2-CD2 4.14Å; T134-F242 HydrophobicContact CG2-CE2 3.9Å; T134-L298 VanDerWaalsContact CB-O 3.24Å; T134-L298 WeakPolarHBondContact CB-O 3.35Å; T134-L298 WeakPolarHBondContact CG2-O 3.11Å; T134-L298 PolarHBondContact OG1-O 2.84Å; T134-I299 HydrophobicContact CG2-CB 4.36Å; T134-I299 HydrophobicContact CG2-CG1 4.06Å; T134-D300 PolarHBondContact N-OD2 3.01Å; T134-D300 WeakPolarHBondContact O-CB 3.19Å; T134-D300 PolarHBondContact O-N 2.94Å; T134-F301 PolarHBondContact O-N 3.49Å
135	L	95.3	Very high	92.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.7	173.6	-53	178.7	0	0	0	110.7	A119 L133 F137 F240 L241 F242 F301	A119-L135 HydrophobicContact CB-CD1 4.49Å; A119-L135 HydrophobicContact CB-CD2 3.81Å; L133-L135 HydrophobicContact CD1-CD2 3.97Å; L133-L135 HydrophobicContact CD1-CG 4.33Å; L133-L135 HydrophobicContact CD2-CD1 4.37Å; L133-L135 HydrophobicContact CD2-CG 4.4Å; L133-L135 HydrophobicContact CG-CD2 4.4Å; L133-L135 HydrophobicContact CG-CG 4.22Å; L135-F137 HydrophobicContact CB-CD1 4.31Å; L135-F137 HydrophobicContact CB-CE1 3.82Å; L135-F137 HydrophobicContact CD1-CE1 4.09Å; L135-F137 HydrophobicContact CD1-CZ 4.48Å; L135-F240 PolarHBondContact N-O 3.33Å; L135-L241 HydrophobicContact CB-CD2 3.61Å; L135-L241 HydrophobicContact CD1-CD2 3.63Å; L135-L241 HydrophobicContact CG-CD2 3.85Å; L135-L241 WeakPolarHBondContact O-CA 3.27Å; L135-F242 PolarHBondContact O-N 3.27Å; L135-F301 HydrophobicContact CD2-CB 3.67Å; L135-F301 HydrophobicContact CD2-CD2 3.64Å; L135-F301 HydrophobicContact CD2-CG 4.1Å
136	S	93.6	Very high	92.3	Very high	4 Å²	4	34.3 Å²	34.3	3%	0.028	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.1	173.8	-160.7	0	0	0	0	110.5	H138 F242 F301 V303	S136-H138 WeakPolarHBondContact CB-NE2 3.34Å; S136-H138 PolarHBondContact O-CD2 3.17Å; S136-H138 PolarHBondContact OG-NE2 3.45Å; S136-F242 CarbonylContact C-O 3.58Å; S136-F301 PolarHBondContact N-O 3.32Å; S136-V303 PolarHBondContact O-N 2.89Å
137	F	95.8	Very high	92.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127	-176.5	-66.8	5.4	0	0	0	109.9	V116 L135 K145 V148 L241 F242 L243 S244 V303 F305	V116-F137 HydrophobicContact CG2-CE1 3.86Å; V116-F137 HydrophobicContact CG2-CZ 3.75Å; L135-F137 HydrophobicContact CB-CD1 4.31Å; L135-F137 HydrophobicContact CB-CE1 3.82Å; L135-F137 HydrophobicContact CD1-CE1 4.09Å; L135-F137 HydrophobicContact CD1-CZ 4.48Å; F137-K145 HydrophobicContact CB-CB 4.41Å; F137-K145 HydrophobicContact CB-CD 4.21Å; F137-K145 HydrophobicContact CB-CG 4.25Å; F137-K145 HydrophobicContact CD2-CB 4.46Å; F137-V148 HydrophobicContact CE2-CB 3.95Å; F137-V148 HydrophobicContact CE2-CG1 3.67Å; F137-V148 HydrophobicContact CZ-CG1 3.91Å; F137-L241 HydrophobicContact CZ-CD2 4.49Å; F137-F242 PolarHBondContact N-O 2.96Å; F137-L243 HydrophobicContact CB-CD2 3.72Å; F137-L243 HydrophobicContact CD2-CD2 3.25Å; F137-L243 HydrophobicContact CE2-CD2 3.99Å; F137-L243 HydrophobicContact CG-CD2 3.68Å; F137-S244 PolarHBondContact O-N 3.02Å; F137-V303 WeakPolarHBondContact CA-O 3.36Å; F137-V303 HydrophobicContact CD1-CB 3.56Å; F137-V303 HydrophobicContact CD1-CG1 4.13Å; F137-V303 HydrophobicContact CD1-CG2 3.7Å; F137-V303 HydrophobicContact CE1-CB 3.97Å; F137-V303 HydrophobicContact CE1-CG1 4.25Å; F137-V303 HydrophobicContact CE1-CG2 3.72Å; F137-V303 HydrophobicContact CG-CB 4.41Å; F137-F305 HydrophobicContact CB-CD2 4.21Å; F137-F305 HydrophobicContact CB-CE2 3.64Å; F137-F305 HydrophobicContact CD1-CE2 4.25Å; F137-F305 AromaticContact CD2-CE2 3.7Å; F137-F305 HydrophobicContact CD2-CE2 3.7Å; F137-F305 AromaticContact CD2-CZ 3.77Å; F137-F305 HydrophobicContact CD2-CZ 3.77Å; F137-F305 HydrophobicContact CE2-CE2 4.45Å; F137-F305 HydrophobicContact CE2-CZ 4.2Å; F137-F305 AromaticContact CG-CE2 3.6Å; F137-F305 HydrophobicContact CG-CE2 3.6Å; F137-F305 HydrophobicContact CG-CZ 4.16Å
138	H	93	Very high	93.3	Very high	3 Å²	3	31 Å²	31	1%	0.014	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.8	-173.5	-67.4	-97.6	0	0	0	111.4	S136 S244 I246 I251 Q290 F302 V303 P304 F305	S136-H138 WeakPolarHBondContact CB-NE2 3.34Å; S136-H138 PolarHBondContact O-CD2 3.17Å; S136-H138 PolarHBondContact OG-NE2 3.45Å; H138-S244 WeakPolarHBondContact CA-O 3.46Å; H138-I246 WeakPolarHBondContact CB-O 3.36Å; H138-I246 PolarHBondContact ND1-O 3.39Å; H138-I246 VanDerWaalsContact ND1-O 3.09Å; H138-I251 HydrophobicContact CB-CD1 4.29Å; H138-Q290 PolarHBondContact CE1-OE1 3.47Å; H138-F302 HydrophobicContact CB-CE1 3.76Å; H138-F302 HydrophobicContact CB-CE2 3.93Å; H138-F302 HydrophobicContact CB-CZ 3.23Å; H138-F302 AromaticContact CD2-CD2 3.44Å; H138-F302 VanDerWaalsContact CD2-CD2 3.44Å; H138-F302 WeakPolarHBondContact CD2-CD2 3.33Å; H138-F302 AromaticContact CD2-CE1 3.91Å; H138-F302 AromaticContact CD2-CE2 2.96Å; H138-F302 WeakPolarHBondContact CD2-CE2 3.41Å; H138-F302 AromaticContact CD2-CZ 3.23Å; H138-F302 WeakPolarHBondContact CD2-CZ 3.35Å; H138-F302 AromaticContact CE1-CE2 3.65Å; H138-F302 AromaticContact CG-CE2 3.29Å; H138-F302 AromaticContact CG-CZ 3.16Å; H138-F302 AromaticContact ND1-CE2 3.7Å; H138-F302 AromaticContact ND1-CZ 3.86Å; H138-F302 AromaticContact NE2-CD2 3.61Å; H138-F302 AromaticContact NE2-CE2 3.23Å; H138-F302 WeakPolarHBondContact NE2-CE2 3.36Å; H138-F302 AromaticContact NE2-CZ 3.96Å; H138-V303 PolarHBondContact N-O 3.02Å; H138-P304 CarbonylContact O-C 3.47Å; H138-P304 WeakPolarHBondContact O-CA 3.16Å; H138-F305 WeakPolarHBondContact O-CB 3.38Å; H138-F305 PolarHBondContact O-N 2.55Å
139	G	93.1	Very high	94	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.1	-176	176.9	0	0	0	0	0	112.2	K145 S244 N245 F305	G139-K145 PolarHBondContact O-NZ 3.48Å; G139-S244 PolarHBondContact N-O 3.27Å; G139-N245 WeakPolarHBondContact O-CA 3.28Å; G139-F305 WeakPolarHBondContact CA-O 3.28Å
140	W	91.8	Very high	94.6	Very high	80 Å²	80	29.6 Å²	29.6	30%	0.303	15%	0.149	S	C	.	.			trans	-69.6	171.3	-176.2	-152.7	1.6	0	0	0	113.6	T143 K145 N252 P307 V343 A352	W140-T143 HydrophobicContact CB-CG2 3.97Å; W140-T143 PolarHBondContact O-OG1 3.23Å; W140-K145 PolarHBondContact O-NZ 3.15Å; W140-N252 VanDerWaalsContact CZ3-ND2 3.28Å; W140-N252 WeakPolarHBondContact CZ3-ND2 3.24Å; W140-P307 HydrophobicContact CE3-CB 4.44Å; W140-V343 HydrophobicContact CH2-CB 4.39Å; W140-V343 HydrophobicContact CH2-CG2 3.26Å; W140-V343 HydrophobicContact CZ2-CG2 4.5Å; W140-V343 HydrophobicContact CZ3-CG2 3.42Å; W140-V343 VanDerWaalsContact CZ3-CG2 3.42Å; W140-A352 HydrophobicContact CH2-CB 4.47Å
141	S	92.1	Very high	95.2	Very high	37 Å²	37	25.1 Å²	25.1	26%	0.259	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	135.7	178	166.1	0	0	0	0	109.7	Q353	S141-Q353 CarbonylContact O-C 3.51Å
142	G	93.7	Very high	95.5	Very high	24 Å²	24	24.6 Å²	24.6	25%	0.247	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	11.4	175.7	0	0	0	0	0	115.3	G354 C355	G142-G354 WeakPolarHBondContact O-CA 3.4Å; G142-C355 PolarHBondContact O-N 3.08Å
143	T	96.4	Very high	95.7	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.031	12%	0.122	C	C	.	.	S	Bend	trans	-83.7	-12.8	176.2	54.7	0	0	0	0	114.2	Q109 W140 F305 L306 L308	Q109-T143 PolarHBondContact NE2-O 3.19Å; Q109-T143 VanDerWaalsContact NE2-O 3.11Å; W140-T143 HydrophobicContact CB-CG2 3.97Å; W140-T143 PolarHBondContact O-OG1 3.23Å; T143-F305 WeakPolarHBondContact OG1-CB 3.2Å; T143-L306 WeakPolarHBondContact CG2-O 3.05Å; T143-L308 HydrophobicContact CG2-CG 4.48Å
144	G	96.2	Very high	95.8	Very high	15 Å²	15	27.3 Å²	27.3	16%	0.155	14%	0.137	C	C	.	.	S	Bend	trans	124.5	1.2	172.9	0	0	0	0	0	116.8	N146 F147 V148	G144-N146 PolarHBondContact O-N 2.59Å; G144-F147 CarbonylContact O-C 3.6Å; G144-F147 WeakPolarHBondContact O-CA 3.48Å; G144-F147 VanDerWaalsContact O-CB 3.31Å; G144-F147 WeakPolarHBondContact O-CB 3.35Å; G144-F147 PolarHBondContact O-N 3.33Å; G144-V148 WeakPolarHBondContact O-CG2 3.39Å; G144-V148 PolarHBondContact O-N 2.7Å
145	K	96.9	Very high	95.9	Very high	13 Å²	13	27.9 Å²	27.9	6%	0.057	14%	0.14	C	C	.	.	H	α-helix	trans	-49	-58.8	-177.2	-59.9	-170.5	-64.7	-88	0	114.4	F137 G139 W140 F147 V148 A149 L243 S244 N245 F305	F137-K145 HydrophobicContact CB-CB 4.41Å; F137-K145 HydrophobicContact CB-CD 4.21Å; F137-K145 HydrophobicContact CB-CG 4.25Å; F137-K145 HydrophobicContact CD2-CB 4.46Å; G139-K145 PolarHBondContact O-NZ 3.48Å; W140-K145 PolarHBondContact O-NZ 3.15Å; K145-F147 PolarHBondContact O-N 2.86Å; K145-V148 PolarHBondContact O-N 3.4Å; K145-A149 PolarHBondContact O-N 3.4Å; K145-L243 HydrophobicContact CB-CD2 4.47Å; K145-S244 VanDerWaalsContact CD-O 3.26Å; K145-S244 WeakPolarHBondContact CD-O 3.4Å; K145-S244 WeakPolarHBondContact CE-O 3.25Å; K145-S244 PolarHBondContact NZ-O 2.81Å; K145-N245 PolarHBondContact NZ-OD1 3.44Å; K145-F305 HydrophobicContact CD-CD2 4.43Å; K145-F305 HydrophobicContact CG-CB 4.3Å; K145-F305 HydrophobicContact CG-CD1 4.07Å; K145-F305 HydrophobicContact CG-CD2 3.71Å; K145-F305 HydrophobicContact CG-CE1 4.32Å; K145-F305 HydrophobicContact CG-CE2 4Å; K145-F305 HydrophobicContact CG-CG 3.75Å; K145-F305 HydrophobicContact CG-CZ 4.29Å
146	N	96.7	Very high	95.9	Very high	81 Å²	81	28 Å²	28	43%	0.433	14%	0.141	S	C	.	.	H	α-helix	trans	-62.7	-30.9	176.9	-88.2	-46.5	0	0	0	112.8	G144 R150 D207 L243	G144-N146 PolarHBondContact O-N 2.59Å; N146-R150 PolarHBondContact O-N 2.97Å; N146-R150 VanDerWaalsContact O-N 3.15Å; N146-D207 PolarHBondContact ND2-OD1 2.74Å; N146-D207 PolarHBondContact ND2-OD2 2.97Å; N146-D207 VanDerWaalsContact ND2-OD2 3.09Å; N146-D207 PolarHBondContact OD1-OD2 3.37Å; N146-L243 WeakPolarHBondContact OD1-CD1 3.47Å
147	F	97.2	Very high	96	Very high	90 Å²	90	27.8 Å²	27.8	40%	0.395	14%	0.139	S	C	.	.	H	α-helix	trans	-70.5	-43.1	178.5	-177	-116.9	0	0	0	111.6	K105 L106 G144 K145 R150 I151	K105-F147 HydrophobicContact CB-CE1 3.8Å; K105-F147 HydrophobicContact CB-CZ 3.78Å; K105-F147 HydrophobicContact CD-CZ 4.36Å; K105-F147 WeakPolarHBondContact O-CE1 3.5Å; L106-F147 HydrophobicContact CD1-CD1 4.3Å; G144-F147 CarbonylContact O-C 3.6Å; G144-F147 WeakPolarHBondContact O-CA 3.48Å; G144-F147 VanDerWaalsContact O-CB 3.31Å; G144-F147 WeakPolarHBondContact O-CB 3.35Å; G144-F147 PolarHBondContact O-N 3.33Å; K145-F147 PolarHBondContact O-N 2.86Å; F147-R150 WeakPolarHBondContact O-CB 3.35Å; F147-R150 PolarHBondContact O-N 3.09Å; F147-I151 HydrophobicContact CD1-CD1 3.86Å; F147-I151 HydrophobicContact CE1-CD1 3.52Å; F147-I151 HydrophobicContact CE1-CG1 4.44Å; F147-I151 HydrophobicContact CZ-CD1 3.9Å; F147-I151 HydrophobicContact CZ-CG1 4.44Å; F147-I151 WeakPolarHBondContact O-CG1 3.35Å; F147-I151 PolarHBondContact O-N 3.21Å
148	V	98.3	Very high	95.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-42.8	174.6	175.8	0	0	0	0	111.3	L102 L106 V116 F137 G144 K145 R150 I151 V152 F305	L102-V148 HydrophobicContact CD2-CG1 4.16Å; L102-V148 HydrophobicContact CD2-CG2 4.43Å; L106-V148 HydrophobicContact CD1-CG2 3.55Å; L106-V148 HydrophobicContact CD2-CG2 3.43Å; L106-V148 VanDerWaalsContact CD2-CG2 3.43Å; L106-V148 HydrophobicContact CG-CG2 4.09Å; V116-V148 HydrophobicContact CG1-CG1 4.2Å; V116-V148 HydrophobicContact CG2-CG1 4.13Å; F137-V148 HydrophobicContact CE2-CB 3.95Å; F137-V148 HydrophobicContact CE2-CG1 3.67Å; F137-V148 HydrophobicContact CZ-CG1 3.91Å; G144-V148 WeakPolarHBondContact O-CG2 3.39Å; G144-V148 PolarHBondContact O-N 2.7Å; K145-V148 PolarHBondContact O-N 3.4Å; V148-R150 PolarHBondContact O-N 3.42Å; V148-I151 PolarHBondContact O-N 2.93Å; V148-I151 VanDerWaalsContact O-N 3.1Å; V148-V152 HydrophobicContact CG1-CG2 4.35Å; V148-V152 WeakPolarHBondContact O-CG2 3.4Å; V148-V152 PolarHBondContact O-N 3.22Å; V148-F305 HydrophobicContact CB-CE1 4.35Å; V148-F305 HydrophobicContact CB-CZ 4.07Å; V148-F305 HydrophobicContact CG1-CZ 4.48Å; V148-F305 HydrophobicContact CG2-CE1 3.71Å; V148-F305 HydrophobicContact CG2-CZ 3.86Å
149	A	98	Very high	95.7	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.017	18%	0.18	C	C	.	.	H	α-helix	trans	-57.2	-38.7	175.4	0	0	0	0	0	111.9	K145 A153 I205 L241 L243	K145-A149 PolarHBondContact O-N 3.4Å; A149-A153 PolarHBondContact O-N 3.05Å; A149-I205 HydrophobicContact CB-CD1 4.33Å; A149-I205 HydrophobicContact CB-CG2 4.46Å; A149-L241 HydrophobicContact CB-CD1 4.26Å; A149-L243 HydrophobicContact CB-CD1 4.06Å; A149-L243 HydrophobicContact CB-CD2 4.27Å
150	R	97.6	Very high	95.8	Very high	143 Å²	143	37 Å²	37	54%	0.54	18%	0.181	S	C	.	.	H	α-helix	trans	-67.9	-44.4	173.4	-178.7	172.8	179.9	173.1	0.9	112.7	N146 F147 V148 V152 A153 D154 V161	N146-R150 PolarHBondContact O-N 2.97Å; N146-R150 VanDerWaalsContact O-N 3.15Å; F147-R150 WeakPolarHBondContact O-CB 3.35Å; F147-R150 PolarHBondContact O-N 3.09Å; V148-R150 PolarHBondContact O-N 3.42Å; R150-V152 VanDerWaalsContact C-N 3.27Å; R150-V152 PolarHBondContact O-N 3.24Å; R150-A153 PolarHBondContact O-N 2.62Å; R150-D154 WeakPolarHBondContact CG-OD2 3.22Å; R150-D154 IonicContact NE-OD2 3.17Å; R150-D154 WeakPolarHBondContact O-CB 3.37Å; R150-D154 PolarHBondContact O-N 3.32Å; R150-V161 HydrophobicContact CB-CG1 4.33Å; R150-V161 HydrophobicContact CG-CG1 4.07Å
151	I	97.9	Very high	95.7	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-57.6	-43.2	175.3	-72.2	170.9	0	0	0	110.8	L98 D101 L102 K105 F147 V148 D154 N155	L98-I151 HydrophobicContact CD1-CG2 3.72Å; D101-I151 HydrophobicContact CB-CG2 3.75Å; L102-I151 HydrophobicContact CD2-CG2 4.27Å; L102-I151 HydrophobicContact CG-CG2 4.32Å; K105-I151 HydrophobicContact CB-CD1 4.37Å; F147-I151 HydrophobicContact CD1-CD1 3.86Å; F147-I151 HydrophobicContact CE1-CD1 3.52Å; F147-I151 HydrophobicContact CE1-CG1 4.44Å; F147-I151 HydrophobicContact CZ-CD1 3.9Å; F147-I151 HydrophobicContact CZ-CG1 4.44Å; F147-I151 WeakPolarHBondContact O-CG1 3.35Å; F147-I151 PolarHBondContact O-N 3.21Å; V148-I151 PolarHBondContact O-N 2.93Å; V148-I151 VanDerWaalsContact O-N 3.1Å; I151-D154 PolarHBondContact O-N 3.1Å; I151-N155 WeakPolarHBondContact O-CB 3.22Å; I151-N155 PolarHBondContact O-N 3.39Å; I151-N155 VanDerWaalsContact O-N 3.07Å; I151-N155 PolarHBondContact O-ND2 2.9Å
152	V	98.1	Very high	95.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-49.3	176.2	171.8	0	0	0	0	110.2	L98 V116 V120 V148 R150 D154 N155 M156 L241	L98-V152 HydrophobicContact CD1-CG2 4.22Å; V116-V152 HydrophobicContact CG1-CG2 3.63Å; V120-V152 HydrophobicContact CG2-CG1 4.37Å; V148-V152 HydrophobicContact CG1-CG2 4.35Å; V148-V152 WeakPolarHBondContact O-CG2 3.4Å; V148-V152 PolarHBondContact O-N 3.22Å; R150-V152 VanDerWaalsContact C-N 3.27Å; R150-V152 PolarHBondContact O-N 3.24Å; V152-D154 PolarHBondContact O-N 3.29Å; V152-N155 PolarHBondContact O-N 2.7Å; V152-M156 HydrophobicContact CG1-CG 4.25Å; V152-M156 HydrophobicContact CG1-SD 3.48Å; V152-M156 WeakPolarHBondContact CG1-SD 3.32Å; V152-M156 WeakPolarHBondContact O-CB 3.47Å; V152-M156 VanDerWaalsContact O-CG 3.27Å; V152-M156 WeakPolarHBondContact O-CG 3.41Å; V152-M156 PolarHBondContact O-N 3.4Å; V152-L241 HydrophobicContact CG1-CD1 4.4Å
153	A	97.6	Very high	95.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-47.7	178	0	0	0	0	0	112.4	A149 R150 N155 M156 Y157 V161 V166 L203	A149-A153 PolarHBondContact O-N 3.05Å; R150-A153 PolarHBondContact O-N 2.62Å; A153-N155 PolarHBondContact O-N 3.22Å; A153-M156 PolarHBondContact O-N 3.36Å; A153-Y157 PolarHBondContact O-N 2.75Å; A153-V161 HydrophobicContact CB-CG1 3.74Å; A153-V166 HydrophobicContact CB-CG2 4.48Å; A153-L203 HydrophobicContact CB-CD2 3.85Å
154	D	96.6	Very high	95.5	Very high	71 Å²	71	48.9 Å²	48.9	38%	0.38	23%	0.231	S	C	.	.	H	α-helix	trans	-64.8	-25.9	-177.6	-68.3	-9.3	0	0	0	112.4	R150 I151 V152 G160	R150-D154 WeakPolarHBondContact CG-OD2 3.22Å; R150-D154 IonicContact NE-OD2 3.17Å; R150-D154 WeakPolarHBondContact O-CB 3.37Å; R150-D154 PolarHBondContact O-N 3.32Å; I151-D154 PolarHBondContact O-N 3.1Å; V152-D154 PolarHBondContact O-N 3.29Å; D154-G160 VanDerWaalsContact OD1-CA 3.32Å; D154-G160 WeakPolarHBondContact OD1-CA 3.07Å
155	N	97.4	Very high	95.5	Very high	12 Å²	12	48.2 Å²	48.2	6%	0.064	22%	0.223	C	C	.	.	H	α-helix	trans	-94.7	-26.4	176.6	-76.6	-81.8	0	0	0	113.6	N94 G97 L98 D101 I151 V152 A153	N94-N155 WeakPolarHBondContact CB-O 3.17Å; N94-N155 PolarHBondContact N-O 2.83Å; G97-N155 WeakPolarHBondContact CA-OD1 3.36Å; L98-N155 HydrophobicContact CB-CB 3.95Å; L98-N155 HydrophobicContact CD1-CB 4.46Å; L98-N155 PolarHBondContact N-OD1 3.09Å; L98-N155 VanDerWaalsContact N-OD1 3.1Å; D101-N155 PolarHBondContact OD2-ND2 3.31Å; D101-N155 VanDerWaalsContact OD2-ND2 3.08Å; I151-N155 WeakPolarHBondContact O-CB 3.22Å; I151-N155 PolarHBondContact O-N 3.39Å; I151-N155 VanDerWaalsContact O-N 3.07Å; I151-N155 PolarHBondContact O-ND2 2.9Å; V152-N155 PolarHBondContact O-N 2.7Å; A153-N155 PolarHBondContact O-N 3.22Å
156	M	95.4	Very high	95.5	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-84.5	-28.3	177.7	-69.4	-176.4	70.6	0	0	112.8	T92 N93 V120 F123 V152 A153 Q201 V239	T92-M156 PolarHBondContact N-O 2.92Å; N93-M156 PolarHBondContact N-O 3.49Å; N93-M156 VanDerWaalsContact N-O 3.15Å; V120-M156 HydrophobicContact CG1-CE 4.38Å; V120-M156 HydrophobicContact CG1-CG 4.23Å; V120-M156 HydrophobicContact CG1-SD 3.77Å; F123-M156 HydrophobicContact CD1-CE 4.28Å; F123-M156 HydrophobicContact CE1-CE 4.14Å; V152-M156 HydrophobicContact CG1-CG 4.25Å; V152-M156 HydrophobicContact CG1-SD 3.48Å; V152-M156 WeakPolarHBondContact CG1-SD 3.32Å; V152-M156 WeakPolarHBondContact O-CB 3.47Å; V152-M156 VanDerWaalsContact O-CG 3.27Å; V152-M156 WeakPolarHBondContact O-CG 3.41Å; V152-M156 PolarHBondContact O-N 3.4Å; A153-M156 PolarHBondContact O-N 3.36Å; M156-Q201 VanDerWaalsContact CE-NE2 3.34Å; M156-V239 HydrophobicContact CE-CG2 4.16Å
157	Y	95.4	Very high	95.5	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-131.1	140.2	-173.8	-55.7	-80.6	0	0	0	112.1	R90 I91 A153 D159 G160 C165 V166 Q201 L203	R90-Y157 VanDerWaalsContact O-CA 3.3Å; R90-Y157 WeakPolarHBondContact O-CA 3.5Å; I91-Y157 HydrophobicContact CG1-CD1 4.29Å; I91-Y157 HydrophobicContact CG1-CE1 4.14Å; A153-Y157 PolarHBondContact O-N 2.75Å; Y157-D159 VanDerWaalsContact C-N 3.33Å; Y157-D159 PolarHBondContact O-N 3.1Å; Y157-G160 PolarHBondContact O-N 2.99Å; Y157-C165 HydrophobicContact CD1-CB 3.66Å; Y157-C165 HydrophobicContact CE1-CB 3.39Å; Y157-V166 HydrophobicContact CD1-CG2 4.45Å; Y157-V166 HydrophobicContact CD2-CG2 3.34Å; Y157-V166 HydrophobicContact CE2-CG2 3.63Å; Y157-V166 HydrophobicContact CG-CG2 3.8Å; Y157-Q201 WeakPolarHBondContact CE1-O 3.44Å; Y157-Q201 PolarHBondContact OH-O 3.47Å; Y157-L203 HydrophobicContact CD2-CD2 4.41Å; Y157-L203 HydrophobicContact CE2-CB 3.56Å; Y157-L203 HydrophobicContact CE2-CD2 3.85Å; Y157-L203 HydrophobicContact CE2-CG 4.35Å; Y157-L203 WeakPolarHBondContact OH-CB 3.5Å; Y157-L203 PolarHBondContact OH-N 2.96Å
158	R	91.8	Very high	95.5	Very high	117 Å²	117	49.3 Å²	49.3	44%	0.442	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-46.1	-177.5	-174.5	-173.6	69.4	-154.4	-4.5	113.1	Q82 R90 T92 G160	Q82-R158 VanDerWaalsContact OE1-NH1 3.12Å; R90-R158 PolarHBondContact O-N 3.14Å; T92-R158 PolarHBondContact OG1-N 2.93Å; R158-G160 VanDerWaalsContact C-N 3.31Å
159	D	92.1	Very high	95.4	Very high	78 Å²	78	49.8 Å²	49.8	42%	0.417	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	13	-177.6	-59.3	-47.6	0	0	0	112.2	Y157 V161 K162 S163	Y157-D159 VanDerWaalsContact C-N 3.33Å; Y157-D159 PolarHBondContact O-N 3.1Å; D159-V161 PolarHBondContact O-N 2.68Å; D159-K162 WeakPolarHBondContact O-CA 3.35Å; D159-K162 WeakPolarHBondContact O-CB 3.41Å; D159-K162 PolarHBondContact O-N 3.34Å; D159-S163 PolarHBondContact O-N 2.93Å
160	G	93.6	Very high	95.3	Very high	2 Å²	2	52.3 Å²	52.3	2%	0.021	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	53.2	-133.7	178.1	0	0	0	0	0	113	D154 Y157 R158 K162 S163 V166	D154-G160 VanDerWaalsContact OD1-CA 3.32Å; D154-G160 WeakPolarHBondContact OD1-CA 3.07Å; Y157-G160 PolarHBondContact O-N 2.99Å; R158-G160 VanDerWaalsContact C-N 3.31Å; G160-K162 PolarHBondContact O-N 2.8Å; G160-S163 WeakPolarHBondContact O-CB 3.45Å; G160-S163 PolarHBondContact O-N 2.7Å; G160-V166 WeakPolarHBondContact O-CG2 3.45Å
161	V	91.4	Very high	95.1	Very high	68 Å²	68	45.6 Å²	45.6	41%	0.412	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-60.9	-14.2	176.5	-62.4	0	0	0	0	114.9	R150 A153 D159	R150-V161 HydrophobicContact CB-CG1 4.33Å; R150-V161 HydrophobicContact CG-CG1 4.07Å; A153-V161 HydrophobicContact CB-CG1 3.74Å; D159-V161 PolarHBondContact O-N 2.68Å
162	K	92.3	Very high	94.8	Very high	188 Å²	188	48.3 Å²	48.3	82%	0.817	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-93.2	-5.2	177.1	-59.6	178.6	-179.6	175.9	0	112.8	D159 G160	D159-K162 WeakPolarHBondContact O-CA 3.35Å; D159-K162 WeakPolarHBondContact O-CB 3.41Å; D159-K162 PolarHBondContact O-N 3.34Å; G160-K162 PolarHBondContact O-N 2.8Å
163	S	93.5	Very high	94.6	Very high	4 Å²	4	55.6 Å²	55.6	3%	0.028	27%	0.265	C	S	.	.	S	Bend	trans	-60.8	143.6	176.4	176.9	0	0	0	0	110.9	D159 G160 C165 V166	D159-S163 PolarHBondContact O-N 2.93Å; G160-S163 WeakPolarHBondContact O-CB 3.45Å; G160-S163 PolarHBondContact O-N 2.7Å; S163-C165 PolarHBondContact O-N 3.11Å; S163-C165 PolarHBondContact OG-N 3.03Å; S163-V166 PolarHBondContact O-N 2.81Å
164	E	92	Very high	94.5	Very high	136 Å²	136	58.5 Å²	58.5	64%	0.636	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.6	173.4	-59.8	179.4	157.4	0	0	112.6	R90 V166	R90-E164 IonicContact NH1-OE2 2.95Å; R90-E164 PolarHBondContact NH1-OE2 2.79Å; E164-V166 VanDerWaalsContact C-N 3.29Å
165	C	95.4	Very high	94.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	2.5	175	-58	0	0	0	0	113.2	Y157 S163 M195 C199 T202 L203	Y157-C165 HydrophobicContact CD1-CB 3.66Å; Y157-C165 HydrophobicContact CE1-CB 3.39Å; S163-C165 PolarHBondContact O-N 3.11Å; S163-C165 PolarHBondContact OG-N 3.03Å; C165-M195 WeakPolarHBondContact O-CE 3.39Å; C165-C199 HydrophobicContact CB-CB 3.86Å; C165-C199 WeakPolarHBondContact CB-SG 3.38Å; C165-C199 WeakPolarHBondContact SG-CB 3.26Å; C165-C199 CovalentContact SG-SG 2.03Å; C165-C199 PolarHBondContact SG-SG 3.42Å; C165-T202 CarbonylContact O-C 3.54Å; C165-T202 WeakPolarHBondContact O-CA 3.45Å; C165-L203 PolarHBondContact O-N 3.3Å
166	V	96.8	Very high	94.3	Very high	14 Å²	14	59 Å²	59	9%	0.085	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131.5	176.8	-175.2	0	0	0	0	110.4	A153 Y157 G160 S163 E164 M195 L203 I205	A153-V166 HydrophobicContact CB-CG2 4.48Å; Y157-V166 HydrophobicContact CD1-CG2 4.45Å; Y157-V166 HydrophobicContact CD2-CG2 3.34Å; Y157-V166 HydrophobicContact CE2-CG2 3.63Å; Y157-V166 HydrophobicContact CG-CG2 3.8Å; G160-V166 WeakPolarHBondContact O-CG2 3.45Å; S163-V166 PolarHBondContact O-N 2.81Å; E164-V166 VanDerWaalsContact C-N 3.29Å; V166-M195 VanDerWaalsContact C-CE 3.44Å; V166-M195 VanDerWaalsContact N-CE 3.26Å; V166-L203 CarbonylContact C-O 3.57Å; V166-L203 WeakPolarHBondContact CA-O 2.95Å; V166-L203 HydrophobicContact CG1-CB 4.4Å; V166-L203 HydrophobicContact CG1-CD2 4.06Å; V166-L203 HydrophobicContact CG1-CG 4.19Å; V166-L203 HydrophobicContact CG2-CB 4.15Å; V166-L203 HydrophobicContact CG2-CD2 4.17Å; V166-I205 HydrophobicContact CG1-CD1 4.17Å
167	R	96.8	Very high	94.2	Very high	118 Å²	118	63.2 Å²	63.2	45%	0.445	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	121.9	177.1	-174	69.5	177.3	-168.4	-0.9	111	F169 M195 L203 F204 I205	R167-F169 HydrophobicContact CB-CE2 4.32Å; R167-F169 HydrophobicContact CG-CD2 4.15Å; R167-F169 HydrophobicContact CG-CE1 4.09Å; R167-F169 HydrophobicContact CG-CE2 3.49Å; R167-F169 VanDerWaalsContact CG-CE2 3.49Å; R167-F169 HydrophobicContact CG-CZ 3.46Å; R167-F169 VanDerWaalsContact CG-CZ 3.46Å; R167-M195 HydrophobicContact CB-CE 3.76Å; R167-M195 HydrophobicContact CB-SD 3.4Å; R167-M195 WeakPolarHBondContact CB-SD 3.32Å; R167-M195 HydrophobicContact CG-SD 4.3Å; R167-L203 PolarHBondContact N-O 3.17Å; R167-F204 HydrophobicContact CB-CD1 4.05Å; R167-F204 HydrophobicContact CB-CE1 4.37Å; R167-F204 WeakPolarHBondContact O-CA 3.07Å; R167-I205 PolarHBondContact O-N 3.26Å
168	L	96.6	Very high	94	Very high	76 Å²	76	66.6 Å²	66.6	40%	0.398	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.3	176	176.4	64.9	0	0	0	110.7	I170 I205 D207	L168-I170 HydrophobicContact CD1-CG1 4.42Å; L168-I170 HydrophobicContact CD2-CD1 4.27Å; L168-I170 HydrophobicContact CD2-CG1 4.19Å; L168-I170 HydrophobicContact CG-CG1 4.15Å; L168-I205 CarbonylContact C-O 3.54Å; L168-I205 HydrophobicContact CD1-CB 3.8Å; L168-I205 HydrophobicContact CD1-CG2 3.59Å; L168-D207 HydrophobicContact CD1-CB 4.17Å
169	F	96.4	Very high	94.1	Very high	9 Å²	9	71.1 Å²	71.1	4%	0.039	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	104	170.9	-63.1	-73	0	0	0	109.6	R167 F175 L188 A191 F204 I205 F206 D207	R167-F169 HydrophobicContact CB-CE2 4.32Å; R167-F169 HydrophobicContact CG-CD2 4.15Å; R167-F169 HydrophobicContact CG-CE1 4.09Å; R167-F169 HydrophobicContact CG-CE2 3.49Å; R167-F169 VanDerWaalsContact CG-CE2 3.49Å; R167-F169 HydrophobicContact CG-CZ 3.46Å; R167-F169 VanDerWaalsContact CG-CZ 3.46Å; F169-F175 HydrophobicContact CB-CE2 4.26Å; F169-F175 HydrophobicContact CD1-CE2 4.46Å; F169-F175 HydrophobicContact CD1-CZ 4.03Å; F169-L188 HydrophobicContact CD2-CD1 4.39Å; F169-L188 HydrophobicContact CE1-CD1 4.09Å; F169-L188 HydrophobicContact CE2-CD1 3.93Å; F169-L188 HydrophobicContact CZ-CD1 3.76Å; F169-A191 HydrophobicContact CZ-CB 4.33Å; F169-F204 HydrophobicContact CE2-CD1 4.04Å; F169-I205 PolarHBondContact N-O 3.3Å; F169-F206 HydrophobicContact CB-CD1 3.88Å; F169-F206 HydrophobicContact CB-CE1 4.1Å; F169-F206 HydrophobicContact CD2-CD1 4.17Å; F169-F206 AromaticContact CD2-CE1 3.67Å; F169-F206 HydrophobicContact CD2-CE1 3.67Å; F169-F206 HydrophobicContact CD2-CE2 4.45Å; F169-F206 AromaticContact CD2-CZ 3.84Å; F169-F206 HydrophobicContact CD2-CZ 3.84Å; F169-F206 HydrophobicContact CE2-CE1 4.37Å; F169-F206 HydrophobicContact CE2-CZ 4.23Å; F169-F206 HydrophobicContact CG-CD1 4.37Å; F169-F206 HydrophobicContact CG-CE1 4.1Å; F169-F206 CarbonylContact O-C 3.51Å; F169-F206 WeakPolarHBondContact O-CA 3.49Å; F169-D207 PolarHBondContact O-N 2.9Å
170	I	95.9	Very high	94.3	Very high	55 Å²	55	70.3 Å²	70.3	28%	0.282	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	112.4	167.7	-58.2	168.5	0	0	0	108.3	L168 P172 F173 H174 D207	L168-I170 HydrophobicContact CD1-CG1 4.42Å; L168-I170 HydrophobicContact CD2-CD1 4.27Å; L168-I170 HydrophobicContact CD2-CG1 4.19Å; L168-I170 HydrophobicContact CG-CG1 4.15Å; I170-P172 HydrophobicContact CG2-CG 4.04Å; I170-F173 HydrophobicContact CB-CB 3.99Å; I170-F173 HydrophobicContact CG2-CB 3.91Å; I170-F173 PolarHBondContact O-N 3.16Å; I170-F173 VanDerWaalsContact O-N 3.11Å; I170-H174 PolarHBondContact N-CE1 2.89Å; I170-H174 PolarHBondContact N-ND1 3.48Å; I170-H174 PolarHBondContact O-N 3.13Å; I170-H174 PolarHBondContact O-ND1 3.43Å; I170-D207 HydrophobicContact CG1-CB 4.24Å
171	A	93	Very high	94.3	Very high	2 Å²	2	70.7 Å²	70.7	2%	0.017	35%	0.345	C	S	.	.	H	α-helix	trans	-52.6	-54.8	-172.4	0	0	0	0	0	114.5	F173 F175 D207 E208 K211 L212	A171-F173 PolarHBondContact O-N 2.85Å; A171-F175 CarbonylContact O-C 3.57Å; A171-F175 WeakPolarHBondContact O-CA 3.46Å; A171-F175 WeakPolarHBondContact O-CB 3.15Å; A171-F175 PolarHBondContact O-N 3.36Å; A171-D207 WeakPolarHBondContact CB-O 3.39Å; A171-D207 PolarHBondContact N-O 3.38Å; A171-E208 WeakPolarHBondContact CB-O 3.41Å; A171-K211 HydrophobicContact CB-CB 4.26Å; A171-L212 HydrophobicContact CB-CD2 3.56Å; A171-L212 HydrophobicContact CB-CG 3.74Å
172	P	92.4	Very high	94.5	Very high	62 Å²	62	73 Å²	73	40%	0.403	36%	0.355	S	S	.	.	H	α-helix	trans	-68.5	-18.1	-178.9	27	-36.3	0	0	0	114.1	I170 P176 E208 K211	I170-P172 HydrophobicContact CG2-CG 4.04Å; P172-P176 WeakPolarHBondContact O-CB 3.37Å; P172-E208 HydrophobicContact CG-CB 4.44Å; P172-K211 HydrophobicContact CB-CD 4.43Å; P172-K211 HydrophobicContact CG-CD 4.29Å
173	F	94.8	Very high	94.7	Very high	154 Å²	154	67.9 Å²	67.9	68%	0.675	34%	0.34	S	S	*	.	H	α-helix	trans	-89.3	-46.5	-180	179.1	-98.6	0	0	0	111.9	I170 A171	I170-F173 HydrophobicContact CB-CB 3.99Å; I170-F173 HydrophobicContact CG2-CB 3.91Å; I170-F173 PolarHBondContact O-N 3.16Å; I170-F173 VanDerWaalsContact O-N 3.11Å; A171-F173 PolarHBondContact O-N 2.85Å
174	H	95.3	Very high	94.9	Very high	60 Å²	60	68.6 Å²	68.6	28%	0.278	34%	0.342	S	S	.	.	H	α-helix	trans	-84.8	-28.9	-177.6	-63.1	97.3	0	0	0	112.7	I170 P176	I170-H174 PolarHBondContact N-CE1 2.89Å; I170-H174 PolarHBondContact N-ND1 3.48Å; I170-H174 PolarHBondContact O-N 3.13Å; I170-H174 PolarHBondContact O-ND1 3.43Å; H174-P176 WeakPolarHBondContact O-CD 3.32Å
175	F	94.9	Very high	95.1	Very high	27 Å²	27	65 Å²	65	12%	0.118	32%	0.324	C	S	.	.	S	Bend	trans	-125.8	54.2	-176.4	-44.5	-59.1	0	0	0	112	F169 A171 H177 Y184 L188 L212 L216	F169-F175 HydrophobicContact CB-CE2 4.26Å; F169-F175 HydrophobicContact CD1-CE2 4.46Å; F169-F175 HydrophobicContact CD1-CZ 4.03Å; A171-F175 CarbonylContact O-C 3.57Å; A171-F175 WeakPolarHBondContact O-CA 3.46Å; A171-F175 WeakPolarHBondContact O-CB 3.15Å; A171-F175 PolarHBondContact O-N 3.36Å; F175-H177 VanDerWaalsContact C-N 3.3Å; F175-H177 PolarHBondContact O-N 3.14Å; F175-Y184 HydrophobicContact CB-CD2 3.98Å; F175-Y184 HydrophobicContact CB-CE2 4.19Å; F175-Y184 HydrophobicContact CD1-CD1 4.19Å; F175-Y184 AromaticContact CD1-CD2 3.98Å; F175-Y184 HydrophobicContact CD1-CD2 3.98Å; F175-Y184 AromaticContact CD1-CG 3.73Å; F175-Y184 HydrophobicContact CD1-CG 3.73Å; F175-Y184 HydrophobicContact CG-CD2 4.45Å; F175-L188 HydrophobicContact CZ-CD1 4.28Å; F175-L188 HydrophobicContact CZ-CD2 4.38Å; F175-L212 HydrophobicContact CD2-CD2 3.55Å; F175-L212 HydrophobicContact CE2-CD2 3.89Å; F175-L216 HydrophobicContact CB-CD1 3.74Å; F175-L216 HydrophobicContact CD1-CD1 3.98Å; F175-L216 HydrophobicContact CD2-CD1 3.86Å; F175-L216 HydrophobicContact CE2-CD1 4.48Å; F175-L216 HydrophobicContact CG-CD1 3.57Å
176	P	94.6	Very high	95.1	Very high	66 Å²	66	66.8 Å²	66.8	43%	0.429	34%	0.343	S	S	.	.			trans	-69.5	-22.7	-171.1	28	-36.7	0	0	0	114.3	P172 H174	P172-P176 WeakPolarHBondContact O-CB 3.37Å; H174-P176 WeakPolarHBondContact O-CD 3.32Å
177	H	93.9	Very high	95	Very high	92 Å²	92	71.2 Å²	71.2	43%	0.426	36%	0.363	S	S	.	.			trans	-121.2	110.6	-168.2	-60.7	-46.3	0	0	0	112.5	F175 R179 L180 Y184	F175-H177 VanDerWaalsContact C-N 3.3Å; F175-H177 PolarHBondContact O-N 3.14Å; H177-R179 HydrophobicContact CB-CG 4.27Å; H177-R179 PolarHBondContact O-N 3.44Å; H177-R179 VanDerWaalsContact O-N 3.11Å; H177-L180 HydrophobicContact CB-CB 4.47Å; H177-L180 HydrophobicContact CB-CD1 4.27Å; H177-L180 HydrophobicContact CB-CG 4.27Å; H177-L180 PolarHBondContact O-N 3.05Å; H177-Y184 VanDerWaalsContact O-CE2 3.28Å; H177-Y184 WeakPolarHBondContact O-CE2 3.23Å
178	A	89.9	Confident	95	Very high	70 Å²	70	65.8 Å²	65.8	58%	0.579	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-56.3	-30.6	178	0	0	0	0	0	113.7	L180 V181	A178-L180 PolarHBondContact O-N 3.24Å; A178-V181 WeakPolarHBondContact O-CB 3.23Å; A178-V181 WeakPolarHBondContact O-CG2 2.96Å; A178-V181 PolarHBondContact O-N 3.44Å
179	R	94.3	Very high	94.9	Very high	213 Å²	213	67.5 Å²	67.5	80%	0.804	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-65.4	-19.1	176.9	71.3	-177	178.1	156.9	-1.9	114.5	H177	H177-R179 HydrophobicContact CB-CG 4.27Å; H177-R179 PolarHBondContact O-N 3.44Å; H177-R179 VanDerWaalsContact O-N 3.11Å
180	L	95.9	Very high	94.8	Very high	61 Å²	61	72.9 Å²	72.9	32%	0.319	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-102.3	12.3	-178.1	-63.9	-178.1	0	0	0	112.2	H177 A178 D182 T183 Y184	H177-L180 HydrophobicContact CB-CB 4.47Å; H177-L180 HydrophobicContact CB-CD1 4.27Å; H177-L180 HydrophobicContact CB-CG 4.27Å; H177-L180 PolarHBondContact O-N 3.05Å; A178-L180 PolarHBondContact O-N 3.24Å; L180-D182 VanDerWaalsContact C-N 3.28Å; L180-D182 PolarHBondContact O-N 3.2Å; L180-T183 WeakPolarHBondContact O-CB 3.5Å; L180-T183 PolarHBondContact O-N 3.37Å; L180-Y184 HydrophobicContact CB-CD1 4.47Å; L180-Y184 HydrophobicContact CB-CD2 4.15Å; L180-Y184 HydrophobicContact CB-CE1 3.99Å; L180-Y184 HydrophobicContact CB-CE2 3.63Å; L180-Y184 HydrophobicContact CD1-CE1 4.39Å; L180-Y184 WeakPolarHBondContact CD1-OH 3.47Å; L180-Y184 WeakPolarHBondContact O-CD2 3.44Å; L180-Y184 VanDerWaalsContact O-CG 3.3Å; L180-Y184 PolarHBondContact O-N 3.32Å
181	V	94.5	Very high	94.7	Very high	9 Å²	9	71.7 Å²	71.7	6%	0.055	37%	0.367	C	S	.	.	H	α-helix	trans	-53.4	-42.7	-176	161.7	0	0	0	0	112.3	A178 T183 Y184 K185 H213	A178-V181 WeakPolarHBondContact O-CB 3.23Å; A178-V181 WeakPolarHBondContact O-CG2 2.96Å; A178-V181 PolarHBondContact O-N 3.44Å; V181-T183 VanDerWaalsContact C-N 3.34Å; V181-T183 PolarHBondContact O-N 3.09Å; V181-Y184 PolarHBondContact O-N 3.22Å; V181-K185 HydrophobicContact CG1-CD 4.43Å; V181-K185 HydrophobicContact CG1-CG 4.37Å; V181-K185 WeakPolarHBondContact O-CG 3.39Å; V181-K185 PolarHBondContact O-N 2.83Å; V181-H213 HydrophobicContact CG2-CB 3.71Å
182	D	95.4	Very high	94.9	Very high	118 Å²	118	71.6 Å²	71.6	63%	0.631	37%	0.366	S	S	*	.	H	α-helix	trans	-68.2	-34.3	-179.2	-63.3	-41.9	0	0	0	112.9	L180 K185 G186	L180-D182 VanDerWaalsContact C-N 3.28Å; L180-D182 PolarHBondContact O-N 3.2Å; D182-K185 IonicContact OD1-NZ 3.54Å; D182-K185 PolarHBondContact OD1-NZ 2.97Å; D182-G186 PolarHBondContact O-N 2.91Å
183	T	96.9	Very high	95	Very high	79 Å²	79	74.2 Å²	74.2	49%	0.485	37%	0.368	S	S	.	.	H	α-helix	trans	-65.2	-45.2	170.8	-53.7	0	0	0	0	110.9	L180 V181 K185 G186 Q187	L180-T183 WeakPolarHBondContact O-CB 3.5Å; L180-T183 PolarHBondContact O-N 3.37Å; V181-T183 VanDerWaalsContact C-N 3.34Å; V181-T183 PolarHBondContact O-N 3.09Å; T183-K185 VanDerWaalsContact C-N 3.33Å; T183-K185 PolarHBondContact O-N 3.34Å; T183-G186 PolarHBondContact O-N 3.49Å; T183-Q187 WeakPolarHBondContact O-CG 3.41Å; T183-Q187 PolarHBondContact O-N 2.88Å
184	Y	96.9	Very high	94.9	Very high	20 Å²	20	70.1 Å²	70.1	8%	0.078	35%	0.353	C	S	.	.	H	α-helix	trans	-64.2	-35.7	178.6	-62.7	-28.1	0	0	0	112.6	F175 H177 L180 V181 G186 Q187 L188	F175-Y184 HydrophobicContact CB-CD2 3.98Å; F175-Y184 HydrophobicContact CB-CE2 4.19Å; F175-Y184 HydrophobicContact CD1-CD1 4.19Å; F175-Y184 AromaticContact CD1-CD2 3.98Å; F175-Y184 HydrophobicContact CD1-CD2 3.98Å; F175-Y184 AromaticContact CD1-CG 3.73Å; F175-Y184 HydrophobicContact CD1-CG 3.73Å; F175-Y184 HydrophobicContact CG-CD2 4.45Å; H177-Y184 VanDerWaalsContact O-CE2 3.28Å; H177-Y184 WeakPolarHBondContact O-CE2 3.23Å; L180-Y184 HydrophobicContact CB-CD1 4.47Å; L180-Y184 HydrophobicContact CB-CD2 4.15Å; L180-Y184 HydrophobicContact CB-CE1 3.99Å; L180-Y184 HydrophobicContact CB-CE2 3.63Å; L180-Y184 HydrophobicContact CD1-CE1 4.39Å; L180-Y184 WeakPolarHBondContact CD1-OH 3.47Å; L180-Y184 WeakPolarHBondContact O-CD2 3.44Å; L180-Y184 VanDerWaalsContact O-CG 3.3Å; L180-Y184 PolarHBondContact O-N 3.32Å; V181-Y184 PolarHBondContact O-N 3.22Å; Y184-G186 PolarHBondContact O-N 3.23Å; Y184-Q187 PolarHBondContact O-N 2.04Å; Y184-L188 WeakPolarHBondContact O-CB 3.49Å; Y184-L188 PolarHBondContact O-N 3.34Å
185	K	95.5	Very high	94.9	Very high	59 Å²	59	67.6 Å²	67.6	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-58	-48.4	172.6	-72.6	176	-174	156.1	0	110.9	V181 D182 T183 L188 R189 G215 L216 A219	V181-K185 HydrophobicContact CG1-CD 4.43Å; V181-K185 HydrophobicContact CG1-CG 4.37Å; V181-K185 WeakPolarHBondContact O-CG 3.39Å; V181-K185 PolarHBondContact O-N 2.83Å; D182-K185 IonicContact OD1-NZ 3.54Å; D182-K185 PolarHBondContact OD1-NZ 2.97Å; T183-K185 VanDerWaalsContact C-N 3.33Å; T183-K185 PolarHBondContact O-N 3.34Å; K185-L188 PolarHBondContact O-N 2.93Å; K185-R189 VanDerWaalsContact O-CG 3.28Å; K185-R189 WeakPolarHBondContact O-CG 3.4Å; K185-R189 PolarHBondContact O-N 3.46Å; K185-G215 VanDerWaalsContact CE-C 3.45Å; K185-G215 WeakPolarHBondContact CE-O 3.31Å; K185-L216 HydrophobicContact CB-CD2 4.48Å; K185-L216 HydrophobicContact CG-CD2 3.88Å; K185-A219 HydrophobicContact CB-CB 4.07Å; K185-A219 HydrophobicContact CD-CB 4.36Å; K185-A219 HydrophobicContact CG-CB 3.82Å
186	G	95.5	Very high	94.8	Very high	39 Å²	39	67 Å²	67	40%	0.402	34%	0.34	S	S	.	.	H	α-helix	trans	-59.5	-51.3	177.9	0	0	0	0	0	112	D182 T183 Y184 L188 R189 E190	D182-G186 PolarHBondContact O-N 2.91Å; T183-G186 PolarHBondContact O-N 3.49Å; Y184-G186 PolarHBondContact O-N 3.23Å; G186-L188 VanDerWaalsContact C-N 3.31Å; G186-L188 PolarHBondContact O-N 2.93Å; G186-R189 PolarHBondContact O-N 3.22Å; G186-E190 PolarHBondContact O-N 3.1Å
187	Q	95.6	Very high	94.7	Very high	107 Å²	107	69 Å²	69	50%	0.5	35%	0.347	S	S	.	.	H	α-helix	trans	-60.3	-39.4	178.7	-70.2	176.3	-16.6	0	0	112.8	T183 Y184 A191	T183-Q187 WeakPolarHBondContact O-CG 3.41Å; T183-Q187 PolarHBondContact O-N 2.88Å; Y184-Q187 PolarHBondContact O-N 2.04Å; Q187-A191 VanDerWaalsContact O-CB 3.23Å; Q187-A191 WeakPolarHBondContact O-CB 3.45Å; Q187-A191 PolarHBondContact O-N 2.92Å
188	L	95.8	Very high	94.5	Very high	3 Å²	3	72.3 Å²	72.3	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-68.6	-43.5	179.7	-178.2	56	0	0	0	111.6	F169 F175 Y184 K185 G186 A191 I192 F206 L216 I220	F169-L188 HydrophobicContact CD2-CD1 4.39Å; F169-L188 HydrophobicContact CE1-CD1 4.09Å; F169-L188 HydrophobicContact CE2-CD1 3.93Å; F169-L188 HydrophobicContact CZ-CD1 3.76Å; F175-L188 HydrophobicContact CZ-CD1 4.28Å; F175-L188 HydrophobicContact CZ-CD2 4.38Å; Y184-L188 WeakPolarHBondContact O-CB 3.49Å; Y184-L188 PolarHBondContact O-N 3.34Å; K185-L188 PolarHBondContact O-N 2.93Å; G186-L188 VanDerWaalsContact C-N 3.31Å; G186-L188 PolarHBondContact O-N 2.93Å; L188-A191 PolarHBondContact O-N 3.21Å; L188-I192 HydrophobicContact CD1-CD1 3.81Å; L188-I192 HydrophobicContact CD1-CG1 4.18Å; L188-I192 HydrophobicContact CG-CD1 3.93Å; L188-I192 WeakPolarHBondContact O-CB 3.37Å; L188-I192 VanDerWaalsContact O-CG1 3.31Å; L188-I192 WeakPolarHBondContact O-CG1 3.43Å; L188-I192 PolarHBondContact O-N 3.11Å; L188-F206 HydrophobicContact CD1-CE1 4.14Å; L188-F206 HydrophobicContact CD1-CZ 4.3Å; L188-F206 HydrophobicContact CD2-CE1 4.44Å; L188-L216 HydrophobicContact CD2-CD2 4.4Å; L188-I220 HydrophobicContact CD2-CG2 3.44Å; L188-I220 VanDerWaalsContact CD2-CG2 3.44Å; L188-I220 HydrophobicContact CG-CG2 3.83Å
189	R	95.1	Very high	94.6	Very high	113 Å²	113	69 Å²	69	43%	0.426	33%	0.328	S	S	.	.	H	α-helix	trans	-61.1	-46.4	176.2	-72.5	178.8	67.2	162.7	0.2	111.8	K185 G186 I192 R193 Y223 D231	K185-R189 VanDerWaalsContact O-CG 3.28Å; K185-R189 WeakPolarHBondContact O-CG 3.4Å; K185-R189 PolarHBondContact O-N 3.46Å; G186-R189 PolarHBondContact O-N 3.22Å; R189-I192 PolarHBondContact O-N 2.96Å; R189-R193 WeakPolarHBondContact O-CB 3.25Å; R189-R193 PolarHBondContact O-N 2.76Å; R189-Y223 HydrophobicContact CG-CE2 4.13Å; R189-Y223 PolarHBondContact NE-OH 2.97Å; R189-D231 IonicContact NH2-OD2 2.68Å; R189-D231 PolarHBondContact NH2-OD2 3.05Å
190	E	94.7	Very high	94.1	Very high	122 Å²	122	62.8 Å²	62.8	57%	0.57	32%	0.315	S	S	*	.	H	α-helix	trans	-61.9	-49.2	177.1	-172.4	174	-164.8	0	0	111	G186 I192 R193 D194	G186-E190 PolarHBondContact O-N 3.1Å; E190-I192 PolarHBondContact O-N 2.97Å; E190-R193 PolarHBondContact O-N 2.66Å; E190-D194 WeakPolarHBondContact O-CB 3.45Å; E190-D194 VanDerWaalsContact O-CG 3.25Å; E190-D194 PolarHBondContact O-N 3.1Å
191	A	94.8	Very high	94	Very high	29 Å²	29	60.1 Å²	60.1	24%	0.24	30%	0.301	C	S	.	.	H	α-helix	trans	-60	-41.1	178.9	0	0	0	0	0	113.4	F169 Q187 L188 M195	F169-A191 HydrophobicContact CZ-CB 4.33Å; Q187-A191 VanDerWaalsContact O-CB 3.23Å; Q187-A191 WeakPolarHBondContact O-CB 3.45Å; Q187-A191 PolarHBondContact O-N 2.92Å; L188-A191 PolarHBondContact O-N 3.21Å; A191-M195 VanDerWaalsContact O-CB 3.3Å; A191-M195 WeakPolarHBondContact O-CB 3.4Å; A191-M195 PolarHBondContact O-N 3.39Å
192	I	95.4	Very high	94.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.6	-49.3	177	-73.8	167.8	0	0	0	110.2	L188 R189 E190 M195 V196 F204 I220 Y223 Y235	L188-I192 HydrophobicContact CD1-CD1 3.81Å; L188-I192 HydrophobicContact CD1-CG1 4.18Å; L188-I192 HydrophobicContact CG-CD1 3.93Å; L188-I192 WeakPolarHBondContact O-CB 3.37Å; L188-I192 VanDerWaalsContact O-CG1 3.31Å; L188-I192 WeakPolarHBondContact O-CG1 3.43Å; L188-I192 PolarHBondContact O-N 3.11Å; R189-I192 PolarHBondContact O-N 2.96Å; E190-I192 PolarHBondContact O-N 2.97Å; I192-M195 PolarHBondContact O-N 3.47Å; I192-V196 WeakPolarHBondContact O-CG2 3.34Å; I192-V196 PolarHBondContact O-N 2.91Å; I192-V196 VanDerWaalsContact O-N 3.12Å; I192-F204 HydrophobicContact CB-CE1 4.28Å; I192-F204 HydrophobicContact CB-CZ 4.15Å; I192-F204 HydrophobicContact CG1-CD1 4.25Å; I192-F204 HydrophobicContact CG1-CE1 3.83Å; I192-F204 HydrophobicContact CG1-CZ 4.09Å; I192-F204 HydrophobicContact CG2-CE1 4.5Å; I192-F204 HydrophobicContact CG2-CE2 4.23Å; I192-F204 HydrophobicContact CG2-CZ 3.91Å; I192-I220 HydrophobicContact CD1-CB 4.49Å; I192-I220 HydrophobicContact CD1-CG2 3.64Å; I192-Y223 HydrophobicContact CD1-CD2 4.13Å; I192-Y223 HydrophobicContact CD1-CE2 4.43Å; I192-Y223 HydrophobicContact CG2-CD2 4.08Å; I192-Y223 HydrophobicContact CG2-CE2 4.42Å; I192-Y223 HydrophobicContact CG2-CG 4.2Å; I192-Y235 HydrophobicContact CG2-CD1 4.24Å; I192-Y235 HydrophobicContact CG2-CE1 3.65Å
193	R	94.6	Very high	94.2	Very high	118 Å²	118	54.1 Å²	54.1	45%	0.445	27%	0.269	S	S	.	.	H	α-helix	trans	-59.5	-50.4	179.2	-179.1	-176.8	173.4	-167.6	-1.9	111.8	R189 E190 M195 V196 L197 V233	R189-R193 WeakPolarHBondContact O-CB 3.25Å; R189-R193 PolarHBondContact O-N 2.76Å; E190-R193 PolarHBondContact O-N 2.66Å; R193-M195 PolarHBondContact O-N 3.45Å; R193-V196 PolarHBondContact O-N 3.49Å; R193-L197 HydrophobicContact CG-CD1 4.06Å; R193-L197 WeakPolarHBondContact O-CG 3.07Å; R193-L197 PolarHBondContact O-N 3.21Å; R193-V233 HydrophobicContact CG-CG2 4.48Å
194	D	93.8	Very high	94.3	Very high	67 Å²	67	50.3 Å²	50.3	36%	0.358	25%	0.246	S	C	.	.	H	α-helix	trans	-61.5	-31.1	-177.9	-74.3	-5.2	0	0	0	112.7	E190 R198	E190-D194 WeakPolarHBondContact O-CB 3.45Å; E190-D194 VanDerWaalsContact O-CG 3.25Å; E190-D194 PolarHBondContact O-N 3.1Å; D194-R198 WeakPolarHBondContact O-CG 2.96Å; D194-R198 PolarHBondContact O-N 3.27Å; D194-R198 PolarHBondContact O-NE 3.4Å
195	M	94	Very high	94.3	Very high	7 Å²	7	49.7 Å²	49.7	3%	0.034	24%	0.244	C	C	.	.	H	α-helix	trans	-76.6	-43.8	179.2	-170.7	-178.8	170.7	0	0	111.8	C165 V166 R167 A191 I192 R193 L197 R198 C199 T202 F204	C165-M195 WeakPolarHBondContact O-CE 3.39Å; V166-M195 VanDerWaalsContact C-CE 3.44Å; V166-M195 VanDerWaalsContact N-CE 3.26Å; R167-M195 HydrophobicContact CB-CE 3.76Å; R167-M195 HydrophobicContact CB-SD 3.4Å; R167-M195 WeakPolarHBondContact CB-SD 3.32Å; R167-M195 HydrophobicContact CG-SD 4.3Å; A191-M195 VanDerWaalsContact O-CB 3.3Å; A191-M195 WeakPolarHBondContact O-CB 3.4Å; A191-M195 PolarHBondContact O-N 3.39Å; I192-M195 PolarHBondContact O-N 3.47Å; R193-M195 PolarHBondContact O-N 3.45Å; M195-L197 VanDerWaalsContact C-N 3.29Å; M195-L197 PolarHBondContact O-N 3.02Å; M195-R198 PolarHBondContact O-N 2.87Å; M195-R198 VanDerWaalsContact O-N 3.08Å; M195-C199 PolarHBondContact O-N 3.02Å; M195-T202 HydrophobicContact CB-CG2 4.45Å; M195-T202 HydrophobicContact CE-CG2 4.1Å; M195-T202 HydrophobicContact CG-CG2 3.77Å; M195-T202 HydrophobicContact SD-CG2 4.37Å; M195-F204 HydrophobicContact CB-CE1 4.22Å; M195-F204 HydrophobicContact CB-CZ 4.16Å; M195-F204 HydrophobicContact CE-CE1 4.37Å; M195-F204 HydrophobicContact CG-CE1 4.3Å; M195-F204 HydrophobicContact CG-CZ 4.33Å; M195-F204 HydrophobicContact SD-CD1 3.9Å; M195-F204 HydrophobicContact SD-CE1 3.2Å; M195-F204 WeakPolarHBondContact SD-CE1 3.49Å; M195-F204 HydrophobicContact SD-CZ 3.69Å
196	V	93.5	Very high	94.4	Very high	16 Å²	16	47 Å²	47	10%	0.097	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-34.7	177.6	174.2	0	0	0	0	111.5	I192 R193 R198 C199 T202 F204 V233 S234 Y235	I192-V196 WeakPolarHBondContact O-CG2 3.34Å; I192-V196 PolarHBondContact O-N 2.91Å; I192-V196 VanDerWaalsContact O-N 3.12Å; R193-V196 PolarHBondContact O-N 3.49Å; V196-R198 VanDerWaalsContact C-N 3.27Å; V196-R198 PolarHBondContact O-N 2.77Å; V196-C199 CarbonylContact O-C 3.57Å; V196-T202 HydrophobicContact CB-CG2 4.45Å; V196-T202 HydrophobicContact CG2-CG2 3.9Å; V196-F204 HydrophobicContact CG2-CE2 4.08Å; V196-F204 HydrophobicContact CG2-CZ 4.04Å; V196-V233 HydrophobicContact CB-CG1 4.32Å; V196-V233 HydrophobicContact CG1-CG1 3.61Å; V196-S234 WeakPolarHBondContact CG1-O 3.48Å; V196-Y235 HydrophobicContact CB-CD1 4.4Å; V196-Y235 HydrophobicContact CB-CE1 4.12Å; V196-Y235 HydrophobicContact CG1-CD1 4.3Å; V196-Y235 HydrophobicContact CG1-CE1 4.31Å; V196-Y235 HydrophobicContact CG2-CD1 3.75Å; V196-Y235 HydrophobicContact CG2-CE1 3.74Å
197	L	92.3	Very high	94.4	Very high	106 Å²	106	46 Å²	46	56%	0.555	22%	0.217	S	C	*	.	H	α-helix	trans	-65.7	-28.8	173.2	-71.5	174	0	0	0	113.2	R193 M195 V233	R193-L197 HydrophobicContact CG-CD1 4.06Å; R193-L197 WeakPolarHBondContact O-CG 3.07Å; R193-L197 PolarHBondContact O-N 3.21Å; M195-L197 VanDerWaalsContact C-N 3.29Å; M195-L197 PolarHBondContact O-N 3.02Å; L197-V233 HydrophobicContact CD2-CG1 4.31Å; L197-V233 HydrophobicContact CD2-CG2 3.87Å; L197-V233 HydrophobicContact CG-CG2 4.4Å
198	R	91.1	Very high	94.3	Very high	163 Å²	163	42.9 Å²	42.9	62%	0.615	20%	0.203	S	C	*	.	H	α-helix	trans	-91.8	-24.7	-178.8	-75.8	-177.5	-71.4	169.3	-5.3	113.9	R90 D194 M195 V196	R90-R198 PolarHBondContact NH2-O 3.23Å; D194-R198 WeakPolarHBondContact O-CG 2.96Å; D194-R198 PolarHBondContact O-N 3.27Å; D194-R198 PolarHBondContact O-NE 3.4Å; M195-R198 PolarHBondContact O-N 2.87Å; M195-R198 VanDerWaalsContact O-N 3.08Å; V196-R198 VanDerWaalsContact C-N 3.27Å; V196-R198 PolarHBondContact O-N 2.77Å
199	C	90.9	Very high	94	Very high	1 Å²	1	43 Å²	43	1%	0.007	20%	0.204	C	C	.	.			trans	-139.7	123.5	-179.4	-173.1	0	0	0	0	110.3	C165 M195 V196 Q201 T202	C165-C199 HydrophobicContact CB-CB 3.86Å; C165-C199 WeakPolarHBondContact CB-SG 3.38Å; C165-C199 WeakPolarHBondContact SG-CB 3.26Å; C165-C199 CovalentContact SG-SG 2.03Å; C165-C199 PolarHBondContact SG-SG 3.42Å; M195-C199 PolarHBondContact O-N 3.02Å; V196-C199 CarbonylContact O-C 3.57Å; C199-Q201 VanDerWaalsContact C-N 3.27Å; C199-Q201 PolarHBondContact O-N 3.31Å; C199-Q201 PolarHBondContact SG-O 3.13Å; C199-T202 HydrophobicContact CB-CG2 4.18Å; C199-T202 VanDerWaalsContact O-CG2 3.31Å; C199-T202 WeakPolarHBondContact O-CG2 3.35Å
200	P	84.8	Confident	93.7	Very high	82 Å²	82	39.3 Å²	39.3	53%	0.532	19%	0.192	S	C	.	.	S	Bend	trans	-66.6	-29.5	-176.4	25.7	-33.7	0	0	0	112.6	I91 R237	I91-P200 HydrophobicContact CD1-CG 4.08Å; P200-R237 WeakPolarHBondContact O-CB 3.44Å
201	Q	93.9	Very high	93.5	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.019	19%	0.19	C	C	.	.	S	Bend	trans	-117.1	95.3	177.2	-170.2	-172.5	-70	0	0	110.9	I91 N93 F123 M156 Y157 C199 R237	I91-Q201 HydrophobicContact CD1-CB 3.54Å; I91-Q201 HydrophobicContact CG1-CB 4.26Å; N93-Q201 PolarHBondContact ND2-OE1 3.42Å; N93-Q201 VanDerWaalsContact ND2-OE1 3.14Å; N93-Q201 PolarHBondContact OD1-NE2 3.01Å; F123-Q201 HydrophobicContact CE1-CG 4.06Å; F123-Q201 HydrophobicContact CZ-CG 4.24Å; M156-Q201 VanDerWaalsContact CE-NE2 3.34Å; Y157-Q201 WeakPolarHBondContact CE1-O 3.44Å; Y157-Q201 PolarHBondContact OH-O 3.47Å; C199-Q201 VanDerWaalsContact C-N 3.27Å; C199-Q201 PolarHBondContact O-N 3.31Å; C199-Q201 PolarHBondContact SG-O 3.13Å; Q201-R237 WeakPolarHBondContact CA-O 3.45Å; Q201-R237 WeakPolarHBondContact CG-O 2.91Å
202	T	95.9	Very high	93.2	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	18%	0.181	C	C	.	.			trans	-97.3	146	-178.2	54.3	0	0	0	0	112.6	C165 M195 V196 C199 F204 A238 V239	C165-T202 CarbonylContact O-C 3.54Å; C165-T202 WeakPolarHBondContact O-CA 3.45Å; M195-T202 HydrophobicContact CB-CG2 4.45Å; M195-T202 HydrophobicContact CE-CG2 4.1Å; M195-T202 HydrophobicContact CG-CG2 3.77Å; M195-T202 HydrophobicContact SD-CG2 4.37Å; V196-T202 HydrophobicContact CB-CG2 4.45Å; V196-T202 HydrophobicContact CG2-CG2 3.9Å; C199-T202 HydrophobicContact CB-CG2 4.18Å; C199-T202 VanDerWaalsContact O-CG2 3.31Å; C199-T202 WeakPolarHBondContact O-CG2 3.35Å; T202-F204 HydrophobicContact CG2-CZ 4.42Å; T202-F204 WeakPolarHBondContact OG1-CE2 3.41Å; T202-A238 CarbonylContact O-C 3.38Å; T202-A238 WeakPolarHBondContact O-CA 3.49Å; T202-A238 WeakPolarHBondContact OG1-CB 3.48Å; T202-V239 PolarHBondContact O-N 2.85Å
203	L	97.8	Very high	93	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	115.5	170.4	171.6	61.7	0	0	0	110.1	A153 Y157 C165 V166 R167 I205 V239 L241	A153-L203 HydrophobicContact CB-CD2 3.85Å; Y157-L203 HydrophobicContact CD2-CD2 4.41Å; Y157-L203 HydrophobicContact CE2-CB 3.56Å; Y157-L203 HydrophobicContact CE2-CD2 3.85Å; Y157-L203 HydrophobicContact CE2-CG 4.35Å; Y157-L203 WeakPolarHBondContact OH-CB 3.5Å; Y157-L203 PolarHBondContact OH-N 2.96Å; C165-L203 PolarHBondContact O-N 3.3Å; V166-L203 CarbonylContact C-O 3.57Å; V166-L203 WeakPolarHBondContact CA-O 2.95Å; V166-L203 HydrophobicContact CG1-CB 4.4Å; V166-L203 HydrophobicContact CG1-CD2 4.06Å; V166-L203 HydrophobicContact CG1-CG 4.19Å; V166-L203 HydrophobicContact CG2-CB 4.15Å; V166-L203 HydrophobicContact CG2-CD2 4.17Å; R167-L203 PolarHBondContact N-O 3.17Å; L203-I205 HydrophobicContact CD1-CG1 4.23Å; L203-I205 HydrophobicContact CD2-CD1 4.19Å; L203-I205 HydrophobicContact CD2-CG1 4.39Å; L203-I205 HydrophobicContact CG-CD1 4.35Å; L203-I205 HydrophobicContact CG-CG1 4.04Å; L203-V239 WeakPolarHBondContact CA-O 3.45Å; L203-V239 HydrophobicContact CD1-CB 3.88Å; L203-V239 HydrophobicContact CD1-CG1 3.75Å; L203-L241 HydrophobicContact CD1-CD1 3.67Å; L203-L241 HydrophobicContact CD1-CG 3.65Å
204	F	98	Very high	92.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.2	173.9	-61	-75.4	0	0	0	109.8	R167 F169 I192 M195 V196 T202 F206 A238 V239 F240 L241	R167-F204 HydrophobicContact CB-CD1 4.05Å; R167-F204 HydrophobicContact CB-CE1 4.37Å; R167-F204 WeakPolarHBondContact O-CA 3.07Å; F169-F204 HydrophobicContact CE2-CD1 4.04Å; I192-F204 HydrophobicContact CB-CE1 4.28Å; I192-F204 HydrophobicContact CB-CZ 4.15Å; I192-F204 HydrophobicContact CG1-CD1 4.25Å; I192-F204 HydrophobicContact CG1-CE1 3.83Å; I192-F204 HydrophobicContact CG1-CZ 4.09Å; I192-F204 HydrophobicContact CG2-CE1 4.5Å; I192-F204 HydrophobicContact CG2-CE2 4.23Å; I192-F204 HydrophobicContact CG2-CZ 3.91Å; M195-F204 HydrophobicContact CB-CE1 4.22Å; M195-F204 HydrophobicContact CB-CZ 4.16Å; M195-F204 HydrophobicContact CE-CE1 4.37Å; M195-F204 HydrophobicContact CG-CE1 4.3Å; M195-F204 HydrophobicContact CG-CZ 4.33Å; M195-F204 HydrophobicContact SD-CD1 3.9Å; M195-F204 HydrophobicContact SD-CE1 3.2Å; M195-F204 WeakPolarHBondContact SD-CE1 3.49Å; M195-F204 HydrophobicContact SD-CZ 3.69Å; V196-F204 HydrophobicContact CG2-CE2 4.08Å; V196-F204 HydrophobicContact CG2-CZ 4.04Å; T202-F204 HydrophobicContact CG2-CZ 4.42Å; T202-F204 WeakPolarHBondContact OG1-CE2 3.41Å; F204-F206 HydrophobicContact CB-CD2 4.48Å; F204-F206 HydrophobicContact CB-CE2 3.82Å; F204-A238 HydrophobicContact CD2-CB 4.48Å; F204-A238 HydrophobicContact CE2-CB 4.27Å; F204-V239 PolarHBondContact N-O 3.16Å; F204-F240 HydrophobicContact CB-CD1 3.96Å; F204-F240 HydrophobicContact CB-CE1 4.2Å; F204-F240 HydrophobicContact CD2-CD1 4.09Å; F204-F240 AromaticContact CD2-CE1 3.63Å; F204-F240 HydrophobicContact CD2-CE1 3.63Å; F204-F240 HydrophobicContact CD2-CE2 4.49Å; F204-F240 AromaticContact CD2-CZ 3.86Å; F204-F240 HydrophobicContact CD2-CZ 3.86Å; F204-F240 HydrophobicContact CE2-CE1 4.32Å; F204-F240 HydrophobicContact CE2-CZ 4.22Å; F204-F240 HydrophobicContact CG-CD1 4.36Å; F204-F240 HydrophobicContact CG-CE1 4.12Å; F204-L241 PolarHBondContact O-N 2.76Å
205	I	98.1	Very high	92.4	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.036	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.5	178.2	-55.2	170.4	0	0	0	108.3	A149 V166 R167 L168 F169 L203 L241 L243	A149-I205 HydrophobicContact CB-CD1 4.33Å; A149-I205 HydrophobicContact CB-CG2 4.46Å; V166-I205 HydrophobicContact CG1-CD1 4.17Å; R167-I205 PolarHBondContact O-N 3.26Å; L168-I205 CarbonylContact C-O 3.54Å; L168-I205 HydrophobicContact CD1-CB 3.8Å; L168-I205 HydrophobicContact CD1-CG2 3.59Å; F169-I205 PolarHBondContact N-O 3.3Å; L203-I205 HydrophobicContact CD1-CG1 4.23Å; L203-I205 HydrophobicContact CD2-CD1 4.19Å; L203-I205 HydrophobicContact CD2-CG1 4.39Å; L203-I205 HydrophobicContact CG-CD1 4.35Å; L203-I205 HydrophobicContact CG-CG1 4.04Å; I205-L241 CarbonylContact C-O 3.34Å; I205-L241 WeakPolarHBondContact CA-O 3.42Å; I205-L241 HydrophobicContact CG1-CB 4.35Å; I205-L241 HydrophobicContact CG1-CD1 4.28Å; I205-L243 HydrophobicContact CG2-CD1 3.86Å; I205-L243 HydrophobicContact CG2-CG 4.22Å
206	F	96.9	Very high	92.3	Very high	1 Å²	1	35.5 Å²	35.5	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	99.8	174.4	-67.5	-89.4	0	0	0	109	F169 L188 F204 L212 I220 F240 L241 F242 L243	F169-F206 HydrophobicContact CB-CD1 3.88Å; F169-F206 HydrophobicContact CB-CE1 4.1Å; F169-F206 HydrophobicContact CD2-CD1 4.17Å; F169-F206 AromaticContact CD2-CE1 3.67Å; F169-F206 HydrophobicContact CD2-CE1 3.67Å; F169-F206 HydrophobicContact CD2-CE2 4.45Å; F169-F206 AromaticContact CD2-CZ 3.84Å; F169-F206 HydrophobicContact CD2-CZ 3.84Å; F169-F206 HydrophobicContact CE2-CE1 4.37Å; F169-F206 HydrophobicContact CE2-CZ 4.23Å; F169-F206 HydrophobicContact CG-CD1 4.37Å; F169-F206 HydrophobicContact CG-CE1 4.1Å; F169-F206 CarbonylContact O-C 3.51Å; F169-F206 WeakPolarHBondContact O-CA 3.49Å; L188-F206 HydrophobicContact CD1-CE1 4.14Å; L188-F206 HydrophobicContact CD1-CZ 4.3Å; L188-F206 HydrophobicContact CD2-CE1 4.44Å; F204-F206 HydrophobicContact CB-CD2 4.48Å; F204-F206 HydrophobicContact CB-CE2 3.82Å; F206-L212 HydrophobicContact CB-CD1 4.24Å; F206-L212 HydrophobicContact CD1-CD1 3.98Å; F206-L212 HydrophobicContact CG-CD1 4.41Å; F206-I220 HydrophobicContact CE1-CD1 4.38Å; F206-I220 HydrophobicContact CE2-CD1 4.36Å; F206-I220 HydrophobicContact CZ-CD1 4.11Å; F206-F240 AromaticContact CE2-CD1 3.99Å; F206-F240 HydrophobicContact CE2-CD1 3.99Å; F206-F240 HydrophobicContact CE2-CE1 4.48Å; F206-L241 PolarHBondContact N-O 2.71Å; F206-F242 HydrophobicContact CB-CD1 3.59Å; F206-F242 HydrophobicContact CB-CE1 3.86Å; F206-F242 HydrophobicContact CB-CG 4.49Å; F206-F242 HydrophobicContact CD1-CE1 4.48Å; F206-F242 HydrophobicContact CD2-CD1 4.03Å; F206-F242 AromaticContact CD2-CE1 3.53Å; F206-F242 HydrophobicContact CD2-CE1 3.53Å; F206-F242 AromaticContact CD2-CZ 3.94Å; F206-F242 HydrophobicContact CD2-CZ 3.94Å; F206-F242 HydrophobicContact CE2-CE1 4.2Å; F206-F242 HydrophobicContact CE2-CZ 4.31Å; F206-F242 AromaticContact CG-CD1 3.98Å; F206-F242 HydrophobicContact CG-CD1 3.98Å; F206-F242 AromaticContact CG-CE1 3.7Å; F206-F242 HydrophobicContact CG-CE1 3.7Å; F206-L243 PolarHBondContact O-N 2.73Å
207	D	96	Very high	92	Very high	19 Å²	19	34.8 Å²	34.8	10%	0.102	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	145.1	178.2	-167	20.1	0	0	0	111.2	N146 L168 F169 I170 A171 A209 L243	N146-D207 PolarHBondContact ND2-OD1 2.74Å; N146-D207 PolarHBondContact ND2-OD2 2.97Å; N146-D207 VanDerWaalsContact ND2-OD2 3.09Å; N146-D207 PolarHBondContact OD1-OD2 3.37Å; L168-D207 HydrophobicContact CD1-CB 4.17Å; F169-D207 PolarHBondContact O-N 2.9Å; I170-D207 HydrophobicContact CG1-CB 4.24Å; A171-D207 WeakPolarHBondContact CB-O 3.39Å; A171-D207 PolarHBondContact N-O 3.38Å; D207-A209 VanDerWaalsContact C-N 3.28Å; D207-A209 PolarHBondContact O-N 2.79Å; D207-L243 HydrophobicContact CB-CD1 4.33Å
208	E	92.3	Very high	91.8	Very high	41 Å²	41	33 Å²	33	19%	0.192	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	45.3	-171.6	-61	-82.2	164	0	0	111.6	A171 P172 E210 K211 L243 N245	A171-E208 WeakPolarHBondContact CB-O 3.41Å; P172-E208 HydrophobicContact CG-CB 4.44Å; E208-E210 PolarHBondContact O-N 3.07Å; E208-E210 VanDerWaalsContact O-N 3.13Å; E208-K211 HydrophobicContact CB-CD 4.25Å; E208-K211 WeakPolarHBondContact O-CB 3.22Å; E208-K211 PolarHBondContact O-N 3.33Å; E208-K211 WeakPolarHBondContact OE2-CE 3.49Å; E208-K211 IonicContact OE2-NZ 3.35Å; E208-K211 PolarHBondContact OE2-NZ 2.85Å; E208-L243 PolarHBondContact N-O 2.96Å; E208-L243 VanDerWaalsContact N-O 3.14Å; E208-N245 PolarHBondContact OE1-ND2 3.47Å; E208-N245 PolarHBondContact OE2-ND2 3Å
209	A	91.1	Very high	91.8	Very high	5 Å²	5	26 Å²	26	4%	0.041	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-59.9	-24.7	-172.8	0	0	0	0	0	113.7	D207 K211 L212 F242 L243	D207-A209 VanDerWaalsContact C-N 3.28Å; D207-A209 PolarHBondContact O-N 2.79Å; A209-K211 PolarHBondContact O-N 3.32Å; A209-L212 HydrophobicContact CB-CD1 4.19Å; A209-L212 WeakPolarHBondContact O-CB 3.13Å; A209-L212 PolarHBondContact O-N 2.97Å; A209-L212 VanDerWaalsContact O-N 3.09Å; A209-F242 HydrophobicContact CB-CB 4.12Å; A209-F242 HydrophobicContact CB-CD1 4.04Å; A209-L243 PolarHBondContact N-O 2.83Å
210	E	87.4	Confident	91.8	Very high	36 Å²	36	26 Å²	26	17%	0.168	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-62.2	-19.6	172.1	66.1	-85.1	-155.6	0	0	114	E208 S244 N245 I246	E208-E210 PolarHBondContact O-N 3.07Å; E208-E210 VanDerWaalsContact O-N 3.13Å; E210-S244 WeakPolarHBondContact CB-OG 3.38Å; E210-S244 WeakPolarHBondContact OE2-CA 3.47Å; E210-S244 VanDerWaalsContact OE2-CB 3.23Å; E210-S244 WeakPolarHBondContact OE2-CB 3.37Å; E210-S244 PolarHBondContact OE2-OG 3.41Å; E210-N245 VanDerWaalsContact OE1-CB 3.3Å; E210-N245 WeakPolarHBondContact OE1-CB 3.23Å; E210-N245 PolarHBondContact OE1-N 3.33Å; E210-N245 VanDerWaalsContact OE1-N 3.15Å; E210-N245 PolarHBondContact OE1-ND2 3.23Å; E210-N245 PolarHBondContact OE2-N 2.89Å; E210-I246 HydrophobicContact CB-CD1 3.33Å; E210-I246 HydrophobicContact CB-CG1 3.58Å; E210-I246 HydrophobicContact CG-CD1 4.48Å; E210-I246 HydrophobicContact CG-CG1 4.29Å
211	K	90	Very high	92	Very high	123 Å²	123	24 Å²	24	54%	0.535	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-93.5	-3.3	178.1	-59	-178.4	179.5	145.1	0	112.3	A171 P172 E208 A209	A171-K211 HydrophobicContact CB-CB 4.26Å; P172-K211 HydrophobicContact CB-CD 4.43Å; P172-K211 HydrophobicContact CG-CD 4.29Å; E208-K211 HydrophobicContact CB-CD 4.25Å; E208-K211 WeakPolarHBondContact O-CB 3.22Å; E208-K211 PolarHBondContact O-N 3.33Å; E208-K211 WeakPolarHBondContact OE2-CE 3.49Å; E208-K211 IonicContact OE2-NZ 3.35Å; E208-K211 PolarHBondContact OE2-NZ 2.85Å; A209-K211 PolarHBondContact O-N 3.32Å
212	L	90.1	Very high	91.9	Very high	9 Å²	9	26 Å²	26	5%	0.047	14%	0.135	C	C	.	.	S	Bend	trans	-67	135	174.9	-72.3	170.5	0	0	0	109.9	A171 F175 F206 A209 L216 I217	A171-L212 HydrophobicContact CB-CD2 3.56Å; A171-L212 HydrophobicContact CB-CG 3.74Å; F175-L212 HydrophobicContact CD2-CD2 3.55Å; F175-L212 HydrophobicContact CE2-CD2 3.89Å; F206-L212 HydrophobicContact CB-CD1 4.24Å; F206-L212 HydrophobicContact CD1-CD1 3.98Å; F206-L212 HydrophobicContact CG-CD1 4.41Å; A209-L212 HydrophobicContact CB-CD1 4.19Å; A209-L212 WeakPolarHBondContact O-CB 3.13Å; A209-L212 PolarHBondContact O-N 2.97Å; A209-L212 VanDerWaalsContact O-N 3.09Å; L212-L216 HydrophobicContact CD2-CD1 4.32Å; L212-I217 HydrophobicContact CB-CD1 4.24Å; L212-I217 HydrophobicContact CB-CG1 4.13Å
213	H	89.7	Confident	91.7	Very high	79 Å²	79	26.2 Å²	26.2	37%	0.366	14%	0.136	S	C	.	.			trans	-65.6	137.4	173.3	-170.7	-80.9	0	0	0	109.8	V181 G215 L216 I217	V181-H213 HydrophobicContact CG2-CB 3.71Å; H213-G215 VanDerWaalsContact C-N 3.27Å; H213-G215 PolarHBondContact ND1-N 3.38Å; H213-G215 VanDerWaalsContact ND1-N 3.15Å; H213-G215 PolarHBondContact O-N 3.5Å; H213-G215 VanDerWaalsContact O-N 3.16Å; H213-L216 HydrophobicContact CB-CD1 4.35Å; H213-L216 HydrophobicContact CB-CG 4.4Å; H213-L216 WeakPolarHBondContact O-CB 3.39Å; H213-L216 PolarHBondContact O-N 3.01Å; H213-I217 PolarHBondContact O-N 3.41Å
214	P	87.4	Confident	91.4	Very high	43 Å²	43	26.2 Å²	26.2	28%	0.279	14%	0.136	S	C	.	.	H	α-helix	trans	-50.9	-43.8	-178.7	-27.8	32.4	0	0	0	113.6	L216 I217 D218 F288 A289	P214-L216 PolarHBondContact O-N 3.4Å; P214-L216 VanDerWaalsContact O-N 3.1Å; P214-I217 WeakPolarHBondContact O-CA 3.39Å; P214-I217 VanDerWaalsContact O-CB 3.31Å; P214-I217 WeakPolarHBondContact O-CB 3.45Å; P214-I217 PolarHBondContact O-N 3.32Å; P214-D218 PolarHBondContact O-N 3.22Å; P214-F288 HydrophobicContact CB-CD1 4.38Å; P214-A289 HydrophobicContact CB-CB 4.18Å; P214-A289 HydrophobicContact CG-CB 4.05Å
215	G	89.1	Confident	90.9	Very high	6 Å²	6	28.6 Å²	28.6	6%	0.062	15%	0.149	C	C	.	.	H	α-helix	trans	-58.5	-24.2	175.6	0	0	0	0	0	115.8	K185 H213 D218 A219	K185-G215 VanDerWaalsContact CE-C 3.45Å; K185-G215 WeakPolarHBondContact CE-O 3.31Å; H213-G215 VanDerWaalsContact C-N 3.27Å; H213-G215 PolarHBondContact ND1-N 3.38Å; H213-G215 VanDerWaalsContact ND1-N 3.15Å; H213-G215 PolarHBondContact O-N 3.5Å; H213-G215 VanDerWaalsContact O-N 3.16Å; G215-D218 WeakPolarHBondContact CA-OD2 3.11Å; G215-A219 PolarHBondContact O-N 3.44Å
216	L	91.6	Very high	90.2	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-77	-36.7	172.1	-68	174.4	0	0	0	111.5	F175 K185 L188 L212 H213 P214 A219 I220	F175-L216 HydrophobicContact CB-CD1 3.74Å; F175-L216 HydrophobicContact CD1-CD1 3.98Å; F175-L216 HydrophobicContact CD2-CD1 3.86Å; F175-L216 HydrophobicContact CE2-CD1 4.48Å; F175-L216 HydrophobicContact CG-CD1 3.57Å; K185-L216 HydrophobicContact CB-CD2 4.48Å; K185-L216 HydrophobicContact CG-CD2 3.88Å; L188-L216 HydrophobicContact CD2-CD2 4.4Å; L212-L216 HydrophobicContact CD2-CD1 4.32Å; H213-L216 HydrophobicContact CB-CD1 4.35Å; H213-L216 HydrophobicContact CB-CG 4.4Å; H213-L216 WeakPolarHBondContact O-CB 3.39Å; H213-L216 PolarHBondContact O-N 3.01Å; P214-L216 PolarHBondContact O-N 3.4Å; P214-L216 VanDerWaalsContact O-N 3.1Å; L216-A219 PolarHBondContact O-N 2.94Å; L216-I220 PolarHBondContact O-N 3.43Å
217	I	88.4	Confident	89.6	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-62	-47.9	173	-56.7	-157.9	0	0	0	109.2	L212 H213 P214 A219 I220 K221 A289 L293	L212-I217 HydrophobicContact CB-CD1 4.24Å; L212-I217 HydrophobicContact CB-CG1 4.13Å; H213-I217 PolarHBondContact O-N 3.41Å; P214-I217 WeakPolarHBondContact O-CA 3.39Å; P214-I217 VanDerWaalsContact O-CB 3.31Å; P214-I217 WeakPolarHBondContact O-CB 3.45Å; P214-I217 PolarHBondContact O-N 3.32Å; I217-A219 PolarHBondContact O-N 2.85Å; I217-I220 WeakPolarHBondContact O-CG1 3.38Å; I217-I220 PolarHBondContact O-N 2.85Å; I217-K221 WeakPolarHBondContact O-CG 3.31Å; I217-K221 PolarHBondContact O-N 3.15Å; I217-A289 HydrophobicContact CD1-CB 3.36Å; I217-A289 HydrophobicContact CG1-CB 4.19Å; I217-L293 HydrophobicContact CD1-CD1 3.81Å; I217-L293 HydrophobicContact CD1-CG 4.49Å; I217-L293 HydrophobicContact CG2-CD1 3.74Å; I217-L293 HydrophobicContact CG2-CD2 3.54Å; I217-L293 HydrophobicContact CG2-CG 3.43Å; I217-L293 VanDerWaalsContact CG2-CG 3.43Å
218	D	86.9	Confident	88.9	Confident	69 Å²	69	43.6 Å²	43.6	37%	0.369	22%	0.217	S	C	.	.	H	α-helix	trans	-52	-40	174.3	-68.4	-37.1	0	0	0	113.2	P214 G215 I220 K221	P214-D218 PolarHBondContact O-N 3.22Å; G215-D218 WeakPolarHBondContact CA-OD2 3.11Å; D218-I220 VanDerWaalsContact C-N 3.29Å; D218-I220 PolarHBondContact O-N 2.75Å; D218-K221 WeakPolarHBondContact OD1-CE 3.32Å; D218-K221 IonicContact OD1-NZ 3.93Å; D218-K221 PolarHBondContact OD1-NZ 3.26Å
219	A	90.6	Very high	88.6	Confident	15 Å²	15	46 Å²	46	12%	0.124	23%	0.231	C	C	.	.	H	α-helix	trans	-70.4	-24	-179.3	0	0	0	0	0	113.4	K185 G215 L216 I217 Y223	K185-A219 HydrophobicContact CB-CB 4.07Å; K185-A219 HydrophobicContact CD-CB 4.36Å; K185-A219 HydrophobicContact CG-CB 3.82Å; G215-A219 PolarHBondContact O-N 3.44Å; L216-A219 PolarHBondContact O-N 2.94Å; I217-A219 PolarHBondContact O-N 2.85Å; A219-Y223 WeakPolarHBondContact O-CE2 3.48Å
220	I	91.8	Very high	88.5	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-97.5	-19.3	178.9	63.6	173.3	0	0	0	114	L188 I192 F206 L216 I217 D218 P222 Y223 M224 F242	L188-I220 HydrophobicContact CD2-CG2 3.44Å; L188-I220 VanDerWaalsContact CD2-CG2 3.44Å; L188-I220 HydrophobicContact CG-CG2 3.83Å; I192-I220 HydrophobicContact CD1-CB 4.49Å; I192-I220 HydrophobicContact CD1-CG2 3.64Å; F206-I220 HydrophobicContact CE1-CD1 4.38Å; F206-I220 HydrophobicContact CE2-CD1 4.36Å; F206-I220 HydrophobicContact CZ-CD1 4.11Å; L216-I220 PolarHBondContact O-N 3.43Å; I217-I220 WeakPolarHBondContact O-CG1 3.38Å; I217-I220 PolarHBondContact O-N 2.85Å; D218-I220 VanDerWaalsContact C-N 3.29Å; D218-I220 PolarHBondContact O-N 2.75Å; I220-P222 VanDerWaalsContact C-N 3.32Å; I220-Y223 HydrophobicContact CB-CD2 4.43Å; I220-Y223 WeakPolarHBondContact O-CB 3.44Å; I220-Y223 PolarHBondContact O-N 3.42Å; I220-M224 HydrophobicContact CD1-SD 4.15Å; I220-M224 HydrophobicContact CG1-SD 4.21Å; I220-F242 HydrophobicContact CD1-CE1 3.79Å; I220-F242 HydrophobicContact CD1-CZ 3.73Å
221	K	89.9	Confident	88.5	Confident	39 Å²	39	49.8 Å²	49.8	17%	0.17	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-46.3	-46.2	179.3	-72.3	178.4	-173.9	162.2	0	113.8	I217 D218 Y223 M224 D225 E292 L298	I217-K221 WeakPolarHBondContact O-CG 3.31Å; I217-K221 PolarHBondContact O-N 3.15Å; D218-K221 WeakPolarHBondContact OD1-CE 3.32Å; D218-K221 IonicContact OD1-NZ 3.93Å; D218-K221 PolarHBondContact OD1-NZ 3.26Å; K221-Y223 PolarHBondContact O-N 2.71Å; K221-Y223 VanDerWaalsContact O-N 3.16Å; K221-M224 PolarHBondContact O-N 3Å; K221-D225 PolarHBondContact O-N 3.38Å; K221-E292 IonicContact NZ-OE1 2.71Å; K221-E292 PolarHBondContact NZ-OE1 3.28Å; K221-E292 IonicContact NZ-OE2 3.69Å; K221-E292 PolarHBondContact NZ-OE2 3.06Å; K221-L298 HydrophobicContact CB-CD1 3.91Å; K221-L298 HydrophobicContact CD-CD1 4.12Å; K221-L298 HydrophobicContact CG-CD1 3.58Å
222	P	90.9	Very high	88.4	Confident	48 Å²	48	47 Å²	47	31%	0.312	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-59.5	-31.1	-178.4	-24.3	35.4	0	0	0	113.3	I220 M224 Y227 V230	I220-P222 VanDerWaalsContact C-N 3.32Å; P222-M224 PolarHBondContact O-N 3.41Å; P222-Y227 WeakPolarHBondContact O-CD2 3.24Å; P222-V230 HydrophobicContact CB-CG1 4.22Å; P222-V230 HydrophobicContact CB-CG2 4.24Å; P222-V230 WeakPolarHBondContact O-CG2 3.16Å
223	Y	92.1	Very high	88.4	Confident	5 Å²	5	47.3 Å²	47.3	2%	0.02	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-78.7	-8.4	-179.4	-50.7	-56.5	0	0	0	113.4	P132 R189 I192 A219 I220 K221 V230 Y235 F240	P132-Y223 WeakPolarHBondContact CG-O 3.41Å; R189-Y223 HydrophobicContact CG-CE2 4.13Å; R189-Y223 PolarHBondContact NE-OH 2.97Å; I192-Y223 HydrophobicContact CD1-CD2 4.13Å; I192-Y223 HydrophobicContact CD1-CE2 4.43Å; I192-Y223 HydrophobicContact CG2-CD2 4.08Å; I192-Y223 HydrophobicContact CG2-CE2 4.42Å; I192-Y223 HydrophobicContact CG2-CG 4.2Å; A219-Y223 WeakPolarHBondContact O-CE2 3.48Å; I220-Y223 HydrophobicContact CB-CD2 4.43Å; I220-Y223 WeakPolarHBondContact O-CB 3.44Å; I220-Y223 PolarHBondContact O-N 3.42Å; K221-Y223 PolarHBondContact O-N 2.71Å; K221-Y223 VanDerWaalsContact O-N 3.16Å; Y223-V230 HydrophobicContact CD1-CB 4.05Å; Y223-V230 HydrophobicContact CD1-CG1 4.06Å; Y223-V230 HydrophobicContact CD1-CG2 4.26Å; Y223-V230 HydrophobicContact CE1-CB 4.01Å; Y223-V230 HydrophobicContact CE1-CG1 3.63Å; Y223-Y235 AromaticContact CD1-CD1 3.97Å; Y223-Y235 HydrophobicContact CD1-CD1 3.97Å; Y223-Y235 AromaticContact CD1-CD2 3.84Å; Y223-Y235 HydrophobicContact CD1-CD2 3.84Å; Y223-Y235 AromaticContact CD1-CE1 3.64Å; Y223-Y235 HydrophobicContact CD1-CE1 3.64Å; Y223-Y235 AromaticContact CD1-CE2 3.5Å; Y223-Y235 HydrophobicContact CD1-CE2 3.5Å; Y223-Y235 HydrophobicContact CD1-CG 4.06Å; Y223-Y235 AromaticContact CD1-CZ 3.37Å; Y223-Y235 HydrophobicContact CE1-CE1 4.15Å; Y223-Y235 AromaticContact CE1-CE2 3.85Å; Y223-Y235 HydrophobicContact CE1-CE2 3.85Å; Y223-Y235 AromaticContact CE1-CZ 3.55Å; Y223-Y235 WeakPolarHBondContact CE1-OH 3.42Å; Y223-Y235 HydrophobicContact CG-CD1 4.3Å; Y223-Y235 HydrophobicContact CG-CE1 4.2Å; Y223-F240 WeakPolarHBondContact O-CE2 3.26Å
224	M	91	Very high	88.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-110	-7.3	-178.3	-61.7	169.8	55.6	0	0	112.9	K131 T134 I220 K221 P222 F240 F242 L293 L298	K131-M224 WeakPolarHBondContact CE-O 3.31Å; T134-M224 HydrophobicContact CG2-CE 3.33Å; I220-M224 HydrophobicContact CD1-SD 4.15Å; I220-M224 HydrophobicContact CG1-SD 4.21Å; K221-M224 PolarHBondContact O-N 3Å; P222-M224 PolarHBondContact O-N 3.41Å; M224-F240 HydrophobicContact CG-CD1 4.08Å; M224-F240 HydrophobicContact CG-CD2 3.88Å; M224-F240 HydrophobicContact CG-CE1 4.19Å; M224-F240 HydrophobicContact CG-CE2 3.97Å; M224-F240 HydrophobicContact CG-CG 3.94Å; M224-F240 HydrophobicContact CG-CZ 4.14Å; M224-F240 HydrophobicContact SD-CD1 4.39Å; M224-F240 HydrophobicContact SD-CG 4.48Å; M224-F242 HydrophobicContact CE-CE2 3.41Å; M224-F242 VanDerWaalsContact CE-CE2 3.41Å; M224-F242 HydrophobicContact CE-CZ 3.79Å; M224-F242 HydrophobicContact SD-CE2 3.9Å; M224-F242 HydrophobicContact SD-CZ 3.65Å; M224-L293 HydrophobicContact CE-CD2 3.94Å; M224-L293 HydrophobicContact SD-CD2 4.3Å; M224-L298 HydrophobicContact CB-CD2 4.43Å; M224-L298 HydrophobicContact CE-CB 4.22Å
225	D	87.6	Confident	88.8	Confident	50 Å²	50	44.8 Å²	44.8	27%	0.267	25%	0.251	S	S	.	.	S	Bend	trans	-90.8	177.3	-177.1	-157.8	-6.6	0	0	0	111.3	K221 Y227 L298	K221-D225 PolarHBondContact O-N 3.38Å; D225-Y227 HydrophobicContact CB-CD2 3.71Å; D225-Y227 HydrophobicContact CB-CE2 3.62Å; D225-Y227 PolarHBondContact O-N 2.91Å; D225-Y227 WeakPolarHBondContact OD2-CE2 3.42Å; D225-L298 HydrophobicContact CB-CD2 3.78Å
226	H	83.9	Confident	89	Confident	109 Å²	109	47 Å²	47	51%	0.505	26%	0.258	S	S	.	.	S	Bend	trans	-79.5	30.5	-174.3	-60.2	79.5	0	0	0	113.9
227	Y	83.8	Confident	89.1	Confident	128 Å²	128	49.6 Å²	49.6	50%	0.502	27%	0.267	S	S	.	.			trans	-78	139.6	178.6	-64.3	-69.1	0	0	0	111.3	P222 D225 N229 V230	P222-Y227 WeakPolarHBondContact O-CD2 3.24Å; D225-Y227 HydrophobicContact CB-CD2 3.71Å; D225-Y227 HydrophobicContact CB-CE2 3.62Å; D225-Y227 PolarHBondContact O-N 2.91Å; D225-Y227 WeakPolarHBondContact OD2-CE2 3.42Å; Y227-N229 VanDerWaalsContact C-N 3.29Å; Y227-N229 PolarHBondContact O-N 2.89Å; Y227-V230 HydrophobicContact CD2-CG2 4.36Å
228	D	80.6	Confident	89.4	Confident	105 Å²	105	49.5 Å²	49.5	56%	0.561	27%	0.267	S	S	*	.	S	Bend	trans	-62.1	-41.7	174.4	-64.3	-10.2	0	0	0	111.5	R236	D228-R236 VanDerWaalsContact CG-NH2 3.34Å; D228-R236 IonicContact OD1-CZ 2.71Å; D228-R236 IonicContact OD1-NH2 3.86Å; D228-R236 PolarHBondContact OD1-NH2 3.41Å
229	N	86.8	Confident	89.9	Confident	92 Å²	92	46.3 Å²	46.3	49%	0.492	25%	0.25	S	S	.	.			trans	-151.2	155.1	172.6	61.4	75.9	0	0	0	110.3	Y227 V233	Y227-N229 VanDerWaalsContact C-N 3.29Å; Y227-N229 PolarHBondContact O-N 2.89Å; N229-V233 CarbonylContact C-O 3.56Å; N229-V233 WeakPolarHBondContact CA-O 3.39Å; N229-V233 WeakPolarHBondContact CB-O 2.97Å
230	V	88.1	Confident	90.2	Very high	20 Å²	20	45.6 Å²	45.6	12%	0.121	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-120.5	124.4	167.1	-177.5	0	0	0	0	106.5	P222 Y223 Y227 G232 V233 Y235	P222-V230 HydrophobicContact CB-CG1 4.22Å; P222-V230 HydrophobicContact CB-CG2 4.24Å; P222-V230 WeakPolarHBondContact O-CG2 3.16Å; Y223-V230 HydrophobicContact CD1-CB 4.05Å; Y223-V230 HydrophobicContact CD1-CG1 4.06Å; Y223-V230 HydrophobicContact CD1-CG2 4.26Å; Y223-V230 HydrophobicContact CE1-CB 4.01Å; Y223-V230 HydrophobicContact CE1-CG1 3.63Å; Y227-V230 HydrophobicContact CD2-CG2 4.36Å; V230-G232 PolarHBondContact O-N 3.27Å; V230-G232 VanDerWaalsContact O-N 3.16Å; V230-V233 PolarHBondContact N-O 3.33Å; V230-V233 PolarHBondContact O-N 2.89Å; V230-Y235 HydrophobicContact CB-CD2 4.06Å; V230-Y235 HydrophobicContact CB-CE2 3.72Å; V230-Y235 HydrophobicContact CG2-CD2 4.21Å; V230-Y235 HydrophobicContact CG2-CE2 4.35Å
231	D	87.5	Confident	90.5	Very high	100 Å²	100	45.5 Å²	45.5	54%	0.535	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	35.3	-176	-58.1	-34.4	0	0	0	113.1	R189 V233	R189-D231 IonicContact NH2-OD2 2.68Å; R189-D231 PolarHBondContact NH2-OD2 3.05Å; D231-V233 VanDerWaalsContact C-N 3.34Å; D231-V233 PolarHBondContact O-N 3.1Å
232	G	87.6	Confident	90.7	Very high	64 Å²	64	43.7 Å²	43.7	66%	0.66	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.7	4.8	179.3	0	0	0	0	0	115.7	V230	V230-G232 PolarHBondContact O-N 3.27Å; V230-G232 VanDerWaalsContact O-N 3.16Å
233	V	91.5	Very high	90.9	Very high	16 Å²	16	41.4 Å²	41.4	10%	0.097	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-113.3	135.2	178.6	-176.8	0	0	0	0	110.4	R193 V196 L197 N229 V230 D231 Y235	R193-V233 HydrophobicContact CG-CG2 4.48Å; V196-V233 HydrophobicContact CB-CG1 4.32Å; V196-V233 HydrophobicContact CG1-CG1 3.61Å; L197-V233 HydrophobicContact CD2-CG1 4.31Å; L197-V233 HydrophobicContact CD2-CG2 3.87Å; L197-V233 HydrophobicContact CG-CG2 4.4Å; N229-V233 CarbonylContact C-O 3.56Å; N229-V233 WeakPolarHBondContact CA-O 3.39Å; N229-V233 WeakPolarHBondContact CB-O 2.97Å; V230-V233 PolarHBondContact N-O 3.33Å; V230-V233 PolarHBondContact O-N 2.89Å; D231-V233 VanDerWaalsContact C-N 3.34Å; D231-V233 PolarHBondContact O-N 3.1Å; V233-Y235 HydrophobicContact CB-CE2 3.89Å; V233-Y235 HydrophobicContact CG1-CE2 4.1Å; V233-Y235 VanDerWaalsContact O-CD2 3.24Å; V233-Y235 WeakPolarHBondContact O-CD2 3.45Å; V233-Y235 VanDerWaalsContact O-CE2 3.22Å; V233-Y235 WeakPolarHBondContact O-CE2 3.4Å
234	S	92.1	Very high	90.9	Very high	60 Å²	60	41.2 Å²	41.2	42%	0.42	22%	0.22	S	C	.	.			trans	-86.6	130.6	175.1	179.9	0	0	0	0	111.1	V196	V196-S234 WeakPolarHBondContact CG1-O 3.48Å
235	Y	93.6	Very high	90.9	Very high	8 Å²	8	43.6 Å²	43.6	3%	0.031	23%	0.233	C	C	.	.			trans	-106.4	3.3	178.8	-64.8	-89.7	0	0	0	112.5	P132 I192 V196 Y223 V230 V233 R237 A238	P132-Y235 WeakPolarHBondContact CB-O 3.34Å; I192-Y235 HydrophobicContact CG2-CD1 4.24Å; I192-Y235 HydrophobicContact CG2-CE1 3.65Å; V196-Y235 HydrophobicContact CB-CD1 4.4Å; V196-Y235 HydrophobicContact CB-CE1 4.12Å; V196-Y235 HydrophobicContact CG1-CD1 4.3Å; V196-Y235 HydrophobicContact CG1-CE1 4.31Å; V196-Y235 HydrophobicContact CG2-CD1 3.75Å; V196-Y235 HydrophobicContact CG2-CE1 3.74Å; Y223-Y235 AromaticContact CD1-CD1 3.97Å; Y223-Y235 HydrophobicContact CD1-CD1 3.97Å; Y223-Y235 AromaticContact CD1-CD2 3.84Å; Y223-Y235 HydrophobicContact CD1-CD2 3.84Å; Y223-Y235 AromaticContact CD1-CE1 3.64Å; Y223-Y235 HydrophobicContact CD1-CE1 3.64Å; Y223-Y235 AromaticContact CD1-CE2 3.5Å; Y223-Y235 HydrophobicContact CD1-CE2 3.5Å; Y223-Y235 HydrophobicContact CD1-CG 4.06Å; Y223-Y235 AromaticContact CD1-CZ 3.37Å; Y223-Y235 HydrophobicContact CE1-CE1 4.15Å; Y223-Y235 AromaticContact CE1-CE2 3.85Å; Y223-Y235 HydrophobicContact CE1-CE2 3.85Å; Y223-Y235 AromaticContact CE1-CZ 3.55Å; Y223-Y235 WeakPolarHBondContact CE1-OH 3.42Å; Y223-Y235 HydrophobicContact CG-CD1 4.3Å; Y223-Y235 HydrophobicContact CG-CE1 4.2Å; V230-Y235 HydrophobicContact CB-CD2 4.06Å; V230-Y235 HydrophobicContact CB-CE2 3.72Å; V230-Y235 HydrophobicContact CG2-CD2 4.21Å; V230-Y235 HydrophobicContact CG2-CE2 4.35Å; V233-Y235 HydrophobicContact CB-CE2 3.89Å; V233-Y235 HydrophobicContact CG1-CE2 4.1Å; V233-Y235 VanDerWaalsContact O-CD2 3.24Å; V233-Y235 WeakPolarHBondContact O-CD2 3.45Å; V233-Y235 VanDerWaalsContact O-CE2 3.22Å; V233-Y235 WeakPolarHBondContact O-CE2 3.4Å; Y235-R237 PolarHBondContact O-N 3.32Å; Y235-R237 VanDerWaalsContact O-N 3.09Å; Y235-A238 WeakPolarHBondContact O-CB 3.45Å; Y235-A238 PolarHBondContact O-N 3.09Å
236	R	92.5	Very high	90.8	Very high	52 Å²	52	42.4 Å²	42.4	20%	0.196	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.7	-172.8	-68.6	174.1	173.9	-161.9	1.3	114.6	S129 D228	S129-R236 WeakPolarHBondContact O-CB 3.44Å; S129-R236 WeakPolarHBondContact O-CD 3.4Å; D228-R236 VanDerWaalsContact CG-NH2 3.34Å; D228-R236 IonicContact OD1-CZ 2.71Å; D228-R236 IonicContact OD1-NH2 3.86Å; D228-R236 PolarHBondContact OD1-NH2 3.41Å
237	R	93	Very high	90.9	Very high	58 Å²	58	37.2 Å²	37.2	22%	0.219	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	10.5	177.1	-67.2	-63.5	-61	165.9	-2.5	113	F123 P200 Q201 Y235	F123-R237 WeakPolarHBondContact CZ-O 3.03Å; F123-R237 PolarHBondContact O-NH1 3.11Å; P200-R237 WeakPolarHBondContact O-CB 3.44Å; Q201-R237 WeakPolarHBondContact CA-O 3.45Å; Q201-R237 WeakPolarHBondContact CG-O 2.91Å; Y235-R237 PolarHBondContact O-N 3.32Å; Y235-R237 VanDerWaalsContact O-N 3.09Å
238	A	95.4	Very high	91.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.008	18%	0.181	C	C	.	.			trans	-83.6	151	171	0	0	0	0	0	111.6	P132 L133 T202 F204 Y235 F240	P132-A238 WeakPolarHBondContact CA-O 3.24Å; P132-A238 HydrophobicContact CB-CB 4.24Å; P132-A238 WeakPolarHBondContact CB-O 3.41Å; L133-A238 PolarHBondContact N-O 3.5Å; L133-A238 VanDerWaalsContact N-O 3.11Å; T202-A238 CarbonylContact O-C 3.38Å; T202-A238 WeakPolarHBondContact O-CA 3.49Å; T202-A238 WeakPolarHBondContact OG1-CB 3.48Å; F204-A238 HydrophobicContact CD2-CB 4.48Å; F204-A238 HydrophobicContact CE2-CB 4.27Å; Y235-A238 WeakPolarHBondContact O-CB 3.45Å; Y235-A238 PolarHBondContact O-N 3.09Å; A238-F240 HydrophobicContact CB-CD2 4.38Å; A238-F240 HydrophobicContact CB-CE2 3.74Å; A238-F240 HydrophobicContact CB-CZ 4.31Å
239	V	97.1	Very high	91.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126	170.9	-176.4	0	0	0	0	108.3	F123 L133 M156 T202 L203 F204 L241	F123-V239 HydrophobicContact CD1-CG2 3.96Å; F123-V239 HydrophobicContact CE1-CG2 3.47Å; F123-V239 VanDerWaalsContact CE1-CG2 3.47Å; F123-V239 HydrophobicContact CE2-CG2 4.17Å; F123-V239 HydrophobicContact CG-CG2 4.5Å; F123-V239 HydrophobicContact CZ-CG2 3.59Å; L133-V239 HydrophobicContact CB-CG1 4.35Å; L133-V239 HydrophobicContact CB-CG2 4.3Å; L133-V239 HydrophobicContact CD2-CG1 4.09Å; L133-V239 HydrophobicContact CG-CG1 4.29Å; L133-V239 CarbonylContact O-C 3.47Å; L133-V239 VanDerWaalsContact O-CA 3.29Å; L133-V239 WeakPolarHBondContact O-CA 3.48Å; M156-V239 HydrophobicContact CE-CG2 4.16Å; T202-V239 PolarHBondContact O-N 2.85Å; L203-V239 WeakPolarHBondContact CA-O 3.45Å; L203-V239 HydrophobicContact CD1-CB 3.88Å; L203-V239 HydrophobicContact CD1-CG1 3.75Å; F204-V239 PolarHBondContact N-O 3.16Å; V239-L241 HydrophobicContact CG1-CD2 4.03Å; V239-L241 HydrophobicContact CG1-CG 4.31Å
240	F	97.1	Very high	91.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.1	175.3	-66.6	-92.4	0	0	0	109.4	P132 L133 T134 L135 F204 F206 Y223 M224 A238 F242	P132-F240 HydrophobicContact CB-CD2 3.98Å; P132-F240 HydrophobicContact CB-CE2 3.92Å; P132-F240 HydrophobicContact CG-CD2 4.33Å; P132-F240 HydrophobicContact CG-CE2 4.12Å; L133-F240 PolarHBondContact O-N 3Å; T134-F240 WeakPolarHBondContact CA-O 3.22Å; T134-F240 HydrophobicContact CG2-CB 4.32Å; L135-F240 PolarHBondContact N-O 3.33Å; F204-F240 HydrophobicContact CB-CD1 3.96Å; F204-F240 HydrophobicContact CB-CE1 4.2Å; F204-F240 HydrophobicContact CD2-CD1 4.09Å; F204-F240 AromaticContact CD2-CE1 3.63Å; F204-F240 HydrophobicContact CD2-CE1 3.63Å; F204-F240 HydrophobicContact CD2-CE2 4.49Å; F204-F240 AromaticContact CD2-CZ 3.86Å; F204-F240 HydrophobicContact CD2-CZ 3.86Å; F204-F240 HydrophobicContact CE2-CE1 4.32Å; F204-F240 HydrophobicContact CE2-CZ 4.22Å; F204-F240 HydrophobicContact CG-CD1 4.36Å; F204-F240 HydrophobicContact CG-CE1 4.12Å; F206-F240 AromaticContact CE2-CD1 3.99Å; F206-F240 HydrophobicContact CE2-CD1 3.99Å; F206-F240 HydrophobicContact CE2-CE1 4.48Å; Y223-F240 WeakPolarHBondContact O-CE2 3.26Å; M224-F240 HydrophobicContact CG-CD1 4.08Å; M224-F240 HydrophobicContact CG-CD2 3.88Å; M224-F240 HydrophobicContact CG-CE1 4.19Å; M224-F240 HydrophobicContact CG-CE2 3.97Å; M224-F240 HydrophobicContact CG-CG 3.94Å; M224-F240 HydrophobicContact CG-CZ 4.14Å; M224-F240 HydrophobicContact SD-CD1 4.39Å; M224-F240 HydrophobicContact SD-CG 4.48Å; A238-F240 HydrophobicContact CB-CD2 4.38Å; A238-F240 HydrophobicContact CB-CE2 3.74Å; A238-F240 HydrophobicContact CB-CZ 4.31Å; F240-F242 HydrophobicContact CB-CE2 3.88Å; F240-F242 HydrophobicContact CB-CZ 4.45Å
241	L	97.4	Very high	92.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.7	174.4	-59	-173.7	0	0	0	109.7	L135 F137 A149 V152 L203 F204 I205 F206 V239	L135-L241 HydrophobicContact CB-CD2 3.61Å; L135-L241 HydrophobicContact CD1-CD2 3.63Å; L135-L241 HydrophobicContact CG-CD2 3.85Å; L135-L241 WeakPolarHBondContact O-CA 3.27Å; F137-L241 HydrophobicContact CZ-CD2 4.49Å; A149-L241 HydrophobicContact CB-CD1 4.26Å; V152-L241 HydrophobicContact CG1-CD1 4.4Å; L203-L241 HydrophobicContact CD1-CD1 3.67Å; L203-L241 HydrophobicContact CD1-CG 3.65Å; F204-L241 PolarHBondContact O-N 2.76Å; I205-L241 CarbonylContact C-O 3.34Å; I205-L241 WeakPolarHBondContact CA-O 3.42Å; I205-L241 HydrophobicContact CG1-CB 4.35Å; I205-L241 HydrophobicContact CG1-CD1 4.28Å; F206-L241 PolarHBondContact N-O 2.71Å; V239-L241 HydrophobicContact CG1-CD2 4.03Å; V239-L241 HydrophobicContact CG1-CG 4.31Å
242	F	95.8	Very high	92.3	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.3	172.4	-63.5	-84.1	0	0	0	109.5	T134 L135 S136 F137 F206 A209 I220 M224 F240	T134-F242 HydrophobicContact CG2-CD2 4.14Å; T134-F242 HydrophobicContact CG2-CE2 3.9Å; L135-F242 PolarHBondContact O-N 3.27Å; S136-F242 CarbonylContact C-O 3.58Å; F137-F242 PolarHBondContact N-O 2.96Å; F206-F242 HydrophobicContact CB-CD1 3.59Å; F206-F242 HydrophobicContact CB-CE1 3.86Å; F206-F242 HydrophobicContact CB-CG 4.49Å; F206-F242 HydrophobicContact CD1-CE1 4.48Å; F206-F242 HydrophobicContact CD2-CD1 4.03Å; F206-F242 AromaticContact CD2-CE1 3.53Å; F206-F242 HydrophobicContact CD2-CE1 3.53Å; F206-F242 AromaticContact CD2-CZ 3.94Å; F206-F242 HydrophobicContact CD2-CZ 3.94Å; F206-F242 HydrophobicContact CE2-CE1 4.2Å; F206-F242 HydrophobicContact CE2-CZ 4.31Å; F206-F242 AromaticContact CG-CD1 3.98Å; F206-F242 HydrophobicContact CG-CD1 3.98Å; F206-F242 AromaticContact CG-CE1 3.7Å; F206-F242 HydrophobicContact CG-CE1 3.7Å; A209-F242 HydrophobicContact CB-CB 4.12Å; A209-F242 HydrophobicContact CB-CD1 4.04Å; I220-F242 HydrophobicContact CD1-CE1 3.79Å; I220-F242 HydrophobicContact CD1-CZ 3.73Å; M224-F242 HydrophobicContact CE-CE2 3.41Å; M224-F242 VanDerWaalsContact CE-CE2 3.41Å; M224-F242 HydrophobicContact CE-CZ 3.79Å; M224-F242 HydrophobicContact SD-CE2 3.9Å; M224-F242 HydrophobicContact SD-CZ 3.65Å; F240-F242 HydrophobicContact CB-CE2 3.88Å; F240-F242 HydrophobicContact CB-CZ 4.45Å
243	L	95.4	Very high	92.6	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	122.2	178	-46	-179.8	0	0	0	108.6	F137 K145 N146 A149 I205 F206 D207 E208 A209	F137-L243 HydrophobicContact CB-CD2 3.72Å; F137-L243 HydrophobicContact CD2-CD2 3.25Å; F137-L243 HydrophobicContact CE2-CD2 3.99Å; F137-L243 HydrophobicContact CG-CD2 3.68Å; K145-L243 HydrophobicContact CB-CD2 4.47Å; N146-L243 WeakPolarHBondContact OD1-CD1 3.47Å; A149-L243 HydrophobicContact CB-CD1 4.06Å; A149-L243 HydrophobicContact CB-CD2 4.27Å; I205-L243 HydrophobicContact CG2-CD1 3.86Å; I205-L243 HydrophobicContact CG2-CG 4.22Å; F206-L243 PolarHBondContact O-N 2.73Å; D207-L243 HydrophobicContact CB-CD1 4.33Å; E208-L243 PolarHBondContact N-O 2.96Å; E208-L243 VanDerWaalsContact N-O 3.14Å; A209-L243 PolarHBondContact N-O 2.83Å
244	S	92	Very high	92.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.7	-174.8	-171.2	0	0	0	0	114.5	F137 H138 G139 K145 E210 I246 Q290	F137-S244 PolarHBondContact O-N 3.02Å; H138-S244 WeakPolarHBondContact CA-O 3.46Å; G139-S244 PolarHBondContact N-O 3.27Å; K145-S244 VanDerWaalsContact CD-O 3.26Å; K145-S244 WeakPolarHBondContact CD-O 3.4Å; K145-S244 WeakPolarHBondContact CE-O 3.25Å; K145-S244 PolarHBondContact NZ-O 2.81Å; E210-S244 WeakPolarHBondContact CB-OG 3.38Å; E210-S244 WeakPolarHBondContact OE2-CA 3.47Å; E210-S244 VanDerWaalsContact OE2-CB 3.23Å; E210-S244 WeakPolarHBondContact OE2-CB 3.37Å; E210-S244 PolarHBondContact OE2-OG 3.41Å; S244-I246 PolarHBondContact OG-N 2.97Å; S244-I246 VanDerWaalsContact OG-N 3.15Å; S244-Q290 PolarHBondContact OG-NE2 3.02Å
245	N	90.4	Very high	92.9	Very high	50 Å²	50	19.9 Å²	19.9	27%	0.267	10%	0.104	S	C	.	.			trans	-92.6	-6.1	169.6	-54.8	-61.1	0	0	0	113.8	G139 K145 E208 E210 G248	G139-N245 WeakPolarHBondContact O-CA 3.28Å; K145-N245 PolarHBondContact NZ-OD1 3.44Å; E208-N245 PolarHBondContact OE1-ND2 3.47Å; E208-N245 PolarHBondContact OE2-ND2 3Å; E210-N245 VanDerWaalsContact OE1-CB 3.3Å; E210-N245 WeakPolarHBondContact OE1-CB 3.23Å; E210-N245 PolarHBondContact OE1-N 3.33Å; E210-N245 VanDerWaalsContact OE1-N 3.15Å; E210-N245 PolarHBondContact OE1-ND2 3.23Å; E210-N245 PolarHBondContact OE2-N 2.89Å; N245-G248 PolarHBondContact O-N 3.41Å
246	I	85.9	Confident	92.9	Very high	25 Å²	25	21 Å²	21	13%	0.128	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	142.7	173.2	-72.1	175.7	0	0	0	109.7	H138 E210 S244 G248 Q290	H138-I246 WeakPolarHBondContact CB-O 3.36Å; H138-I246 PolarHBondContact ND1-O 3.39Å; H138-I246 VanDerWaalsContact ND1-O 3.09Å; E210-I246 HydrophobicContact CB-CD1 3.33Å; E210-I246 HydrophobicContact CB-CG1 3.58Å; E210-I246 HydrophobicContact CG-CD1 4.48Å; E210-I246 HydrophobicContact CG-CG1 4.29Å; S244-I246 PolarHBondContact OG-N 2.97Å; S244-I246 VanDerWaalsContact OG-N 3.15Å; I246-G248 PolarHBondContact O-N 2.87Å; I246-Q290 HydrophobicContact CD1-CG 4.28Å; I246-Q290 VanDerWaalsContact CG2-OE1 3.26Å
247	G	85.3	Confident	93	Very high	1 Å²	1	22 Å²	22	1%	0.01	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	-8.1	-176	0	0	0	0	0	113.7	T249 T250 I251 E280	G247-T249 VanDerWaalsContact C-N 3.34Å; G247-T249 PolarHBondContact O-N 2.8Å; G247-T250 PolarHBondContact O-N 3.27Å; G247-I251 WeakPolarHBondContact O-CB 3.28Å; G247-I251 WeakPolarHBondContact O-CD1 3.48Å; G247-I251 WeakPolarHBondContact O-CG1 3.31Å; G247-I251 PolarHBondContact O-N 3.1Å; G247-E280 WeakPolarHBondContact CA-OE1 3.43Å; G247-E280 WeakPolarHBondContact CA-OE2 3.44Å; G247-E280 PolarHBondContact N-OE1 3.18Å; G247-E280 VanDerWaalsContact N-OE1 3.09Å
248	G	88.6	Confident	93.2	Very high	5 Å²	5	20.4 Å²	20.4	5%	0.052	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-39.6	-176.9	0	0	0	0	0	113.2	N245 I246 N252	N245-G248 PolarHBondContact O-N 3.41Å; I246-G248 PolarHBondContact O-N 2.87Å; G248-N252 PolarHBondContact O-N 3.22Å; G248-N252 VanDerWaalsContact O-N 3.13Å; G248-N252 PolarHBondContact O-ND2 3.15Å; G248-N252 PolarHBondContact O-OD1 3.33Å
249	T	90	Very high	93.1	Very high	89 Å²	89	26 Å²	26	55%	0.546	14%	0.135	S	C	.	.	H	α-helix	trans	-67.1	-49.3	177.2	44.3	0	0	0	0	111.2	G247 I251 N252 D253	G247-T249 VanDerWaalsContact C-N 3.34Å; G247-T249 PolarHBondContact O-N 2.8Å; T249-I251 VanDerWaalsContact C-N 3.33Å; T249-I251 PolarHBondContact O-N 3.31Å; T249-N252 WeakPolarHBondContact O-CB 3.41Å; T249-N252 PolarHBondContact O-N 2.81Å; T249-D253 VanDerWaalsContact O-CG 3.3Å; T249-D253 PolarHBondContact O-N 2.87Å
250	T	91.5	Very high	93	Very high	19 Å²	19	30.9 Å²	30.9	12%	0.117	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-41.2	178.7	-67.6	0	0	0	0	112.7	G247 N252 D253 V254 R276 L277 E280	G247-T250 PolarHBondContact O-N 3.27Å; T250-N252 VanDerWaalsContact C-N 3.29Å; T250-N252 PolarHBondContact O-N 2.96Å; T250-D253 PolarHBondContact O-N 2.96Å; T250-V254 WeakPolarHBondContact O-CG2 3.4Å; T250-V254 PolarHBondContact O-N 3.05Å; T250-R276 HydrophobicContact CG2-CB 3.33Å; T250-R276 HydrophobicContact CG2-CG 4.41Å; T250-L277 HydrophobicContact CG2-CD2 4.42Å; T250-L277 HydrophobicContact CG2-CG 4.42Å; T250-E280 WeakPolarHBondContact CB-OE2 3.34Å; T250-E280 PolarHBondContact OG1-OE2 3.01Å
251	I	94.1	Very high	93	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-41.9	175.2	-71.8	161.7	0	0	0	110.7	H138 G247 T249 A255 L273 L277 P304 L306	H138-I251 HydrophobicContact CB-CD1 4.29Å; G247-I251 WeakPolarHBondContact O-CB 3.28Å; G247-I251 WeakPolarHBondContact O-CD1 3.48Å; G247-I251 WeakPolarHBondContact O-CG1 3.31Å; G247-I251 PolarHBondContact O-N 3.1Å; T249-I251 VanDerWaalsContact C-N 3.33Å; T249-I251 PolarHBondContact O-N 3.31Å; I251-A255 PolarHBondContact O-N 3.37Å; I251-L273 HydrophobicContact CB-CD2 4.49Å; I251-L273 HydrophobicContact CG1-CD2 4.22Å; I251-L273 HydrophobicContact CG2-CD2 4.47Å; I251-L277 HydrophobicContact CD1-CD1 4.25Å; I251-L277 HydrophobicContact CD1-CD2 4.08Å; I251-L277 HydrophobicContact CG1-CD1 4.01Å; I251-L277 HydrophobicContact CG1-CD2 3.93Å; I251-L277 HydrophobicContact CG1-CG 4.32Å; I251-P304 HydrophobicContact CD1-CB 3.9Å; I251-P304 HydrophobicContact CG1-CB 4.31Å; I251-L306 HydrophobicContact CG2-CD2 3.65Å
252	N	93.1	Very high	92.8	Very high	17 Å²	17	38 Å²	38	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-66.8	-40.2	178.3	-64.5	-15.2	0	0	0	112	W140 G248 T249 T250 V254 A255 L256 P307	W140-N252 VanDerWaalsContact CZ3-ND2 3.28Å; W140-N252 WeakPolarHBondContact CZ3-ND2 3.24Å; G248-N252 PolarHBondContact O-N 3.22Å; G248-N252 VanDerWaalsContact O-N 3.13Å; G248-N252 PolarHBondContact O-ND2 3.15Å; G248-N252 PolarHBondContact O-OD1 3.33Å; T249-N252 WeakPolarHBondContact O-CB 3.41Å; T249-N252 PolarHBondContact O-N 2.81Å; T250-N252 VanDerWaalsContact C-N 3.29Å; T250-N252 PolarHBondContact O-N 2.96Å; N252-V254 VanDerWaalsContact C-N 3.35Å; N252-A255 PolarHBondContact O-N 3.26Å; N252-L256 WeakPolarHBondContact O-CB 3.36Å; N252-L256 PolarHBondContact O-N 3.5Å; N252-P307 HydrophobicContact CB-CG 4.3Å; N252-P307 VanDerWaalsContact OD1-CB 3.28Å; N252-P307 WeakPolarHBondContact OD1-CB 3.35Å; N252-P307 VanDerWaalsContact OD1-CD 3.27Å; N252-P307 WeakPolarHBondContact OD1-CD 3.2Å; N252-P307 VanDerWaalsContact OD1-CG 3.29Å; N252-P307 WeakPolarHBondContact OD1-CG 3.42Å
253	D	93.4	Very high	92.8	Very high	79 Å²	79	42.5 Å²	42.5	42%	0.422	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-43	178.8	-65.9	-18.4	0	0	0	110.7	T249 T250 A255 L256 D257	T249-D253 VanDerWaalsContact O-CG 3.3Å; T249-D253 PolarHBondContact O-N 2.87Å; T250-D253 PolarHBondContact O-N 2.96Å; D253-A255 PolarHBondContact O-N 2.87Å; D253-L256 WeakPolarHBondContact O-CB 3.33Å; D253-L256 PolarHBondContact O-N 3.04Å; D253-D257 WeakPolarHBondContact O-CB 3.46Å; D253-D257 VanDerWaalsContact O-CG 3.23Å; D253-D257 PolarHBondContact O-N 2.96Å
254	V	94.3	Very high	92.8	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-43.9	174.1	173.8	0	0	0	0	111.3	T250 N252 L256 D257 F258 I268 D272 L273	T250-V254 WeakPolarHBondContact O-CG2 3.4Å; T250-V254 PolarHBondContact O-N 3.05Å; N252-V254 VanDerWaalsContact C-N 3.35Å; V254-L256 VanDerWaalsContact C-N 3.26Å; V254-L256 PolarHBondContact O-N 3.32Å; V254-D257 PolarHBondContact O-N 3.43Å; V254-F258 HydrophobicContact CG1-CD2 4.05Å; V254-F258 HydrophobicContact CG1-CE2 4.03Å; V254-F258 WeakPolarHBondContact O-CD2 3.23Å; V254-F258 PolarHBondContact O-N 3.26Å; V254-I268 HydrophobicContact CG1-CG2 4.39Å; V254-D272 HydrophobicContact CG1-CB 4.29Å; V254-L273 HydrophobicContact CB-CD2 3.71Å; V254-L273 HydrophobicContact CG1-CD2 3.69Å; V254-L273 HydrophobicContact CG1-CG 4.49Å; V254-L273 HydrophobicContact CG2-CD2 4.01Å
255	A	95.3	Very high	93	Very high	6 Å²	6	48.1 Å²	48.1	5%	0.05	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-35	176.7	0	0	0	0	0	112.3	I251 N252 D253 W259 I268 P307 F350	I251-A255 PolarHBondContact O-N 3.37Å; N252-A255 PolarHBondContact O-N 3.26Å; D253-A255 PolarHBondContact O-N 2.87Å; A255-W259 PolarHBondContact O-N 2.93Å; A255-I268 HydrophobicContact CB-CD1 4.16Å; A255-P307 HydrophobicContact CB-CG 3.87Å; A255-F350 HydrophobicContact CB-CE2 4.5Å; A255-F350 HydrophobicContact CB-CZ 3.92Å
256	L	94.3	Very high	93.2	Very high	32 Å²	32	49.9 Å²	49.9	17%	0.168	28%	0.275	C	S	.	.	H	α-helix	trans	-70.8	-42.4	175.9	-173.3	61.9	0	0	0	111.7	N252 D253 V254 F258 W259 H260 P344 L349 F350	N252-L256 WeakPolarHBondContact O-CB 3.36Å; N252-L256 PolarHBondContact O-N 3.5Å; D253-L256 WeakPolarHBondContact O-CB 3.33Å; D253-L256 PolarHBondContact O-N 3.04Å; V254-L256 VanDerWaalsContact C-N 3.26Å; V254-L256 PolarHBondContact O-N 3.32Å; L256-F258 VanDerWaalsContact C-N 3.35Å; L256-F258 PolarHBondContact O-N 3.03Å; L256-W259 WeakPolarHBondContact O-CB 3.47Å; L256-W259 PolarHBondContact O-N 3Å; L256-W259 VanDerWaalsContact O-N 3.17Å; L256-H260 PolarHBondContact O-CD2 3.4Å; L256-H260 PolarHBondContact O-N 3.39Å; L256-P344 HydrophobicContact CD1-CG 4.27Å; L256-P344 HydrophobicContact CD2-CG 4.35Å; L256-L349 HydrophobicContact CD1-CD2 4.14Å; L256-F350 HydrophobicContact CB-CE2 4.16Å; L256-F350 HydrophobicContact CD1-CE2 4.25Å
257	D	94.5	Very high	93.7	Very high	73 Å²	73	53 Å²	53	39%	0.39	29%	0.292	S	S	.	.	H	α-helix	trans	-60.3	-43.3	177.5	-72.8	-20.4	0	0	0	111.5	D253 V254 W259 H260 S261 R276	D253-D257 WeakPolarHBondContact O-CB 3.46Å; D253-D257 VanDerWaalsContact O-CG 3.23Å; D253-D257 PolarHBondContact O-N 2.96Å; V254-D257 PolarHBondContact O-N 3.43Å; D257-W259 VanDerWaalsContact C-N 3.35Å; D257-H260 PolarHBondContact O-N 2.94Å; D257-S261 WeakPolarHBondContact O-CB 3.41Å; D257-S261 PolarHBondContact O-N 2.86Å; D257-S261 PolarHBondContact O-OG 2.94Å; D257-R276 IonicContact OD2-NH2 3.84Å
258	F	95.7	Very high	94.1	Very high	24 Å²	24	53.1 Å²	53.1	11%	0.105	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-42.8	174.3	-91.3	-114.9	0	0	0	111.7	V254 L256 S261 G262 Q263 D267 I268 D272	V254-F258 HydrophobicContact CG1-CD2 4.05Å; V254-F258 HydrophobicContact CG1-CE2 4.03Å; V254-F258 WeakPolarHBondContact O-CD2 3.23Å; V254-F258 PolarHBondContact O-N 3.26Å; L256-F258 VanDerWaalsContact C-N 3.35Å; L256-F258 PolarHBondContact O-N 3.03Å; F258-S261 CarbonylContact O-C 3.34Å; F258-S261 PolarHBondContact O-N 2.98Å; F258-G262 PolarHBondContact O-N 3.11Å; F258-Q263 HydrophobicContact CB-CB 4.41Å; F258-Q263 HydrophobicContact CD1-CB 3.81Å; F258-Q263 HydrophobicContact CG-CB 4.45Å; F258-Q263 PolarHBondContact O-N 2.94Å; F258-D267 HydrophobicContact CE1-CB 4.46Å; F258-I268 HydrophobicContact CB-CD1 4.28Å; F258-I268 HydrophobicContact CB-CG1 4.13Å; F258-I268 HydrophobicContact CD1-CB 4.47Å; F258-I268 HydrophobicContact CD1-CD1 4.45Å; F258-I268 HydrophobicContact CD1-CG1 3.44Å; F258-I268 VanDerWaalsContact CD1-CG1 3.44Å; F258-I268 HydrophobicContact CD2-CG1 4.1Å; F258-I268 HydrophobicContact CE1-CB 4.34Å; F258-I268 HydrophobicContact CE1-CG1 3.76Å; F258-I268 HydrophobicContact CE2-CG1 4.37Å; F258-I268 HydrophobicContact CG-CD1 4.26Å; F258-I268 HydrophobicContact CG-CG1 3.62Å; F258-I268 HydrophobicContact CZ-CG1 4.22Å; F258-D272 HydrophobicContact CE2-CB 4.32Å; F258-D272 HydrophobicContact CZ-CB 4.37Å
259	W	94.3	Very high	94.4	Very high	117 Å²	117	54 Å²	54	44%	0.443	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-44.6	178.1	-175.2	86.9	0	0	0	112.1	A255 L256 D257 S261 G262 E347 L349	A255-W259 PolarHBondContact O-N 2.93Å; L256-W259 WeakPolarHBondContact O-CB 3.47Å; L256-W259 PolarHBondContact O-N 3Å; L256-W259 VanDerWaalsContact O-N 3.17Å; D257-W259 VanDerWaalsContact C-N 3.35Å; W259-S261 PolarHBondContact O-N 3.45Å; W259-G262 PolarHBondContact O-N 2.98Å; W259-E347 HydrophobicContact CH2-CB 4.41Å; W259-E347 HydrophobicContact CH2-CG 4.16Å; W259-E347 HydrophobicContact CZ3-CB 4.48Å; W259-E347 HydrophobicContact CZ3-CG 3.95Å; W259-L349 HydrophobicContact CB-CD2 3.92Å; W259-L349 HydrophobicContact CD2-CD1 4.35Å; W259-L349 HydrophobicContact CD2-CD2 3.58Å; W259-L349 HydrophobicContact CE3-CD2 4.13Å; W259-L349 HydrophobicContact CG-CD1 4.36Å; W259-L349 HydrophobicContact CG-CD2 3.44Å; W259-L349 VanDerWaalsContact CG-CD2 3.44Å; W259-L349 HydrophobicContact CZ2-CD1 4.34Å
260	H	95.2	Very high	94.4	Very high	104 Å²	104	52.3 Å²	52.3	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-62.2	-30.6	174.7	-76.9	-49.2	0	0	0	112.7	L256 D257 G262 E347	L256-H260 PolarHBondContact O-CD2 3.4Å; L256-H260 PolarHBondContact O-N 3.39Å; D257-H260 PolarHBondContact O-N 2.94Å; H260-G262 PolarHBondContact O-N 2.75Å; H260-E347 IonicContact CE1-OE1 2.62Å
261	S	96	Very high	94.3	Very high	83 Å²	83	59.4 Å²	59.4	58%	0.58	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-0.8	175.8	-55.5	0	0	0	0	113.3	D257 F258 W259 Q263	D257-S261 WeakPolarHBondContact O-CB 3.41Å; D257-S261 PolarHBondContact O-N 2.86Å; D257-S261 PolarHBondContact O-OG 2.94Å; F258-S261 CarbonylContact O-C 3.34Å; F258-S261 PolarHBondContact O-N 2.98Å; W259-S261 PolarHBondContact O-N 3.45Å; S261-Q263 PolarHBondContact O-N 2.89Å
262	G	94.4	Very high	94.1	Very high	68 Å²	68	62.7 Å²	62.7	70%	0.701	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	18.1	-178.7	0	0	0	0	0	114	F258 W259 H260	F258-G262 PolarHBondContact O-N 3.11Å; W259-G262 PolarHBondContact O-N 2.98Å; H260-G262 PolarHBondContact O-N 2.75Å
263	Q	95.9	Very high	94	Very high	94 Å²	94	61.9 Å²	61.9	44%	0.439	33%	0.333	S	S	.	.			trans	-85.4	156	177	-63.1	-179	-89	0	0	110.7	F258 S261	F258-Q263 HydrophobicContact CB-CB 4.41Å; F258-Q263 HydrophobicContact CD1-CB 3.81Å; F258-Q263 HydrophobicContact CG-CB 4.45Å; F258-Q263 PolarHBondContact O-N 2.94Å; S261-Q263 PolarHBondContact O-N 2.89Å
264	N	94.9	Very high	93.4	Very high	102 Å²	102	61.7 Å²	61.7	55%	0.545	33%	0.33	S	S	.	.			trans	-76.9	150.8	176.1	-55	-67.3	0	0	0	109.9	E266 D267	N264-E266 PolarHBondContact O-N 2.83Å; N264-D267 WeakPolarHBondContact CB-OD2 3.43Å; N264-D267 PolarHBondContact N-OD2 3Å; N264-D267 VanDerWaalsContact N-OD2 3.14Å; N264-D267 PolarHBondContact ND2-OD2 3.27Å; N264-D267 WeakPolarHBondContact O-CB 3.49Å; N264-D267 PolarHBondContact O-N 2.77Å; N264-D267 VanDerWaalsContact O-N 3.15Å
265	R	94.9	Very high	92.6	Very high	16 Å²	16	68.7 Å²	68.7	6%	0.06	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-58	-39.2	173	179.8	-160.8	-174.9	80.6	-11.2	111.6	G108 H110 D267 I268 L306 P307 E309	G108-R265 PolarHBondContact O-NE 3.31Å; G108-R265 PolarHBondContact O-NH2 3.35Å; H110-R265 PolarHBondContact CE1-O 2.84Å; H110-R265 VanDerWaalsContact CE1-O 3.22Å; R265-D267 PolarHBondContact O-N 2.83Å; R265-I268 HydrophobicContact CG-CD1 4.28Å; R265-I268 VanDerWaalsContact O-CB 3.32Å; R265-I268 WeakPolarHBondContact O-CB 3.13Å; R265-I268 WeakPolarHBondContact O-CD1 3.38Å; R265-I268 VanDerWaalsContact O-CG1 3.27Å; R265-I268 WeakPolarHBondContact O-CG1 3.24Å; R265-I268 PolarHBondContact O-N 3.05Å; R265-I268 VanDerWaalsContact O-N 3.09Å; R265-L306 HydrophobicContact CG-CD1 4.05Å; R265-L306 VanDerWaalsContact CZ-CB 3.44Å; R265-L306 PolarHBondContact NH2-O 2.92Å; R265-P307 PolarHBondContact NH1-O 3.45Å; R265-P307 PolarHBondContact NH2-O 3.27Å; R265-E309 WeakPolarHBondContact CD-OE1 3.48Å; R265-E309 IonicContact NH1-OE1 2.62Å; R265-E309 PolarHBondContact NH1-OE1 2.91Å
266	E	95.6	Very high	92.1	Very high	87 Å²	87	73.2 Å²	73.2	41%	0.407	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-67.6	-16	-177.3	-64.4	75.4	-167.9	0	0	112.4	H110 N264 I268 R311	H110-E266 PolarHBondContact NE2-O 3.49Å; N264-E266 PolarHBondContact O-N 2.83Å; E266-I268 VanDerWaalsContact C-N 3.33Å; E266-R311 IonicContact OE1-CZ 2.71Å; E266-R311 IonicContact OE1-NH1 3.31Å; E266-R311 PolarHBondContact OE1-NH1 3.38Å; E266-R311 IonicContact OE1-NH2 3.95Å; E266-R311 PolarHBondContact OE1-NH2 3.47Å; E266-R311 IonicContact OE2-NH2 3.64Å
267	D	95.6	Very high	91.3	Very high	91 Å²	91	72.1 Å²	72.1	49%	0.487	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-80.1	-13.6	174.4	-57.8	-36.5	0	0	0	112.5	F258 N264 R265 G269	F258-D267 HydrophobicContact CE1-CB 4.46Å; N264-D267 WeakPolarHBondContact CB-OD2 3.43Å; N264-D267 PolarHBondContact N-OD2 3Å; N264-D267 VanDerWaalsContact N-OD2 3.14Å; N264-D267 PolarHBondContact ND2-OD2 3.27Å; N264-D267 WeakPolarHBondContact O-CB 3.49Å; N264-D267 PolarHBondContact O-N 2.77Å; N264-D267 VanDerWaalsContact O-N 3.15Å; R265-D267 PolarHBondContact O-N 2.83Å; D267-G269 PolarHBondContact O-N 3.41Å
268	I	95.5	Very high	90.2	Very high	3 Å²	3	75.1 Å²	75.1	2%	0.015	38%	0.377	C	S	.	.			trans	-65.5	118.8	175.9	-59.3	167.6	0	0	0	108.6	H110 L111 V254 A255 F258 R265 E266 L273 L306	H110-I268 PolarHBondContact NE2-O 3.43Å; L111-I268 HydrophobicContact CD1-CG2 4.34Å; L111-I268 WeakPolarHBondContact CD2-O 3.22Å; V254-I268 HydrophobicContact CG1-CG2 4.39Å; A255-I268 HydrophobicContact CB-CD1 4.16Å; F258-I268 HydrophobicContact CB-CD1 4.28Å; F258-I268 HydrophobicContact CB-CG1 4.13Å; F258-I268 HydrophobicContact CD1-CB 4.47Å; F258-I268 HydrophobicContact CD1-CD1 4.45Å; F258-I268 HydrophobicContact CD1-CG1 3.44Å; F258-I268 VanDerWaalsContact CD1-CG1 3.44Å; F258-I268 HydrophobicContact CD2-CG1 4.1Å; F258-I268 HydrophobicContact CE1-CB 4.34Å; F258-I268 HydrophobicContact CE1-CG1 3.76Å; F258-I268 HydrophobicContact CE2-CG1 4.37Å; F258-I268 HydrophobicContact CG-CD1 4.26Å; F258-I268 HydrophobicContact CG-CG1 3.62Å; F258-I268 HydrophobicContact CZ-CG1 4.22Å; R265-I268 HydrophobicContact CG-CD1 4.28Å; R265-I268 VanDerWaalsContact O-CB 3.32Å; R265-I268 WeakPolarHBondContact O-CB 3.13Å; R265-I268 WeakPolarHBondContact O-CD1 3.38Å; R265-I268 VanDerWaalsContact O-CG1 3.27Å; R265-I268 WeakPolarHBondContact O-CG1 3.24Å; R265-I268 PolarHBondContact O-N 3.05Å; R265-I268 VanDerWaalsContact O-N 3.09Å; E266-I268 VanDerWaalsContact C-N 3.33Å; I268-L273 HydrophobicContact CG2-CD1 4.08Å; I268-L273 HydrophobicContact CG2-CG 4.18Å; I268-L306 HydrophobicContact CD1-CD1 4.32Å; I268-L306 HydrophobicContact CD1-CD2 4.46Å; I268-L306 HydrophobicContact CG2-CD2 4.49Å
269	G	93.8	Very high	89.3	Confident	24 Å²	24	76 Å²	76	25%	0.247	39%	0.39	C	S	.	.			trans	-95.3	172.4	177.8	0	0	0	0	0	113.5	D267 E271 D272	D267-G269 PolarHBondContact O-N 3.41Å; G269-E271 VanDerWaalsContact C-N 3.31Å; G269-D272 WeakPolarHBondContact CA-OD2 3.37Å; G269-D272 PolarHBondContact N-OD2 3Å
270	M	90.3	Very high	88.4	Confident	53 Å²	53	72.3 Å²	72.3	26%	0.261	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-35.6	172.1	-75.7	-60.5	-64.5	0	0	112.1	L111 V115 D272 L273 E274 F302 P304	L111-M270 HydrophobicContact CB-SD 4.34Å; L111-M270 HydrophobicContact CD1-SD 4.32Å; L111-M270 HydrophobicContact CD2-CG 4.21Å; L111-M270 HydrophobicContact CD2-SD 4.33Å; V115-M270 HydrophobicContact CG2-SD 4.26Å; M270-D272 VanDerWaalsContact C-N 3.31Å; M270-D272 PolarHBondContact O-N 3.25Å; M270-L273 PolarHBondContact O-N 3.12Å; M270-E274 WeakPolarHBondContact O-CB 3.4Å; M270-E274 PolarHBondContact O-N 3.34Å; M270-F302 WeakPolarHBondContact CE-O 3.4Å; M270-P304 HydrophobicContact CE-CG 4.23Å; M270-P304 VanDerWaalsContact SD-CD 3.52Å; M270-P304 HydrophobicContact SD-CG 3.61Å
271	E	89.6	Confident	87	Confident	169 Å²	169	67.6 Å²	67.6	79%	0.79	36%	0.356	S	S	*	.	H	α-helix	trans	-63	-36.5	-177.6	-63.8	179.8	-173.6	0	0	112.2	G269 L273	G269-E271 VanDerWaalsContact C-N 3.31Å; E271-L273 PolarHBondContact O-N 2.85Å
272	D	90.4	Very high	85.6	Confident	69 Å²	69	70.5 Å²	70.5	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-64.3	-30.8	178.4	-57.6	-55.9	0	0	0	112.5	V254 F258 G269 M270	V254-D272 HydrophobicContact CG1-CB 4.29Å; F258-D272 HydrophobicContact CE2-CB 4.32Å; F258-D272 HydrophobicContact CZ-CB 4.37Å; G269-D272 WeakPolarHBondContact CA-OD2 3.37Å; G269-D272 PolarHBondContact N-OD2 3Å; M270-D272 VanDerWaalsContact C-N 3.31Å; M270-D272 PolarHBondContact O-N 3.25Å
273	L	89.9	Confident	84.3	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-94.2	-41.4	-174.2	-65.4	173.3	0	0	0	111.6	L111 I251 V254 I268 M270 E271 H275 R276 L277 P304 L306	L111-L273 HydrophobicContact CD1-CD1 3.54Å; I251-L273 HydrophobicContact CB-CD2 4.49Å; I251-L273 HydrophobicContact CG1-CD2 4.22Å; I251-L273 HydrophobicContact CG2-CD2 4.47Å; V254-L273 HydrophobicContact CB-CD2 3.71Å; V254-L273 HydrophobicContact CG1-CD2 3.69Å; V254-L273 HydrophobicContact CG1-CG 4.49Å; V254-L273 HydrophobicContact CG2-CD2 4.01Å; I268-L273 HydrophobicContact CG2-CD1 4.08Å; I268-L273 HydrophobicContact CG2-CG 4.18Å; M270-L273 PolarHBondContact O-N 3.12Å; E271-L273 PolarHBondContact O-N 2.85Å; L273-H275 PolarHBondContact O-N 3.34Å; L273-R276 PolarHBondContact O-N 3.49Å; L273-L277 HydrophobicContact CB-CD1 3.84Å; L273-L277 VanDerWaalsContact O-CB 3.3Å; L273-L277 WeakPolarHBondContact O-CB 3.29Å; L273-L277 WeakPolarHBondContact O-CD1 3.33Å; L273-L277 VanDerWaalsContact O-CG 3.26Å; L273-L277 WeakPolarHBondContact O-CG 3.13Å; L273-L277 PolarHBondContact O-N 3.24Å; L273-P304 HydrophobicContact CD1-CB 3.68Å; L273-P304 HydrophobicContact CD1-CG 3.58Å; L273-L306 HydrophobicContact CD1-CD2 4.16Å
274	E	80.7	Confident	82.6	Confident	74 Å²	74	72.4 Å²	72.4	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-58.3	-43.9	-170.2	-177.5	167.5	-152.3	0	0	113.1	M270 R278	M270-E274 WeakPolarHBondContact O-CB 3.4Å; M270-E274 PolarHBondContact O-N 3.34Å; E274-R278 HydrophobicContact CG-CG 4.49Å; E274-R278 WeakPolarHBondContact O-CB 3.32Å; E274-R278 VanDerWaalsContact O-CG 3.25Å; E274-R278 WeakPolarHBondContact O-CG 3.42Å; E274-R278 PolarHBondContact O-N 2.85Å; E274-R278 IonicContact OE1-CZ 3.33Å; E274-R278 IonicContact OE1-NE 2.78Å; E274-R278 PolarHBondContact OE1-NE 3.3Å; E274-R278 IonicContact OE1-NH2 3.47Å; E274-R278 PolarHBondContact OE1-NH2 3.07Å
275	H	78.7	Confident	80.5	Confident	153 Å²	153	77.6 Å²	77.6	71%	0.708	38%	0.378	S	S	*	.	H	α-helix	trans	-63.2	-46.5	-179.2	-177.5	-83.7	0	0	0	112.1	L273 A279	L273-H275 PolarHBondContact O-N 3.34Å; H275-A279 PolarHBondContact O-N 2.83Å
276	R	83	Confident	78.6	Confident	102 Å²	102	78.5 Å²	78.5	39%	0.385	39%	0.393	S	S	.	.	H	α-helix	trans	-71.8	-37.7	-177.4	-62.8	-178.9	129.7	-145	12.2	111.9	T250 D257 L273 A279 E280	T250-R276 HydrophobicContact CG2-CB 3.33Å; T250-R276 HydrophobicContact CG2-CG 4.41Å; D257-R276 IonicContact OD2-NH2 3.84Å; L273-R276 PolarHBondContact O-N 3.49Å; R276-A279 WeakPolarHBondContact O-CB 3.43Å; R276-A279 PolarHBondContact O-N 3.48Å; R276-E280 PolarHBondContact O-N 3.08Å
277	L	78.5	Confident	76.5	Confident	8 Å²	8	74.4 Å²	74.4	4%	0.042	37%	0.374	C	S	.	.	H	α-helix	trans	-67.8	-39.8	178.5	-76.9	166.2	0	0	0	112.9	T250 I251 L273 A279 E280 A281 F302	T250-L277 HydrophobicContact CG2-CD2 4.42Å; T250-L277 HydrophobicContact CG2-CG 4.42Å; I251-L277 HydrophobicContact CD1-CD1 4.25Å; I251-L277 HydrophobicContact CD1-CD2 4.08Å; I251-L277 HydrophobicContact CG1-CD1 4.01Å; I251-L277 HydrophobicContact CG1-CD2 3.93Å; I251-L277 HydrophobicContact CG1-CG 4.32Å; L273-L277 HydrophobicContact CB-CD1 3.84Å; L273-L277 VanDerWaalsContact O-CB 3.3Å; L273-L277 WeakPolarHBondContact O-CB 3.29Å; L273-L277 WeakPolarHBondContact O-CD1 3.33Å; L273-L277 VanDerWaalsContact O-CG 3.26Å; L273-L277 WeakPolarHBondContact O-CG 3.13Å; L273-L277 PolarHBondContact O-N 3.24Å; L277-A279 VanDerWaalsContact C-N 3.28Å; L277-A279 PolarHBondContact O-N 2.93Å; L277-E280 PolarHBondContact O-N 2.95Å; L277-A281 WeakPolarHBondContact O-CB 3.17Å; L277-A281 PolarHBondContact O-N 3.43Å; L277-F302 HydrophobicContact CB-CZ 4.21Å; L277-F302 HydrophobicContact CD1-CD1 4.07Å; L277-F302 HydrophobicContact CD1-CE1 3.25Å; L277-F302 HydrophobicContact CD1-CE2 4.47Å; L277-F302 HydrophobicContact CD1-CZ 3.46Å; L277-F302 VanDerWaalsContact CD1-CZ 3.46Å; L277-F302 HydrophobicContact CD2-CE1 4.5Å; L277-F302 HydrophobicContact CD2-CZ 3.91Å; L277-F302 HydrophobicContact CG-CE1 4.34Å; L277-F302 HydrophobicContact CG-CZ 4.09Å
278	R	71.8	Confident	74.3	Confident	136 Å²	136	76.2 Å²	76.2	51%	0.513	38%	0.377	S	S	.	.	H	α-helix	trans	-60.7	-40.4	173.2	-75.9	175.5	179.2	-174.2	-1.3	111.2	E274 M282	E274-R278 HydrophobicContact CG-CG 4.49Å; E274-R278 WeakPolarHBondContact O-CB 3.32Å; E274-R278 VanDerWaalsContact O-CG 3.25Å; E274-R278 WeakPolarHBondContact O-CG 3.42Å; E274-R278 PolarHBondContact O-N 2.85Å; E274-R278 IonicContact OE1-CZ 3.33Å; E274-R278 IonicContact OE1-NE 2.78Å; E274-R278 PolarHBondContact OE1-NE 3.3Å; E274-R278 IonicContact OE1-NH2 3.47Å; E274-R278 PolarHBondContact OE1-NH2 3.07Å; R278-M282 WeakPolarHBondContact O-CG 3.46Å; R278-M282 PolarHBondContact O-N 2.98Å
279	A	76.2	Confident	72.3	Confident	44 Å²	44	76.3 Å²	76.3	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-63	-49.1	176.3	0	0	0	0	0	112.2	H275 R276 L277 A281 M282 E283	H275-A279 PolarHBondContact O-N 2.83Å; R276-A279 WeakPolarHBondContact O-CB 3.43Å; R276-A279 PolarHBondContact O-N 3.48Å; L277-A279 VanDerWaalsContact C-N 3.28Å; L277-A279 PolarHBondContact O-N 2.93Å; A279-A281 PolarHBondContact O-N 3.32Å; A279-M282 PolarHBondContact O-N 3.19Å; A279-E283 PolarHBondContact O-N 2.88Å
280	E	75.6	Confident	70.4	Confident	39 Å²	39	75.6 Å²	75.6	18%	0.182	37%	0.369	C	S	.	.	H	α-helix	trans	-62.7	-40.2	179.1	-173.2	-170.2	151.7	0	0	112.6	G247 T250 R276 L277 M282 E283 S284	G247-E280 WeakPolarHBondContact CA-OE1 3.43Å; G247-E280 WeakPolarHBondContact CA-OE2 3.44Å; G247-E280 PolarHBondContact N-OE1 3.18Å; G247-E280 VanDerWaalsContact N-OE1 3.09Å; T250-E280 WeakPolarHBondContact CB-OE2 3.34Å; T250-E280 PolarHBondContact OG1-OE2 3.01Å; R276-E280 PolarHBondContact O-N 3.08Å; L277-E280 PolarHBondContact O-N 2.95Å; E280-M282 PolarHBondContact O-N 2.77Å; E280-E283 PolarHBondContact O-N 3.06Å; E280-E283 VanDerWaalsContact O-N 3.1Å; E280-S284 PolarHBondContact O-N 2.98Å; E280-S284 VanDerWaalsContact O-N 3.13Å
281	A	66.2	Low	68.8	Low	5 Å²	5	74.4 Å²	74.4	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-60.5	-31.3	178.7	0	0	0	0	0	112.1	L277 A279 G287 M294	L277-A281 WeakPolarHBondContact O-CB 3.17Å; L277-A281 PolarHBondContact O-N 3.43Å; A279-A281 PolarHBondContact O-N 3.32Å; A281-G287 CarbonylContact O-C 3.53Å; A281-G287 VanDerWaalsContact O-CA 3.22Å; A281-G287 WeakPolarHBondContact O-CA 3.48Å; A281-G287 VanDerWaalsContact O-O 3.13Å; A281-M294 HydrophobicContact CB-SD 4.08Å
282	M	65.2	Low	67.4	Low	143 Å²	143	68.5 Å²	68.5	70%	0.704	34%	0.338	S	S	*	.	H	α-helix	trans	-78.8	-25.8	176.6	-64.5	-177	99.3	0	0	113.3	R278 A279 E280	R278-M282 WeakPolarHBondContact O-CG 3.46Å; R278-M282 PolarHBondContact O-N 2.98Å; A279-M282 PolarHBondContact O-N 3.19Å; E280-M282 PolarHBondContact O-N 2.77Å
283	E	67.3	Low	65.9	Low	165 Å²	165	65.4 Å²	65.4	77%	0.771	32%	0.322	S	S	*	.	H	α-helix	trans	-92.6	-26.7	-173.9	-70.9	-178.4	179.5	0	0	114.5	A279 E280	A279-E283 PolarHBondContact O-N 2.88Å; E280-E283 PolarHBondContact O-N 3.06Å; E280-E283 VanDerWaalsContact O-N 3.1Å
284	S	61.1	Low	64.4	Low	38 Å²	38	67.8 Å²	67.8	27%	0.266	33%	0.333	S	S	.	.	S	Bend	trans	-73.9	146.1	-172.8	65.9	0	0	0	0	114.1	E280 G286 G287	E280-S284 PolarHBondContact O-N 2.98Å; E280-S284 VanDerWaalsContact O-N 3.13Å; S284-G286 VanDerWaalsContact C-N 3.26Å; S284-G286 PolarHBondContact O-N 3.45Å; S284-G287 WeakPolarHBondContact O-CA 3.47Å; S284-G287 PolarHBondContact O-N 2.59Å; S284-G287 WeakPolarHBondContact OG-CA 3.27Å; S284-G287 PolarHBondContact OG-N 3.39Å; S284-G287 VanDerWaalsContact OG-N 3.15Å
285	Q	51.1	Low	63.2	Low	211 Å²	211	68.1 Å²	68.1	99%	0.986	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-9.4	-177.5	-75.2	-167.6	-18.3	0	0	115.4
286	G	53.9	Low	62.3	Low	35 Å²	35	62.7 Å²	62.7	36%	0.361	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-3.5	161.2	0	0	0	0	0	112.8	S284 F288 A289	S284-G286 VanDerWaalsContact C-N 3.26Å; S284-G286 PolarHBondContact O-N 3.45Å; G286-F288 PolarHBondContact O-N 3.33Å; G286-A289 PolarHBondContact O-N 3.44Å
287	G	52.3	Low	61.6	Low	1 Å²	1	65 Å²	65	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-68.6	-14	177.5	0	0	0	0	0	113.4	A281 S284 A289 Q290 S291	A281-G287 CarbonylContact O-C 3.53Å; A281-G287 VanDerWaalsContact O-CA 3.22Å; A281-G287 WeakPolarHBondContact O-CA 3.48Å; A281-G287 VanDerWaalsContact O-O 3.13Å; S284-G287 WeakPolarHBondContact O-CA 3.47Å; S284-G287 PolarHBondContact O-N 2.59Å; S284-G287 WeakPolarHBondContact OG-CA 3.27Å; S284-G287 PolarHBondContact OG-N 3.39Å; S284-G287 VanDerWaalsContact OG-N 3.15Å; G287-A289 VanDerWaalsContact C-N 3.33Å; G287-A289 PolarHBondContact O-N 3.46Å; G287-Q290 PolarHBondContact O-N 3.4Å; G287-S291 VanDerWaalsContact O-CA 3.29Å; G287-S291 WeakPolarHBondContact O-CA 3.32Å; G287-S291 WeakPolarHBondContact O-CB 3.5Å; G287-S291 PolarHBondContact O-N 3.49Å
288	F	49.4	Very low	61.8	Low	128 Å²	128	65.1 Å²	65.1	56%	0.561	34%	0.344	S	S	*	.	H	α-helix	trans	-61.5	-43.9	171.9	-169.3	-94.6	0	0	0	111.7	P214 G286 Q290 S291 E292	P214-F288 HydrophobicContact CB-CD1 4.38Å; G286-F288 PolarHBondContact O-N 3.33Å; F288-Q290 PolarHBondContact O-N 2.99Å; F288-S291 PolarHBondContact O-N 3.07Å; F288-E292 HydrophobicContact CD1-CG 4.35Å; F288-E292 HydrophobicContact CE1-CG 3.99Å; F288-E292 WeakPolarHBondContact CE1-OE1 3.44Å; F288-E292 HydrophobicContact CZ-CG 4.25Å; F288-E292 WeakPolarHBondContact O-CG 3.32Å; F288-E292 PolarHBondContact O-N 3.33Å
289	A	53.1	Low	62.6	Low	5 Å²	5	59.8 Å²	59.8	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-67.7	-38.4	-179.2	0	0	0	0	0	111.6	P214 I217 G286 G287 L293	P214-A289 HydrophobicContact CB-CB 4.18Å; P214-A289 HydrophobicContact CG-CB 4.05Å; I217-A289 HydrophobicContact CD1-CB 3.36Å; I217-A289 HydrophobicContact CG1-CB 4.19Å; G286-A289 PolarHBondContact O-N 3.44Å; G287-A289 VanDerWaalsContact C-N 3.33Å; G287-A289 PolarHBondContact O-N 3.46Å; A289-L293 WeakPolarHBondContact O-CG 3.33Å; A289-L293 PolarHBondContact O-N 3.49Å
290	Q	54.6	Low	63.2	Low	10 Å²	10	60.6 Å²	60.6	5%	0.047	32%	0.324	C	S	.	.	H	α-helix	trans	-76.4	-37.6	173.7	-71	-164	-4.2	0	0	112.5	H138 S244 I246 G287 F288 E292 L293 M294	H138-Q290 PolarHBondContact CE1-OE1 3.47Å; S244-Q290 PolarHBondContact OG-NE2 3.02Å; I246-Q290 HydrophobicContact CD1-CG 4.28Å; I246-Q290 VanDerWaalsContact CG2-OE1 3.26Å; G287-Q290 PolarHBondContact O-N 3.4Å; F288-Q290 PolarHBondContact O-N 2.99Å; Q290-E292 VanDerWaalsContact C-N 3.27Å; Q290-E292 PolarHBondContact O-N 2.88Å; Q290-L293 CarbonylContact O-C 3.56Å; Q290-L293 WeakPolarHBondContact O-CB 3.35Å; Q290-L293 PolarHBondContact O-N 3.16Å; Q290-L293 VanDerWaalsContact O-N 3.1Å; Q290-M294 WeakPolarHBondContact O-CB 3.3Å; Q290-M294 WeakPolarHBondContact O-CG 3.36Å; Q290-M294 PolarHBondContact O-N 2.88Å
291	S	56.9	Low	64	Low	27 Å²	27	63.2 Å²	63.2	19%	0.189	34%	0.335	C	S	.	.	H	α-helix	trans	-60.7	-39.7	176.6	175.9	0	0	0	0	109.9	G287 F288 M294 S295	G287-S291 VanDerWaalsContact O-CA 3.29Å; G287-S291 WeakPolarHBondContact O-CA 3.32Å; G287-S291 WeakPolarHBondContact O-CB 3.5Å; G287-S291 PolarHBondContact O-N 3.49Å; F288-S291 PolarHBondContact O-N 3.07Å; S291-M294 PolarHBondContact O-N 2.88Å; S291-S295 WeakPolarHBondContact O-CA 3.2Å; S291-S295 WeakPolarHBondContact O-CB 3.39Å; S291-S295 PolarHBondContact O-N 3.09Å; S291-S295 PolarHBondContact O-OG 2.94Å
292	E	58.7	Low	65.1	Low	45 Å²	45	64.2 Å²	64.2	21%	0.21	34%	0.339	C	S	.	.	H	α-helix	trans	-69.9	-36.2	173.5	-74.3	-173.5	136.9	0	0	113.5	K221 F288 Q290 M294 S295 G296	K221-E292 IonicContact NZ-OE1 2.71Å; K221-E292 PolarHBondContact NZ-OE1 3.28Å; K221-E292 IonicContact NZ-OE2 3.69Å; K221-E292 PolarHBondContact NZ-OE2 3.06Å; F288-E292 HydrophobicContact CD1-CG 4.35Å; F288-E292 HydrophobicContact CE1-CG 3.99Å; F288-E292 WeakPolarHBondContact CE1-OE1 3.44Å; F288-E292 HydrophobicContact CZ-CG 4.25Å; F288-E292 WeakPolarHBondContact O-CG 3.32Å; F288-E292 PolarHBondContact O-N 3.33Å; Q290-E292 VanDerWaalsContact C-N 3.27Å; Q290-E292 PolarHBondContact O-N 2.88Å; E292-M294 VanDerWaalsContact C-N 3.32Å; E292-S295 WeakPolarHBondContact CA-OG 2.94Å; E292-S295 PolarHBondContact O-OG 3.35Å; E292-G296 PolarHBondContact O-N 2.97Å
293	L	59.8	Low	66.5	Low	5 Å²	5	57.4 Å²	57.4	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-65.4	-36.1	171.5	-74.7	172.4	0	0	0	112.1	I217 M224 A289 Q290 L298 I299	I217-L293 HydrophobicContact CD1-CD1 3.81Å; I217-L293 HydrophobicContact CD1-CG 4.49Å; I217-L293 HydrophobicContact CG2-CD1 3.74Å; I217-L293 HydrophobicContact CG2-CD2 3.54Å; I217-L293 HydrophobicContact CG2-CG 3.43Å; I217-L293 VanDerWaalsContact CG2-CG 3.43Å; M224-L293 HydrophobicContact CE-CD2 3.94Å; M224-L293 HydrophobicContact SD-CD2 4.3Å; A289-L293 WeakPolarHBondContact O-CG 3.33Å; A289-L293 PolarHBondContact O-N 3.49Å; Q290-L293 CarbonylContact O-C 3.56Å; Q290-L293 WeakPolarHBondContact O-CB 3.35Å; Q290-L293 PolarHBondContact O-N 3.16Å; Q290-L293 VanDerWaalsContact O-N 3.1Å; L293-L298 HydrophobicContact CD2-CD1 4.23Å; L293-L298 PolarHBondContact O-N 3.14Å; L293-I299 HydrophobicContact CB-CD1 3.8Å; L293-I299 HydrophobicContact CB-CG1 4.28Å
294	M	57.8	Low	67.8	Low	50 Å²	50	49.6 Å²	49.6	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-80.5	-37	179.8	-64.3	-142.6	83.1	0	0	112.2	A281 Q290 S291 E292 H297 I299 F302	A281-M294 HydrophobicContact CB-SD 4.08Å; Q290-M294 WeakPolarHBondContact O-CB 3.3Å; Q290-M294 WeakPolarHBondContact O-CG 3.36Å; Q290-M294 PolarHBondContact O-N 2.88Å; S291-M294 PolarHBondContact O-N 2.88Å; E292-M294 VanDerWaalsContact C-N 3.32Å; M294-H297 PolarHBondContact O-N 3.43Å; M294-I299 HydrophobicContact CG-CD1 4.1Å; M294-F302 HydrophobicContact CE-CD2 3.91Å
295	S	56.3	Low	69.5	Low	80 Å²	80	47.8 Å²	47.8	56%	0.559	26%	0.256	S	S	*	.	H	α-helix	trans	-75.8	-28	-176.3	67.7	0	0	0	0	112.8	S291 E292 H297	S291-S295 WeakPolarHBondContact O-CA 3.2Å; S291-S295 WeakPolarHBondContact O-CB 3.39Å; S291-S295 PolarHBondContact O-N 3.09Å; S291-S295 PolarHBondContact O-OG 2.94Å; E292-S295 WeakPolarHBondContact CA-OG 2.94Å; E292-S295 PolarHBondContact O-OG 3.35Å; S295-H297 VanDerWaalsContact C-N 3.26Å; S295-H297 PolarHBondContact O-N 2.79Å
296	G	59	Low	71.7	Confident	39 Å²	39	37.8 Å²	37.8	40%	0.402	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	4.5	177	0	0	0	0	0	114.6	E292 L298	E292-G296 PolarHBondContact O-N 2.97Å; G296-L298 PolarHBondContact O-N 3.4Å; G296-L298 VanDerWaalsContact O-N 3.1Å
297	H	69.5	Low	73.8	Confident	152 Å²	152	36.1 Å²	36.1	70%	0.704	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	30	-169.6	-61.8	-75.3	0	0	0	113.1	K131 M294 S295	K131-H297 PolarHBondContact NZ-O 3.32Å; M294-H297 PolarHBondContact O-N 3.43Å; S295-H297 VanDerWaalsContact C-N 3.26Å; S295-H297 PolarHBondContact O-N 2.79Å
298	L	82.6	Confident	75.9	Confident	9 Å²	9	36.2 Å²	36.2	5%	0.047	19%	0.192	C	C	.	.			trans	-77.6	-32.2	-178.6	-64.8	174.7	0	0	0	111.1	K131 T134 K221 M224 D225 L293 G296	K131-L298 WeakPolarHBondContact CE-O 3.4Å; K131-L298 VanDerWaalsContact NZ-C 3.33Å; K131-L298 PolarHBondContact NZ-O 2.88Å; T134-L298 VanDerWaalsContact CB-O 3.24Å; T134-L298 WeakPolarHBondContact CB-O 3.35Å; T134-L298 WeakPolarHBondContact CG2-O 3.11Å; T134-L298 PolarHBondContact OG1-O 2.84Å; K221-L298 HydrophobicContact CB-CD1 3.91Å; K221-L298 HydrophobicContact CD-CD1 4.12Å; K221-L298 HydrophobicContact CG-CD1 3.58Å; M224-L298 HydrophobicContact CB-CD2 4.43Å; M224-L298 HydrophobicContact CE-CB 4.22Å; D225-L298 HydrophobicContact CB-CD2 3.78Å; L293-L298 HydrophobicContact CD2-CD1 4.23Å; L293-L298 PolarHBondContact O-N 3.14Å; G296-L298 PolarHBondContact O-N 3.4Å; G296-L298 VanDerWaalsContact O-N 3.1Å
299	I	87.7	Confident	78.1	Confident	24 Å²	24	31.6 Å²	31.6	12%	0.123	17%	0.172	C	C	.	.			trans	-81.4	123.5	171.4	-63.1	164.5	0	0	0	109.3	T134 L293 M294 F301	T134-I299 HydrophobicContact CG2-CB 4.36Å; T134-I299 HydrophobicContact CG2-CG1 4.06Å; L293-I299 HydrophobicContact CB-CD1 3.8Å; L293-I299 HydrophobicContact CB-CG1 4.28Å; M294-I299 HydrophobicContact CG-CD1 4.1Å; I299-F301 WeakPolarHBondContact CG2-O 3.49Å
300	D	89.9	Confident	80.2	Confident	62 Å²	62	34.7 Å²	34.7	33%	0.332	18%	0.183	S	C	.	.	S	Bend	trans	-79.1	-45.6	176.8	-59.2	-49.7	0	0	0	111.2	K131 T134	K131-D300 WeakPolarHBondContact CD-OD1 3.32Å; K131-D300 WeakPolarHBondContact CE-OD1 3.38Å; K131-D300 IonicContact NZ-OD1 2.59Å; K131-D300 PolarHBondContact NZ-OD1 3.1Å; K131-D300 IonicContact NZ-OD2 3.74Å; T134-D300 PolarHBondContact N-OD2 3.01Å; T134-D300 WeakPolarHBondContact O-CB 3.19Å; T134-D300 PolarHBondContact O-N 2.94Å
301	F	91.3	Very high	82.1	Confident	93 Å²	93	39.7 Å²	39.7	41%	0.408	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.5	-179.9	-53.7	-82.3	0	0	0	111.7	V115 A119 L133 T134 L135 S136 I299	V115-F301 HydrophobicContact CG1-CB 3.83Å; V115-F301 HydrophobicContact CG1-CD1 4.37Å; V115-F301 HydrophobicContact CG1-CG 4.22Å; A119-F301 HydrophobicContact CB-CD2 3.67Å; A119-F301 HydrophobicContact CB-CE2 3.75Å; A119-F301 HydrophobicContact CB-CG 4.4Å; L133-F301 HydrophobicContact CD1-CD2 4.2Å; L133-F301 HydrophobicContact CD1-CE2 4.21Å; T134-F301 PolarHBondContact O-N 3.49Å; L135-F301 HydrophobicContact CD2-CB 3.67Å; L135-F301 HydrophobicContact CD2-CD2 3.64Å; L135-F301 HydrophobicContact CD2-CG 4.1Å; S136-F301 PolarHBondContact N-O 3.32Å; I299-F301 WeakPolarHBondContact CG2-O 3.49Å
302	F	89.9	Confident	84	Confident	27 Å²	27	38.8 Å²	38.8	12%	0.118	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.2	164.8	-172.8	-77.8	0	0	0	109.1	H138 M270 L277 M294 P304	H138-F302 HydrophobicContact CB-CE1 3.76Å; H138-F302 HydrophobicContact CB-CE2 3.93Å; H138-F302 HydrophobicContact CB-CZ 3.23Å; H138-F302 AromaticContact CD2-CD2 3.44Å; H138-F302 VanDerWaalsContact CD2-CD2 3.44Å; H138-F302 WeakPolarHBondContact CD2-CD2 3.33Å; H138-F302 AromaticContact CD2-CE1 3.91Å; H138-F302 AromaticContact CD2-CE2 2.96Å; H138-F302 WeakPolarHBondContact CD2-CE2 3.41Å; H138-F302 AromaticContact CD2-CZ 3.23Å; H138-F302 WeakPolarHBondContact CD2-CZ 3.35Å; H138-F302 AromaticContact CE1-CE2 3.65Å; H138-F302 AromaticContact CG-CE2 3.29Å; H138-F302 AromaticContact CG-CZ 3.16Å; H138-F302 AromaticContact ND1-CE2 3.7Å; H138-F302 AromaticContact ND1-CZ 3.86Å; H138-F302 AromaticContact NE2-CD2 3.61Å; H138-F302 AromaticContact NE2-CE2 3.23Å; H138-F302 WeakPolarHBondContact NE2-CE2 3.36Å; H138-F302 AromaticContact NE2-CZ 3.96Å; M270-F302 WeakPolarHBondContact CE-O 3.4Å; L277-F302 HydrophobicContact CB-CZ 4.21Å; L277-F302 HydrophobicContact CD1-CD1 4.07Å; L277-F302 HydrophobicContact CD1-CE1 3.25Å; L277-F302 HydrophobicContact CD1-CE2 4.47Å; L277-F302 HydrophobicContact CD1-CZ 3.46Å; L277-F302 VanDerWaalsContact CD1-CZ 3.46Å; L277-F302 HydrophobicContact CD2-CE1 4.5Å; L277-F302 HydrophobicContact CD2-CZ 3.91Å; L277-F302 HydrophobicContact CG-CE1 4.34Å; L277-F302 HydrophobicContact CG-CZ 4.09Å; M294-F302 HydrophobicContact CE-CD2 3.91Å; F302-P304 HydrophobicContact CE1-CB 4.13Å
303	V	94.4	Very high	85.8	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	102.2	-175.5	-169	0	0	0	0	109.9	A112 V115 V116 S136 F137 H138 F305	A112-V303 HydrophobicContact CB-CG1 3.67Å; V115-V303 HydrophobicContact CG1-CG2 3.83Å; V116-V303 HydrophobicContact CG2-CG1 4.04Å; V116-V303 HydrophobicContact CG2-CG2 4.42Å; S136-V303 PolarHBondContact O-N 2.89Å; F137-V303 WeakPolarHBondContact CA-O 3.36Å; F137-V303 HydrophobicContact CD1-CB 3.56Å; F137-V303 HydrophobicContact CD1-CG1 4.13Å; F137-V303 HydrophobicContact CD1-CG2 3.7Å; F137-V303 HydrophobicContact CE1-CB 3.97Å; F137-V303 HydrophobicContact CE1-CG1 4.25Å; F137-V303 HydrophobicContact CE1-CG2 3.72Å; F137-V303 HydrophobicContact CG-CB 4.41Å; H138-V303 PolarHBondContact N-O 3.02Å; V303-F305 HydrophobicContact CB-CE2 4.44Å; V303-F305 HydrophobicContact CG1-CE2 3.9Å; V303-F305 WeakPolarHBondContact O-CD2 3.34Å
304	P	95.1	Very high	87.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	142.1	179.5	30.9	-32.4	0	0	0	111.7	L111 H138 I251 M270 L273 F302	L111-P304 HydrophobicContact CB-CG 4.23Å; L111-P304 HydrophobicContact CD1-CG 3.87Å; H138-P304 CarbonylContact O-C 3.47Å; H138-P304 WeakPolarHBondContact O-CA 3.16Å; I251-P304 HydrophobicContact CD1-CB 3.9Å; I251-P304 HydrophobicContact CG1-CB 4.31Å; M270-P304 HydrophobicContact CE-CG 4.23Å; M270-P304 VanDerWaalsContact SD-CD 3.52Å; M270-P304 HydrophobicContact SD-CG 3.61Å; L273-P304 HydrophobicContact CD1-CB 3.68Å; L273-P304 HydrophobicContact CD1-CG 3.58Å; F302-P304 HydrophobicContact CE1-CB 4.13Å
305	F	96.9	Very high	89.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	107.7	173.9	-75.4	-105.8	0	0	0	109.2	Q109 A112 F137 H138 G139 T143 K145 V148 V303	Q109-F305 HydrophobicContact CG-CD1 4.1Å; A112-F305 HydrophobicContact CB-CE1 4.14Å; A112-F305 HydrophobicContact CB-CE2 4.16Å; A112-F305 HydrophobicContact CB-CZ 3.94Å; F137-F305 HydrophobicContact CB-CD2 4.21Å; F137-F305 HydrophobicContact CB-CE2 3.64Å; F137-F305 HydrophobicContact CD1-CE2 4.25Å; F137-F305 AromaticContact CD2-CE2 3.7Å; F137-F305 HydrophobicContact CD2-CE2 3.7Å; F137-F305 AromaticContact CD2-CZ 3.77Å; F137-F305 HydrophobicContact CD2-CZ 3.77Å; F137-F305 HydrophobicContact CE2-CE2 4.45Å; F137-F305 HydrophobicContact CE2-CZ 4.2Å; F137-F305 AromaticContact CG-CE2 3.6Å; F137-F305 HydrophobicContact CG-CE2 3.6Å; F137-F305 HydrophobicContact CG-CZ 4.16Å; H138-F305 WeakPolarHBondContact O-CB 3.38Å; H138-F305 PolarHBondContact O-N 2.55Å; G139-F305 WeakPolarHBondContact CA-O 3.28Å; T143-F305 WeakPolarHBondContact OG1-CB 3.2Å; K145-F305 HydrophobicContact CD-CD2 4.43Å; K145-F305 HydrophobicContact CG-CB 4.3Å; K145-F305 HydrophobicContact CG-CD1 4.07Å; K145-F305 HydrophobicContact CG-CD2 3.71Å; K145-F305 HydrophobicContact CG-CE1 4.32Å; K145-F305 HydrophobicContact CG-CE2 4Å; K145-F305 HydrophobicContact CG-CG 3.75Å; K145-F305 HydrophobicContact CG-CZ 4.29Å; V148-F305 HydrophobicContact CB-CE1 4.35Å; V148-F305 HydrophobicContact CB-CZ 4.07Å; V148-F305 HydrophobicContact CG1-CZ 4.48Å; V148-F305 HydrophobicContact CG2-CE1 3.71Å; V148-F305 HydrophobicContact CG2-CZ 3.86Å; V303-F305 HydrophobicContact CB-CE2 4.44Å; V303-F305 HydrophobicContact CG1-CE2 3.9Å; V303-F305 WeakPolarHBondContact O-CD2 3.34Å
306	L	97.3	Very high	91.3	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-70.6	151.8	-177	-63.3	179.7	0	0	0	111.4	Q109 T143 I251 R265 I268 L273	Q109-L306 PolarHBondContact NE2-O 3.43Å; T143-L306 WeakPolarHBondContact CG2-O 3.05Å; I251-L306 HydrophobicContact CG2-CD2 3.65Å; R265-L306 HydrophobicContact CG-CD1 4.05Å; R265-L306 VanDerWaalsContact CZ-CB 3.44Å; R265-L306 PolarHBondContact NH2-O 2.92Å; I268-L306 HydrophobicContact CD1-CD1 4.32Å; I268-L306 HydrophobicContact CD1-CD2 4.46Å; I268-L306 HydrophobicContact CG2-CD2 4.49Å; L273-L306 HydrophobicContact CD1-CD2 4.16Å
307	P	96.9	Very high	93.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-64.5	145.4	177.4	25.9	-33.6	0	0	0	111.7	W140 N252 A255 R265 F350	W140-P307 HydrophobicContact CE3-CB 4.44Å; N252-P307 HydrophobicContact CB-CG 4.3Å; N252-P307 VanDerWaalsContact OD1-CB 3.28Å; N252-P307 WeakPolarHBondContact OD1-CB 3.35Å; N252-P307 VanDerWaalsContact OD1-CD 3.27Å; N252-P307 WeakPolarHBondContact OD1-CD 3.2Å; N252-P307 VanDerWaalsContact OD1-CG 3.29Å; N252-P307 WeakPolarHBondContact OD1-CG 3.42Å; A255-P307 HydrophobicContact CB-CG 3.87Å; R265-P307 PolarHBondContact NH1-O 3.45Å; R265-P307 PolarHBondContact NH2-O 3.27Å; P307-F350 HydrophobicContact CB-CB 3.88Å; P307-F350 HydrophobicContact CB-CD1 3.83Å; P307-F350 HydrophobicContact CB-CD2 4.15Å; P307-F350 HydrophobicContact CB-CE1 4.41Å; P307-F350 HydrophobicContact CB-CG 3.68Å; P307-F350 HydrophobicContact CG-CD1 3.76Å; P307-F350 HydrophobicContact CG-CD2 3.97Å; P307-F350 HydrophobicContact CG-CE1 3.83Å; P307-F350 HydrophobicContact CG-CE2 4.02Å; P307-F350 HydrophobicContact CG-CG 3.84Å; P307-F350 HydrophobicContact CG-CZ 3.96Å
308	L	97.1	Very high	94.3	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-89.5	120.7	-174.9	-63.4	-176.3	0	0	0	112.2	T143 H312 S351 C355	T143-L308 HydrophobicContact CG2-CG 4.48Å; L308-H312 HydrophobicContact CB-CB 4.19Å; L308-H312 HydrophobicContact CD2-CB 4.07Å; L308-S351 PolarHBondContact O-N 3.43Å; L308-C355 HydrophobicContact CD1-CB 4.21Å; L308-C355 WeakPolarHBondContact CD1-SG 3.44Å
309	E	96.1	Very high	94.9	Very high	30 Å²	30	34.4 Å²	34.4	14%	0.14	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-70.8	166.6	170.2	-64.1	158	-147.2	0	0	113.7	R265 R311 H312 V313 F350	R265-E309 WeakPolarHBondContact CD-OE1 3.48Å; R265-E309 IonicContact NH1-OE1 2.62Å; R265-E309 PolarHBondContact NH1-OE1 2.91Å; E309-R311 VanDerWaalsContact C-N 3.28Å; E309-R311 HydrophobicContact CB-CG 4.23Å; E309-R311 PolarHBondContact O-N 3.08Å; E309-R311 IonicContact OE1-NH2 2.81Å; E309-R311 IonicContact OE2-CZ 3.52Å; E309-R311 IonicContact OE2-NE 3.31Å; E309-R311 PolarHBondContact OE2-NE 3.02Å; E309-R311 IonicContact OE2-NH2 2.83Å; E309-R311 PolarHBondContact OE2-NH2 3.29Å; E309-H312 PolarHBondContact N-ND1 3.23Å; E309-H312 WeakPolarHBondContact O-CB 3.39Å; E309-H312 PolarHBondContact O-N 2.92Å; E309-H312 IonicContact OE2-CE1 3.79Å; E309-V313 PolarHBondContact O-N 2.03Å; E309-V313 VanDerWaalsContact O-N 3.17Å; E309-F350 HydrophobicContact CG-CD1 4.08Å; E309-F350 HydrophobicContact CG-CE1 4.05Å
310	Y	95.4	Very high	95.2	Very high	70 Å²	70	34 Å²	34	28%	0.275	16%	0.155	S	C	.	.	H	α-helix	trans	-47.4	-45.3	175.2	-169.6	-92.3	0	0	0	113.9	H312 V313 K314 D334 A337 K338 Y342	Y310-H312 VanDerWaalsContact C-N 3.29Å; Y310-H312 PolarHBondContact O-N 2.87Å; Y310-V313 WeakPolarHBondContact O-CB 3.39Å; Y310-V313 PolarHBondContact O-N 3.22Å; Y310-K314 HydrophobicContact CD1-CD 4.17Å; Y310-K314 HydrophobicContact CD1-CG 4.41Å; Y310-K314 HydrophobicContact CE1-CD 3.67Å; Y310-K314 HydrophobicContact CE1-CG 4.1Å; Y310-K314 PolarHBondContact O-N 3.31Å; Y310-K314 VanDerWaalsContact O-N 3.12Å; Y310-D334 PolarHBondContact OH-O 3.45Å; Y310-D334 PolarHBondContact OH-OD1 3.35Å; Y310-A337 HydrophobicContact CD2-CB 4.18Å; Y310-A337 HydrophobicContact CE1-CB 4.13Å; Y310-A337 HydrophobicContact CE2-CB 3.53Å; Y310-K338 HydrophobicContact CE2-CG 4.41Å; Y310-Y342 HydrophobicContact CD2-CE1 4.04Å; Y310-Y342 HydrophobicContact CD2-CE2 4.17Å; Y310-Y342 AromaticContact CD2-CZ 3.55Å; Y310-Y342 WeakPolarHBondContact CD2-OH 3.44Å
311	R	95.2	Very high	95.4	Very high	115 Å²	115	31.4 Å²	31.4	43%	0.434	14%	0.14	S	C	.	.	H	α-helix	trans	-59.5	-38.3	178.5	61.8	177.5	171.8	145.7	5	112.6	E266 E309 K314 L315	E266-R311 IonicContact OE1-CZ 2.71Å; E266-R311 IonicContact OE1-NH1 3.31Å; E266-R311 PolarHBondContact OE1-NH1 3.38Å; E266-R311 IonicContact OE1-NH2 3.95Å; E266-R311 PolarHBondContact OE1-NH2 3.47Å; E266-R311 IonicContact OE2-NH2 3.64Å; E309-R311 VanDerWaalsContact C-N 3.28Å; E309-R311 HydrophobicContact CB-CG 4.23Å; E309-R311 PolarHBondContact O-N 3.08Å; E309-R311 IonicContact OE1-NH2 2.81Å; E309-R311 IonicContact OE2-CZ 3.52Å; E309-R311 IonicContact OE2-NE 3.31Å; E309-R311 PolarHBondContact OE2-NE 3.02Å; E309-R311 IonicContact OE2-NH2 2.83Å; E309-R311 PolarHBondContact OE2-NH2 3.29Å; R311-K314 PolarHBondContact O-N 3.48Å; R311-L315 WeakPolarHBondContact O-CG 3.21Å; R311-L315 PolarHBondContact O-N 3.15Å
312	H	97.3	Very high	95.5	Very high	9 Å²	9	30 Å²	30	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-72.6	-35.9	179.1	-53.3	120	0	0	0	111.8	H107 G108 L308 E309 Y310 K314 L315 C316	H107-H312 HydrophobicContact CB-CB 4.36Å; G108-H312 VanDerWaalsContact CA-CD2 3.43Å; G108-H312 WeakPolarHBondContact CA-CD2 3.37Å; G108-H312 VanDerWaalsContact CA-NE2 3.25Å; G108-H312 WeakPolarHBondContact CA-NE2 3.21Å; L308-H312 HydrophobicContact CB-CB 4.19Å; L308-H312 HydrophobicContact CD2-CB 4.07Å; E309-H312 PolarHBondContact N-ND1 3.23Å; E309-H312 WeakPolarHBondContact O-CB 3.39Å; E309-H312 PolarHBondContact O-N 2.92Å; E309-H312 IonicContact OE2-CE1 3.79Å; Y310-H312 VanDerWaalsContact C-N 3.29Å; Y310-H312 PolarHBondContact O-N 2.87Å; H312-K314 VanDerWaalsContact C-N 3.32Å; H312-K314 PolarHBondContact O-N 3.14Å; H312-L315 PolarHBondContact O-N 3.06Å; H312-C316 PolarHBondContact O-N 2.99Å; H312-C316 PolarHBondContact O-SG 3.14Å; H312-C316 VanDerWaalsContact O-SG 3.34Å
313	V	96.6	Very high	95.6	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.2	-42.9	174.1	172.4	0	0	0	0	110.7	E309 Y310 L315 C316 A317 A337 M340 I358	E309-V313 PolarHBondContact O-N 2.03Å; E309-V313 VanDerWaalsContact O-N 3.17Å; Y310-V313 WeakPolarHBondContact O-CB 3.39Å; Y310-V313 PolarHBondContact O-N 3.22Å; V313-L315 PolarHBondContact O-N 2.85Å; V313-C316 PolarHBondContact O-N 3.28Å; V313-A317 WeakPolarHBondContact O-CB 3.33Å; V313-A317 PolarHBondContact O-N 2.71Å; V313-A337 HydrophobicContact CG1-CB 3.93Å; V313-M340 HydrophobicContact CG1-CG 3.92Å; V313-I358 HydrophobicContact CB-CD1 4.46Å; V313-I358 HydrophobicContact CG1-CD1 3.82Å
314	K	96.3	Very high	95.5	Very high	42 Å²	42	37.9 Å²	37.9	18%	0.183	19%	0.194	C	C	.	.	H	α-helix	trans	-60.4	-43.5	174.6	-72.4	-171	61.7	171.4	0	112.5	Y310 R311 H312 A317 R318 E330 A337	Y310-K314 HydrophobicContact CD1-CD 4.17Å; Y310-K314 HydrophobicContact CD1-CG 4.41Å; Y310-K314 HydrophobicContact CE1-CD 3.67Å; Y310-K314 HydrophobicContact CE1-CG 4.1Å; Y310-K314 PolarHBondContact O-N 3.31Å; Y310-K314 VanDerWaalsContact O-N 3.12Å; R311-K314 PolarHBondContact O-N 3.48Å; H312-K314 VanDerWaalsContact C-N 3.32Å; H312-K314 PolarHBondContact O-N 3.14Å; K314-A317 PolarHBondContact O-N 2.97Å; K314-R318 PolarHBondContact O-N 2.92Å; K314-E330 WeakPolarHBondContact CE-OE2 3.49Å; K314-E330 IonicContact NZ-OE2 3.75Å; K314-E330 PolarHBondContact NZ-OE2 3.11Å; K314-A337 HydrophobicContact CG-CB 3.72Å
315	L	96.6	Very high	95.4	Very high	55 Å²	55	41.2 Å²	41.2	29%	0.288	23%	0.229	S	C	.	.	H	α-helix	trans	-62.2	-45.1	176.7	-66.1	171	0	0	0	111.6	H107 R311 H312 V313 A317 R318 D319	H107-L315 HydrophobicContact CB-CB 4.37Å; H107-L315 HydrophobicContact CB-CD1 4.2Å; R311-L315 WeakPolarHBondContact O-CG 3.21Å; R311-L315 PolarHBondContact O-N 3.15Å; H312-L315 PolarHBondContact O-N 3.06Å; V313-L315 PolarHBondContact O-N 2.85Å; L315-A317 VanDerWaalsContact C-N 3.3Å; L315-A317 PolarHBondContact O-N 3Å; L315-R318 WeakPolarHBondContact O-CB 3.42Å; L315-R318 PolarHBondContact O-N 3.48Å; L315-D319 PolarHBondContact O-N 2.95Å
316	C	96	Very high	95.2	Very high	25 Å²	25	44.7 Å²	44.7	17%	0.169	25%	0.247	C	C	.	.	H	α-helix	trans	-60.8	-38.2	173.9	-67.5	0	0	0	0	112.8	H312 V313 D319 A320 C355 I358	H312-C316 PolarHBondContact O-N 2.99Å; H312-C316 PolarHBondContact O-SG 3.14Å; H312-C316 VanDerWaalsContact O-SG 3.34Å; V313-C316 PolarHBondContact O-N 3.28Å; C316-D319 PolarHBondContact O-N 3.37Å; C316-A320 WeakPolarHBondContact O-CB 3.36Å; C316-A320 PolarHBondContact O-N 3.14Å; C316-C355 HydrophobicContact CB-CB 3.62Å; C316-C355 WeakPolarHBondContact CB-SG 3.45Å; C316-C355 WeakPolarHBondContact SG-CB 3.24Å; C316-C355 CovalentContact SG-SG 2.04Å; C316-C355 PolarHBondContact SG-SG 3.41Å; C316-I358 HydrophobicContact CB-CD1 3.47Å; C316-I358 VanDerWaalsContact CB-CD1 3.47Å
317	A	95.9	Very high	95	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-45.8	176.3	0	0	0	0	0	111.1	V313 K314 L315 D319 A320 Y321 L333 V336 I358	V313-A317 WeakPolarHBondContact O-CB 3.33Å; V313-A317 PolarHBondContact O-N 2.71Å; K314-A317 PolarHBondContact O-N 2.97Å; L315-A317 VanDerWaalsContact C-N 3.3Å; L315-A317 PolarHBondContact O-N 3Å; A317-D319 VanDerWaalsContact C-N 3.31Å; A317-D319 PolarHBondContact O-N 3.14Å; A317-A320 WeakPolarHBondContact O-CB 3.35Å; A317-A320 PolarHBondContact O-N 2.02Å; A317-A320 VanDerWaalsContact O-N 3.1Å; A317-Y321 WeakPolarHBondContact O-CD2 3.46Å; A317-Y321 PolarHBondContact O-N 3.15Å; A317-L333 HydrophobicContact CB-CD2 3.82Å; A317-V336 HydrophobicContact CB-CB 4.45Å; A317-V336 HydrophobicContact CB-CG1 3.93Å; A317-I358 HydrophobicContact CB-CG2 3.97Å
318	R	95.8	Very high	94.7	Very high	114 Å²	114	55.6 Å²	55.6	43%	0.43	30%	0.301	S	S	.	.	H	α-helix	trans	-55.3	-47.4	174.6	-175.1	-173.2	65.9	177.7	0.5	111.4	K314 L315 A320 Y321 A322 L333	K314-R318 PolarHBondContact O-N 2.92Å; L315-R318 WeakPolarHBondContact O-CB 3.42Å; L315-R318 PolarHBondContact O-N 3.48Å; R318-A320 VanDerWaalsContact C-N 3.29Å; R318-A320 PolarHBondContact O-N 3.46Å; R318-Y321 PolarHBondContact O-N 3.4Å; R318-A322 WeakPolarHBondContact O-CB 3.45Å; R318-A322 PolarHBondContact O-N 2.98Å; R318-L333 HydrophobicContact CB-CD1 4.11Å; R318-L333 HydrophobicContact CB-CD2 4.1Å
319	D	94.9	Very high	94.4	Very high	52 Å²	52	59.8 Å²	59.8	28%	0.278	32%	0.323	S	S	.	.	H	α-helix	trans	-65.8	-34.6	179.1	-65.1	-2.1	0	0	0	111.9	H107 L315 C316 A317 A322 A323	H107-D319 IonicContact CD2-OD2 2.77Å; H107-D319 IonicContact CE1-OD2 2.68Å; H107-D319 IonicContact NE2-OD2 2.95Å; H107-D319 PolarHBondContact NE2-OD2 3Å; L315-D319 PolarHBondContact O-N 2.95Å; C316-D319 PolarHBondContact O-N 3.37Å; A317-D319 VanDerWaalsContact C-N 3.31Å; A317-D319 PolarHBondContact O-N 3.14Å; D319-A322 PolarHBondContact O-N 2.83Å; D319-A323 WeakPolarHBondContact O-CB 3.41Å; D319-A323 PolarHBondContact O-N 2.02Å
320	A	94.3	Very high	94.3	Very high	15 Å²	15	64.2 Å²	64.2	12%	0.124	34%	0.344	C	S	.	.	H	α-helix	trans	-68.9	-35.3	176.5	0	0	0	0	0	112.8	C316 A317 R318 I358 I362	C316-A320 WeakPolarHBondContact O-CB 3.36Å; C316-A320 PolarHBondContact O-N 3.14Å; A317-A320 WeakPolarHBondContact O-CB 3.35Å; A317-A320 PolarHBondContact O-N 2.02Å; A317-A320 VanDerWaalsContact O-N 3.1Å; R318-A320 VanDerWaalsContact C-N 3.29Å; R318-A320 PolarHBondContact O-N 3.46Å; A320-I358 HydrophobicContact CB-CG2 4.07Å; A320-I362 HydrophobicContact CB-CD1 3.8Å; A320-I362 HydrophobicContact CB-CG2 4.49Å
321	Y	95	Very high	94.3	Very high	7 Å²	7	62.6 Å²	62.6	3%	0.027	35%	0.348	C	S	.	.	H	α-helix	trans	-69.6	-43.9	170.4	-81.1	-77.6	0	0	0	111.7	A317 R318 A323 R324 G325 L326 P328 T332 L333 V336 I362 L366	A317-Y321 WeakPolarHBondContact O-CD2 3.46Å; A317-Y321 PolarHBondContact O-N 3.15Å; R318-Y321 PolarHBondContact O-N 3.4Å; Y321-A323 VanDerWaalsContact C-N 3.26Å; Y321-A323 PolarHBondContact O-N 2.79Å; Y321-R324 CarbonylContact O-C 3.48Å; Y321-R324 WeakPolarHBondContact O-CA 3.31Å; Y321-R324 WeakPolarHBondContact O-CB 3.01Å; Y321-R324 PolarHBondContact O-N 3.15Å; Y321-G325 PolarHBondContact O-N 3.36Å; Y321-L326 CarbonylContact C-O 3.57Å; Y321-L326 HydrophobicContact CD1-CB 4.04Å; Y321-L326 HydrophobicContact CD1-CD1 4.07Å; Y321-L326 PolarHBondContact O-N 2.78Å; Y321-L326 VanDerWaalsContact O-N 3.09Å; Y321-P328 HydrophobicContact CD1-CB 4.25Å; Y321-P328 HydrophobicContact CD2-CB 3.71Å; Y321-P328 HydrophobicContact CD2-CG 3.71Å; Y321-P328 HydrophobicContact CE2-CB 4.07Å; Y321-P328 HydrophobicContact CG-CB 3.83Å; Y321-P328 HydrophobicContact CG-CG 3.79Å; Y321-T332 HydrophobicContact CE2-CG2 4.19Å; Y321-T332 VanDerWaalsContact OH-CG2 3.22Å; Y321-T332 WeakPolarHBondContact OH-CG2 3.34Å; Y321-L333 HydrophobicContact CD2-CD2 4.06Å; Y321-L333 HydrophobicContact CE2-CD2 4.29Å; Y321-V336 HydrophobicContact CE2-CG2 4.28Å; Y321-I362 HydrophobicContact CD2-CG2 4.11Å; Y321-I362 HydrophobicContact CE1-CB 4.28Å; Y321-I362 HydrophobicContact CE2-CB 4Å; Y321-I362 HydrophobicContact CE2-CG2 3.62Å; Y321-L366 HydrophobicContact CD1-CD2 4.47Å; Y321-L366 HydrophobicContact CE1-CD2 3.91Å
322	A	93.5	Very high	94.1	Very high	63 Å²	63	58.5 Å²	58.5	52%	0.521	34%	0.336	S	S	.	.	H	α-helix	trans	-59.9	-37.4	177.4	0	0	0	0	0	111.8	R318 D319 R324 G325	R318-A322 WeakPolarHBondContact O-CB 3.45Å; R318-A322 PolarHBondContact O-N 2.98Å; D319-A322 PolarHBondContact O-N 2.83Å; A322-R324 PolarHBondContact O-N 3.41Å; A322-R324 VanDerWaalsContact O-N 3.1Å; A322-G325 PolarHBondContact O-N 2.83Å
323	A	91.9	Very high	94	Very high	90 Å²	90	58.3 Å²	58.3	74%	0.744	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.1	173.5	0	0	0	0	0	113.9	D319 Y321	D319-A323 WeakPolarHBondContact O-CB 3.41Å; D319-A323 PolarHBondContact O-N 2.02Å; Y321-A323 VanDerWaalsContact C-N 3.26Å; Y321-A323 PolarHBondContact O-N 2.79Å
324	R	91.6	Very high	94	Very high	103 Å²	103	60.3 Å²	60.3	39%	0.389	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	5.2	173.9	-61.3	-174.6	179.5	-176.8	0.9	113.4	Y321 A322 L326 P359 N363	Y321-R324 CarbonylContact O-C 3.48Å; Y321-R324 WeakPolarHBondContact O-CA 3.31Å; Y321-R324 WeakPolarHBondContact O-CB 3.01Å; Y321-R324 PolarHBondContact O-N 3.15Å; A322-R324 PolarHBondContact O-N 3.41Å; A322-R324 VanDerWaalsContact O-N 3.1Å; R324-L326 VanDerWaalsContact C-N 3.29Å; R324-L326 HydrophobicContact CB-CD1 4.25Å; R324-L326 HydrophobicContact CB-CG 4.27Å; R324-L326 PolarHBondContact O-N 3.46Å; R324-P359 PolarHBondContact NH2-O 3.47Å; R324-N363 PolarHBondContact NH1-OD1 2.84Å; R324-N363 PolarHBondContact NH2-OD1 3.09Å
325	G	93.3	Very high	93.9	Very high	71 Å²	71	63.5 Å²	63.5	73%	0.732	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	26	-175.7	0	0	0	0	0	113.6	Y321 A322	Y321-G325 PolarHBondContact O-N 3.36Å; A322-G325 PolarHBondContact O-N 2.83Å
326	L	93.2	Very high	93.7	Very high	73 Å²	73	60.9 Å²	60.9	38%	0.382	35%	0.348	S	S	.	.			trans	-108.3	140.3	177.8	-61.8	174.1	0	0	0	110.1	Y321 R324 P328 L366	Y321-L326 CarbonylContact C-O 3.57Å; Y321-L326 HydrophobicContact CD1-CB 4.04Å; Y321-L326 HydrophobicContact CD1-CD1 4.07Å; Y321-L326 PolarHBondContact O-N 2.78Å; Y321-L326 VanDerWaalsContact O-N 3.09Å; R324-L326 VanDerWaalsContact C-N 3.29Å; R324-L326 HydrophobicContact CB-CD1 4.25Å; R324-L326 HydrophobicContact CB-CG 4.27Å; R324-L326 PolarHBondContact O-N 3.46Å; L326-P328 WeakPolarHBondContact O-CD 3.05Å; L326-L366 HydrophobicContact CD1-CD2 3.35Å
327	E	91.5	Very high	93.7	Very high	198 Å²	198	59.7 Å²	59.7	93%	0.925	34%	0.34	S	S	*	.			trans	-104.1	103.8	171.7	-66.9	-167.2	155.7	0	0	109.1
328	P	90.3	Very high	93.5	Very high	32 Å²	32	66.3 Å²	66.3	21%	0.208	37%	0.369	C	S	.	.			trans	-80.1	147.3	179.9	33.9	-34.2	0	0	0	110.6	Y321 L326 L333	Y321-P328 HydrophobicContact CD1-CB 4.25Å; Y321-P328 HydrophobicContact CD2-CB 3.71Å; Y321-P328 HydrophobicContact CD2-CG 3.71Å; Y321-P328 HydrophobicContact CE2-CB 4.07Å; Y321-P328 HydrophobicContact CG-CB 3.83Å; Y321-P328 HydrophobicContact CG-CG 3.79Å; L326-P328 WeakPolarHBondContact O-CD 3.05Å; P328-L333 HydrophobicContact CB-CD2 3.96Å; P328-L333 HydrophobicContact CB-CG 4.1Å; P328-L333 HydrophobicContact CG-CD1 4.26Å; P328-L333 HydrophobicContact CG-CD2 3.62Å; P328-L333 HydrophobicContact CG-CG 3.97Å
329	D	92.7	Very high	93.4	Very high	91 Å²	91	62.7 Å²	62.7	49%	0.487	36%	0.363	S	S	.	.			trans	-76.1	160	166.8	67.6	-67.2	0	0	0	111.2	G331 T332 L333	D329-G331 PolarHBondContact O-N 3.45Å; D329-G331 VanDerWaalsContact OD2-CA 3.22Å; D329-G331 WeakPolarHBondContact OD2-CA 3.3Å; D329-G331 PolarHBondContact OD2-N 3.15Å; D329-T332 PolarHBondContact O-N 2.62Å; D329-T332 WeakPolarHBondContact OD1-CB 3.31Å; D329-T332 PolarHBondContact OD1-OG1 3.07Å; D329-T332 PolarHBondContact OD2-N 3.39Å; D329-L333 PolarHBondContact O-N 2.06Å; D329-L333 VanDerWaalsContact O-N 3.14Å
330	E	93.8	Very high	93.3	Very high	124 Å²	124	60.7 Å²	60.7	58%	0.579	35%	0.352	S	S	*	.	H	α-helix	trans	-60.6	-27.5	178.8	-79.3	-65.5	151.4	0	0	113.3	K314 D334	K314-E330 WeakPolarHBondContact CE-OE2 3.49Å; K314-E330 IonicContact NZ-OE2 3.75Å; K314-E330 PolarHBondContact NZ-OE2 3.11Å; E330-D334 WeakPolarHBondContact O-CB 3.19Å; E330-D334 PolarHBondContact O-N 3.45Å; E330-D334 VanDerWaalsContact O-N 3.11Å
331	G	93.8	Very high	93.3	Very high	36 Å²	36	65.5 Å²	65.5	37%	0.371	38%	0.375	S	S	.	.	H	α-helix	trans	-67.9	-50.3	176.1	0	0	0	0	0	111.6	D329 L333 D334 E335	D329-G331 PolarHBondContact O-N 3.45Å; D329-G331 VanDerWaalsContact OD2-CA 3.22Å; D329-G331 WeakPolarHBondContact OD2-CA 3.3Å; D329-G331 PolarHBondContact OD2-N 3.15Å; G331-L333 VanDerWaalsContact C-N 3.32Å; G331-L333 PolarHBondContact O-N 3.06Å; G331-D334 WeakPolarHBondContact O-CA 3.26Å; G331-D334 WeakPolarHBondContact O-CB 3.01Å; G331-D334 PolarHBondContact O-N 3.32Å; G331-D334 VanDerWaalsContact O-N 3.07Å; G331-E335 PolarHBondContact O-N 3.1Å
332	T	92.9	Very high	93.2	Very high	29 Å²	29	66.6 Å²	66.6	18%	0.178	38%	0.379	C	S	.	.	H	α-helix	trans	-58.7	-41.8	175.5	-63	0	0	0	0	112.1	Y321 D329 D334 E335 V336 F365	Y321-T332 HydrophobicContact CE2-CG2 4.19Å; Y321-T332 VanDerWaalsContact OH-CG2 3.22Å; Y321-T332 WeakPolarHBondContact OH-CG2 3.34Å; D329-T332 PolarHBondContact O-N 2.62Å; D329-T332 WeakPolarHBondContact OD1-CB 3.31Å; D329-T332 PolarHBondContact OD1-OG1 3.07Å; D329-T332 PolarHBondContact OD2-N 3.39Å; T332-D334 VanDerWaalsContact C-N 3.28Å; T332-D334 PolarHBondContact O-N 3.45Å; T332-E335 PolarHBondContact O-N 2.87Å; T332-V336 WeakPolarHBondContact O-CG2 3.37Å; T332-V336 PolarHBondContact O-N 3.21Å; T332-F365 HydrophobicContact CG2-CB 4.32Å
333	L	94.9	Very high	93.2	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-38.7	175.6	-67.4	179.8	0	0	0	112.3	A317 R318 Y321 P328 D329 G331 A337	A317-L333 HydrophobicContact CB-CD2 3.82Å; R318-L333 HydrophobicContact CB-CD1 4.11Å; R318-L333 HydrophobicContact CB-CD2 4.1Å; Y321-L333 HydrophobicContact CD2-CD2 4.06Å; Y321-L333 HydrophobicContact CE2-CD2 4.29Å; P328-L333 HydrophobicContact CB-CD2 3.96Å; P328-L333 HydrophobicContact CB-CG 4.1Å; P328-L333 HydrophobicContact CG-CD1 4.26Å; P328-L333 HydrophobicContact CG-CD2 3.62Å; P328-L333 HydrophobicContact CG-CG 3.97Å; D329-L333 PolarHBondContact O-N 2.06Å; D329-L333 VanDerWaalsContact O-N 3.14Å; G331-L333 VanDerWaalsContact C-N 3.32Å; G331-L333 PolarHBondContact O-N 3.06Å; L333-A337 WeakPolarHBondContact O-CB 2.94Å; L333-A337 PolarHBondContact O-N 2.84Å
334	D	95	Very high	93.1	Very high	41 Å²	41	63 Å²	63	22%	0.219	34%	0.342	C	S	.	.	H	α-helix	trans	-68.7	-39.5	177.4	-163.4	67.2	0	0	0	112	Y310 E330 G331 T332 A337 K338	Y310-D334 PolarHBondContact OH-O 3.45Å; Y310-D334 PolarHBondContact OH-OD1 3.35Å; E330-D334 WeakPolarHBondContact O-CB 3.19Å; E330-D334 PolarHBondContact O-N 3.45Å; E330-D334 VanDerWaalsContact O-N 3.11Å; G331-D334 WeakPolarHBondContact O-CA 3.26Å; G331-D334 WeakPolarHBondContact O-CB 3.01Å; G331-D334 PolarHBondContact O-N 3.32Å; G331-D334 VanDerWaalsContact O-N 3.07Å; T332-D334 VanDerWaalsContact C-N 3.28Å; T332-D334 PolarHBondContact O-N 3.45Å; D334-A337 PolarHBondContact O-N 2.93Å; D334-K338 WeakPolarHBondContact O-CB 2.81Å; D334-K338 WeakPolarHBondContact O-CG 2.97Å; D334-K338 PolarHBondContact O-N 3.29Å; D334-K338 WeakPolarHBondContact OD2-CE 3.2Å; D334-K338 IonicContact OD2-NZ 3.61Å; D334-K338 PolarHBondContact OD2-NZ 2.89Å
335	E	94.1	Very high	92.9	Very high	109 Å²	109	66.1 Å²	66.1	51%	0.509	36%	0.358	S	S	.	.	H	α-helix	trans	-62.4	-45.5	174.3	-70.8	-173.6	177.9	0	0	112.3	G331 T332 A337 K338 A339 F365	G331-E335 PolarHBondContact O-N 3.1Å; T332-E335 PolarHBondContact O-N 2.87Å; E335-A337 VanDerWaalsContact C-N 3.33Å; E335-A337 PolarHBondContact O-N 3.41Å; E335-K338 PolarHBondContact O-N 2.86Å; E335-A339 PolarHBondContact O-N 2.94Å; E335-F365 HydrophobicContact CB-CD1 4.06Å; E335-F365 HydrophobicContact CB-CE1 3.92Å
336	V	94.2	Very high	92.6	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-44.7	175.5	173.1	0	0	0	0	110.7	A317 Y321 T332 A339 I362 F365	A317-V336 HydrophobicContact CB-CB 4.45Å; A317-V336 HydrophobicContact CB-CG1 3.93Å; Y321-V336 HydrophobicContact CE2-CG2 4.28Å; T332-V336 WeakPolarHBondContact O-CG2 3.37Å; T332-V336 PolarHBondContact O-N 3.21Å; V336-A339 PolarHBondContact O-N 2.92Å; V336-I362 HydrophobicContact CG1-CG2 4.23Å; V336-I362 HydrophobicContact CG2-CG2 4.35Å; V336-F365 HydrophobicContact CG2-CB 4.17Å; V336-F365 HydrophobicContact CG2-CD2 3.6Å; V336-F365 HydrophobicContact CG2-CE2 4.12Å; V336-F365 HydrophobicContact CG2-CG 3.9Å
337	A	94.4	Very high	92.3	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-67.4	-38.9	-180	0	0	0	0	0	112.4	Y310 V313 K314 L333 D334 E335 A339 M340 Y342	Y310-A337 HydrophobicContact CD2-CB 4.18Å; Y310-A337 HydrophobicContact CE1-CB 4.13Å; Y310-A337 HydrophobicContact CE2-CB 3.53Å; V313-A337 HydrophobicContact CG1-CB 3.93Å; K314-A337 HydrophobicContact CG-CB 3.72Å; L333-A337 WeakPolarHBondContact O-CB 2.94Å; L333-A337 PolarHBondContact O-N 2.84Å; D334-A337 PolarHBondContact O-N 2.93Å; E335-A337 VanDerWaalsContact C-N 3.33Å; E335-A337 PolarHBondContact O-N 3.41Å; A337-A339 VanDerWaalsContact C-N 3.28Å; A337-A339 PolarHBondContact O-N 3.45Å; A337-M340 WeakPolarHBondContact O-CB 3.11Å; A337-M340 PolarHBondContact O-N 2.88Å; A337-Y342 VanDerWaalsContact O-CE2 3.23Å; A337-Y342 WeakPolarHBondContact O-CE2 3.17Å; A337-Y342 PolarHBondContact O-OH 3.45Å
338	K	93.3	Very high	92.2	Very high	140 Å²	140	69.5 Å²	69.5	61%	0.609	35%	0.345	S	S	*	.	H	α-helix	trans	-64.1	-29.4	173.9	-80.9	167.3	174.5	164.4	0	113.4	Y310 D334 E335 M340	Y310-K338 HydrophobicContact CE2-CG 4.41Å; D334-K338 WeakPolarHBondContact O-CB 2.81Å; D334-K338 WeakPolarHBondContact O-CG 2.97Å; D334-K338 PolarHBondContact O-N 3.29Å; D334-K338 WeakPolarHBondContact OD2-CE 3.2Å; D334-K338 IonicContact OD2-NZ 3.61Å; D334-K338 PolarHBondContact OD2-NZ 2.89Å; E335-K338 PolarHBondContact O-N 2.86Å; K338-M340 PolarHBondContact O-N 3.45Å
339	A	92.3	Very high	92.3	Very high	38 Å²	38	69.1 Å²	69.1	31%	0.314	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-7.1	178.8	0	0	0	0	0	113.9	E335 V336 A337 R361 F365	E335-A339 PolarHBondContact O-N 2.94Å; V336-A339 PolarHBondContact O-N 2.92Å; A337-A339 VanDerWaalsContact C-N 3.28Å; A337-A339 PolarHBondContact O-N 3.45Å; A339-R361 PolarHBondContact O-NH1 3.08Å; A339-F365 HydrophobicContact CB-CE2 4.27Å; A339-F365 HydrophobicContact CB-CZ 3.87Å
340	M	93.5	Very high	92.4	Very high	10 Å²	10	65.1 Å²	65.1	5%	0.049	32%	0.32	C	S	.	.	S	Bend	trans	-82.2	158.1	177.7	-64.7	-66.5	-70.7	0	0	112.1	V313 A337 K338 Y342 G354 S357 I358 R361	V313-M340 HydrophobicContact CG1-CG 3.92Å; A337-M340 WeakPolarHBondContact O-CB 3.11Å; A337-M340 PolarHBondContact O-N 2.88Å; K338-M340 PolarHBondContact O-N 3.45Å; M340-Y342 HydrophobicContact CB-CE2 3.75Å; M340-Y342 WeakPolarHBondContact O-CD2 3.25Å; M340-Y342 WeakPolarHBondContact O-CE2 3.45Å; M340-G354 VanDerWaalsContact CE-O 3.27Å; M340-G354 WeakPolarHBondContact CE-O 3.41Å; M340-S357 WeakPolarHBondContact CE-OG 3.35Å; M340-S357 PolarHBondContact SD-OG 2.9Å; M340-S357 VanDerWaalsContact SD-OG 3.4Å; M340-I358 HydrophobicContact CE-CG1 4.43Å; M340-I358 HydrophobicContact SD-CG1 4.4Å; M340-R361 WeakPolarHBondContact SD-CD 3.44Å; M340-R361 PolarHBondContact SD-NE 2.96Å
341	L	93.4	Very high	92.5	Very high	115 Å²	115	59.3 Å²	59.3	60%	0.602	29%	0.293	S	S	*	.			trans	-91.3	128.6	174.9	-67.5	174	0	0	0	109.9	S351 A352	L341-S351 WeakPolarHBondContact O-CA 3.24Å; L341-A352 HydrophobicContact CB-CB 4.37Å; L341-A352 PolarHBondContact O-N 2.98Å
342	Y	94.5	Very high	92.4	Very high	31 Å²	31	58.6 Å²	58.6	12%	0.122	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	148.4	179.4	-63.8	-94.2	0	0	0	112.3	Y310 A337 M340 R348 F350	Y310-Y342 HydrophobicContact CD2-CE1 4.04Å; Y310-Y342 HydrophobicContact CD2-CE2 4.17Å; Y310-Y342 AromaticContact CD2-CZ 3.55Å; Y310-Y342 WeakPolarHBondContact CD2-OH 3.44Å; A337-Y342 VanDerWaalsContact O-CE2 3.23Å; A337-Y342 WeakPolarHBondContact O-CE2 3.17Å; A337-Y342 PolarHBondContact O-OH 3.45Å; M340-Y342 HydrophobicContact CB-CE2 3.75Å; M340-Y342 WeakPolarHBondContact O-CD2 3.25Å; M340-Y342 WeakPolarHBondContact O-CE2 3.45Å; Y342-R348 WeakPolarHBondContact CB-O 3.15Å; Y342-F350 CarbonylContact C-O 3.54Å; Y342-F350 WeakPolarHBondContact CA-O 3.35Å
343	V	92.5	Very high	92.3	Very high	43 Å²	43	61.2 Å²	61.2	26%	0.261	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153.9	179.7	-67.5	0	0	0	0	110.5	W140 L349 F350 A352	W140-V343 HydrophobicContact CH2-CB 4.39Å; W140-V343 HydrophobicContact CH2-CG2 3.26Å; W140-V343 HydrophobicContact CZ2-CG2 4.5Å; W140-V343 HydrophobicContact CZ3-CG2 3.42Å; W140-V343 VanDerWaalsContact CZ3-CG2 3.42Å; V343-L349 PolarHBondContact O-N 3.21Å; V343-F350 HydrophobicContact CG2-CB 4.29Å; V343-F350 WeakPolarHBondContact CG2-O 3.35Å; V343-F350 PolarHBondContact N-O 3.31Å; V343-F350 WeakPolarHBondContact O-CB 3.34Å; V343-F350 PolarHBondContact O-N 3.32Å; V343-A352 HydrophobicContact CG1-CB 4.09Å; V343-A352 HydrophobicContact CG2-CB 4.4Å
344	P	91	Very high	92.3	Very high	34 Å²	34	61 Å²	61	22%	0.221	29%	0.294	C	S	.	.	S	Bend	cis	-55.3	165.2	-17.3	19.6	-30.4	0	0	0	113.5	L256 E346 E347 R348	L256-P344 HydrophobicContact CD1-CG 4.27Å; L256-P344 HydrophobicContact CD2-CG 4.35Å; P344-E346 VanDerWaalsContact C-N 3.27Å; P344-E346 PolarHBondContact O-N 2.99Å; P344-E347 WeakPolarHBondContact CB-OE2 3.31Å; P344-E347 HydrophobicContact CG-CB 4.39Å; P344-E347 WeakPolarHBondContact CG-OE2 3.49Å; P344-R348 VanDerWaalsContact O-CA 3.27Å; P344-R348 WeakPolarHBondContact O-CA 3.46Å; P344-R348 PolarHBondContact O-N 3.39Å
345	K	86.4	Confident	92.3	Very high	168 Å²	168	60.2 Å²	60.2	73%	0.73	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-29	-169.1	-76	-177.5	-179.5	175.2	0	112.4	R348	K345-R348 WeakPolarHBondContact O-CG 3.32Å
346	E	86.4	Confident	92.3	Very high	150 Å²	150	61.8 Å²	61.8	70%	0.701	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-50.8	-175	-59.5	70	-157.8	0	0	109.8	P344	P344-E346 VanDerWaalsContact C-N 3.27Å; P344-E346 PolarHBondContact O-N 2.99Å
347	E	87.6	Confident	92.2	Very high	82 Å²	82	62.4 Å²	62.4	38%	0.383	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-22.6	-177.8	-60.4	80.2	-177.8	0	0	113.8	W259 H260 P344 L349	W259-E347 HydrophobicContact CH2-CB 4.41Å; W259-E347 HydrophobicContact CH2-CG 4.16Å; W259-E347 HydrophobicContact CZ3-CB 4.48Å; W259-E347 HydrophobicContact CZ3-CG 3.95Å; H260-E347 IonicContact CE1-OE1 2.62Å; P344-E347 WeakPolarHBondContact CB-OE2 3.31Å; P344-E347 HydrophobicContact CG-CB 4.39Å; P344-E347 WeakPolarHBondContact CG-OE2 3.49Å; E347-L349 VanDerWaalsContact C-N 3.29Å; E347-L349 HydrophobicContact CB-CB 4.48Å; E347-L349 PolarHBondContact O-N 3.02Å
348	R	89.8	Confident	92.2	Very high	181 Å²	181	62.5 Å²	62.5	68%	0.683	30%	0.301	S	S	*	.			trans	49.2	45.7	-178.2	-62.5	-175	179.7	-174	-0.3	113.5	Y342 P344 K345	Y342-R348 WeakPolarHBondContact CB-O 3.15Å; P344-R348 VanDerWaalsContact O-CA 3.27Å; P344-R348 WeakPolarHBondContact O-CA 3.46Å; P344-R348 PolarHBondContact O-N 3.39Å; K345-R348 WeakPolarHBondContact O-CG 3.32Å
349	L	91.4	Very high	92.1	Very high	24 Å²	24	59.1 Å²	59.1	13%	0.126	29%	0.293	C	S	.	.			trans	-84.6	-48.5	-169.1	-174.1	62.2	0	0	0	113.7	L256 W259 V343 E347	L256-L349 HydrophobicContact CD1-CD2 4.14Å; W259-L349 HydrophobicContact CB-CD2 3.92Å; W259-L349 HydrophobicContact CD2-CD1 4.35Å; W259-L349 HydrophobicContact CD2-CD2 3.58Å; W259-L349 HydrophobicContact CE3-CD2 4.13Å; W259-L349 HydrophobicContact CG-CD1 4.36Å; W259-L349 HydrophobicContact CG-CD2 3.44Å; W259-L349 VanDerWaalsContact CG-CD2 3.44Å; W259-L349 HydrophobicContact CZ2-CD1 4.34Å; V343-L349 PolarHBondContact O-N 3.21Å; E347-L349 VanDerWaalsContact C-N 3.29Å; E347-L349 HydrophobicContact CB-CB 4.48Å; E347-L349 PolarHBondContact O-N 3.02Å
350	F	95.4	Very high	92	Very high	7 Å²	7	64 Å²	64	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	137.9	-170.7	-57.1	-50.5	0	0	0	112.3	A255 L256 P307 E309 Y342 V343 A352	A255-F350 HydrophobicContact CB-CE2 4.5Å; A255-F350 HydrophobicContact CB-CZ 3.92Å; L256-F350 HydrophobicContact CB-CE2 4.16Å; L256-F350 HydrophobicContact CD1-CE2 4.25Å; P307-F350 HydrophobicContact CB-CB 3.88Å; P307-F350 HydrophobicContact CB-CD1 3.83Å; P307-F350 HydrophobicContact CB-CD2 4.15Å; P307-F350 HydrophobicContact CB-CE1 4.41Å; P307-F350 HydrophobicContact CB-CG 3.68Å; P307-F350 HydrophobicContact CG-CD1 3.76Å; P307-F350 HydrophobicContact CG-CD2 3.97Å; P307-F350 HydrophobicContact CG-CE1 3.83Å; P307-F350 HydrophobicContact CG-CE2 4.02Å; P307-F350 HydrophobicContact CG-CG 3.84Å; P307-F350 HydrophobicContact CG-CZ 3.96Å; E309-F350 HydrophobicContact CG-CD1 4.08Å; E309-F350 HydrophobicContact CG-CE1 4.05Å; Y342-F350 CarbonylContact C-O 3.54Å; Y342-F350 WeakPolarHBondContact CA-O 3.35Å; V343-F350 HydrophobicContact CG2-CB 4.29Å; V343-F350 WeakPolarHBondContact CG2-O 3.35Å; V343-F350 PolarHBondContact N-O 3.31Å; V343-F350 WeakPolarHBondContact O-CB 3.34Å; V343-F350 PolarHBondContact O-N 3.32Å; F350-A352 PolarHBondContact O-N 3.46Å
351	S	95.3	Very high	91.8	Very high	2 Å²	2	66.7 Å²	66.7	1%	0.014	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	121.2	173.6	175.3	0	0	0	0	110.7	L308 L341 Q353 G354	L308-S351 PolarHBondContact O-N 3.43Å; L341-S351 WeakPolarHBondContact O-CA 3.24Å; S351-Q353 PolarHBondContact O-N 2.88Å; S351-Q353 VanDerWaalsContact O-N 3.16Å; S351-G354 PolarHBondContact O-N 2.89Å; S351-G354 VanDerWaalsContact O-N 3.16Å; S351-G354 WeakPolarHBondContact OG-CA 3.31Å; S351-G354 PolarHBondContact OG-N 3.41Å; S351-G354 PolarHBondContact OG-O 3.34Å
352	A	92.3	Very high	91.7	Very high	22 Å²	22	61.3 Å²	61.3	18%	0.182	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.8	-178.8	0	0	0	0	0	113.7	W140 L341 V343 F350	W140-A352 HydrophobicContact CH2-CB 4.47Å; L341-A352 HydrophobicContact CB-CB 4.37Å; L341-A352 PolarHBondContact O-N 2.98Å; V343-A352 HydrophobicContact CG1-CB 4.09Å; V343-A352 HydrophobicContact CG2-CB 4.4Å; F350-A352 PolarHBondContact O-N 3.46Å
353	Q	91.4	Very high	91.5	Very high	83 Å²	83	63.7 Å²	63.7	39%	0.388	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	10.1	179.2	-62.4	-176.3	-6.6	0	0	112.5	S141 S351 C355 K356	S141-Q353 CarbonylContact O-C 3.51Å; S351-Q353 PolarHBondContact O-N 2.88Å; S351-Q353 VanDerWaalsContact O-N 3.16Å; Q353-C355 PolarHBondContact O-N 3.46Å; Q353-K356 WeakPolarHBondContact O-CB 3.42Å; Q353-K356 PolarHBondContact O-N 3.46Å; Q353-K356 VanDerWaalsContact O-N 3.13Å
354	G	93.8	Very high	91.3	Very high	2 Å²	2	69.8 Å²	69.8	2%	0.021	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	-128.1	-171	0	0	0	0	0	111.5	G142 M340 S351	G142-G354 WeakPolarHBondContact O-CA 3.4Å; M340-G354 VanDerWaalsContact CE-O 3.27Å; M340-G354 WeakPolarHBondContact CE-O 3.41Å; S351-G354 PolarHBondContact O-N 2.89Å; S351-G354 VanDerWaalsContact O-N 3.16Å; S351-G354 WeakPolarHBondContact OG-CA 3.31Å; S351-G354 PolarHBondContact OG-N 3.41Å; S351-G354 PolarHBondContact OG-O 3.34Å
355	C	95.4	Very high	91.1	Very high	23 Å²	23	71 Å²	71	16%	0.155	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	6.1	178.2	-66.1	0	0	0	0	114.3	G142 L308 C316 Q353 S357 I358	G142-C355 PolarHBondContact O-N 3.08Å; L308-C355 HydrophobicContact CD1-CB 4.21Å; L308-C355 WeakPolarHBondContact CD1-SG 3.44Å; C316-C355 HydrophobicContact CB-CB 3.62Å; C316-C355 WeakPolarHBondContact CB-SG 3.45Å; C316-C355 WeakPolarHBondContact SG-CB 3.24Å; C316-C355 CovalentContact SG-SG 2.04Å; C316-C355 PolarHBondContact SG-SG 3.41Å; Q353-C355 PolarHBondContact O-N 3.46Å; C355-S357 PolarHBondContact O-N 2.97Å; C355-I358 HydrophobicContact CB-CD1 3.69Å; C355-I358 HydrophobicContact CB-CG1 4.45Å; C355-I358 PolarHBondContact O-N 3.44Å
356	K	93.6	Very high	90.8	Very high	143 Å²	143	66 Å²	66	62%	0.622	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-41.4	-169.4	-171.6	175.4	-176.8	174.3	0	113.8	Q353	Q353-K356 WeakPolarHBondContact O-CB 3.42Å; Q353-K356 PolarHBondContact O-N 3.46Å; Q353-K356 VanDerWaalsContact O-N 3.13Å
357	S	92.6	Very high	89.7	Confident	13 Å²	13	68.1 Å²	68.1	9%	0.091	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-6.8	-176.4	61.8	0	0	0	0	114.3	M340 C355 Q360 R361	M340-S357 WeakPolarHBondContact CE-OG 3.35Å; M340-S357 PolarHBondContact SD-OG 2.9Å; M340-S357 VanDerWaalsContact SD-OG 3.4Å; C355-S357 PolarHBondContact O-N 2.97Å; S357-Q360 PolarHBondContact O-N 3.11Å; S357-R361 WeakPolarHBondContact O-CG 3.42Å; S357-R361 PolarHBondContact O-N 3.4Å; S357-R361 WeakPolarHBondContact OG-CD 2.98Å; S357-R361 PolarHBondContact OG-NE 2.65Å; S357-R361 VanDerWaalsContact OG-NE 3.08Å
358	I	93.5	Very high	89.9	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-60.1	-48.5	-171.5	-66.1	176.5	0	0	0	112.2	V313 C316 A317 A320 M340 C355 Q360 R361 I362	V313-I358 HydrophobicContact CB-CD1 4.46Å; V313-I358 HydrophobicContact CG1-CD1 3.82Å; C316-I358 HydrophobicContact CB-CD1 3.47Å; C316-I358 VanDerWaalsContact CB-CD1 3.47Å; A317-I358 HydrophobicContact CB-CG2 3.97Å; A320-I358 HydrophobicContact CB-CG2 4.07Å; M340-I358 HydrophobicContact CE-CG1 4.43Å; M340-I358 HydrophobicContact SD-CG1 4.4Å; C355-I358 HydrophobicContact CB-CD1 3.69Å; C355-I358 HydrophobicContact CB-CG1 4.45Å; C355-I358 PolarHBondContact O-N 3.44Å; I358-Q360 PolarHBondContact O-N 3.15Å; I358-R361 PolarHBondContact O-N 2.74Å; I358-I362 HydrophobicContact CG2-CG2 4.08Å; I358-I362 WeakPolarHBondContact O-CG2 3.45Å; I358-I362 PolarHBondContact O-N 3.42Å
359	P	91.5	Very high	89.9	Confident	69 Å²	69	61.4 Å²	61.4	45%	0.448	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-25.8	-178.3	-25.9	35.9	0	0	0	114.6	R324 I362	R324-P359 PolarHBondContact NH2-O 3.47Å; P359-I362 WeakPolarHBondContact O-CG1 3.44Å
360	Q	90.6	Very high	89.8	Confident	141 Å²	141	63.5 Å²	63.5	66%	0.659	33%	0.328	S	S	*	.	H	α-helix	trans	-84.8	-36.2	174.8	-66.8	175.1	-16.2	0	0	111.5	S357 I358 N363	S357-Q360 PolarHBondContact O-N 3.11Å; I358-Q360 PolarHBondContact O-N 3.15Å; Q360-N363 WeakPolarHBondContact O-CB 3.26Å; Q360-N363 PolarHBondContact O-N 3.24Å; Q360-N363 PolarHBondContact O-ND2 3.2Å
361	R	89.3	Confident	89.4	Confident	66 Å²	66	66.8 Å²	66.8	25%	0.249	35%	0.346	C	S	.	.	H	α-helix	trans	-71.2	-35	-177.3	-77.5	176.6	177.3	-96	5.8	113.7	A339 M340 S357 I358 N363 F364 F365	A339-R361 PolarHBondContact O-NH1 3.08Å; M340-R361 WeakPolarHBondContact SD-CD 3.44Å; M340-R361 PolarHBondContact SD-NE 2.96Å; S357-R361 WeakPolarHBondContact O-CG 3.42Å; S357-R361 PolarHBondContact O-N 3.4Å; S357-R361 WeakPolarHBondContact OG-CD 2.98Å; S357-R361 PolarHBondContact OG-NE 2.65Å; S357-R361 VanDerWaalsContact OG-NE 3.08Å; I358-R361 PolarHBondContact O-N 2.74Å; R361-N363 PolarHBondContact O-N 2.92Å; R361-F364 WeakPolarHBondContact O-CD2 3.44Å; R361-F364 PolarHBondContact O-N 3.04Å; R361-F365 WeakPolarHBondContact O-CD2 3.4Å
362	I	91.5	Very high	89.1	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-57.9	-22.6	178.2	64.8	176.7	0	0	0	112.4	A320 Y321 V336 I358 P359 F364 F365 L366	A320-I362 HydrophobicContact CB-CD1 3.8Å; A320-I362 HydrophobicContact CB-CG2 4.49Å; Y321-I362 HydrophobicContact CD2-CG2 4.11Å; Y321-I362 HydrophobicContact CE1-CB 4.28Å; Y321-I362 HydrophobicContact CE2-CB 4Å; Y321-I362 HydrophobicContact CE2-CG2 3.62Å; V336-I362 HydrophobicContact CG1-CG2 4.23Å; V336-I362 HydrophobicContact CG2-CG2 4.35Å; I358-I362 HydrophobicContact CG2-CG2 4.08Å; I358-I362 WeakPolarHBondContact O-CG2 3.45Å; I358-I362 PolarHBondContact O-N 3.42Å; P359-I362 WeakPolarHBondContact O-CG1 3.44Å; I362-F364 PolarHBondContact O-N 3.07Å; I362-F365 CarbonylContact O-C 3.45Å; I362-F365 PolarHBondContact O-N 3.34Å; I362-F365 VanDerWaalsContact O-N 3.15Å; I362-L366 PolarHBondContact O-N 3.14Å
363	N	89.8	Confident	88.9	Confident	82 Å²	82	74.1 Å²	74.1	44%	0.439	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-59.2	-30.3	173.8	-67.4	-29.1	0	0	0	113.8	R324 Q360 R361 F365	R324-N363 PolarHBondContact NH1-OD1 2.84Å; R324-N363 PolarHBondContact NH2-OD1 3.09Å; Q360-N363 WeakPolarHBondContact O-CB 3.26Å; Q360-N363 PolarHBondContact O-N 3.24Å; Q360-N363 PolarHBondContact O-ND2 3.2Å; R361-N363 PolarHBondContact O-N 2.92Å; N363-F365 PolarHBondContact O-N 3.08Å
364	F	88.6	Confident	88.7	Confident	170 Å²	170	73.5 Å²	73.5	75%	0.746	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-77.2	-15	-179.4	-64.3	-70.2	0	0	0	113	R361 I362	R361-F364 WeakPolarHBondContact O-CD2 3.44Å; R361-F364 PolarHBondContact O-N 3.04Å; I362-F364 PolarHBondContact O-N 3.07Å
365	F	86.1	Confident	88.3	Confident	60 Å²	60	79 Å²	79	26%	0.263	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-117.1	12.4	-176.9	-55.8	-88.7	0	0	0	111.4	T332 E335 V336 A339 R361 I362 N363	T332-F365 HydrophobicContact CG2-CB 4.32Å; E335-F365 HydrophobicContact CB-CD1 4.06Å; E335-F365 HydrophobicContact CB-CE1 3.92Å; V336-F365 HydrophobicContact CG2-CB 4.17Å; V336-F365 HydrophobicContact CG2-CD2 3.6Å; V336-F365 HydrophobicContact CG2-CE2 4.12Å; V336-F365 HydrophobicContact CG2-CG 3.9Å; A339-F365 HydrophobicContact CB-CE2 4.27Å; A339-F365 HydrophobicContact CB-CZ 3.87Å; R361-F365 WeakPolarHBondContact O-CD2 3.4Å; I362-F365 CarbonylContact O-C 3.45Å; I362-F365 PolarHBondContact O-N 3.34Å; I362-F365 VanDerWaalsContact O-N 3.15Å; N363-F365 PolarHBondContact O-N 3.08Å
366	L	81.4	Confident	87.7	Confident	64 Å²	64	83.7 Å²	83.7	34%	0.335	43%	0.427	S	S	.	.			trans	-73.4	141.6	167.9	-72.9	178.8	0	0	0	109.2	Y321 L326 I362	Y321-L366 HydrophobicContact CD1-CD2 4.47Å; Y321-L366 HydrophobicContact CE1-CD2 3.91Å; L326-L366 HydrophobicContact CD1-CD2 3.35Å; I362-L366 PolarHBondContact O-N 3.14Å
367	P	63.9	Low	87.2	Confident	193 Å²	193	78.3 Å²	78.3	100%	1.253	41%	0.409	S	S	*	.			trans	-64.8	0	177.2	26.8	-33.7	0	0	0	113.7

Retrieved 367 of 367 residues in 1736.7 ms (Link to these results)

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