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Septin-10

Filament-forming GTP-binding protein. Lacks GTPase activity, which is likely due to absence of an essential threonine residue important for hydrolytic activity in septins. May be involved in membrane remodeling, potentially by its nucleotide-dependent cellular membrane association/dissociation ability¹. Able to bind to phosphatidylinositol-4,5-bisphosphate (PIP2)-containing giant unilamellar vesicles (GUVs), which serve as a model of biological membranes. Self-assembles into ordered cage-like structures on the vesicle membrane. Also binds to 1,2-dioleoyl-sn-glycero-3-phospho-L-serine (DOPS)-containing vesicles suggesting the requirement for negatively charged membranes. Is also able to promote deformation of the GUVs².

AlphaFold DB , UniProt , Accession A0A3Q0KDV9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene SEPT10, Length 412 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	43.5	Very low	59	Low	211 Å²	211	120 Å²	120	100%	1.039	70%	0.695	S	S	*	*				0	119.5	0	-75.8	-171.2	-110.9	0	0	107.6
2	T	47.1	Very low	59.9	Low	102 Å²	102	123.2 Å²	123.2	63%	0.626	71%	0.708	S	S	*	*			trans	-59.7	145	174.7	41.1	0	0	0	0	109.9	D4 V5	T2-D4 PolarHBondContact O-N 3.08Å; T2-V5 PolarHBondContact O-N 3.28Å; T2-V5 VanDerWaalsContact O-N 3.13Å
3	A	58.1	Low	60.4	Low	78 Å²	78	119 Å²	119	65%	0.645	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-19	-173	0	0	0	0	0	114
4	D	58.7	Low	61.1	Low	131 Å²	131	125.6 Å²	125.6	70%	0.701	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-20	-178.2	-60.4	-46.1	0	0	0	114.2	T2	T2-D4 PolarHBondContact O-N 3.08Å
5	V	60.7	Low	61.4	Low	81 Å²	81	125.1 Å²	125.1	49%	0.491	70%	0.695	S	S	.	*	G	3₁₀ helix	trans	-79	-22.6	178.9	-176.2	0	0	0	0	112.1	T2 K7	T2-V5 PolarHBondContact O-N 3.28Å; T2-V5 VanDerWaalsContact O-N 3.13Å; V5-K7 PolarHBondContact O-N 3.46Å
6	L	57.3	Low	61.7	Low	111 Å²	111	125.1 Å²	125.1	58%	0.581	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-78.3	-15.2	-177.5	-77	162.5	0	0	0	114	L9	L6-L9 HydrophobicContact CD2-CD1 4.38Å
7	K	60.1	Low	62.4	Low	189 Å²	189	129.5 Å²	129.5	82%	0.822	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-84.4	-5.8	-177.7	-82.2	-178	177	174.4	0	115	V5	V5-K7 PolarHBondContact O-N 3.46Å
8	A	63.8	Low	62.8	Low	89 Å²	89	130.1 Å²	130.1	74%	0.736	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-109.3	5.9	-175.4	0	0	0	0	0	114.5
9	L	60.6	Low	63.3	Low	97 Å²	97	130.5 Å²	130.5	51%	0.508	72%	0.718	S	S	.	*	S	Bend	trans	-88.5	133.2	-177.4	-75.2	154.8	0	0	0	110.9	L6 V13	L6-L9 HydrophobicContact CD2-CD1 4.38Å; L9-V13 HydrophobicContact CB-CG2 4.12Å; L9-V13 HydrophobicContact CD2-CG1 4.47Å; L9-V13 HydrophobicContact CD2-CG2 4.02Å
10	P	73.6	Confident	63.9	Low	86 Å²	86	126.2 Å²	126.2	56%	0.558	71%	0.706	S	S	*	*			trans	-59.7	154.6	178.5	20.6	-29	0	0	0	112	D12 V13	P10-D12 PolarHBondContact O-N 3.43Å; P10-V13 HydrophobicContact CG-CG2 4.04Å; P10-V13 WeakPolarHBondContact O-CG2 3.49Å; P10-V13 PolarHBondContact O-N 3.04Å
11	P	66.1	Low	64.6	Low	145 Å²	145	127 Å²	127	94%	0.942	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	1.8	-169.7	24.8	-33.7	0	0	0	115.8
12	D	69.4	Low	66	Low	158 Å²	158	121.8 Å²	121.8	85%	0.845	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	17.1	-177.9	-147.3	9.2	0	0	0	113.5	P10 R14	P10-D12 PolarHBondContact O-N 3.43Å; D12-R14 PolarHBondContact O-N 2.95Å
13	V	66.2	Low	67.5	Low	69 Å²	69	118.1 Å²	118.1	42%	0.418	67%	0.666	S	S	.	*			trans	-80.6	107.7	177.5	179.1	0	0	0	0	110	L9 P10 T15	L9-V13 HydrophobicContact CB-CG2 4.12Å; L9-V13 HydrophobicContact CD2-CG1 4.47Å; L9-V13 HydrophobicContact CD2-CG2 4.02Å; P10-V13 HydrophobicContact CG-CG2 4.04Å; P10-V13 WeakPolarHBondContact O-CG2 3.49Å; P10-V13 PolarHBondContact O-N 3.04Å; V13-T15 PolarHBondContact O-N 3.49Å; V13-T15 PolarHBondContact O-OG1 3.23Å
14	R	69.7	Low	68.7	Low	212 Å²	212	123.1 Å²	123.1	80%	0.8	67%	0.673	S	S	*	*			trans	-57.5	97.1	171.9	-172.3	178.2	-176.3	178.7	0.2	110.1	D12 L16	D12-R14 PolarHBondContact O-N 2.95Å; R14-L16 HydrophobicContact CG-CD2 4.24Å; R14-L16 HydrophobicContact CG-CG 4.39Å; R14-L16 PolarHBondContact O-N 3.19Å; R14-L16 VanDerWaalsContact O-N 3.14Å
15	T	66.4	Low	69.9	Low	117 Å²	117	121.9 Å²	121.9	72%	0.718	67%	0.667	S	S	*	*			trans	-80.7	95.1	176.4	-50.3	0	0	0	0	108.4	V13 K17	V13-T15 PolarHBondContact O-N 3.49Å; V13-T15 PolarHBondContact O-OG1 3.23Å; T15-K17 PolarHBondContact O-N 3.47Å
16	L	66.7	Low	71	Confident	126 Å²	126	118.7 Å²	118.7	66%	0.66	65%	0.648	S	S	*	*			trans	-72.6	115.1	172.1	-67.4	173.6	0	0	0	108.6	R14 L18	R14-L16 HydrophobicContact CG-CD2 4.24Å; R14-L16 HydrophobicContact CG-CG 4.39Å; R14-L16 PolarHBondContact O-N 3.19Å; R14-L16 VanDerWaalsContact O-N 3.14Å; L16-L18 PolarHBondContact O-N 2.8Å
17	K	72.3	Confident	72.3	Confident	200 Å²	200	117.3 Å²	117.3	87%	0.87	64%	0.641	S	S	*	*			trans	-67.2	125	167.1	-73.5	-174.8	178	-179.1	0	108.1	T15 S19	T15-K17 PolarHBondContact O-N 3.47Å; K17-S19 PolarHBondContact O-N 3.14Å
18	L	69.7	Low	73.6	Confident	139 Å²	139	112 Å²	112	73%	0.728	63%	0.625	S	S	*	*			trans	-58.6	124.9	172.3	-60.4	171.6	0	0	0	108.3	L16 G20 V22	L16-L18 PolarHBondContact O-N 2.8Å; L18-G20 PolarHBondContact O-N 3.48Å; L18-V22 HydrophobicContact CD2-CG2 4.05Å
19	S	73.6	Confident	74.6	Confident	138 Å²	138	112.5 Å²	112.5	97%	0.965	62%	0.616	S	S	*	*	S	Bend	trans	-78.5	1.9	-178.9	55.6	0	0	0	0	113.5	K17	K17-S19 PolarHBondContact O-N 3.14Å
20	G	74.6	Confident	75.7	Confident	45 Å²	45	112.8 Å²	112.8	46%	0.464	61%	0.614	S	S	.	*	S	Bend	trans	175.1	-173.3	-176.6	0	0	0	0	0	112.3	L18	L18-G20 PolarHBondContact O-N 3.48Å
21	H	79.5	Confident	76.2	Confident	142 Å²	142	114.3 Å²	114.3	66%	0.657	62%	0.617	S	S	*	*			trans	-61.6	137.2	172.7	-171.7	74.2	0	0	0	110.3	D25	H21-D25 IonicContact CD2-OD1 3.52Å; H21-D25 IonicContact CD2-OD2 3.44Å; H21-D25 PolarHBondContact CD2-OD2 3.09Å; H21-D25 IonicContact NE2-OD1 3.47Å; H21-D25 PolarHBondContact NE2-OD1 3.47Å; H21-D25 IonicContact NE2-OD2 3.25Å; H21-D25 PolarHBondContact NE2-OD2 2.8Å
22	V	71.3	Confident	77.1	Confident	103 Å²	103	111.2 Å²	111.2	62%	0.624	60%	0.596	S	S	*	*			trans	-125.2	111.4	176	179.8	0	0	0	0	107.6	L18	L18-V22 HydrophobicContact CD2-CG2 4.05Å
23	G	78.3	Confident	77.7	Confident	24 Å²	24	108.5 Å²	108.5	25%	0.247	58%	0.581	C	S	.	*	S	Bend	trans	-161.6	164.6	177.9	0	0	0	0	0	110.7	D25 S26	G23-D25 WeakPolarHBondContact CA-OD1 3Å; G23-D25 PolarHBondContact O-N 3.04Å; G23-S26 PolarHBondContact O-N 3.43Å; G23-S26 PolarHBondContact O-OG 3.37Å
24	F	83.5	Confident	78.6	Confident	183 Å²	183	111 Å²	111	80%	0.803	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-62.2	-24.2	175.8	-67	-75.2	0	0	0	112.4	S26 L27	F24-S26 PolarHBondContact O-N 2.86Å; F24-L27 HydrophobicContact CB-CD1 4.45Å; F24-L27 HydrophobicContact CD1-CD1 3.99Å; F24-L27 WeakPolarHBondContact O-CB 3.46Å; F24-L27 WeakPolarHBondContact O-CG 3.49Å; F24-L27 PolarHBondContact O-N 2.92Å; F24-L27 VanDerWaalsContact O-N 3.16Å
25	D	85.5	Confident	79.2	Confident	105 Å²	105	102.4 Å²	102.4	56%	0.561	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-60	-26.8	171.8	63.3	-24.7	0	0	0	113.3	H21 G23 P28	H21-D25 IonicContact CD2-OD1 3.52Å; H21-D25 IonicContact CD2-OD2 3.44Å; H21-D25 PolarHBondContact CD2-OD2 3.09Å; H21-D25 IonicContact NE2-OD1 3.47Å; H21-D25 PolarHBondContact NE2-OD1 3.47Å; H21-D25 IonicContact NE2-OD2 3.25Å; H21-D25 PolarHBondContact NE2-OD2 2.8Å; G23-D25 WeakPolarHBondContact CA-OD1 3Å; G23-D25 PolarHBondContact O-N 3.04Å; D25-P28 WeakPolarHBondContact O-CD 3.47Å
26	S	83.3	Confident	80	Confident	14 Å²	14	99.3 Å²	99.3	10%	0.098	54%	0.539	C	S	.	.	G	3₁₀ helix	trans	-83.4	-5.9	176.3	71.4	0	0	0	0	114.4	G23 F24 D29 Q30	G23-S26 PolarHBondContact O-N 3.43Å; G23-S26 PolarHBondContact O-OG 3.37Å; F24-S26 PolarHBondContact O-N 2.86Å; S26-D29 PolarHBondContact O-N 3.37Å; S26-Q30 VanDerWaalsContact O-CG 3.28Å; S26-Q30 WeakPolarHBondContact O-CG 3.42Å; S26-Q30 PolarHBondContact O-N 3.47Å; S26-Q30 PolarHBondContact OG-NE2 3.3Å
27	L	84.2	Confident	80.7	Confident	83 Å²	83	97.5 Å²	97.5	44%	0.435	54%	0.537	S	S	.	.	H	α-helix	trans	-59.4	-44.3	-179.4	-74.6	174.2	0	0	0	113.3	F24 D29 Q30 L31	F24-L27 HydrophobicContact CB-CD1 4.45Å; F24-L27 HydrophobicContact CD1-CD1 3.99Å; F24-L27 WeakPolarHBondContact O-CB 3.46Å; F24-L27 WeakPolarHBondContact O-CG 3.49Å; F24-L27 PolarHBondContact O-N 2.92Å; F24-L27 VanDerWaalsContact O-N 3.16Å; L27-D29 VanDerWaalsContact C-N 3.33Å; L27-D29 PolarHBondContact O-N 3.36Å; L27-Q30 PolarHBondContact O-N 2.88Å; L27-L31 WeakPolarHBondContact O-CG 3.28Å; L27-L31 PolarHBondContact O-N 3.31Å
28	P	86.6	Confident	81.1	Confident	76 Å²	76	93.8 Å²	93.8	49%	0.494	52%	0.523	S	S	.	.	H	α-helix	trans	-57.5	-46.7	173.5	-23.8	35.5	0	0	0	111.6	D25 Q30 L31 V32	D25-P28 WeakPolarHBondContact O-CD 3.47Å; P28-Q30 VanDerWaalsContact C-N 3.32Å; P28-Q30 PolarHBondContact O-N 2.81Å; P28-L31 PolarHBondContact O-N 3.4Å; P28-V32 VanDerWaalsContact O-CG2 3.3Å; P28-V32 WeakPolarHBondContact O-CG2 3.43Å; P28-V32 PolarHBondContact O-N 2.85Å
29	D	84.9	Confident	81.9	Confident	101 Å²	101	88 Å²	88	54%	0.54	50%	0.498	S	S	.	.	H	α-helix	trans	-61.8	-39.9	178.5	-64.6	-27.8	0	0	0	111.8	S26 L27 V32 N33	S26-D29 PolarHBondContact O-N 3.37Å; L27-D29 VanDerWaalsContact C-N 3.33Å; L27-D29 PolarHBondContact O-N 3.36Å; D29-V32 PolarHBondContact O-N 2.86Å; D29-N33 WeakPolarHBondContact O-CB 3.4Å; D29-N33 PolarHBondContact O-N 2.81Å; D29-N33 PolarHBondContact O-ND2 2.98Å
30	Q	83.7	Confident	82.6	Confident	102 Å²	102	84.6 Å²	84.6	48%	0.477	47%	0.465	S	S	.	.	H	α-helix	trans	-65.1	-41.9	176.4	-71.7	174.7	31.8	0	0	111.9	S26 L27 P28 K34	S26-Q30 VanDerWaalsContact O-CG 3.28Å; S26-Q30 WeakPolarHBondContact O-CG 3.42Å; S26-Q30 PolarHBondContact O-N 3.47Å; S26-Q30 PolarHBondContact OG-NE2 3.3Å; L27-Q30 PolarHBondContact O-N 2.88Å; P28-Q30 VanDerWaalsContact C-N 3.32Å; P28-Q30 PolarHBondContact O-N 2.81Å; Q30-K34 WeakPolarHBondContact O-CB 3.43Å; Q30-K34 PolarHBondContact O-N 3.41Å
31	L	84.8	Confident	83.4	Confident	118 Å²	118	83.7 Å²	83.7	62%	0.618	45%	0.451	S	S	*	.	H	α-helix	trans	-64.1	-45.9	176.5	-72.5	172.1	0	0	0	111.1	L27 P28 K34 A35	L27-L31 WeakPolarHBondContact O-CG 3.28Å; L27-L31 PolarHBondContact O-N 3.31Å; P28-L31 PolarHBondContact O-N 3.4Å; L31-K34 PolarHBondContact O-N 3.43Å; L31-A35 WeakPolarHBondContact O-CB 3.31Å; L31-A35 PolarHBondContact O-N 2.8Å
32	V	84.4	Confident	84.2	Confident	81 Å²	81	77 Å²	77	49%	0.491	42%	0.419	S	S	.	.	H	α-helix	trans	-62.1	-49.5	176.6	172	0	0	0	0	110.7	P28 D29 K34 A35 I36	P28-V32 VanDerWaalsContact O-CG2 3.3Å; P28-V32 WeakPolarHBondContact O-CG2 3.43Å; P28-V32 PolarHBondContact O-N 2.85Å; D29-V32 PolarHBondContact O-N 2.86Å; V32-K34 VanDerWaalsContact C-N 3.29Å; V32-K34 PolarHBondContact O-N 2.86Å; V32-A35 PolarHBondContact O-N 3.36Å; V32-I36 HydrophobicContact CG1-CD1 3.64Å; V32-I36 HydrophobicContact CG1-CG1 4.3Å; V32-I36 WeakPolarHBondContact O-CB 3.44Å; V32-I36 VanDerWaalsContact O-CG1 3.25Å; V32-I36 WeakPolarHBondContact O-CG1 3.23Å; V32-I36 PolarHBondContact O-N 3.44Å
33	N	83.3	Confident	85.4	Confident	101 Å²	101	72.1 Å²	72.1	54%	0.54	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-39	178.3	-76	-42.3	0	0	0	112.1	D29 S37	D29-N33 WeakPolarHBondContact O-CB 3.4Å; D29-N33 PolarHBondContact O-N 2.81Å; D29-N33 PolarHBondContact O-ND2 2.98Å; N33-S37 VanDerWaalsContact O-CB 3.31Å; N33-S37 WeakPolarHBondContact O-CB 3.4Å; N33-S37 PolarHBondContact O-N 3.24Å; N33-S37 PolarHBondContact O-OG 3.43Å
34	K	84.1	Confident	86.2	Confident	121 Å²	121	71 Å²	71	53%	0.526	38%	0.378	S	S	.	.	H	α-helix	trans	-64.3	-47.4	175	-175	178.5	178.3	-175.9	0	110.9	Q30 L31 V32 S37 Q38	Q30-K34 WeakPolarHBondContact O-CB 3.43Å; Q30-K34 PolarHBondContact O-N 3.41Å; L31-K34 PolarHBondContact O-N 3.43Å; V32-K34 VanDerWaalsContact C-N 3.29Å; V32-K34 PolarHBondContact O-N 2.86Å; K34-S37 PolarHBondContact O-N 2.78Å; K34-S37 PolarHBondContact O-OG 3.49Å; K34-Q38 WeakPolarHBondContact O-CG 3.33Å; K34-Q38 PolarHBondContact O-N 2.82Å
35	A	82.4	Confident	86.9	Confident	32 Å²	32	62.2 Å²	62.2	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-45.6	177	0	0	0	0	0	111.9	L31 V32 S37 Q38 G39 F40	L31-A35 WeakPolarHBondContact O-CB 3.31Å; L31-A35 PolarHBondContact O-N 2.8Å; V32-A35 PolarHBondContact O-N 3.36Å; A35-S37 VanDerWaalsContact C-N 3.31Å; A35-S37 PolarHBondContact O-N 2.87Å; A35-Q38 PolarHBondContact O-N 3.4Å; A35-G39 PolarHBondContact O-N 3.31Å; A35-F40 HydrophobicContact CB-CZ 4.09Å
36	I	84.1	Confident	87.4	Confident	52 Å²	52	57.2 Å²	57.2	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-59.7	-42.7	175.3	-67.1	169.4	0	0	0	110.9	V32 Q38 G39 N91 V92	V32-I36 HydrophobicContact CG1-CD1 3.64Å; V32-I36 HydrophobicContact CG1-CG1 4.3Å; V32-I36 WeakPolarHBondContact O-CB 3.44Å; V32-I36 VanDerWaalsContact O-CG1 3.25Å; V32-I36 WeakPolarHBondContact O-CG1 3.23Å; V32-I36 PolarHBondContact O-N 3.44Å; I36-Q38 VanDerWaalsContact C-N 3.34Å; I36-Q38 PolarHBondContact O-N 2.82Å; I36-G39 PolarHBondContact O-N 2.84Å; I36-N91 HydrophobicContact CG2-CB 4.4Å; I36-N91 VanDerWaalsContact CG2-O 3.32Å; I36-N91 WeakPolarHBondContact CG2-O 3.36Å; I36-V92 HydrophobicContact CG1-CG2 4.46Å
37	S	80.2	Confident	88	Confident	88 Å²	88	56.6 Å²	56.6	62%	0.615	31%	0.309	S	S	*	.	H	α-helix	trans	-66.4	-35.2	-179.7	75.7	0	0	0	0	113.2	N33 K34 A35	N33-S37 VanDerWaalsContact O-CB 3.31Å; N33-S37 WeakPolarHBondContact O-CB 3.4Å; N33-S37 PolarHBondContact O-N 3.24Å; N33-S37 PolarHBondContact O-OG 3.43Å; K34-S37 PolarHBondContact O-N 2.78Å; K34-S37 PolarHBondContact O-OG 3.49Å; A35-S37 VanDerWaalsContact C-N 3.31Å; A35-S37 PolarHBondContact O-N 2.87Å
38	Q	81.3	Confident	88.5	Confident	121 Å²	121	52.7 Å²	52.7	57%	0.565	29%	0.288	S	S	*	.	H	α-helix	trans	-77.9	-33	177.7	-71.2	-178.6	-20.2	0	0	111.7	K34 A35 I36	K34-Q38 WeakPolarHBondContact O-CG 3.33Å; K34-Q38 PolarHBondContact O-N 2.82Å; A35-Q38 PolarHBondContact O-N 3.4Å; I36-Q38 VanDerWaalsContact C-N 3.34Å; I36-Q38 PolarHBondContact O-N 2.82Å
39	G	85.6	Confident	88.8	Confident	19 Å²	19	51 Å²	51	20%	0.196	27%	0.274	C	S	.	.			trans	77	178.1	-171.4	0	0	0	0	0	112.3	A35 I36 K93	A35-G39 PolarHBondContact O-N 3.31Å; I36-G39 PolarHBondContact O-N 2.84Å; G39-K93 CarbonylContact C-O 3.6Å; G39-K93 WeakPolarHBondContact CA-O 3.46Å
40	F	88.5	Confident	89.2	Confident	66 Å²	66	47.1 Å²	47.1	29%	0.289	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	153.2	-177.2	-60.3	-86.3	0	0	0	110.5	A35 V92 K93 L94 K95	A35-F40 HydrophobicContact CB-CZ 4.09Å; F40-V92 HydrophobicContact CD2-CG1 3.49Å; F40-V92 VanDerWaalsContact CD2-CG1 3.49Å; F40-V92 HydrophobicContact CE2-CG1 3.59Å; F40-K93 PolarHBondContact N-O 2.9Å; F40-L94 HydrophobicContact CB-CD1 3.87Å; F40-L94 CarbonylContact O-C 3.56Å; F40-L94 WeakPolarHBondContact O-CA 3.33Å; F40-K95 PolarHBondContact O-N 3.24Å
41	V	92.8	Very high	89.5	Confident	26 Å²	26	44.7 Å²	44.7	16%	0.158	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.4	174.8	-70.1	0	0	0	0	108.1	K95 D144 H148 R286	V41-K95 WeakPolarHBondContact CA-O 3.4Å; V41-K95 HydrophobicContact CG1-CB 4.27Å; V41-D144 HydrophobicContact CG2-CB 4.06Å; V41-H148 PolarHBondContact O-CE1 3.24Å; V41-R286 WeakPolarHBondContact O-CD 3.33Å; V41-R286 PolarHBondContact O-NE 3.29Å
42	F	94.7	Very high	89.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	126.6	175.5	-162.4	-121.9	0	0	0	110.6	I44 L94 K95 L96 T97 H148 V149 L278 M282 L285 R286	F42-I44 HydrophobicContact CD1-CD1 3.8Å; F42-I44 HydrophobicContact CD1-CG1 3.65Å; F42-I44 HydrophobicContact CE1-CD1 3.54Å; F42-I44 HydrophobicContact CE1-CG1 3.52Å; F42-I44 HydrophobicContact CZ-CG1 4.42Å; F42-L94 HydrophobicContact CB-CD1 3.8Å; F42-K95 PolarHBondContact N-O 3.03Å; F42-L96 HydrophobicContact CB-CD1 4.4Å; F42-L96 HydrophobicContact CD1-CD1 4.13Å; F42-L96 CarbonylContact O-C 3.51Å; F42-L96 VanDerWaalsContact O-CA 3.29Å; F42-L96 WeakPolarHBondContact O-CA 3.44Å; F42-T97 PolarHBondContact O-N 2.9Å; F42-H148 WeakPolarHBondContact CA-ND1 3.46Å; F42-H148 HydrophobicContact CD2-CB 3.99Å; F42-H148 AromaticContact CD2-ND1 3.61Å; F42-H148 HydrophobicContact CE2-CB 3.77Å; F42-V149 HydrophobicContact CE1-CG1 3.94Å; F42-V149 HydrophobicContact CE2-CG1 4.35Å; F42-V149 HydrophobicContact CZ-CB 4.48Å; F42-V149 HydrophobicContact CZ-CG1 3.57Å; F42-L278 HydrophobicContact CE1-CD2 4.34Å; F42-M282 HydrophobicContact CB-SD 4.23Å; F42-M282 HydrophobicContact CD2-CG 3.51Å; F42-M282 HydrophobicContact CD2-SD 4.23Å; F42-M282 HydrophobicContact CE2-CG 3.64Å; F42-M282 HydrophobicContact CG-CG 4Å; F42-M282 HydrophobicContact CG-SD 4.18Å; F42-M282 HydrophobicContact CZ-CG 4.19Å; F42-L285 HydrophobicContact CE2-CB 4.27Å; F42-L285 HydrophobicContact CE2-CD1 4.2Å; F42-L285 HydrophobicContact CZ-CD1 3.89Å; F42-R286 HydrophobicContact CD2-CG 4.34Å
43	N	96.4	Very high	90.3	Very high	1 Å²	1	37 Å²	37	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	113.4	-172.8	-56.1	-44.2	0	0	0	108.1	T97 D144 T145 R146 H148 V149	N43-T97 CarbonylContact C-O 3.59Å; N43-T97 VanDerWaalsContact CA-O 3.29Å; N43-T97 WeakPolarHBondContact CA-O 3.33Å; N43-T97 WeakPolarHBondContact OD1-CB 3.36Å; N43-T97 PolarHBondContact OD1-OG1 3.45Å; N43-T97 VanDerWaalsContact OD1-OG1 3.08Å; N43-D144 PolarHBondContact ND2-O 2.88Å; N43-T145 VanDerWaalsContact ND2-C 3.29Å; N43-T145 WeakPolarHBondContact ND2-CA 3.3Å; N43-R146 VanDerWaalsContact CB-O 3.24Å; N43-R146 WeakPolarHBondContact CB-O 3.3Å; N43-R146 PolarHBondContact ND2-O 2.87Å; N43-H148 PolarHBondContact N-ND1 2.86Å; N43-H148 PolarHBondContact ND2-CE1 3.35Å; N43-H148 PolarHBondContact O-N 3.19Å; N43-V149 PolarHBondContact O-N 3.08Å
44	I	96.2	Very high	90.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.9	-177.3	-55.7	-174.8	0	0	0	108.9	F42 L58 L61 F62 L96 T97 V99 V149 L151	F42-I44 HydrophobicContact CD1-CD1 3.8Å; F42-I44 HydrophobicContact CD1-CG1 3.65Å; F42-I44 HydrophobicContact CE1-CD1 3.54Å; F42-I44 HydrophobicContact CE1-CG1 3.52Å; F42-I44 HydrophobicContact CZ-CG1 4.42Å; I44-L58 HydrophobicContact CG2-CD2 4.25Å; I44-L61 HydrophobicContact CD1-CD2 4.41Å; I44-F62 HydrophobicContact CD1-CE2 3.71Å; I44-F62 HydrophobicContact CD1-CZ 3.58Å; I44-L96 HydrophobicContact CD1-CD1 4.09Å; I44-L96 HydrophobicContact CG1-CD1 4.17Å; I44-T97 PolarHBondContact N-O 2.86Å; I44-V99 PolarHBondContact O-N 2.96Å; I44-V149 HydrophobicContact CB-CG1 4.18Å; I44-V149 HydrophobicContact CD1-CG1 4.44Å; I44-V149 HydrophobicContact CG1-CG1 3.72Å; I44-V149 HydrophobicContact CG2-CG1 4.13Å; I44-L151 HydrophobicContact CG2-CD1 4.19Å; I44-L151 HydrophobicContact CG2-CG 4.19Å
45	L	97.2	Very high	91.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	131.9	170.6	172.6	67.4	0	0	0	109.9	V47 L80 V99 V117 I121 V147 V149 C150 L151	L45-V47 HydrophobicContact CD1-CG2 4.27Å; L45-V47 HydrophobicContact CD2-CG2 3.93Å; L45-V47 HydrophobicContact CG-CG2 3.84Å; L45-L80 HydrophobicContact CD1-CD2 3.86Å; L45-V99 CarbonylContact C-O 3.54Å; L45-V99 WeakPolarHBondContact CA-O 3.33Å; L45-V99 HydrophobicContact CD1-CB 3.91Å; L45-V99 HydrophobicContact CD1-CG1 3.77Å; L45-V117 HydrophobicContact CD1-CG1 4.4Å; L45-V117 HydrophobicContact CD2-CG1 3.57Å; L45-I121 HydrophobicContact CD2-CD1 3.95Å; L45-I121 HydrophobicContact CD2-CG1 4.3Å; L45-V147 HydrophobicContact CB-CG1 3.46Å; L45-V147 VanDerWaalsContact CB-CG1 3.46Å; L45-V147 HydrophobicContact CB-CG2 4.39Å; L45-V147 HydrophobicContact CD2-CG1 4.36Å; L45-V149 PolarHBondContact N-O 2.91Å; L45-C150 HydrophobicContact CB-CB 4.45Å; L45-C150 HydrophobicContact CD2-CB 4.26Å; L45-C150 CarbonylContact O-C 3.59Å; L45-C150 VanDerWaalsContact O-CA 3.3Å; L45-C150 WeakPolarHBondContact O-CA 3.4Å; L45-L151 PolarHBondContact O-N 3.42Å
46	C	96.6	Very high	91.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	113.5	173.7	-67.3	0	0	0	0	110.6	K54 L58 V99 E100 T101 F153	C46-K54 HydrophobicContact CB-CB 4.16Å; C46-K54 HydrophobicContact CB-CD 4.11Å; C46-K54 HydrophobicContact CB-CG 4.34Å; C46-L58 HydrophobicContact CB-CD1 4.27Å; C46-L58 WeakPolarHBondContact SG-CD1 3.19Å; C46-V99 PolarHBondContact N-O 3.43Å; C46-E100 HydrophobicContact CB-CG 4.42Å; C46-T101 PolarHBondContact O-N 2.89Å; C46-T101 VanDerWaalsContact O-N 3.1Å; C46-T101 PolarHBondContact O-OG1 3.39Å; C46-F153 HydrophobicContact CB-CE2 3.84Å
47	V	96.3	Very high	92.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.9	178.6	-176	0	0	0	0	109.3	L45 T101 Y104 I114 V117 L151 Y152 F153 L172	L45-V47 HydrophobicContact CD1-CG2 4.27Å; L45-V47 HydrophobicContact CD2-CG2 3.93Å; L45-V47 HydrophobicContact CG-CG2 3.84Å; V47-T101 WeakPolarHBondContact CA-OG1 3.29Å; V47-T101 HydrophobicContact CB-CG2 4.4Å; V47-T101 HydrophobicContact CG1-CG2 4.38Å; V47-T101 HydrophobicContact CG2-CG2 4.04Å; V47-Y104 HydrophobicContact CG1-CD1 4.37Å; V47-Y104 HydrophobicContact CG1-CD2 4.46Å; V47-Y104 HydrophobicContact CG1-CE1 4.05Å; V47-Y104 HydrophobicContact CG1-CE2 4.17Å; V47-I114 HydrophobicContact CG1-CD1 4.4Å; V47-V117 HydrophobicContact CG2-CG1 4.02Å; V47-L151 PolarHBondContact N-O 2.86Å; V47-Y152 HydrophobicContact CB-CD2 3.92Å; V47-Y152 HydrophobicContact CB-CE2 4.13Å; V47-Y152 HydrophobicContact CG1-CD2 3.91Å; V47-Y152 HydrophobicContact CG1-CE2 3.58Å; V47-F153 PolarHBondContact O-N 2.83Å; V47-L172 HydrophobicContact CG2-CD1 4.47Å
48	G	94.6	Very high	92.8	Very high	1 Å²	1	23 Å²	23	1%	0.01	14%	0.143	C	C	.	.			trans	164.6	171.9	175.1	0	0	0	0	0	112.6	K54 T101	G48-K54 PolarHBondContact O-NZ 2.85Å; G48-T101 PolarHBondContact N-OG1 2.92Å
49	E	93.1	Very high	93.2	Very high	42 Å²	42	18.7 Å²	18.7	20%	0.196	12%	0.123	C	C	.	.			trans	-59.3	156.2	-174.3	-65	-179.4	159.5	0	0	113.5	G51 I52 K54 Y104 K162	E49-G51 PolarHBondContact O-N 3.34Å; E49-I52 WeakPolarHBondContact O-CB 3.39Å; E49-I52 WeakPolarHBondContact O-CG2 3.46Å; E49-I52 PolarHBondContact O-N 2.84Å; E49-K54 PolarHBondContact O-NZ 3.49Å; E49-Y104 WeakPolarHBondContact CA-O 3.33Å; E49-K162 IonicContact OE1-NZ 3.88Å; E49-K162 PolarHBondContact OE1-NZ 2.59Å; E49-K162 IonicContact OE2-NZ 3.41Å; E49-K162 PolarHBondContact OE2-NZ 3.33Å
50	T	92.2	Very high	93.5	Very high	18 Å²	18	18 Å²	18	11%	0.11	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	134.7	174.7	-62.7	0	0	0	0	110	I52 S71 G103 D106	T50-I52 VanDerWaalsContact C-N 3.29Å; T50-I52 PolarHBondContact O-N 3.41Å; T50-S71 WeakPolarHBondContact CG2-O 3.38Å; T50-G103 WeakPolarHBondContact OG1-CA 3.41Å; T50-G103 PolarHBondContact OG1-N 2.84Å; T50-D106 VanDerWaalsContact CB-OD2 3.24Å; T50-D106 WeakPolarHBondContact CB-OD2 3.44Å; T50-D106 PolarHBondContact OG1-OD2 3.27Å
51	G	90.9	Very high	93.6	Very high	52 Å²	52	15.3 Å²	15.3	54%	0.536	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	7.5	-178.6	0	0	0	0	0	115.9	E49 G53 K184	E49-G51 PolarHBondContact O-N 3.34Å; G51-G53 VanDerWaalsContact C-N 3.26Å; G51-G53 PolarHBondContact O-N 3.48Å; G51-K184 VanDerWaalsContact O-CE 3.27Å; G51-K184 WeakPolarHBondContact O-CE 3.26Å; G51-K184 PolarHBondContact O-NZ 2.93Å
52	I	94.1	Very high	93.3	Very high	14 Å²	14	15.4 Å²	15.4	7%	0.072	10%	0.101	C	C	.	.	S	Bend	trans	-71.8	-16.7	-179.1	-160.6	57.4	0	0	0	114	E49 T50 K54 F153 A155 A183 K184	E49-I52 WeakPolarHBondContact O-CB 3.39Å; E49-I52 WeakPolarHBondContact O-CG2 3.46Å; E49-I52 PolarHBondContact O-N 2.84Å; T50-I52 VanDerWaalsContact C-N 3.29Å; T50-I52 PolarHBondContact O-N 3.41Å; I52-K54 HydrophobicContact CG2-CD 4.22Å; I52-K54 HydrophobicContact CG2-CG 3.55Å; I52-F153 HydrophobicContact CG1-CB 4.19Å; I52-F153 HydrophobicContact CG2-CB 3.93Å; I52-F153 HydrophobicContact CG2-CD1 4.11Å; I52-F153 HydrophobicContact CG2-CG 4.17Å; I52-A155 HydrophobicContact CD1-CB 4.19Å; I52-A183 HydrophobicContact CD1-CB 3.8Å; I52-A183 HydrophobicContact CG1-CB 3.46Å; I52-A183 VanDerWaalsContact CG1-CB 3.46Å; I52-K184 WeakPolarHBondContact O-CE 3.44Å
53	G	92.8	Very high	92.8	Very high	23 Å²	23	20.9 Å²	20.9	24%	0.237	13%	0.131	C	C	.	.	S	Bend	trans	106	24	178.2	0	0	0	0	0	115.3	G51 L57	G51-G53 VanDerWaalsContact C-N 3.26Å; G51-G53 PolarHBondContact O-N 3.48Å; G53-L57 WeakPolarHBondContact O-CB 3.41Å; G53-L57 PolarHBondContact O-N 3.29Å
54	K	93.3	Very high	92.1	Very high	13 Å²	13	24 Å²	24	6%	0.057	15%	0.146	C	C	.	.	H	α-helix	trans	-57.5	-57.8	179.9	-58.3	-176.1	-67	-91.9	0	112.4	C46 G48 E49 I52 T56 L57 L58 T101 F153	C46-K54 HydrophobicContact CB-CB 4.16Å; C46-K54 HydrophobicContact CB-CD 4.11Å; C46-K54 HydrophobicContact CB-CG 4.34Å; G48-K54 PolarHBondContact O-NZ 2.85Å; E49-K54 PolarHBondContact O-NZ 3.49Å; I52-K54 HydrophobicContact CG2-CD 4.22Å; I52-K54 HydrophobicContact CG2-CG 3.55Å; K54-T56 VanDerWaalsContact C-N 3.34Å; K54-T56 PolarHBondContact O-N 3.41Å; K54-L57 PolarHBondContact O-N 2.89Å; K54-L57 VanDerWaalsContact O-N 3.13Å; K54-L58 PolarHBondContact O-N 3.45Å; K54-T101 WeakPolarHBondContact CE-O 3.45Å; K54-T101 PolarHBondContact NZ-O 3.42Å; K54-T101 VanDerWaalsContact NZ-O 3.13Å; K54-F153 HydrophobicContact CB-CE2 4.38Å; K54-F153 HydrophobicContact CB-CZ 4.21Å; K54-F153 HydrophobicContact CG-CD1 4.3Å; K54-F153 HydrophobicContact CG-CD2 4.01Å; K54-F153 HydrophobicContact CG-CE1 4.29Å; K54-F153 HydrophobicContact CG-CE2 4.01Å; K54-F153 HydrophobicContact CG-CG 4.17Å; K54-F153 HydrophobicContact CG-CZ 4.14Å
55	S	91.9	Very high	91.3	Very high	38 Å²	38	31.4 Å²	31.4	27%	0.266	18%	0.178	S	C	.	.	H	α-helix	trans	-62	-42.9	-178.2	-28.7	0	0	0	0	111.5	L57 L58 E59 E100	S55-L57 VanDerWaalsContact C-N 3.35Å; S55-L57 PolarHBondContact O-N 2.94Å; S55-L58 PolarHBondContact O-N 2.86Å; S55-E59 WeakPolarHBondContact O-CG 3.21Å; S55-E59 PolarHBondContact O-N 3.26Å; S55-E100 WeakPolarHBondContact CA-OE1 3.32Å; S55-E100 VanDerWaalsContact CB-OE1 3.25Å; S55-E100 WeakPolarHBondContact CB-OE1 3.49Å; S55-E100 PolarHBondContact N-OE1 3.22Å; S55-E100 VanDerWaalsContact OG-CD 3.3Å; S55-E100 PolarHBondContact OG-OE1 3.23Å; S55-E100 VanDerWaalsContact OG-OE1 3.12Å; S55-E100 PolarHBondContact OG-OE2 2.82Å
56	T	93.1	Very high	90.5	Very high	45 Å²	45	31.8 Å²	31.8	28%	0.276	18%	0.179	S	C	.	.	H	α-helix	trans	-60.5	-41.1	175.3	-47.1	0	0	0	0	112.3	K54 E59 T60	K54-T56 VanDerWaalsContact C-N 3.34Å; K54-T56 PolarHBondContact O-N 3.41Å; T56-E59 PolarHBondContact O-N 2.94Å; T56-T60 WeakPolarHBondContact O-CB 3.32Å; T56-T60 PolarHBondContact O-N 2.82Å; T56-T60 PolarHBondContact O-OG1 3.3Å
57	L	94.3	Very high	89.5	Confident	4 Å²	4	39 Å²	39	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-42.2	176.8	-175	69.9	0	0	0	111.2	G53 K54 S55 T60 L61 L151 F153 V236 F270 L273	G53-L57 WeakPolarHBondContact O-CB 3.41Å; G53-L57 PolarHBondContact O-N 3.29Å; K54-L57 PolarHBondContact O-N 2.89Å; K54-L57 VanDerWaalsContact O-N 3.13Å; S55-L57 VanDerWaalsContact C-N 3.35Å; S55-L57 PolarHBondContact O-N 2.94Å; L57-T60 CarbonylContact O-C 3.59Å; L57-T60 WeakPolarHBondContact O-CA 3.11Å; L57-T60 WeakPolarHBondContact O-CB 3.26Å; L57-T60 PolarHBondContact O-N 2.91Å; L57-T60 VanDerWaalsContact O-N 3.17Å; L57-L61 WeakPolarHBondContact O-CB 3.34Å; L57-L61 PolarHBondContact O-N 3.4Å; L57-L151 HydrophobicContact CD2-CD1 4.43Å; L57-F153 HydrophobicContact CB-CE1 4.02Å; L57-F153 HydrophobicContact CB-CZ 4.01Å; L57-F153 HydrophobicContact CD2-CE1 3.58Å; L57-F153 HydrophobicContact CD2-CE2 4.41Å; L57-F153 HydrophobicContact CD2-CZ 3.37Å; L57-F153 HydrophobicContact CG-CE1 4.43Å; L57-F153 HydrophobicContact CG-CZ 4.3Å; L57-V236 HydrophobicContact CD1-CB 3.97Å; L57-V236 HydrophobicContact CD1-CG2 4Å; L57-V236 HydrophobicContact CD2-CG2 3.99Å; L57-F270 HydrophobicContact CD1-CD2 3.88Å; L57-F270 HydrophobicContact CD1-CE2 4.11Å; L57-L273 HydrophobicContact CD2-CD2 4.14Å
58	L	92.2	Very high	88.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-63.3	-46	178.1	-73	159.8	0	0	0	111.4	I44 C46 K54 S55 T60 L61 F62 F66 V98 E100	I44-L58 HydrophobicContact CG2-CD2 4.25Å; C46-L58 HydrophobicContact CB-CD1 4.27Å; C46-L58 WeakPolarHBondContact SG-CD1 3.19Å; K54-L58 PolarHBondContact O-N 3.45Å; S55-L58 PolarHBondContact O-N 2.86Å; L58-T60 PolarHBondContact O-N 3.26Å; L58-L61 PolarHBondContact O-N 3.19Å; L58-L61 VanDerWaalsContact O-N 3.14Å; L58-F62 HydrophobicContact CD2-CE2 4.38Å; L58-F62 PolarHBondContact O-N 3.39Å; L58-F62 VanDerWaalsContact O-N 3.09Å; L58-F66 HydrophobicContact CB-CD2 3.98Å; L58-F66 HydrophobicContact CB-CE2 3.83Å; L58-F66 WeakPolarHBondContact O-CE2 3.28Å; L58-V98 HydrophobicContact CB-CG1 4.46Å; L58-V98 HydrophobicContact CD1-CG1 3.21Å; L58-V98 HydrophobicContact CD2-CG1 3.71Å; L58-V98 HydrophobicContact CG-CG1 3.95Å; L58-E100 HydrophobicContact CD1-CG 3.84Å; L58-E100 WeakPolarHBondContact CD1-OE1 3.35Å
59	E	90.8	Very high	87.5	Confident	30 Å²	30	43.6 Å²	43.6	14%	0.14	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-38	173.4	-66.8	-170.9	158.9	0	0	111.7	S55 T56 N63 Q64 K65 F66 S240 R251	S55-E59 WeakPolarHBondContact O-CG 3.21Å; S55-E59 PolarHBondContact O-N 3.26Å; T56-E59 PolarHBondContact O-N 2.94Å; E59-N63 WeakPolarHBondContact O-CA 3.43Å; E59-N63 PolarHBondContact O-N 2.93Å; E59-N63 VanDerWaalsContact O-N 3.08Å; E59-Q64 VanDerWaalsContact CA-O 3.22Å; E59-Q64 WeakPolarHBondContact CA-O 3.38Å; E59-Q64 WeakPolarHBondContact CB-O 3.33Å; E59-Q64 WeakPolarHBondContact CG-O 3.38Å; E59-Q64 PolarHBondContact O-N 3.49Å; E59-K65 WeakPolarHBondContact OE1-CA 3.46Å; E59-F66 HydrophobicContact CG-CD2 4.03Å; E59-F66 PolarHBondContact OE1-N 2.92Å; E59-S240 PolarHBondContact OE2-OG 3.49Å; E59-R251 PolarHBondContact O-NH1 2.88Å
60	T	91.4	Very high	86.8	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-45.6	176.4	-53.4	0	0	0	0	110.6	T56 L57 L58 G238 S239 R251 V262 F270	T56-T60 WeakPolarHBondContact O-CB 3.32Å; T56-T60 PolarHBondContact O-N 2.82Å; T56-T60 PolarHBondContact O-OG1 3.3Å; L57-T60 CarbonylContact O-C 3.59Å; L57-T60 WeakPolarHBondContact O-CA 3.11Å; L57-T60 WeakPolarHBondContact O-CB 3.26Å; L57-T60 PolarHBondContact O-N 2.91Å; L57-T60 VanDerWaalsContact O-N 3.17Å; L58-T60 PolarHBondContact O-N 3.26Å; T60-G238 WeakPolarHBondContact OG1-CA 3.46Å; T60-S239 PolarHBondContact OG1-N 2.97Å; T60-S239 PolarHBondContact OG1-O 3Å; T60-R251 PolarHBondContact O-NH1 2.8Å; T60-V262 HydrophobicContact CG2-CG1 3.6Å; T60-F270 HydrophobicContact CG2-CD2 4.08Å; T60-F270 HydrophobicContact CG2-CE1 3.93Å; T60-F270 HydrophobicContact CG2-CE2 3.44Å; T60-F270 VanDerWaalsContact CG2-CE2 3.44Å; T60-F270 HydrophobicContact CG2-CZ 3.35Å
61	L	90.4	Very high	86.2	Confident	9 Å²	9	48.3 Å²	48.3	5%	0.047	28%	0.282	C	S	.	.	H	α-helix	trans	-67.2	-42.7	-174.5	-173.8	63.1	0	0	0	113.1	I44 L57 L58 F270 R274 L277 L278	I44-L61 HydrophobicContact CD1-CD2 4.41Å; L57-L61 WeakPolarHBondContact O-CB 3.34Å; L57-L61 PolarHBondContact O-N 3.4Å; L58-L61 PolarHBondContact O-N 3.19Å; L58-L61 VanDerWaalsContact O-N 3.14Å; L61-F270 HydrophobicContact CB-CE2 4.38Å; L61-F270 HydrophobicContact CD1-CE2 4.36Å; L61-F270 HydrophobicContact CD1-CZ 4.47Å; L61-R274 HydrophobicContact CD1-CB 3.74Å; L61-R274 HydrophobicContact CD1-CG 3.82Å; L61-L277 HydrophobicContact CD2-CD1 3.93Å; L61-L278 HydrophobicContact CD1-CD1 4.05Å; L61-L278 HydrophobicContact CG-CD1 4.09Å
62	F	86.8	Confident	85.7	Confident	27 Å²	27	51.1 Å²	51.1	12%	0.118	28%	0.284	C	S	.	.	H	α-helix	trans	-101.5	1.6	-175.1	-68.7	-72.1	0	0	0	114.8	I44 L58 Q64 F66 L87 L96 L278	I44-F62 HydrophobicContact CD1-CE2 3.71Å; I44-F62 HydrophobicContact CD1-CZ 3.58Å; L58-F62 HydrophobicContact CD2-CE2 4.38Å; L58-F62 PolarHBondContact O-N 3.39Å; L58-F62 VanDerWaalsContact O-N 3.09Å; F62-Q64 PolarHBondContact O-N 2.95Å; F62-F66 HydrophobicContact CB-CE2 4.3Å; F62-F66 HydrophobicContact CB-CZ 3.81Å; F62-F66 HydrophobicContact CD2-CE2 4.1Å; F62-F66 AromaticContact CD2-CZ 3.88Å; F62-F66 HydrophobicContact CD2-CZ 3.88Å; F62-F66 HydrophobicContact CG-CZ 4.11Å; F62-L87 HydrophobicContact CB-CD1 4.41Å; F62-L87 HydrophobicContact CD1-CD1 3.62Å; F62-L87 HydrophobicContact CE1-CD1 4.23Å; F62-L87 HydrophobicContact CG-CD1 4.21Å; F62-L96 HydrophobicContact CD1-CD2 3.69Å; F62-L96 HydrophobicContact CD2-CD2 3.5Å; F62-L96 HydrophobicContact CE1-CD1 3.93Å; F62-L96 HydrophobicContact CE1-CD2 3.62Å; F62-L96 HydrophobicContact CE1-CG 4.37Å; F62-L96 HydrophobicContact CE2-CD1 3.92Å; F62-L96 HydrophobicContact CE2-CD2 3.43Å; F62-L96 VanDerWaalsContact CE2-CD2 3.43Å; F62-L96 HydrophobicContact CE2-CG 4.32Å; F62-L96 HydrophobicContact CG-CD2 3.62Å; F62-L96 HydrophobicContact CZ-CD1 3.42Å; F62-L96 VanDerWaalsContact CZ-CD1 3.42Å; F62-L96 HydrophobicContact CZ-CD2 3.48Å; F62-L96 VanDerWaalsContact CZ-CD2 3.48Å; F62-L96 HydrophobicContact CZ-CG 4.1Å; F62-L278 HydrophobicContact CD1-CD1 4.35Å; F62-L278 HydrophobicContact CE1-CD1 3.94Å; F62-L278 HydrophobicContact CE1-CD2 3.68Å; F62-L278 HydrophobicContact CE1-CG 4.49Å; F62-L278 HydrophobicContact CZ-CD1 4.5Å; F62-L278 HydrophobicContact CZ-CD2 3.85Å
63	N	84	Confident	85.2	Confident	115 Å²	115	55.7 Å²	55.7	62%	0.615	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	33.4	-177	-164.5	27.4	0	0	0	113.6	E59 R251	E59-N63 WeakPolarHBondContact O-CA 3.43Å; E59-N63 PolarHBondContact O-N 2.93Å; E59-N63 VanDerWaalsContact O-N 3.08Å; N63-R251 PolarHBondContact OD1-NH2 2.86Å
64	Q	81.2	Confident	84.6	Confident	68 Å²	68	61.6 Å²	61.6	32%	0.318	33%	0.331	S	S	.	.	S	Bend	trans	-139.9	136.9	-176.6	175.6	165	-9.3	0	0	110	E59 F62 F66	E59-Q64 VanDerWaalsContact CA-O 3.22Å; E59-Q64 WeakPolarHBondContact CA-O 3.38Å; E59-Q64 WeakPolarHBondContact CB-O 3.33Å; E59-Q64 WeakPolarHBondContact CG-O 3.38Å; E59-Q64 PolarHBondContact O-N 3.49Å; F62-Q64 PolarHBondContact O-N 2.95Å; Q64-F66 HydrophobicContact CB-CE1 4.32Å; Q64-F66 HydrophobicContact CB-CZ 4.49Å; Q64-F66 HydrophobicContact CG-CD1 4.3Å; Q64-F66 HydrophobicContact CG-CE1 4.1Å
65	K	81.2	Confident	84	Confident	155 Å²	155	63.5 Å²	63.5	67%	0.674	34%	0.342	S	S	*	.			trans	-74.7	135.3	170.2	-69.4	-171.4	177.2	-178	0	109.9	E59	E59-K65 WeakPolarHBondContact OE1-CA 3.46Å
66	F	78.9	Confident	83.4	Confident	8 Å²	8	66.8 Å²	66.8	4%	0.035	36%	0.361	C	S	.	.			trans	-111.3	137.6	178.6	-62	-55.3	0	0	0	109	L58 E59 F62 Q64 F68 Y85 L96 V98	L58-F66 HydrophobicContact CB-CD2 3.98Å; L58-F66 HydrophobicContact CB-CE2 3.83Å; L58-F66 WeakPolarHBondContact O-CE2 3.28Å; E59-F66 HydrophobicContact CG-CD2 4.03Å; E59-F66 PolarHBondContact OE1-N 2.92Å; F62-F66 HydrophobicContact CB-CE2 4.3Å; F62-F66 HydrophobicContact CB-CZ 3.81Å; F62-F66 HydrophobicContact CD2-CE2 4.1Å; F62-F66 AromaticContact CD2-CZ 3.88Å; F62-F66 HydrophobicContact CD2-CZ 3.88Å; F62-F66 HydrophobicContact CG-CZ 4.11Å; Q64-F66 HydrophobicContact CB-CE1 4.32Å; Q64-F66 HydrophobicContact CB-CZ 4.49Å; Q64-F66 HydrophobicContact CG-CD1 4.3Å; Q64-F66 HydrophobicContact CG-CE1 4.1Å; F66-F68 HydrophobicContact CB-CD2 3.45Å; F66-F68 VanDerWaalsContact CB-CD2 3.45Å; F66-F68 HydrophobicContact CB-CE2 3.51Å; F66-F68 HydrophobicContact CD2-CE2 4.42Å; F66-F68 HydrophobicContact CG-CD2 4.46Å; F66-F68 HydrophobicContact CG-CE2 4.12Å; F66-F68 PolarHBondContact O-N 3.14Å; F66-Y85 WeakPolarHBondContact CA-OH 3.4Å; F66-Y85 HydrophobicContact CB-CE2 4.29Å; F66-Y85 HydrophobicContact CD1-CD1 4.27Å; F66-Y85 AromaticContact CD1-CD2 3.56Å; F66-Y85 HydrophobicContact CD1-CD2 3.56Å; F66-Y85 AromaticContact CD1-CE1 3.91Å; F66-Y85 HydrophobicContact CD1-CE1 3.91Å; F66-Y85 AromaticContact CD1-CE2 3.14Å; F66-Y85 HydrophobicContact CD1-CE2 3.14Å; F66-Y85 HydrophobicContact CD1-CG 4.11Å; F66-Y85 AromaticContact CD1-CZ 3.34Å; F66-Y85 HydrophobicContact CE1-CD1 4.41Å; F66-Y85 AromaticContact CE1-CD2 3.5Å; F66-Y85 HydrophobicContact CE1-CD2 3.5Å; F66-Y85 HydrophobicContact CE1-CE1 4.5Å; F66-Y85 AromaticContact CE1-CE2 3.62Å; F66-Y85 HydrophobicContact CE1-CE2 3.62Å; F66-Y85 AromaticContact CE1-CG 3.93Å; F66-Y85 HydrophobicContact CE1-CG 3.93Å; F66-Y85 HydrophobicContact CG-CE2 4Å; F66-L96 HydrophobicContact CZ-CD2 4.04Å; F66-V98 HydrophobicContact CE2-CG2 4.5Å; F66-V98 HydrophobicContact CZ-CG2 4.25Å
67	D	75.6	Confident	82.8	Confident	150 Å²	150	69.4 Å²	69.4	80%	0.802	37%	0.373	S	S	*	.			trans	-76.7	60.7	-177.5	-68.8	-27.8	0	0	0	111.5	Y85	D67-Y85 PolarHBondContact N-OH 3.18Å
68	F	73	Confident	82.4	Confident	27 Å²	27	69.7 Å²	69.7	12%	0.118	38%	0.375	C	S	.	.			trans	-95.7	115.8	171.4	-68.3	-71.4	0	0	0	109.8	F66 K81 V83 V98 E100	F66-F68 HydrophobicContact CB-CD2 3.45Å; F66-F68 VanDerWaalsContact CB-CD2 3.45Å; F66-F68 HydrophobicContact CB-CE2 3.51Å; F66-F68 HydrophobicContact CD2-CE2 4.42Å; F66-F68 HydrophobicContact CG-CD2 4.46Å; F66-F68 HydrophobicContact CG-CE2 4.12Å; F66-F68 PolarHBondContact O-N 3.14Å; F68-K81 HydrophobicContact CD1-CB 4.39Å; F68-K81 HydrophobicContact CE1-CB 4.17Å; F68-V83 HydrophobicContact CD1-CG2 4.39Å; F68-V83 HydrophobicContact CE1-CB 4.47Å; F68-V83 HydrophobicContact CE1-CG2 3.66Å; F68-V83 HydrophobicContact CZ-CB 4.2Å; F68-V83 HydrophobicContact CZ-CG2 3.87Å; F68-V98 HydrophobicContact CE2-CB 4.5Å; F68-V98 HydrophobicContact CE2-CG1 4.15Å; F68-V98 HydrophobicContact CZ-CB 4.23Å; F68-V98 HydrophobicContact CZ-CG1 4.04Å; F68-E100 HydrophobicContact CE1-CB 4.35Å; F68-E100 HydrophobicContact CE1-CG 4.11Å; F68-E100 HydrophobicContact CE2-CG 4.35Å; F68-E100 HydrophobicContact CZ-CG 4.03Å
69	S	76.4	Confident	82.2	Confident	71 Å²	71	75.8 Å²	75.8	50%	0.497	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-67.8	131.9	168.5	72.2	0	0	0	0	109.6	S71 K81	S69-S71 PolarHBondContact O-N 3.42Å; S69-K81 PolarHBondContact O-NZ 2.89Å; S69-K81 PolarHBondContact OG-NZ 2.84Å
70	P	77.9	Confident	82.2	Confident	124 Å²	124	76.4 Å²	76.4	81%	0.805	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-49.2	136	170.7	-27.5	34.9	0	0	0	110.9
71	S	79.2	Confident	82.2	Confident	35 Å²	35	79.4 Å²	79.4	25%	0.245	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-93.4	138.6	179.6	-60.7	0	0	0	0	110	T50 S69 C102	T50-S71 WeakPolarHBondContact CG2-O 3.38Å; S69-S71 PolarHBondContact O-N 3.42Å; S71-C102 WeakPolarHBondContact OG-CB 3.45Å; S71-C102 PolarHBondContact OG-SG 3.38Å; S71-C102 VanDerWaalsContact OG-SG 3.34Å
72	N	80.8	Confident	82.3	Confident	111 Å²	111	81.4 Å²	81.4	59%	0.594	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-78.5	156.3	173.4	-63.9	-5	0	0	0	110.3	D74	N72-D74 PolarHBondContact O-N 3.38Å
73	H	83.8	Confident	82.5	Confident	111 Å²	111	82.2 Å²	82.2	51%	0.514	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.2	175.2	-68.8	-81.2	0	0	0	113.5	L75 D106	H73-L75 VanDerWaalsContact C-N 3.27Å; H73-L75 PolarHBondContact O-N 3.44Å; H73-D106 IonicContact CE1-OD1 2.77Å; H73-D106 IonicContact CG-OD1 2.83Å; H73-D106 IonicContact ND1-OD1 3.18Å; H73-D106 PolarHBondContact ND1-OD1 3.21Å; H73-D106 IonicContact ND1-OD2 3.44Å; H73-D106 WeakPolarHBondContact O-CB 3.47Å
74	D	80.5	Confident	82.9	Confident	146 Å²	146	79.7 Å²	79.7	78%	0.781	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	11.9	-174.2	-53.3	-39.1	0	0	0	113.9	N72 T76	N72-D74 PolarHBondContact O-N 3.38Å; D74-T76 PolarHBondContact O-N 2.87Å
75	L	80.2	Confident	83.4	Confident	54 Å²	54	77.9 Å²	77.9	28%	0.283	42%	0.422	S	S	.	.			trans	-70.6	124.9	-179.5	-69.5	172.4	0	0	0	110.4	H73 D77 C102 Q107	H73-L75 VanDerWaalsContact C-N 3.27Å; H73-L75 PolarHBondContact O-N 3.44Å; L75-D77 VanDerWaalsContact C-N 3.28Å; L75-D77 PolarHBondContact O-N 2.95Å; L75-C102 HydrophobicContact CD1-CB 4.11Å; L75-Q107 PolarHBondContact O-NE2 2.95Å
76	T	79.9	Confident	83.8	Confident	107 Å²	107	76.8 Å²	76.8	66%	0.656	42%	0.424	S	S	*	.	S	Bend	trans	-62	-37.3	179.8	57.4	0	0	0	0	112.4	D74 Q107	D74-T76 PolarHBondContact O-N 2.87Å; T76-Q107 VanDerWaalsContact O-CG 3.26Å; T76-Q107 WeakPolarHBondContact O-CG 3.29Å
77	D	81.5	Confident	84.2	Confident	99 Å²	99	77.7 Å²	77.7	53%	0.529	43%	0.429	S	S	.	.	S	Bend	trans	-137.6	144.8	-176.1	-57.9	-72.8	0	0	0	110.6	L75 K79	L75-D77 VanDerWaalsContact C-N 3.28Å; L75-D77 PolarHBondContact O-N 2.95Å; D77-K79 PolarHBondContact O-N 3.46Å
78	P	84.7	Confident	84.7	Confident	10 Å²	10	77.4 Å²	77.4	7%	0.065	42%	0.421	C	S	.	.			trans	-66.9	131.8	175.7	20.5	-23	0	0	0	110.9	C102 N113 P116	P78-C102 VanDerWaalsContact CA-O 3.32Å; P78-C102 WeakPolarHBondContact CA-O 3.31Å; P78-N113 HydrophobicContact CG-CB 4.16Å; P78-N113 WeakPolarHBondContact CG-O 3.25Å; P78-P116 HydrophobicContact CG-CG 4.11Å; P78-P116 WeakPolarHBondContact O-CG 3.17Å
79	K	88.3	Confident	85.2	Confident	129 Å²	129	84 Å²	84	56%	0.561	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	157.1	178.8	-65.4	-177.7	-178.2	179.3	0	110.4	D77 C102	D77-K79 PolarHBondContact O-N 3.46Å; K79-C102 PolarHBondContact N-O 2.99Å; K79-C102 PolarHBondContact O-N 3.47Å
80	L	91.5	Very high	85.5	Confident	43 Å²	43	84.7 Å²	84.7	23%	0.225	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137	172.2	-67.2	93.9	0	0	0	109.9	L45 V99 E100 P116 V117 Y120	L45-L80 HydrophobicContact CD1-CD2 3.86Å; L80-V99 HydrophobicContact CB-CG1 4.11Å; L80-V99 HydrophobicContact CD2-CG1 3.69Å; L80-V99 HydrophobicContact CG-CG1 4.47Å; L80-E100 WeakPolarHBondContact CA-O 3.3Å; L80-P116 VanDerWaalsContact CD1-C 3.49Å; L80-P116 HydrophobicContact CD1-CB 3.81Å; L80-P116 VanDerWaalsContact CD1-O 3.26Å; L80-P116 WeakPolarHBondContact CD1-O 3.36Å; L80-V117 HydrophobicContact CD1-CG2 4.37Å; L80-V117 HydrophobicContact CD2-CG2 4.41Å; L80-Y120 HydrophobicContact CD2-CD1 4.07Å; L80-Y120 HydrophobicContact CD2-CD2 4.34Å; L80-Y120 HydrophobicContact CD2-CG 3.82Å
81	K	91.1	Very high	85.8	Confident	68 Å²	68	84.8 Å²	84.8	30%	0.296	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.6	169.1	-69.5	-177.9	-173	172.3	0	108	F68 S69 V99 E100 C102	F68-K81 HydrophobicContact CD1-CB 4.39Å; F68-K81 HydrophobicContact CE1-CB 4.17Å; S69-K81 PolarHBondContact O-NZ 2.89Å; S69-K81 PolarHBondContact OG-NZ 2.84Å; K81-V99 CarbonylContact O-C 3.55Å; K81-V99 WeakPolarHBondContact O-CA 3.36Å; K81-E100 PolarHBondContact N-O 2.86Å; K81-E100 PolarHBondContact O-N 2.92Å; K81-C102 WeakPolarHBondContact CD-SG 3.33Å; K81-C102 VanDerWaalsContact CE-SG 3.55Å
82	A	92.6	Very high	86.1	Confident	51 Å²	51	85.7 Å²	85.7	42%	0.421	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.3	175.3	0	0	0	0	0	109.3	T97 V98 V99	A82-T97 HydrophobicContact CB-CG2 4.44Å; A82-V98 CarbonylContact C-O 3.6Å; A82-V98 WeakPolarHBondContact CA-O 3.25Å; A82-V99 HydrophobicContact CB-CG1 4.34Å; A82-V99 HydrophobicContact CB-CG2 3.96Å
83	V	91	Very high	86.5	Confident	44 Å²	44	86.4 Å²	86.4	27%	0.267	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134	173.7	-168.4	0	0	0	0	108.9	F68 Y85 T97 V98	F68-V83 HydrophobicContact CD1-CG2 4.39Å; F68-V83 HydrophobicContact CE1-CB 4.47Å; F68-V83 HydrophobicContact CE1-CG2 3.66Å; F68-V83 HydrophobicContact CZ-CB 4.2Å; F68-V83 HydrophobicContact CZ-CG2 3.87Å; V83-Y85 HydrophobicContact CB-CE2 3.68Å; V83-Y85 HydrophobicContact CG1-CD2 4.15Å; V83-Y85 HydrophobicContact CG1-CE1 4.22Å; V83-Y85 HydrophobicContact CG1-CE2 3.33Å; V83-Y85 WeakPolarHBondContact CG1-OH 3.18Å; V83-T97 WeakPolarHBondContact O-CA 3.36Å; V83-V98 PolarHBondContact N-O 2.83Å; V83-V98 PolarHBondContact O-N 3.23Å
84	T	92.3	Very high	86.8	Confident	62 Å²	62	82.4 Å²	82.4	38%	0.38	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.3	-179.4	-55.1	0	0	0	0	110.3	K95 L96 T97	T84-K95 HydrophobicContact CG2-CD 4.21Å; T84-K95 VanDerWaalsContact CG2-CE 3.47Å; T84-K95 HydrophobicContact CG2-CG 3.62Å; T84-L96 CarbonylContact C-O 3.53Å; T84-L96 WeakPolarHBondContact CA-O 3.31Å; T84-T97 WeakPolarHBondContact OG1-CG2 3.42Å; T84-T97 PolarHBondContact OG1-OG1 3.29Å
85	Y	90.8	Very high	87.4	Confident	31 Å²	31	78.8 Å²	78.8	12%	0.122	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	138.2	179.4	-62.2	-87.9	0	0	0	110	F66 D67 V83 L96	F66-Y85 WeakPolarHBondContact CA-OH 3.4Å; F66-Y85 HydrophobicContact CB-CE2 4.29Å; F66-Y85 HydrophobicContact CD1-CD1 4.27Å; F66-Y85 AromaticContact CD1-CD2 3.56Å; F66-Y85 HydrophobicContact CD1-CD2 3.56Å; F66-Y85 AromaticContact CD1-CE1 3.91Å; F66-Y85 HydrophobicContact CD1-CE1 3.91Å; F66-Y85 AromaticContact CD1-CE2 3.14Å; F66-Y85 HydrophobicContact CD1-CE2 3.14Å; F66-Y85 HydrophobicContact CD1-CG 4.11Å; F66-Y85 AromaticContact CD1-CZ 3.34Å; F66-Y85 HydrophobicContact CE1-CD1 4.41Å; F66-Y85 AromaticContact CE1-CD2 3.5Å; F66-Y85 HydrophobicContact CE1-CD2 3.5Å; F66-Y85 HydrophobicContact CE1-CE1 4.5Å; F66-Y85 AromaticContact CE1-CE2 3.62Å; F66-Y85 HydrophobicContact CE1-CE2 3.62Å; F66-Y85 AromaticContact CE1-CG 3.93Å; F66-Y85 HydrophobicContact CE1-CG 3.93Å; F66-Y85 HydrophobicContact CG-CE2 4Å; D67-Y85 PolarHBondContact N-OH 3.18Å; V83-Y85 HydrophobicContact CB-CE2 3.68Å; V83-Y85 HydrophobicContact CG1-CD2 4.15Å; V83-Y85 HydrophobicContact CG1-CE1 4.22Å; V83-Y85 HydrophobicContact CG1-CE2 3.33Å; V83-Y85 WeakPolarHBondContact CG1-OH 3.18Å; Y85-L96 PolarHBondContact N-O 3.39Å; Y85-L96 PolarHBondContact O-N 2.87Å
86	D	90.3	Very high	88	Confident	132 Å²	132	76.2 Å²	76.2	71%	0.706	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	101.2	171	-68	-42.7	0	0	0	108.8	K95	D86-K95 WeakPolarHBondContact OD1-CG 3.21Å
87	L	87.6	Confident	88.7	Confident	26 Å²	26	71.4 Å²	71.4	14%	0.136	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	148.6	175.9	-52.4	-175.4	0	0	0	109.9	F62 K93 L94 L96	F62-L87 HydrophobicContact CB-CD1 4.41Å; F62-L87 HydrophobicContact CD1-CD1 3.62Å; F62-L87 HydrophobicContact CE1-CD1 4.23Å; F62-L87 HydrophobicContact CG-CD1 4.21Å; L87-K93 WeakPolarHBondContact O-CA 3.4Å; L87-L94 WeakPolarHBondContact CA-O 3.48Å; L87-L94 HydrophobicContact CB-CB 4.29Å; L87-L94 WeakPolarHBondContact CB-O 3.15Å; L87-L94 HydrophobicContact CD1-CD2 4.37Å; L87-L94 PolarHBondContact N-O 3.39Å; L87-L94 PolarHBondContact O-N 2.9Å; L87-L96 HydrophobicContact CD1-CB 3.95Å; L87-L96 HydrophobicContact CD1-CD2 3.69Å; L87-L96 HydrophobicContact CD1-CG 4.45Å; L87-L96 HydrophobicContact CG-CB 4.24Å
88	K	85.9	Confident	89.3	Confident	145 Å²	145	66.7 Å²	66.7	63%	0.63	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136	120.7	173.7	-175.4	178.2	168.6	-178.9	0	109.7	A90 V92	K88-A90 WeakPolarHBondContact CE-O 3.46Å; K88-V92 WeakPolarHBondContact CA-O 3.5Å
89	E	82.5	Confident	89.8	Confident	165 Å²	165	66.3 Å²	66.3	77%	0.771	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	117.6	172.6	-168.3	173.3	169	0	0	108.6	N91 V92	E89-N91 PolarHBondContact O-N 3.42Å; E89-N91 VanDerWaalsContact O-N 3.07Å; E89-V92 PolarHBondContact N-O 2.85Å; E89-V92 PolarHBondContact O-N 3.34Å
90	A	83.7	Confident	90	Very high	85 Å²	85	60.5 Å²	60.5	70%	0.702	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	-113.1	-169.3	0	0	0	0	0	112.3	K88	K88-A90 WeakPolarHBondContact CE-O 3.46Å
91	N	83.1	Confident	90.1	Very high	126 Å²	126	58.7 Å²	58.7	67%	0.674	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-1.4	179	-70.5	-25.1	0	0	0	113.6	I36 E89	I36-N91 HydrophobicContact CG2-CB 4.4Å; I36-N91 VanDerWaalsContact CG2-O 3.32Å; I36-N91 WeakPolarHBondContact CG2-O 3.36Å; E89-N91 PolarHBondContact O-N 3.42Å; E89-N91 VanDerWaalsContact O-N 3.07Å
92	V	85.5	Confident	90	Very high	54 Å²	54	55.6 Å²	55.6	33%	0.327	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.5	-176.5	-177.7	0	0	0	0	109.8	I36 F40 K88 E89	I36-V92 HydrophobicContact CG1-CG2 4.46Å; F40-V92 HydrophobicContact CD2-CG1 3.49Å; F40-V92 VanDerWaalsContact CD2-CG1 3.49Å; F40-V92 HydrophobicContact CE2-CG1 3.59Å; K88-V92 WeakPolarHBondContact CA-O 3.5Å; E89-V92 PolarHBondContact N-O 2.85Å; E89-V92 PolarHBondContact O-N 3.34Å
93	K	89.6	Confident	89.7	Confident	126 Å²	126	53.2 Å²	53.2	55%	0.548	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.2	172.3	-64.1	179.3	-177.6	176.8	0	109.3	G39 F40 L87	G39-K93 CarbonylContact C-O 3.6Å; G39-K93 WeakPolarHBondContact CA-O 3.46Å; F40-K93 PolarHBondContact N-O 2.9Å; L87-K93 WeakPolarHBondContact O-CA 3.4Å
94	L	90.2	Very high	89.6	Confident	27 Å²	27	51.1 Å²	51.1	14%	0.141	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	114.7	175.2	175.7	67.1	0	0	0	108.7	F40 F42 L87 L96 M282	F40-L94 HydrophobicContact CB-CD1 3.87Å; F40-L94 CarbonylContact O-C 3.56Å; F40-L94 WeakPolarHBondContact O-CA 3.33Å; F42-L94 HydrophobicContact CB-CD1 3.8Å; L87-L94 WeakPolarHBondContact CA-O 3.48Å; L87-L94 HydrophobicContact CB-CB 4.29Å; L87-L94 WeakPolarHBondContact CB-O 3.15Å; L87-L94 HydrophobicContact CD1-CD2 4.37Å; L87-L94 PolarHBondContact N-O 3.39Å; L87-L94 PolarHBondContact O-N 2.9Å; L94-L96 PolarHBondContact O-N 2.75Å; L94-M282 HydrophobicContact CD1-SD 4.1Å; L94-M282 HydrophobicContact CD2-CE 4.26Å
95	K	92.7	Very high	89.3	Confident	71 Å²	71	48.4 Å²	48.4	31%	0.309	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	98.7	169.8	-174.1	167	-177.6	-174.3	0	108.6	F40 V41 F42 T84 D86 H143	F40-K95 PolarHBondContact O-N 3.24Å; V41-K95 WeakPolarHBondContact CA-O 3.4Å; V41-K95 HydrophobicContact CG1-CB 4.27Å; F42-K95 PolarHBondContact N-O 3.03Å; T84-K95 HydrophobicContact CG2-CD 4.21Å; T84-K95 VanDerWaalsContact CG2-CE 3.47Å; T84-K95 HydrophobicContact CG2-CG 3.62Å; D86-K95 WeakPolarHBondContact OD1-CG 3.21Å; K95-H143 VanDerWaalsContact CD-CE1 3.47Å; K95-H143 WeakPolarHBondContact CD-CE1 3.4Å; K95-H143 WeakPolarHBondContact CE-CE1 3.37Å; K95-H143 WeakPolarHBondContact CE-NE2 3.25Å; K95-H143 PolarHBondContact NZ-ND1 3.44Å
96	L	93	Very high	89.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	121.3	-177.7	176.7	72.8	0	0	0	109.7	F42 I44 F62 F66 T84 Y85 L87 L94 V98	F42-L96 HydrophobicContact CB-CD1 4.4Å; F42-L96 HydrophobicContact CD1-CD1 4.13Å; F42-L96 CarbonylContact O-C 3.51Å; F42-L96 VanDerWaalsContact O-CA 3.29Å; F42-L96 WeakPolarHBondContact O-CA 3.44Å; I44-L96 HydrophobicContact CD1-CD1 4.09Å; I44-L96 HydrophobicContact CG1-CD1 4.17Å; F62-L96 HydrophobicContact CD1-CD2 3.69Å; F62-L96 HydrophobicContact CD2-CD2 3.5Å; F62-L96 HydrophobicContact CE1-CD1 3.93Å; F62-L96 HydrophobicContact CE1-CD2 3.62Å; F62-L96 HydrophobicContact CE1-CG 4.37Å; F62-L96 HydrophobicContact CE2-CD1 3.92Å; F62-L96 HydrophobicContact CE2-CD2 3.43Å; F62-L96 VanDerWaalsContact CE2-CD2 3.43Å; F62-L96 HydrophobicContact CE2-CG 4.32Å; F62-L96 HydrophobicContact CG-CD2 3.62Å; F62-L96 HydrophobicContact CZ-CD1 3.42Å; F62-L96 VanDerWaalsContact CZ-CD1 3.42Å; F62-L96 HydrophobicContact CZ-CD2 3.48Å; F62-L96 VanDerWaalsContact CZ-CD2 3.48Å; F62-L96 HydrophobicContact CZ-CG 4.1Å; F66-L96 HydrophobicContact CZ-CD2 4.04Å; T84-L96 CarbonylContact C-O 3.53Å; T84-L96 WeakPolarHBondContact CA-O 3.31Å; Y85-L96 PolarHBondContact N-O 3.39Å; Y85-L96 PolarHBondContact O-N 2.87Å; L87-L96 HydrophobicContact CD1-CB 3.95Å; L87-L96 HydrophobicContact CD1-CD2 3.69Å; L87-L96 HydrophobicContact CD1-CG 4.45Å; L87-L96 HydrophobicContact CG-CB 4.24Å; L94-L96 PolarHBondContact O-N 2.75Å; L96-V98 HydrophobicContact CD1-CG2 4.36Å; L96-V98 HydrophobicContact CD2-CG2 3.66Å; L96-V98 HydrophobicContact CG-CG2 3.76Å
97	T	94.8	Very high	89	Confident	6 Å²	6	44 Å²	44	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	124.5	166.3	-52.6	0	0	0	0	109.7	F42 N43 I44 A82 V83 T84 V99	F42-T97 PolarHBondContact O-N 2.9Å; N43-T97 CarbonylContact C-O 3.59Å; N43-T97 VanDerWaalsContact CA-O 3.29Å; N43-T97 WeakPolarHBondContact CA-O 3.33Å; N43-T97 WeakPolarHBondContact OD1-CB 3.36Å; N43-T97 PolarHBondContact OD1-OG1 3.45Å; N43-T97 VanDerWaalsContact OD1-OG1 3.08Å; I44-T97 PolarHBondContact N-O 2.86Å; A82-T97 HydrophobicContact CB-CG2 4.44Å; V83-T97 WeakPolarHBondContact O-CA 3.36Å; T84-T97 WeakPolarHBondContact OG1-CG2 3.42Å; T84-T97 PolarHBondContact OG1-OG1 3.29Å; T97-V99 HydrophobicContact CG2-CG2 4.15Å
98	V	93.8	Very high	88.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.9	177.8	-174.2	0	0	0	0	108.4	L58 F66 F68 A82 V83 L96 E100	L58-V98 HydrophobicContact CB-CG1 4.46Å; L58-V98 HydrophobicContact CD1-CG1 3.21Å; L58-V98 HydrophobicContact CD2-CG1 3.71Å; L58-V98 HydrophobicContact CG-CG1 3.95Å; F66-V98 HydrophobicContact CE2-CG2 4.5Å; F66-V98 HydrophobicContact CZ-CG2 4.25Å; F68-V98 HydrophobicContact CE2-CB 4.5Å; F68-V98 HydrophobicContact CE2-CG1 4.15Å; F68-V98 HydrophobicContact CZ-CB 4.23Å; F68-V98 HydrophobicContact CZ-CG1 4.04Å; A82-V98 CarbonylContact C-O 3.6Å; A82-V98 WeakPolarHBondContact CA-O 3.25Å; V83-V98 PolarHBondContact N-O 2.83Å; V83-V98 PolarHBondContact O-N 3.23Å; L96-V98 HydrophobicContact CD1-CG2 4.36Å; L96-V98 HydrophobicContact CD2-CG2 3.66Å; L96-V98 HydrophobicContact CG-CG2 3.76Å; V98-E100 HydrophobicContact CG1-CG 4.45Å
99	V	95	Very high	88.9	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.5	-179	-168.9	0	0	0	0	109	I44 L45 C46 L80 K81 A82 T97 Y120	I44-V99 PolarHBondContact O-N 2.96Å; L45-V99 CarbonylContact C-O 3.54Å; L45-V99 WeakPolarHBondContact CA-O 3.33Å; L45-V99 HydrophobicContact CD1-CB 3.91Å; L45-V99 HydrophobicContact CD1-CG1 3.77Å; C46-V99 PolarHBondContact N-O 3.43Å; L80-V99 HydrophobicContact CB-CG1 4.11Å; L80-V99 HydrophobicContact CD2-CG1 3.69Å; L80-V99 HydrophobicContact CG-CG1 4.47Å; K81-V99 CarbonylContact O-C 3.55Å; K81-V99 WeakPolarHBondContact O-CA 3.36Å; A82-V99 HydrophobicContact CB-CG1 4.34Å; A82-V99 HydrophobicContact CB-CG2 3.96Å; T97-V99 HydrophobicContact CG2-CG2 4.15Å; V99-Y120 HydrophobicContact CB-CE1 4.46Å; V99-Y120 HydrophobicContact CG1-CD1 4.41Å; V99-Y120 HydrophobicContact CG1-CE1 3.96Å; V99-Y120 HydrophobicContact CG1-CE2 4.46Å; V99-Y120 HydrophobicContact CG2-CE1 3.91Å; V99-Y120 WeakPolarHBondContact CG2-OH 3.33Å
100	E	93.7	Very high	89.1	Confident	8 Å²	8	45.5 Å²	45.5	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.5	179.1	-66.6	-169.5	179.5	0	0	112.2	C46 S55 L58 F68 L80 K81 V98	C46-E100 HydrophobicContact CB-CG 4.42Å; S55-E100 WeakPolarHBondContact CA-OE1 3.32Å; S55-E100 VanDerWaalsContact CB-OE1 3.25Å; S55-E100 WeakPolarHBondContact CB-OE1 3.49Å; S55-E100 PolarHBondContact N-OE1 3.22Å; S55-E100 VanDerWaalsContact OG-CD 3.3Å; S55-E100 PolarHBondContact OG-OE1 3.23Å; S55-E100 VanDerWaalsContact OG-OE1 3.12Å; S55-E100 PolarHBondContact OG-OE2 2.82Å; L58-E100 HydrophobicContact CD1-CG 3.84Å; L58-E100 WeakPolarHBondContact CD1-OE1 3.35Å; F68-E100 HydrophobicContact CE1-CB 4.35Å; F68-E100 HydrophobicContact CE1-CG 4.11Å; F68-E100 HydrophobicContact CE2-CG 4.35Å; F68-E100 HydrophobicContact CZ-CG 4.03Å; L80-E100 WeakPolarHBondContact CA-O 3.3Å; K81-E100 PolarHBondContact N-O 2.86Å; K81-E100 PolarHBondContact O-N 2.92Å; V98-E100 HydrophobicContact CG1-CG 4.45Å
101	T	92.8	Very high	89.1	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.025	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	127.5	168.9	51.8	0	0	0	0	111.3	C46 V47 G48 K54 V117	C46-T101 PolarHBondContact O-N 2.89Å; C46-T101 VanDerWaalsContact O-N 3.1Å; C46-T101 PolarHBondContact O-OG1 3.39Å; V47-T101 WeakPolarHBondContact CA-OG1 3.29Å; V47-T101 HydrophobicContact CB-CG2 4.4Å; V47-T101 HydrophobicContact CG1-CG2 4.38Å; V47-T101 HydrophobicContact CG2-CG2 4.04Å; G48-T101 PolarHBondContact N-OG1 2.92Å; K54-T101 WeakPolarHBondContact CE-O 3.45Å; K54-T101 PolarHBondContact NZ-O 3.42Å; K54-T101 VanDerWaalsContact NZ-O 3.13Å; T101-V117 HydrophobicContact CG2-CG2 3.63Å
102	C	89.8	Confident	89.1	Confident	4 Å²	4	46.3 Å²	46.3	3%	0.027	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.4	176.9	-59.6	0	0	0	0	108.9	S71 L75 P78 K79 K81 Y104	S71-C102 WeakPolarHBondContact OG-CB 3.45Å; S71-C102 PolarHBondContact OG-SG 3.38Å; S71-C102 VanDerWaalsContact OG-SG 3.34Å; L75-C102 HydrophobicContact CD1-CB 4.11Å; P78-C102 VanDerWaalsContact CA-O 3.32Å; P78-C102 WeakPolarHBondContact CA-O 3.31Å; K79-C102 PolarHBondContact N-O 2.99Å; K79-C102 PolarHBondContact O-N 3.47Å; K81-C102 WeakPolarHBondContact CD-SG 3.33Å; K81-C102 VanDerWaalsContact CE-SG 3.55Å; C102-Y104 VanDerWaalsContact C-N 3.31Å; C102-Y104 PolarHBondContact O-N 3.33Å
103	G	85.1	Confident	89.3	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	78.4	12.1	178.7	0	0	0	0	0	114.6	T50 G105 D106 Q107	T50-G103 WeakPolarHBondContact OG1-CA 3.41Å; T50-G103 PolarHBondContact OG1-N 2.84Å; G103-G105 PolarHBondContact O-N 3.46Å; G103-D106 VanDerWaalsContact CA-OD2 3.24Å; G103-D106 WeakPolarHBondContact CA-OD2 3.5Å; G103-Q107 PolarHBondContact O-NE2 2.95Å; G103-Q107 PolarHBondContact O-OE1 3.47Å
104	Y	89.1	Confident	89.5	Confident	1 Å²	1	38.2 Å²	38.2	0%	0.004	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	123.1	-177	179.6	-94.9	0	0	0	110.7	V47 E49 C102 D106 N113 I114 Y152 I164 A168	V47-Y104 HydrophobicContact CG1-CD1 4.37Å; V47-Y104 HydrophobicContact CG1-CD2 4.46Å; V47-Y104 HydrophobicContact CG1-CE1 4.05Å; V47-Y104 HydrophobicContact CG1-CE2 4.17Å; E49-Y104 WeakPolarHBondContact CA-O 3.33Å; C102-Y104 VanDerWaalsContact C-N 3.31Å; C102-Y104 PolarHBondContact O-N 3.33Å; Y104-D106 VanDerWaalsContact C-N 3.33Å; Y104-N113 HydrophobicContact CD2-CB 4.17Å; Y104-N113 HydrophobicContact CE2-CB 4.03Å; Y104-I114 HydrophobicContact CE2-CD1 4.09Å; Y104-Y152 PolarHBondContact OH-OH 2.93Å; Y104-I164 HydrophobicContact CE1-CD1 4.01Å; Y104-I164 HydrophobicContact CE2-CD1 4.44Å; Y104-A168 WeakPolarHBondContact OH-CB 3.42Å
105	G	87.3	Confident	89.6	Confident	4 Å²	4	42 Å²	42	4%	0.041	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	0.9	176	0	0	0	0	0	115.1	G103 K110 N113	G103-G105 PolarHBondContact O-N 3.46Å; G105-K110 WeakPolarHBondContact O-CE 3.41Å; G105-K110 PolarHBondContact O-NZ 3.3Å; G105-N113 WeakPolarHBondContact CA-ND2 3.43Å; G105-N113 PolarHBondContact N-ND2 2.81Å
106	D	88.1	Confident	89.7	Confident	47 Å²	47	40.3 Å²	40.3	25%	0.251	20%	0.203	S	C	.	.			trans	-81	-24.3	180	-66.7	-36.7	0	0	0	112.8	T50 H73 G103 Y104	T50-D106 VanDerWaalsContact CB-OD2 3.24Å; T50-D106 WeakPolarHBondContact CB-OD2 3.44Å; T50-D106 PolarHBondContact OG1-OD2 3.27Å; H73-D106 IonicContact CE1-OD1 2.77Å; H73-D106 IonicContact CG-OD1 2.83Å; H73-D106 IonicContact ND1-OD1 3.18Å; H73-D106 PolarHBondContact ND1-OD1 3.21Å; H73-D106 IonicContact ND1-OD2 3.44Å; H73-D106 WeakPolarHBondContact O-CB 3.47Å; G103-D106 VanDerWaalsContact CA-OD2 3.24Å; G103-D106 WeakPolarHBondContact CA-OD2 3.5Å; Y104-D106 VanDerWaalsContact C-N 3.33Å
107	Q	86.6	Confident	89.8	Confident	24 Å²	24	40.4 Å²	40.4	11%	0.112	20%	0.203	C	C	.	.	S	Bend	trans	-71.8	151.1	-178.1	-60	70.9	36.3	0	0	111.9	L75 T76 G103 N109 K110 N113	L75-Q107 PolarHBondContact O-NE2 2.95Å; T76-Q107 VanDerWaalsContact O-CG 3.26Å; T76-Q107 WeakPolarHBondContact O-CG 3.29Å; G103-Q107 PolarHBondContact O-NE2 2.95Å; G103-Q107 PolarHBondContact O-OE1 3.47Å; Q107-N109 WeakPolarHBondContact CB-O 3.44Å; Q107-K110 WeakPolarHBondContact O-CE 3.36Å; Q107-K110 VanDerWaalsContact O-CG 3.25Å; Q107-K110 WeakPolarHBondContact O-CG 3.35Å; Q107-N113 VanDerWaalsContact OE1-CG 3.26Å; Q107-N113 PolarHBondContact OE1-ND2 2.89Å; Q107-N113 PolarHBondContact OE1-OD1 2.87Å; Q107-N113 VanDerWaalsContact OE1-OD1 3.12Å
108	I	84.8	Confident	89.9	Confident	179 Å²	179	41.1 Å²	41.1	92%	0.918	21%	0.208	S	C	*	.	S	Bend	trans	-65	-48.6	173.9	-60.6	175.3	0	0	0	110.2
109	N	86.7	Confident	90	Very high	105 Å²	105	44.5 Å²	44.5	56%	0.561	23%	0.226	S	C	*	.			trans	-90.6	117.2	171.2	-173.7	-6.1	0	0	0	109.6	Q107 E111	Q107-N109 WeakPolarHBondContact CB-O 3.44Å; N109-E111 WeakPolarHBondContact OD1-CB 3.33Å; N109-E111 PolarHBondContact OD1-N 3.34Å; N109-E111 VanDerWaalsContact OD1-N 3.08Å
110	K	86.6	Confident	90.1	Very high	83 Å²	83	46.5 Å²	46.5	36%	0.361	23%	0.234	S	C	.	.			trans	-105.2	-1.3	-174	-60.4	-177.9	-173.7	-158.6	0	113.9	G105 Q107 N112 N113 I164	G105-K110 WeakPolarHBondContact O-CE 3.41Å; G105-K110 PolarHBondContact O-NZ 3.3Å; Q107-K110 WeakPolarHBondContact O-CE 3.36Å; Q107-K110 VanDerWaalsContact O-CG 3.25Å; Q107-K110 WeakPolarHBondContact O-CG 3.35Å; K110-N112 VanDerWaalsContact C-N 3.27Å; K110-N112 PolarHBondContact O-N 2.87Å; K110-N113 WeakPolarHBondContact O-CB 3.46Å; K110-N113 PolarHBondContact O-N 3.43Å; K110-I164 HydrophobicContact CB-CD1 3.97Å; K110-I164 HydrophobicContact CB-CG1 4.44Å; K110-I164 HydrophobicContact CD-CD1 4.03Å; K110-I164 HydrophobicContact CG-CD1 4.34Å
111	E	82.6	Confident	90.3	Very high	130 Å²	130	46.2 Å²	46.2	61%	0.607	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-38	-171.5	-171.8	179	-176	0	0	113	N109	N109-E111 WeakPolarHBondContact OD1-CB 3.33Å; N109-E111 PolarHBondContact OD1-N 3.34Å; N109-E111 VanDerWaalsContact OD1-N 3.08Å
112	N	84.2	Confident	90.5	Very high	98 Å²	98	47.2 Å²	47.2	52%	0.524	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	6.9	-177.8	-68.6	-40.8	0	0	0	114	K110 I114 K115 P116	K110-N112 VanDerWaalsContact C-N 3.27Å; K110-N112 PolarHBondContact O-N 2.87Å; N112-I114 PolarHBondContact O-N 3.46Å; N112-I114 VanDerWaalsContact O-N 3.12Å; N112-K115 WeakPolarHBondContact O-CB 3.47Å; N112-K115 PolarHBondContact O-N 2.85Å; N112-P116 WeakPolarHBondContact O-CD 3.33Å
113	N	88.7	Confident	90.9	Very high	7 Å²	7	51.1 Å²	51.1	4%	0.037	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.8	-174.8	-80.3	8.1	0	0	0	113.8	P78 Y104 G105 Q107 K110 I164	P78-N113 HydrophobicContact CG-CB 4.16Å; P78-N113 WeakPolarHBondContact CG-O 3.25Å; Y104-N113 HydrophobicContact CD2-CB 4.17Å; Y104-N113 HydrophobicContact CE2-CB 4.03Å; G105-N113 WeakPolarHBondContact CA-ND2 3.43Å; G105-N113 PolarHBondContact N-ND2 2.81Å; Q107-N113 VanDerWaalsContact OE1-CG 3.26Å; Q107-N113 PolarHBondContact OE1-ND2 2.89Å; Q107-N113 PolarHBondContact OE1-OD1 2.87Å; Q107-N113 VanDerWaalsContact OE1-OD1 3.12Å; K110-N113 WeakPolarHBondContact O-CB 3.46Å; K110-N113 PolarHBondContact O-N 3.43Å; N113-I164 HydrophobicContact CB-CD1 4.35Å
114	I	93.8	Very high	91.5	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.021	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-14.5	179.7	-163.3	61.8	0	0	0	113	V47 Y104 N112 V117 V118 A168 K171 L172	V47-I114 HydrophobicContact CG1-CD1 4.4Å; Y104-I114 HydrophobicContact CE2-CD1 4.09Å; N112-I114 PolarHBondContact O-N 3.46Å; N112-I114 VanDerWaalsContact O-N 3.12Å; I114-V117 HydrophobicContact CD1-CB 3.95Å; I114-V117 HydrophobicContact CD1-CG1 4.31Å; I114-V117 HydrophobicContact CD1-CG2 4.11Å; I114-V117 WeakPolarHBondContact O-CB 3.33Å; I114-V117 PolarHBondContact O-N 2.98Å; I114-V117 VanDerWaalsContact O-N 3.1Å; I114-V118 HydrophobicContact CG1-CG2 4.3Å; I114-V118 PolarHBondContact O-N 3.34Å; I114-A168 HydrophobicContact CB-CB 4.4Å; I114-A168 HydrophobicContact CD1-CB 3.87Å; I114-A168 HydrophobicContact CG1-CB 4.04Å; I114-K171 HydrophobicContact CG2-CB 4.46Å; I114-K171 HydrophobicContact CG2-CD 3.42Å; I114-K171 VanDerWaalsContact CG2-CD 3.42Å; I114-L172 HydrophobicContact CD1-CD1 3.97Å; I114-L172 HydrophobicContact CD1-CD2 4.38Å; I114-L172 HydrophobicContact CD1-CG 4.18Å; I114-L172 HydrophobicContact CG1-CG 4.41Å
115	K	93.4	Very high	91.9	Very high	105 Å²	105	51.7 Å²	51.7	46%	0.457	26%	0.261	S	S	.	.	H	α-helix	trans	-57.9	-47.4	-176.7	172.3	168.8	173.5	47.3	0	112.6	N112 V117 V118 D119	N112-K115 WeakPolarHBondContact O-CB 3.47Å; N112-K115 PolarHBondContact O-N 2.85Å; K115-V117 PolarHBondContact O-N 2.85Å; K115-V118 PolarHBondContact O-N 3.23Å; K115-V118 VanDerWaalsContact O-N 3.16Å; K115-D119 WeakPolarHBondContact CE-OD2 3.43Å; K115-D119 WeakPolarHBondContact CG-OD2 3.41Å; K115-D119 VanDerWaalsContact NZ-CG 3.26Å; K115-D119 IonicContact NZ-OD1 2.72Å; K115-D119 PolarHBondContact NZ-OD1 2.91Å; K115-D119 IonicContact NZ-OD2 3.75Å; K115-D119 PolarHBondContact NZ-OD2 2.86Å; K115-D119 WeakPolarHBondContact O-CB 3.33Å; K115-D119 VanDerWaalsContact O-CG 3.23Å; K115-D119 PolarHBondContact O-N 3.25Å
116	P	94.3	Very high	92.3	Very high	37 Å²	37	53.2 Å²	53.2	24%	0.24	27%	0.267	C	S	.	.	H	α-helix	trans	-59.2	-32	177.6	-28.3	38.8	0	0	0	113.6	P78 L80 N112 Y120	P78-P116 HydrophobicContact CG-CG 4.11Å; P78-P116 WeakPolarHBondContact O-CG 3.17Å; L80-P116 VanDerWaalsContact CD1-C 3.49Å; L80-P116 HydrophobicContact CD1-CB 3.81Å; L80-P116 VanDerWaalsContact CD1-O 3.26Å; L80-P116 WeakPolarHBondContact CD1-O 3.36Å; N112-P116 WeakPolarHBondContact O-CD 3.33Å; P116-Y120 WeakPolarHBondContact O-CB 3.34Å; P116-Y120 PolarHBondContact O-N 2.87Å
117	V	95.8	Very high	92.6	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-70.8	-45.5	177.7	-176.7	0	0	0	0	110.9	L45 V47 L80 T101 I114 K115 Y120 I121 L172	L45-V117 HydrophobicContact CD1-CG1 4.4Å; L45-V117 HydrophobicContact CD2-CG1 3.57Å; V47-V117 HydrophobicContact CG2-CG1 4.02Å; L80-V117 HydrophobicContact CD1-CG2 4.37Å; L80-V117 HydrophobicContact CD2-CG2 4.41Å; T101-V117 HydrophobicContact CG2-CG2 3.63Å; I114-V117 HydrophobicContact CD1-CB 3.95Å; I114-V117 HydrophobicContact CD1-CG1 4.31Å; I114-V117 HydrophobicContact CD1-CG2 4.11Å; I114-V117 WeakPolarHBondContact O-CB 3.33Å; I114-V117 PolarHBondContact O-N 2.98Å; I114-V117 VanDerWaalsContact O-N 3.1Å; K115-V117 PolarHBondContact O-N 2.85Å; V117-Y120 PolarHBondContact O-N 3.37Å; V117-I121 HydrophobicContact CG1-CD1 4.23Å; V117-I121 WeakPolarHBondContact O-CG1 3.45Å; V117-I121 PolarHBondContact O-N 2.82Å; V117-I121 VanDerWaalsContact O-N 3.08Å; V117-L172 HydrophobicContact CG1-CD2 4.08Å
118	V	96.1	Very high	93.1	Very high	21 Å²	21	54.5 Å²	54.5	13%	0.127	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-47.1	175.8	172.8	0	0	0	0	110.7	I114 K115 Y120 I121 D122 L172 K175	I114-V118 HydrophobicContact CG1-CG2 4.3Å; I114-V118 PolarHBondContact O-N 3.34Å; K115-V118 PolarHBondContact O-N 3.23Å; K115-V118 VanDerWaalsContact O-N 3.16Å; V118-Y120 VanDerWaalsContact C-N 3.27Å; V118-Y120 PolarHBondContact O-N 2.77Å; V118-I121 PolarHBondContact O-N 3.44Å; V118-D122 WeakPolarHBondContact O-CB 3.46Å; V118-D122 PolarHBondContact O-N 2.99Å; V118-L172 HydrophobicContact CG2-CD2 4.28Å; V118-K175 HydrophobicContact CG1-CD 3.77Å
119	D	96.1	Very high	93.5	Very high	71 Å²	71	46 Å²	46	38%	0.38	23%	0.229	S	C	.	.	H	α-helix	trans	-60.2	-38	178.2	-67.2	-15.7	0	0	0	111.1	K115 N123	K115-D119 WeakPolarHBondContact CE-OD2 3.43Å; K115-D119 WeakPolarHBondContact CG-OD2 3.41Å; K115-D119 VanDerWaalsContact NZ-CG 3.26Å; K115-D119 IonicContact NZ-OD1 2.72Å; K115-D119 PolarHBondContact NZ-OD1 2.91Å; K115-D119 IonicContact NZ-OD2 3.75Å; K115-D119 PolarHBondContact NZ-OD2 2.86Å; K115-D119 WeakPolarHBondContact O-CB 3.33Å; K115-D119 VanDerWaalsContact O-CG 3.23Å; K115-D119 PolarHBondContact O-N 3.25Å; D119-N123 VanDerWaalsContact O-CB 3.24Å; D119-N123 WeakPolarHBondContact O-CB 3.25Å; D119-N123 PolarHBondContact O-N 3.4Å
120	Y	97.2	Very high	93.7	Very high	44 Å²	44	45 Å²	45	17%	0.173	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-48.8	174.8	178.8	-90.4	0	0	0	112.2	L80 V99 P116 V117 V118 N123 Q124 V147	L80-Y120 HydrophobicContact CD2-CD1 4.07Å; L80-Y120 HydrophobicContact CD2-CD2 4.34Å; L80-Y120 HydrophobicContact CD2-CG 3.82Å; V99-Y120 HydrophobicContact CB-CE1 4.46Å; V99-Y120 HydrophobicContact CG1-CD1 4.41Å; V99-Y120 HydrophobicContact CG1-CE1 3.96Å; V99-Y120 HydrophobicContact CG1-CE2 4.46Å; V99-Y120 HydrophobicContact CG2-CE1 3.91Å; V99-Y120 WeakPolarHBondContact CG2-OH 3.33Å; P116-Y120 WeakPolarHBondContact O-CB 3.34Å; P116-Y120 PolarHBondContact O-N 2.87Å; V117-Y120 PolarHBondContact O-N 3.37Å; V118-Y120 VanDerWaalsContact C-N 3.27Å; V118-Y120 PolarHBondContact O-N 2.77Å; Y120-N123 PolarHBondContact O-N 2.79Å; Y120-Q124 HydrophobicContact CD1-CG 4.22Å; Y120-Q124 HydrophobicContact CE1-CG 3.83Å; Y120-Q124 VanDerWaalsContact O-CG 3.29Å; Y120-Q124 WeakPolarHBondContact O-CG 3.48Å; Y120-Q124 PolarHBondContact O-N 3.38Å; Y120-Q124 VanDerWaalsContact O-N 3.12Å; Y120-Q124 PolarHBondContact O-NE2 2.84Å; Y120-Q124 VanDerWaalsContact O-NE2 3.08Å; Y120-V147 HydrophobicContact CD1-CG2 4.28Å; Y120-V147 HydrophobicContact CE1-CG2 3.9Å
121	I	97.5	Very high	94	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-48.1	179.4	-66.3	163.5	0	0	0	110.1	L45 V117 V118 N123 Q124 F125 V147 L172 K175 V176	L45-I121 HydrophobicContact CD2-CD1 3.95Å; L45-I121 HydrophobicContact CD2-CG1 4.3Å; V117-I121 HydrophobicContact CG1-CD1 4.23Å; V117-I121 WeakPolarHBondContact O-CG1 3.45Å; V117-I121 PolarHBondContact O-N 2.82Å; V117-I121 VanDerWaalsContact O-N 3.08Å; V118-I121 PolarHBondContact O-N 3.44Å; I121-N123 VanDerWaalsContact C-N 3.31Å; I121-N123 PolarHBondContact O-N 3.3Å; I121-Q124 PolarHBondContact O-N 3.45Å; I121-Q124 VanDerWaalsContact O-N 3.08Å; I121-F125 HydrophobicContact CG2-CD2 3.94Å; I121-F125 HydrophobicContact CG2-CE2 3.44Å; I121-F125 VanDerWaalsContact CG2-CE2 3.44Å; I121-F125 HydrophobicContact CG2-CZ 3.96Å; I121-F125 PolarHBondContact O-N 3.22Å; I121-V147 HydrophobicContact CG1-CG2 4.16Å; I121-L172 HydrophobicContact CD1-CD2 3.67Å; I121-K175 HydrophobicContact CG2-CB 4.14Å; I121-V176 HydrophobicContact CD1-CB 4.24Å; I121-V176 HydrophobicContact CD1-CG1 4Å
122	D	97.2	Very high	94.3	Very high	26 Å²	26	37.6 Å²	37.6	14%	0.139	19%	0.187	C	C	.	.	H	α-helix	trans	-62.1	-38.3	179.1	-75.8	-11.3	0	0	0	112	V118 Q124 F125 E126 K175 Y297	V118-D122 WeakPolarHBondContact O-CB 3.46Å; V118-D122 PolarHBondContact O-N 2.99Å; D122-Q124 VanDerWaalsContact C-N 3.31Å; D122-Q124 PolarHBondContact O-N 3.41Å; D122-F125 PolarHBondContact O-N 3.38Å; D122-E126 WeakPolarHBondContact O-CB 3.33Å; D122-E126 PolarHBondContact O-N 2.9Å; D122-K175 IonicContact OD1-NZ 3.92Å; D122-K175 PolarHBondContact OD1-NZ 3.27Å; D122-K175 IonicContact OD2-NZ 3.42Å; D122-K175 PolarHBondContact OD2-NZ 2.9Å; D122-Y297 HydrophobicContact CB-CD2 4.46Å; D122-Y297 HydrophobicContact CB-CE2 3.76Å; D122-Y297 PolarHBondContact O-OH 2.6Å
123	N	97.3	Very high	94.4	Very high	85 Å²	85	34 Å²	34	46%	0.455	17%	0.168	S	C	.	.	H	α-helix	trans	-64.6	-34.6	174.9	-167.8	29.1	0	0	0	112.4	D119 Y120 I121 E126 N127	D119-N123 VanDerWaalsContact O-CB 3.24Å; D119-N123 WeakPolarHBondContact O-CB 3.25Å; D119-N123 PolarHBondContact O-N 3.4Å; Y120-N123 PolarHBondContact O-N 2.79Å; I121-N123 VanDerWaalsContact C-N 3.31Å; I121-N123 PolarHBondContact O-N 3.3Å; N123-E126 PolarHBondContact O-N 2.84Å; N123-N127 WeakPolarHBondContact O-CB 3.39Å; N123-N127 PolarHBondContact O-N 3.4Å; N123-N127 PolarHBondContact O-ND2 3.36Å; N123-N127 VanDerWaalsContact O-ND2 3.16Å
124	Q	97.3	Very high	94.4	Very high	13 Å²	13	39 Å²	39	6%	0.061	19%	0.189	C	C	.	.	H	α-helix	trans	-68.9	-39.5	174.4	-52.2	-36.6	-54.8	0	0	111.6	Y120 I121 D122 E126 N127 Y128 T145 R146	Y120-Q124 HydrophobicContact CD1-CG 4.22Å; Y120-Q124 HydrophobicContact CE1-CG 3.83Å; Y120-Q124 VanDerWaalsContact O-CG 3.29Å; Y120-Q124 WeakPolarHBondContact O-CG 3.48Å; Y120-Q124 PolarHBondContact O-N 3.38Å; Y120-Q124 VanDerWaalsContact O-N 3.12Å; Y120-Q124 PolarHBondContact O-NE2 2.84Å; Y120-Q124 VanDerWaalsContact O-NE2 3.08Å; I121-Q124 PolarHBondContact O-N 3.45Å; I121-Q124 VanDerWaalsContact O-N 3.08Å; D122-Q124 VanDerWaalsContact C-N 3.31Å; D122-Q124 PolarHBondContact O-N 3.41Å; Q124-E126 VanDerWaalsContact C-N 3.34Å; Q124-N127 PolarHBondContact O-N 2.8Å; Q124-Y128 PolarHBondContact O-N 2.91Å; Q124-Y128 VanDerWaalsContact O-N 3.13Å; Q124-T145 WeakPolarHBondContact CG-O 3.36Å; Q124-T145 VanDerWaalsContact OE1-CB 3.32Å; Q124-T145 PolarHBondContact OE1-OG1 2.84Å; Q124-R146 HydrophobicContact CB-CG 4.46Å
125	F	97.7	Very high	93.6	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-40.1	172.7	-66.6	-38	0	0	0	112	I121 D122 Y128 L129 R146 K175 T289 H293 Y294 Y297	I121-F125 HydrophobicContact CG2-CD2 3.94Å; I121-F125 HydrophobicContact CG2-CE2 3.44Å; I121-F125 VanDerWaalsContact CG2-CE2 3.44Å; I121-F125 HydrophobicContact CG2-CZ 3.96Å; I121-F125 PolarHBondContact O-N 3.22Å; D122-F125 PolarHBondContact O-N 3.38Å; F125-Y128 PolarHBondContact O-N 2.87Å; F125-L129 WeakPolarHBondContact O-CB 3.5Å; F125-L129 PolarHBondContact O-N 3.14Å; F125-R146 HydrophobicContact CD1-CB 4.22Å; F125-R146 HydrophobicContact CD1-CG 3.69Å; F125-R146 HydrophobicContact CE1-CB 4.06Å; F125-R146 HydrophobicContact CE1-CG 4.03Å; F125-K175 WeakPolarHBondContact CE2-O 3.5Å; F125-K175 VanDerWaalsContact CZ-O 3.28Å; F125-K175 WeakPolarHBondContact CZ-O 3.39Å; F125-T289 HydrophobicContact CE1-CG2 4.09Å; F125-H293 HydrophobicContact CZ-CB 3.88Å; F125-Y294 HydrophobicContact CB-CD2 4.2Å; F125-Y294 AromaticContact CD1-CD2 3.79Å; F125-Y294 HydrophobicContact CD1-CD2 3.79Å; F125-Y294 HydrophobicContact CD1-CG 4.42Å; F125-Y294 HydrophobicContact CG-CD2 4.27Å; F125-Y297 HydrophobicContact CB-CD1 3.38Å; F125-Y297 HydrophobicContact CB-CD2 4.17Å; F125-Y297 HydrophobicContact CB-CE1 3.64Å; F125-Y297 HydrophobicContact CB-CE2 4.4Å; F125-Y297 HydrophobicContact CB-CG 3.67Å; F125-Y297 HydrophobicContact CD2-CD1 4.48Å; F125-Y297 HydrophobicContact CD2-CD2 4.06Å; F125-Y297 AromaticContact CD2-CG 3.89Å; F125-Y297 HydrophobicContact CD2-CG 3.89Å; F125-Y297 HydrophobicContact CG-CD1 4.27Å; F125-Y297 HydrophobicContact CG-CG 4.12Å
126	E	96.1	Very high	93.1	Very high	36 Å²	36	51 Å²	51	17%	0.168	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-47.7	175.4	-168.2	59.1	-150.1	0	0	111.5	D122 N123 Q124 Y128 L129 Q130 Y297 R301	D122-E126 WeakPolarHBondContact O-CB 3.33Å; D122-E126 PolarHBondContact O-N 2.9Å; N123-E126 PolarHBondContact O-N 2.84Å; Q124-E126 VanDerWaalsContact C-N 3.34Å; E126-Y128 VanDerWaalsContact C-N 3.29Å; E126-Y128 PolarHBondContact O-N 3.36Å; E126-L129 PolarHBondContact O-N 2.83Å; E126-Q130 HydrophobicContact CG-CG 4.37Å; E126-Q130 WeakPolarHBondContact O-CB 3.36Å; E126-Q130 VanDerWaalsContact O-CG 3.28Å; E126-Q130 WeakPolarHBondContact O-CG 3.29Å; E126-Q130 PolarHBondContact O-N 2.88Å; E126-Q130 PolarHBondContact OE1-NE2 3.33Å; E126-Y297 HydrophobicContact CB-CE1 4.46Å; E126-Y297 WeakPolarHBondContact OE2-CE1 3.37Å; E126-Y297 PolarHBondContact OE2-OH 3.07Å; E126-R301 IonicContact OE2-NE 3.39Å
127	N	95.4	Very high	92.6	Very high	67 Å²	67	57.2 Å²	57.2	36%	0.358	27%	0.265	S	S	.	.	H	α-helix	trans	-57.9	-42.4	178	-71	-28.6	0	0	0	112.2	N123 Q124 E131	N123-N127 WeakPolarHBondContact O-CB 3.39Å; N123-N127 PolarHBondContact O-N 3.4Å; N123-N127 PolarHBondContact O-ND2 3.36Å; N123-N127 VanDerWaalsContact O-ND2 3.16Å; Q124-N127 PolarHBondContact O-N 2.8Å; N127-E131 PolarHBondContact O-N 3.38Å
128	Y	95.5	Very high	92.1	Very high	31 Å²	31	59.8 Å²	59.8	12%	0.122	28%	0.283	C	S	.	.	H	α-helix	trans	-66.8	-44.3	176.7	-169	-80.3	0	0	0	111.6	Q124 F125 E126 Q130 E131 E132 M139 F142 R146 Y294	Q124-Y128 PolarHBondContact O-N 2.91Å; Q124-Y128 VanDerWaalsContact O-N 3.13Å; F125-Y128 PolarHBondContact O-N 2.87Å; E126-Y128 VanDerWaalsContact C-N 3.29Å; E126-Y128 PolarHBondContact O-N 3.36Å; Y128-Q130 PolarHBondContact O-N 2.84Å; Y128-E131 PolarHBondContact O-N 3.44Å; Y128-E132 PolarHBondContact O-N 2.82Å; Y128-M139 HydrophobicContact CD1-CE 4.42Å; Y128-M139 HydrophobicContact CE1-CE 3.67Å; Y128-M139 HydrophobicContact CE2-CE 3.85Å; Y128-M139 WeakPolarHBondContact OH-CE 3.23Å; Y128-F142 HydrophobicContact CD2-CD1 4.1Å; Y128-F142 AromaticContact CD2-CE1 3.76Å; Y128-F142 HydrophobicContact CD2-CE1 3.76Å; Y128-F142 HydrophobicContact CE2-CD1 4.45Å; Y128-F142 HydrophobicContact CG-CE1 4.35Å; Y128-R146 HydrophobicContact CD2-CG 4.42Å; Y128-R146 VanDerWaalsContact CD2-NE 3.34Å; Y128-R146 VanDerWaalsContact CE2-NH2 3.27Å; Y128-R146 HydrophobicContact CG-CG 4.45Å; Y128-R146 VanDerWaalsContact CZ-CZ 3.48Å; Y128-Y294 HydrophobicContact CD1-CD2 4.26Å; Y128-Y294 AromaticContact CD1-CE1 3.97Å; Y128-Y294 HydrophobicContact CD1-CE1 3.97Å; Y128-Y294 AromaticContact CD1-CE2 3.58Å; Y128-Y294 HydrophobicContact CD1-CE2 3.58Å; Y128-Y294 AromaticContact CD1-CZ 3.41Å; Y128-Y294 VanDerWaalsContact CD1-CZ 3.41Å; Y128-Y294 WeakPolarHBondContact CD1-OH 3.34Å; Y128-Y294 AromaticContact CE1-CE1 3.96Å; Y128-Y294 HydrophobicContact CE1-CE1 3.96Å; Y128-Y294 HydrophobicContact CE1-CE2 4.39Å; Y128-Y294 AromaticContact CE1-CZ 3.87Å; Y128-Y294 HydrophobicContact CG-CE2 4.27Å
129	L	94.1	Very high	91.6	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-45.2	177.4	179.1	57.9	0	0	0	111.3	F125 E126 E131 E132 L133 Y294 Y297 R298 R301 M305	F125-L129 WeakPolarHBondContact O-CB 3.5Å; F125-L129 PolarHBondContact O-N 3.14Å; E126-L129 PolarHBondContact O-N 2.83Å; L129-E131 VanDerWaalsContact C-N 3.3Å; L129-E131 PolarHBondContact O-N 3.37Å; L129-E132 WeakPolarHBondContact O-CB 3.28Å; L129-E132 PolarHBondContact O-N 3.41Å; L129-E132 VanDerWaalsContact O-N 3.13Å; L129-L133 HydrophobicContact CD1-CD1 3.82Å; L129-L133 HydrophobicContact CD1-CD2 4.49Å; L129-L133 HydrophobicContact CD1-CG 4.03Å; L129-L133 HydrophobicContact CG-CD1 3.69Å; L129-L133 HydrophobicContact CG-CG 4.38Å; L129-L133 WeakPolarHBondContact O-CB 3.3Å; L129-L133 WeakPolarHBondContact O-CD1 3.31Å; L129-L133 WeakPolarHBondContact O-CG 3.4Å; L129-L133 PolarHBondContact O-N 3.4Å; L129-Y294 VanDerWaalsContact CA-OH 3.32Å; L129-Y294 WeakPolarHBondContact CA-OH 3.3Å; L129-Y294 HydrophobicContact CB-CE2 4.19Å; L129-Y294 WeakPolarHBondContact CD1-OH 3.4Å; L129-Y297 HydrophobicContact CD2-CE1 4.36Å; L129-R298 HydrophobicContact CD1-CG 3.91Å; L129-R301 HydrophobicContact CD2-CB 3.72Å; L129-R301 HydrophobicContact CD2-CG 4.25Å; L129-M305 HydrophobicContact CD2-CE 4.31Å
130	Q	91.6	Very high	90.9	Very high	85 Å²	85	65.2 Å²	65.2	40%	0.397	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-36.8	177.4	-69	-59.2	-34.3	0	0	112.5	E126 Y128 K134	E126-Q130 HydrophobicContact CG-CG 4.37Å; E126-Q130 WeakPolarHBondContact O-CB 3.36Å; E126-Q130 VanDerWaalsContact O-CG 3.28Å; E126-Q130 WeakPolarHBondContact O-CG 3.29Å; E126-Q130 PolarHBondContact O-N 2.88Å; E126-Q130 PolarHBondContact OE1-NE2 3.33Å; Y128-Q130 PolarHBondContact O-N 2.84Å; Q130-K134 WeakPolarHBondContact O-CG 3.36Å; Q130-K134 PolarHBondContact O-N 3.22Å
131	E	91.2	Very high	90.2	Very high	10 Å²	10	67.3 Å²	67.3	5%	0.047	33%	0.331	C	S	.	.	H	α-helix	trans	-68.4	-42.1	172.8	-174.8	68.9	-157.3	0	0	111.9	N127 Y128 L129 L133 K134 S138 M139 F142	N127-E131 PolarHBondContact O-N 3.38Å; Y128-E131 PolarHBondContact O-N 3.44Å; L129-E131 VanDerWaalsContact C-N 3.3Å; L129-E131 PolarHBondContact O-N 3.37Å; E131-L133 PolarHBondContact O-N 2.88Å; E131-K134 WeakPolarHBondContact O-CB 3.25Å; E131-K134 PolarHBondContact O-N 2.85Å; E131-K134 WeakPolarHBondContact OE2-CD 3.31Å; E131-K134 WeakPolarHBondContact OE2-CE 3.39Å; E131-K134 IonicContact OE2-NZ 4Å; E131-K134 PolarHBondContact OE2-NZ 3.49Å; E131-S138 PolarHBondContact OE1-N 3.25Å; E131-S138 PolarHBondContact OE1-OG 3.38Å; E131-M139 HydrophobicContact CB-SD 4.47Å; E131-M139 HydrophobicContact CG-SD 3.83Å; E131-F142 HydrophobicContact CB-CD2 3.75Å; E131-F142 HydrophobicContact CB-CE2 3.75Å; E131-F142 HydrophobicContact CB-CG 4.15Å; E131-F142 HydrophobicContact CB-CZ 4.16Å; E131-F142 HydrophobicContact CG-CB 3.96Å; E131-F142 HydrophobicContact CG-CD1 4.43Å; E131-F142 HydrophobicContact CG-CD2 3.48Å; E131-F142 VanDerWaalsContact CG-CD2 3.48Å; E131-F142 HydrophobicContact CG-CE2 4.04Å; E131-F142 HydrophobicContact CG-CG 3.7Å
132	E	89.7	Confident	89.7	Confident	46 Å²	46	69.8 Å²	69.8	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-36.3	177.9	-166.9	-167.6	157.4	0	0	111.7	Y128 L129 Y294 R298	Y128-E132 PolarHBondContact O-N 2.82Å; L129-E132 WeakPolarHBondContact O-CB 3.28Å; L129-E132 PolarHBondContact O-N 3.41Å; L129-E132 VanDerWaalsContact O-N 3.13Å; E132-Y294 PolarHBondContact OE2-OH 2.89Å; E132-R298 IonicContact OE1-CZ 2.84Å; E132-R298 IonicContact OE1-NE 2.89Å; E132-R298 PolarHBondContact OE1-NE 3.01Å; E132-R298 IonicContact OE1-NH2 3.72Å; E132-R298 PolarHBondContact OE1-NH2 3.33Å; E132-R298 VanDerWaalsContact OE1-NH2 3.12Å; E132-R298 IonicContact OE2-NE 2.78Å; E132-R298 PolarHBondContact OE2-NE 2.92Å; E132-R298 VanDerWaalsContact OE2-NE 3.1Å
133	L	87.2	Confident	89.4	Confident	22 Å²	22	71 Å²	71	12%	0.115	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10.3	-178	-66.4	165.1	0	0	0	114.2	L129 E131 L302 M305 L315 Y319	L129-L133 HydrophobicContact CD1-CD1 3.82Å; L129-L133 HydrophobicContact CD1-CD2 4.49Å; L129-L133 HydrophobicContact CD1-CG 4.03Å; L129-L133 HydrophobicContact CG-CD1 3.69Å; L129-L133 HydrophobicContact CG-CG 4.38Å; L129-L133 WeakPolarHBondContact O-CB 3.3Å; L129-L133 WeakPolarHBondContact O-CD1 3.31Å; L129-L133 WeakPolarHBondContact O-CG 3.4Å; L129-L133 PolarHBondContact O-N 3.4Å; E131-L133 PolarHBondContact O-N 2.88Å; L133-L302 HydrophobicContact CD2-CD2 4.49Å; L133-M305 HydrophobicContact CD1-SD 4.45Å; L133-L315 HydrophobicContact CD2-CD1 4.15Å; L133-L315 HydrophobicContact CD2-CD2 4.14Å; L133-Y319 WeakPolarHBondContact CD1-OH 3.27Å; L133-Y319 HydrophobicContact CD2-CE2 3.9Å; L133-Y319 WeakPolarHBondContact CD2-OH 3.36Å; L133-Y319 WeakPolarHBondContact CG-OH 3.44Å
134	K	87.1	Confident	89.2	Confident	112 Å²	112	67.6 Å²	67.6	49%	0.487	33%	0.329	S	S	.	.			trans	-66.3	138	177.6	-75.3	174.6	-172.8	172.7	0	111.1	Q130 E131 K136 R137	Q130-K134 WeakPolarHBondContact O-CG 3.36Å; Q130-K134 PolarHBondContact O-N 3.22Å; E131-K134 WeakPolarHBondContact O-CB 3.25Å; E131-K134 PolarHBondContact O-N 2.85Å; E131-K134 WeakPolarHBondContact OE2-CD 3.31Å; E131-K134 WeakPolarHBondContact OE2-CE 3.39Å; E131-K134 IonicContact OE2-NZ 4Å; E131-K134 PolarHBondContact OE2-NZ 3.49Å; K134-K136 VanDerWaalsContact C-N 3.35Å; K134-K136 PolarHBondContact O-N 2.83Å; K134-R137 PolarHBondContact O-N 3.44Å
135	M	78.3	Confident	89.2	Confident	162 Å²	162	68.4 Å²	68.4	80%	0.798	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-45.9	174.1	-66.2	-179.5	72	0	0	112.2
136	K	82.7	Confident	89.2	Confident	200 Å²	200	68.8 Å²	68.8	87%	0.87	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	75.1	172.1	-68.3	-174	179.3	-178.4	0	108.8	K134	K134-K136 VanDerWaalsContact C-N 3.35Å; K134-K136 PolarHBondContact O-N 2.83Å
137	R	84.3	Confident	89.2	Confident	167 Å²	167	67.1 Å²	67.1	63%	0.63	33%	0.328	S	S	*	.			trans	-70.3	141.6	177.5	62.3	-172.9	-179.3	-179.2	0.6	111.5	K134 M139	K134-R137 PolarHBondContact O-N 3.44Å; R137-M139 HydrophobicContact CB-CG 4.35Å; R137-M139 HydrophobicContact CG-CG 4.46Å
138	S	85.3	Confident	89.3	Confident	55 Å²	55	64 Å²	64	39%	0.385	31%	0.311	S	S	.	.			trans	-123.2	49.8	177	61.2	0	0	0	0	111.4	E131 Q140 A141 F142	E131-S138 PolarHBondContact OE1-N 3.25Å; E131-S138 PolarHBondContact OE1-OG 3.38Å; S138-Q140 PolarHBondContact O-N 2.88Å; S138-A141 CarbonylContact O-C 3.6Å; S138-A141 WeakPolarHBondContact O-CA 3.48Å; S138-A141 PolarHBondContact O-N 3.5Å; S138-F142 PolarHBondContact O-N 2.92Å
139	M	84.3	Confident	89.4	Confident	44 Å²	44	62.5 Å²	62.5	22%	0.217	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-33.1	-172.6	-60.2	-53.8	-66.2	0	0	113.9	Y128 E131 R137 A141	Y128-M139 HydrophobicContact CD1-CE 4.42Å; Y128-M139 HydrophobicContact CE1-CE 3.67Å; Y128-M139 HydrophobicContact CE2-CE 3.85Å; Y128-M139 WeakPolarHBondContact OH-CE 3.23Å; E131-M139 HydrophobicContact CB-SD 4.47Å; E131-M139 HydrophobicContact CG-SD 3.83Å; R137-M139 HydrophobicContact CB-CG 4.35Å; R137-M139 HydrophobicContact CG-CG 4.46Å; M139-A141 VanDerWaalsContact C-N 3.35Å
140	Q	80.9	Confident	89.6	Confident	163 Å²	163	62.5 Å²	62.5	76%	0.762	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-26	178	-63.7	78.2	22.7	0	0	113.3	S138	S138-Q140 PolarHBondContact O-N 2.88Å
141	A	82.9	Confident	89.9	Confident	88 Å²	88	58.4 Å²	58.4	73%	0.727	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-14.8	176.9	0	0	0	0	0	112.2	S138 M139	S138-A141 CarbonylContact O-C 3.6Å; S138-A141 WeakPolarHBondContact O-CA 3.48Å; S138-A141 PolarHBondContact O-N 3.5Å; M139-A141 VanDerWaalsContact C-N 3.35Å
142	F	88.5	Confident	90.2	Very high	53 Å²	53	58 Å²	58	23%	0.232	28%	0.284	C	S	.	.	S	Bend	trans	-70	129.7	178.8	-174.3	-102	0	0	0	110.8	Y128 E131 S138 D144	Y128-F142 HydrophobicContact CD2-CD1 4.1Å; Y128-F142 AromaticContact CD2-CE1 3.76Å; Y128-F142 HydrophobicContact CD2-CE1 3.76Å; Y128-F142 HydrophobicContact CE2-CD1 4.45Å; Y128-F142 HydrophobicContact CG-CE1 4.35Å; E131-F142 HydrophobicContact CB-CD2 3.75Å; E131-F142 HydrophobicContact CB-CE2 3.75Å; E131-F142 HydrophobicContact CB-CG 4.15Å; E131-F142 HydrophobicContact CB-CZ 4.16Å; E131-F142 HydrophobicContact CG-CB 3.96Å; E131-F142 HydrophobicContact CG-CD1 4.43Å; E131-F142 HydrophobicContact CG-CD2 3.48Å; E131-F142 VanDerWaalsContact CG-CD2 3.48Å; E131-F142 HydrophobicContact CG-CE2 4.04Å; E131-F142 HydrophobicContact CG-CG 3.7Å; S138-F142 PolarHBondContact O-N 2.92Å; F142-D144 PolarHBondContact O-N 3.14Å
143	H	89.9	Confident	90.6	Very high	51 Å²	51	56 Å²	56	24%	0.236	28%	0.275	C	S	.	.			trans	-81.5	109.1	174.8	178.1	45.5	0	0	0	109.6	K95 T145	K95-H143 VanDerWaalsContact CD-CE1 3.47Å; K95-H143 WeakPolarHBondContact CD-CE1 3.4Å; K95-H143 WeakPolarHBondContact CE-CE1 3.37Å; K95-H143 WeakPolarHBondContact CE-NE2 3.25Å; K95-H143 PolarHBondContact NZ-ND1 3.44Å; H143-T145 PolarHBondContact O-N 3.43Å
144	D	94	Very high	91	Very high	13 Å²	13	55 Å²	55	7%	0.07	27%	0.27	C	S	.	.			trans	-68.5	112.7	174.9	-171	0.8	0	0	0	111	V41 N43 F142 R146 H148	V41-D144 HydrophobicContact CG2-CB 4.06Å; N43-D144 PolarHBondContact ND2-O 2.88Å; F142-D144 PolarHBondContact O-N 3.14Å; D144-R146 VanDerWaalsContact OD1-CB 3.26Å; D144-R146 WeakPolarHBondContact OD1-CB 3.47Å; D144-R146 WeakPolarHBondContact OD1-CG 3.37Å; D144-R146 IonicContact OD1-CZ 3.69Å; D144-R146 PolarHBondContact OD1-N 3.14Å; D144-R146 IonicContact OD1-NE 3.59Å; D144-R146 PolarHBondContact OD1-NE 3.25Å; D144-R146 IonicContact OD1-NH2 3.97Å; D144-R146 IonicContact OD2-CZ 3.32Å; D144-R146 IonicContact OD2-NE 3.87Å; D144-R146 PolarHBondContact OD2-NE 3.01Å; D144-R146 IonicContact OD2-NH2 3.57Å; D144-R146 PolarHBondContact OD2-NH2 2.78Å; D144-H148 IonicContact OD2-NE2 2.73Å
145	T	95.9	Very high	91.4	Very high	30 Å²	30	50.3 Å²	50.3	18%	0.184	25%	0.252	C	S	.	.			trans	-102	2.7	178.1	59.8	0	0	0	0	113.1	N43 Q124 H143	N43-T145 VanDerWaalsContact ND2-C 3.29Å; N43-T145 WeakPolarHBondContact ND2-CA 3.3Å; Q124-T145 WeakPolarHBondContact CG-O 3.36Å; Q124-T145 VanDerWaalsContact OE1-CB 3.32Å; Q124-T145 PolarHBondContact OE1-OG1 2.84Å; H143-T145 PolarHBondContact O-N 3.43Å
146	R	97.6	Very high	92.2	Very high	9 Å²	9	44.1 Å²	44.1	3%	0.034	22%	0.224	C	C	.	.			trans	-62.2	137.6	-179.8	-63.2	175.3	-64.2	177.7	5.3	110.4	N43 Q124 F125 Y128 D144 H148 T289 H290	N43-R146 VanDerWaalsContact CB-O 3.24Å; N43-R146 WeakPolarHBondContact CB-O 3.3Å; N43-R146 PolarHBondContact ND2-O 2.87Å; Q124-R146 HydrophobicContact CB-CG 4.46Å; F125-R146 HydrophobicContact CD1-CB 4.22Å; F125-R146 HydrophobicContact CD1-CG 3.69Å; F125-R146 HydrophobicContact CE1-CB 4.06Å; F125-R146 HydrophobicContact CE1-CG 4.03Å; Y128-R146 HydrophobicContact CD2-CG 4.42Å; Y128-R146 VanDerWaalsContact CD2-NE 3.34Å; Y128-R146 VanDerWaalsContact CE2-NH2 3.27Å; Y128-R146 HydrophobicContact CG-CG 4.45Å; Y128-R146 VanDerWaalsContact CZ-CZ 3.48Å; D144-R146 VanDerWaalsContact OD1-CB 3.26Å; D144-R146 WeakPolarHBondContact OD1-CB 3.47Å; D144-R146 WeakPolarHBondContact OD1-CG 3.37Å; D144-R146 IonicContact OD1-CZ 3.69Å; D144-R146 PolarHBondContact OD1-N 3.14Å; D144-R146 IonicContact OD1-NE 3.59Å; D144-R146 PolarHBondContact OD1-NE 3.25Å; D144-R146 IonicContact OD1-NH2 3.97Å; D144-R146 IonicContact OD2-CZ 3.32Å; D144-R146 IonicContact OD2-NE 3.87Å; D144-R146 PolarHBondContact OD2-NE 3.01Å; D144-R146 IonicContact OD2-NH2 3.57Å; D144-R146 PolarHBondContact OD2-NH2 2.78Å; R146-H148 PolarHBondContact O-CD2 2.84Å; R146-H148 PolarHBondContact O-N 3.12Å; R146-H148 PolarHBondContact O-NE2 3.39Å; R146-T289 HydrophobicContact CB-CG2 4.16Å; R146-H290 PolarHBondContact NH1-ND1 3.12Å
147	V	97.9	Very high	92.6	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	20%	0.199	C	C	.	.			trans	-72.1	119.3	-179.5	-177.8	0	0	0	0	109.3	L45 Y120 I121 V149 V176 T289	L45-V147 HydrophobicContact CB-CG1 3.46Å; L45-V147 VanDerWaalsContact CB-CG1 3.46Å; L45-V147 HydrophobicContact CB-CG2 4.39Å; L45-V147 HydrophobicContact CD2-CG1 4.36Å; Y120-V147 HydrophobicContact CD1-CG2 4.28Å; Y120-V147 HydrophobicContact CE1-CG2 3.9Å; I121-V147 HydrophobicContact CG1-CG2 4.16Å; V147-V149 WeakPolarHBondContact CG1-O 3.14Å; V147-V176 HydrophobicContact CB-CG2 4.17Å; V147-V176 HydrophobicContact CG1-CG2 3.6Å; V147-T289 WeakPolarHBondContact O-CG2 3.5Å; V147-T289 PolarHBondContact O-OG1 2.89Å
148	H	97	Very high	92.8	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	18%	0.179	C	C	.	.			trans	-86.2	-31	-179.6	-54	132.2	0	0	0	112.2	V41 F42 N43 D144 R146 N177 R286 T289	V41-H148 PolarHBondContact O-CE1 3.24Å; F42-H148 WeakPolarHBondContact CA-ND1 3.46Å; F42-H148 HydrophobicContact CD2-CB 3.99Å; F42-H148 AromaticContact CD2-ND1 3.61Å; F42-H148 HydrophobicContact CE2-CB 3.77Å; N43-H148 PolarHBondContact N-ND1 2.86Å; N43-H148 PolarHBondContact ND2-CE1 3.35Å; N43-H148 PolarHBondContact O-N 3.19Å; D144-H148 IonicContact OD2-NE2 2.73Å; R146-H148 PolarHBondContact O-CD2 2.84Å; R146-H148 PolarHBondContact O-N 3.12Å; R146-H148 PolarHBondContact O-NE2 3.39Å; H148-N177 WeakPolarHBondContact O-CB 3.41Å; H148-N177 PolarHBondContact O-ND2 2.86Å; H148-R286 HydrophobicContact CB-CG 4.3Å; H148-T289 WeakPolarHBondContact CA-OG1 3.26Å; H148-T289 PolarHBondContact O-OG1 3.17Å
149	V	97.4	Very high	93.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	140.7	-180	56.5	0	0	0	0	111.4	F42 N43 I44 L45 V147 L151 I179 L277 L285	F42-V149 HydrophobicContact CE1-CG1 3.94Å; F42-V149 HydrophobicContact CE2-CG1 4.35Å; F42-V149 HydrophobicContact CZ-CB 4.48Å; F42-V149 HydrophobicContact CZ-CG1 3.57Å; N43-V149 PolarHBondContact O-N 3.08Å; I44-V149 HydrophobicContact CB-CG1 4.18Å; I44-V149 HydrophobicContact CD1-CG1 4.44Å; I44-V149 HydrophobicContact CG1-CG1 3.72Å; I44-V149 HydrophobicContact CG2-CG1 4.13Å; L45-V149 PolarHBondContact N-O 2.91Å; V147-V149 WeakPolarHBondContact CG1-O 3.14Å; V149-L151 HydrophobicContact CG2-CD2 4.04Å; V149-I179 HydrophobicContact CG2-CD1 3.6Å; V149-I179 HydrophobicContact CG2-CG1 4.38Å; V149-L277 HydrophobicContact CG1-CD2 4.41Å; V149-L277 HydrophobicContact CG2-CD2 3.91Å; V149-L285 HydrophobicContact CB-CD1 4.24Å; V149-L285 HydrophobicContact CB-CD2 4.22Å; V149-L285 HydrophobicContact CG2-CD2 4.48Å
150	C	97.7	Very high	93.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	110	171	176	0	0	0	0	109.6	L45 Y152 V176 N177 I179	L45-C150 HydrophobicContact CB-CB 4.45Å; L45-C150 HydrophobicContact CD2-CB 4.26Å; L45-C150 CarbonylContact O-C 3.59Å; L45-C150 VanDerWaalsContact O-CA 3.3Å; L45-C150 WeakPolarHBondContact O-CA 3.4Å; C150-Y152 PolarHBondContact O-N 3.36Å; C150-V176 HydrophobicContact CB-CB 4.3Å; C150-V176 HydrophobicContact CB-CG1 3.59Å; C150-V176 HydrophobicContact CB-CG2 3.67Å; C150-N177 PolarHBondContact N-O 2.93Å; C150-I179 PolarHBondContact O-N 3.34Å
151	L	97.5	Very high	94	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	110.2	168.1	-58	-176	0	0	0	108.6	I44 L45 V47 L57 V149 F153 I179 L273 L277	I44-L151 HydrophobicContact CG2-CD1 4.19Å; I44-L151 HydrophobicContact CG2-CG 4.19Å; L45-L151 PolarHBondContact O-N 3.42Å; V47-L151 PolarHBondContact N-O 2.86Å; L57-L151 HydrophobicContact CD2-CD1 4.43Å; V149-L151 HydrophobicContact CG2-CD2 4.04Å; L151-F153 HydrophobicContact CB-CD2 4.42Å; L151-F153 HydrophobicContact CB-CE2 3.86Å; L151-F153 WeakPolarHBondContact O-CD2 3.33Å; L151-I179 HydrophobicContact CD2-CB 4.08Å; L151-I179 HydrophobicContact CD2-CG2 4.14Å; L151-L273 HydrophobicContact CD2-CD1 4.37Å; L151-L277 HydrophobicContact CD1-CD1 4.19Å; L151-L277 HydrophobicContact CD2-CD1 4.02Å; L151-L277 HydrophobicContact CD2-CD2 4.3Å
152	Y	97.6	Very high	94.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	108.1	179.7	-163.3	-81.1	0	0	0	110.2	V47 Y104 C150 I154 D165 A168 M169 L172 I179 P180 V181	V47-Y152 HydrophobicContact CB-CD2 3.92Å; V47-Y152 HydrophobicContact CB-CE2 4.13Å; V47-Y152 HydrophobicContact CG1-CD2 3.91Å; V47-Y152 HydrophobicContact CG1-CE2 3.58Å; Y104-Y152 PolarHBondContact OH-OH 2.93Å; C150-Y152 PolarHBondContact O-N 3.36Å; Y152-I154 HydrophobicContact CD1-CG1 4.15Å; Y152-I154 PolarHBondContact O-N 2.75Å; Y152-D165 HydrophobicContact CE1-CB 3.88Å; Y152-D165 WeakPolarHBondContact OH-CA 3.35Å; Y152-D165 PolarHBondContact OH-OD1 3.33Å; Y152-A168 HydrophobicContact CE2-CB 3.75Å; Y152-A168 WeakPolarHBondContact OH-CB 3.25Å; Y152-M169 HydrophobicContact CD1-CG 4.01Å; Y152-M169 HydrophobicContact CD1-SD 4.12Å; Y152-M169 HydrophobicContact CD2-CG 3.97Å; Y152-M169 HydrophobicContact CE1-CG 4.21Å; Y152-M169 HydrophobicContact CE2-CG 4.15Å; Y152-M169 HydrophobicContact CG-CG 3.91Å; Y152-M169 HydrophobicContact CG-SD 4.35Å; Y152-L172 HydrophobicContact CD2-CD1 4.3Å; Y152-I179 PolarHBondContact N-O 3.43Å; Y152-P180 WeakPolarHBondContact O-CA 3.25Å; Y152-V181 PolarHBondContact O-N 2.92Å
153	F	97.7	Very high	94.7	Very high	5 Å²	5	28.1 Å²	28.1	2%	0.022	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	110.8	-175.3	-70.9	-114	0	0	0	110.6	C46 V47 I52 K54 L57 L151 V181 A183	C46-F153 HydrophobicContact CB-CE2 3.84Å; V47-F153 PolarHBondContact O-N 2.83Å; I52-F153 HydrophobicContact CG1-CB 4.19Å; I52-F153 HydrophobicContact CG2-CB 3.93Å; I52-F153 HydrophobicContact CG2-CD1 4.11Å; I52-F153 HydrophobicContact CG2-CG 4.17Å; K54-F153 HydrophobicContact CB-CE2 4.38Å; K54-F153 HydrophobicContact CB-CZ 4.21Å; K54-F153 HydrophobicContact CG-CD1 4.3Å; K54-F153 HydrophobicContact CG-CD2 4.01Å; K54-F153 HydrophobicContact CG-CE1 4.29Å; K54-F153 HydrophobicContact CG-CE2 4.01Å; K54-F153 HydrophobicContact CG-CG 4.17Å; K54-F153 HydrophobicContact CG-CZ 4.14Å; L57-F153 HydrophobicContact CB-CE1 4.02Å; L57-F153 HydrophobicContact CB-CZ 4.01Å; L57-F153 HydrophobicContact CD2-CE1 3.58Å; L57-F153 HydrophobicContact CD2-CE2 4.41Å; L57-F153 HydrophobicContact CD2-CZ 3.37Å; L57-F153 HydrophobicContact CG-CE1 4.43Å; L57-F153 HydrophobicContact CG-CZ 4.3Å; L151-F153 HydrophobicContact CB-CD2 4.42Å; L151-F153 HydrophobicContact CB-CE2 3.86Å; L151-F153 WeakPolarHBondContact O-CD2 3.33Å; F153-V181 CarbonylContact C-O 3.59Å; F153-V181 WeakPolarHBondContact CA-O 3.39Å; F153-V181 HydrophobicContact CB-CG2 4.31Å; F153-V181 HydrophobicContact CD1-CG2 3.93Å; F153-V181 HydrophobicContact CD2-CG2 3.92Å; F153-V181 HydrophobicContact CE1-CG2 4.23Å; F153-V181 HydrophobicContact CE2-CG2 4.21Å; F153-V181 HydrophobicContact CG-CG2 3.77Å; F153-V181 HydrophobicContact CZ-CG2 4.37Å; F153-A183 HydrophobicContact CB-CB 4.36Å; F153-A183 HydrophobicContact CD1-CB 3.81Å
154	I	96.9	Very high	94.8	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.8	174.1	-60.4	163.9	0	0	0	108.4	Y152 L161 P180 V181 A183 F196 I200	Y152-I154 HydrophobicContact CD1-CG1 4.15Å; Y152-I154 PolarHBondContact O-N 2.75Å; I154-L161 HydrophobicContact CD1-CD2 3.73Å; I154-L161 HydrophobicContact CG1-CD2 3.93Å; I154-L161 HydrophobicContact CG2-CD2 3.81Å; I154-P180 HydrophobicContact CD1-CB 3.77Å; I154-V181 PolarHBondContact N-O 2.89Å; I154-A183 PolarHBondContact O-N 2.9Å; I154-F196 HydrophobicContact CG2-CE1 4.49Å; I154-F196 HydrophobicContact CG2-CZ 4.02Å; I154-I200 HydrophobicContact CD1-CD1 4.15Å; I154-I200 HydrophobicContact CD1-CG2 3.92Å; I154-I200 HydrophobicContact CG2-CD1 4.14Å
155	A	95.6	Very high	94.9	Very high	12 Å²	12	26 Å²	26	10%	0.099	15%	0.154	C	C	.	.			trans	-65.3	138.1	176	0	0	0	0	0	111.3	I52 T157 F196	I52-A155 HydrophobicContact CD1-CB 4.19Å; A155-T157 HydrophobicContact CB-CG2 4.12Å; A155-T157 PolarHBondContact O-N 2.84Å; A155-F196 WeakPolarHBondContact O-CZ 3.32Å
156	P	94.4	Very high	94.8	Very high	33 Å²	33	26.2 Å²	26.2	21%	0.214	15%	0.154	C	C	.	.			trans	-77.1	62.1	-178.6	33.8	-37.9	0	0	0	111.8	G158 I182 A183 K184 T187 I188	P156-G158 VanDerWaalsContact C-N 3.32Å; P156-I182 HydrophobicContact CB-CG2 4.32Å; P156-A183 WeakPolarHBondContact CB-O 3.4Å; P156-A183 WeakPolarHBondContact CD-O 3.04Å; P156-A183 VanDerWaalsContact CG-O 3.27Å; P156-A183 WeakPolarHBondContact CG-O 3.24Å; P156-K184 HydrophobicContact CG-CB 4.26Å; P156-T187 WeakPolarHBondContact CB-OG1 3.23Å; P156-T187 WeakPolarHBondContact CG-OG1 3.33Å; P156-I188 HydrophobicContact CB-CD1 3.49Å; P156-I188 VanDerWaalsContact CB-CD1 3.49Å; P156-I188 HydrophobicContact CB-CG1 3.82Å
157	T	92	Very high	94.6	Very high	57 Å²	57	29.3 Å²	29.3	35%	0.35	17%	0.173	S	C	.	.			trans	-75.6	-22	-177.8	62.4	0	0	0	0	112.9	A155 H159	A155-T157 HydrophobicContact CB-CG2 4.12Å; A155-T157 PolarHBondContact O-N 2.84Å; T157-H159 PolarHBondContact O-CD2 3.43Å; T157-H159 VanDerWaalsContact O-CD2 3.31Å; T157-H159 PolarHBondContact O-N 2.9Å; T157-H159 PolarHBondContact OG1-N 3.3Å
158	G	87.2	Confident	94.5	Very high	20 Å²	20	29.3 Å²	29.3	21%	0.206	17%	0.173	C	C	.	.	S	Bend	trans	69.9	11.8	-171.9	0	0	0	0	0	113.9	P156 R199	P156-G158 VanDerWaalsContact C-N 3.32Å; G158-R199 PolarHBondContact O-NH1 3.33Å; G158-R199 PolarHBondContact O-NH2 3.46Å
159	H	91.3	Very high	94.4	Very high	128 Å²	128	29.2 Å²	29.2	59%	0.593	17%	0.173	S	C	*	.	S	Bend	trans	-112.3	-131.2	180	-68.9	-66.9	0	0	0	112.1	T157 F196 R199	T157-H159 PolarHBondContact O-CD2 3.43Å; T157-H159 VanDerWaalsContact O-CD2 3.31Å; T157-H159 PolarHBondContact O-N 2.9Å; T157-H159 PolarHBondContact OG1-N 3.3Å; H159-F196 WeakPolarHBondContact O-CD2 3.36Å; H159-F196 VanDerWaalsContact O-CE2 3.29Å; H159-F196 WeakPolarHBondContact O-CE2 3.05Å; H159-R199 VanDerWaalsContact CA-NH1 3.35Å; H159-R199 VanDerWaalsContact O-CZ 3.27Å; H159-R199 PolarHBondContact O-NE 3.13Å; H159-R199 PolarHBondContact O-NH1 3.16Å
160	S	91.3	Very high	94.3	Very high	55 Å²	55	33.2 Å²	33.2	39%	0.385	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-95.7	172.4	169.2	40.2	0	0	0	0	110.8	E203	S160-E203 VanDerWaalsContact CB-CD 3.5Å; S160-E203 WeakPolarHBondContact CB-OE1 3.41Å; S160-E203 WeakPolarHBondContact CB-OE2 3.48Å
161	L	94	Very high	94.2	Very high	9 Å²	9	37.8 Å²	37.8	5%	0.047	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-59.9	144.4	165.9	-70.3	173.7	0	0	0	110.4	I154 D165 L166 M169 I200 E203 I204	I154-L161 HydrophobicContact CD1-CD2 3.73Å; I154-L161 HydrophobicContact CG1-CD2 3.93Å; I154-L161 HydrophobicContact CG2-CD2 3.81Å; L161-D165 HydrophobicContact CB-CB 4.44Å; L161-D165 HydrophobicContact CD2-CB 4.32Å; L161-L166 HydrophobicContact CB-CD2 4.25Å; L161-L166 HydrophobicContact CB-CG 4.23Å; L161-L166 HydrophobicContact CD1-CD2 3.65Å; L161-L166 HydrophobicContact CD1-CG 4.46Å; L161-M169 HydrophobicContact CD1-CE 3.67Å; L161-M169 HydrophobicContact CD2-CE 4.27Å; L161-I200 HydrophobicContact CD1-CG2 4.22Å; L161-I200 HydrophobicContact CD2-CG1 3.99Å; L161-I200 HydrophobicContact CD2-CG2 4.08Å; L161-I200 HydrophobicContact CG-CG1 4.17Å; L161-I200 HydrophobicContact CG-CG2 4.29Å; L161-E203 VanDerWaalsContact CB-OE2 3.26Å; L161-E203 WeakPolarHBondContact CB-OE2 3.47Å; L161-E203 HydrophobicContact CD1-CB 4.08Å; L161-E203 PolarHBondContact N-OE2 3.18Å; L161-I204 HydrophobicContact CD1-CG1 4.04Å
162	K	93.2	Very high	94.1	Very high	66 Å²	66	37.8 Å²	37.8	29%	0.287	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-71.2	152.1	172.6	-60.5	172.3	174.2	177	0	108.6	E49 I164 D165 L166	E49-K162 IonicContact OE1-NZ 3.88Å; E49-K162 PolarHBondContact OE1-NZ 2.59Å; E49-K162 IonicContact OE2-NZ 3.41Å; E49-K162 PolarHBondContact OE2-NZ 3.33Å; K162-I164 HydrophobicContact CB-CG2 3.81Å; K162-I164 HydrophobicContact CD-CG2 4.48Å; K162-I164 PolarHBondContact O-N 3.13Å; K162-D165 VanDerWaalsContact CB-OD2 3.32Å; K162-D165 WeakPolarHBondContact CB-OD2 3.24Å; K162-D165 PolarHBondContact N-OD2 2.95Å; K162-D165 WeakPolarHBondContact O-CB 3.32Å; K162-D165 PolarHBondContact O-N 3Å; K162-L166 PolarHBondContact O-N 3.47Å
163	S	92.4	Very high	94	Very high	98 Å²	98	39 Å²	39	69%	0.685	22%	0.216	S	C	*	.	H	α-helix	trans	-57.1	-35.9	176.3	53.9	0	0	0	0	112.7	D165 L166 V167	S163-D165 VanDerWaalsContact C-N 3.29Å; S163-D165 PolarHBondContact O-N 3.34Å; S163-L166 PolarHBondContact O-N 2.78Å; S163-V167 WeakPolarHBondContact O-CG2 3.41Å; S163-V167 PolarHBondContact O-N 3.33Å
164	I	92.9	Very high	93.8	Very high	16 Å²	16	43.8 Å²	43.8	8%	0.082	24%	0.242	C	C	.	.	H	α-helix	trans	-60.6	-37.6	173.5	-174	178.1	0	0	0	112.1	Y104 K110 N113 K162 V167 A168	Y104-I164 HydrophobicContact CE1-CD1 4.01Å; Y104-I164 HydrophobicContact CE2-CD1 4.44Å; K110-I164 HydrophobicContact CB-CD1 3.97Å; K110-I164 HydrophobicContact CB-CG1 4.44Å; K110-I164 HydrophobicContact CD-CD1 4.03Å; K110-I164 HydrophobicContact CG-CD1 4.34Å; N113-I164 HydrophobicContact CB-CD1 4.35Å; K162-I164 HydrophobicContact CB-CG2 3.81Å; K162-I164 HydrophobicContact CD-CG2 4.48Å; K162-I164 PolarHBondContact O-N 3.13Å; I164-V167 PolarHBondContact O-N 2.62Å; I164-A168 WeakPolarHBondContact O-CB 3.21Å; I164-A168 PolarHBondContact O-N 2.87Å
165	D	94.9	Very high	93.8	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.027	25%	0.252	C	S	.	.	H	α-helix	trans	-67.7	-43.8	-177.6	-55.8	-32.6	0	0	0	110.8	Y152 L161 K162 S163 A168 M169	Y152-D165 HydrophobicContact CE1-CB 3.88Å; Y152-D165 WeakPolarHBondContact OH-CA 3.35Å; Y152-D165 PolarHBondContact OH-OD1 3.33Å; L161-D165 HydrophobicContact CB-CB 4.44Å; L161-D165 HydrophobicContact CD2-CB 4.32Å; K162-D165 VanDerWaalsContact CB-OD2 3.32Å; K162-D165 WeakPolarHBondContact CB-OD2 3.24Å; K162-D165 PolarHBondContact N-OD2 2.95Å; K162-D165 WeakPolarHBondContact O-CB 3.32Å; K162-D165 PolarHBondContact O-N 3Å; S163-D165 VanDerWaalsContact C-N 3.29Å; S163-D165 PolarHBondContact O-N 3.34Å; D165-A168 PolarHBondContact O-N 3.46Å; D165-M169 HydrophobicContact CB-CE 4.29Å; D165-M169 WeakPolarHBondContact O-CB 3.5Å; D165-M169 WeakPolarHBondContact O-CG 3.33Å; D165-M169 PolarHBondContact O-N 3.06Å
166	L	94.3	Very high	93.9	Very high	33 Å²	33	45.6 Å²	45.6	17%	0.173	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-50.2	176.2	-66.8	174.4	0	0	0	111.5	L161 K162 S163 A168 K170 E203 N207 I209	L161-L166 HydrophobicContact CB-CD2 4.25Å; L161-L166 HydrophobicContact CB-CG 4.23Å; L161-L166 HydrophobicContact CD1-CD2 3.65Å; L161-L166 HydrophobicContact CD1-CG 4.46Å; K162-L166 PolarHBondContact O-N 3.47Å; S163-L166 PolarHBondContact O-N 2.78Å; L166-A168 VanDerWaalsContact C-N 3.3Å; L166-A168 PolarHBondContact O-N 2.85Å; L166-K170 VanDerWaalsContact O-CB 3.26Å; L166-K170 WeakPolarHBondContact O-CB 3.42Å; L166-K170 PolarHBondContact O-N 3.39Å; L166-E203 HydrophobicContact CD2-CB 4.45Å; L166-N207 HydrophobicContact CD2-CB 4.47Å; L166-I209 HydrophobicContact CD2-CD1 3.73Å
167	V	93.7	Very high	94	Very high	74 Å²	74	44.1 Å²	44.1	45%	0.448	24%	0.238	S	C	.	.	H	α-helix	trans	-62.3	-39.3	179.5	173.8	0	0	0	0	111.4	S163 I164 K171	S163-V167 WeakPolarHBondContact O-CG2 3.41Å; S163-V167 PolarHBondContact O-N 3.33Å; I164-V167 PolarHBondContact O-N 2.62Å; V167-K171 HydrophobicContact CG1-CD 4.3Å; V167-K171 WeakPolarHBondContact O-CG 3.41Å; V167-K171 PolarHBondContact O-N 3.4Å
168	A	95.3	Very high	94.3	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-70.4	-50.4	-178.9	0	0	0	0	0	112.5	Y104 I114 Y152 I164 D165 L166 K170 K171 L172	Y104-A168 WeakPolarHBondContact OH-CB 3.42Å; I114-A168 HydrophobicContact CB-CB 4.4Å; I114-A168 HydrophobicContact CD1-CB 3.87Å; I114-A168 HydrophobicContact CG1-CB 4.04Å; Y152-A168 HydrophobicContact CE2-CB 3.75Å; Y152-A168 WeakPolarHBondContact OH-CB 3.25Å; I164-A168 WeakPolarHBondContact O-CB 3.21Å; I164-A168 PolarHBondContact O-N 2.87Å; D165-A168 PolarHBondContact O-N 3.46Å; L166-A168 VanDerWaalsContact C-N 3.3Å; L166-A168 PolarHBondContact O-N 2.85Å; A168-K170 VanDerWaalsContact C-N 3.28Å; A168-K170 PolarHBondContact O-N 3.35Å; A168-K171 PolarHBondContact O-N 3.16Å; A168-L172 WeakPolarHBondContact O-CG 3.19Å; A168-L172 PolarHBondContact O-N 3.1Å; A168-L172 VanDerWaalsContact O-N 3.1Å
169	M	95.8	Very high	94.8	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-39.1	178.4	-68.7	-172.4	-74.7	0	0	111.1	Y152 L161 D165 K171 L172 E173 V178 I204 I209	Y152-M169 HydrophobicContact CD1-CG 4.01Å; Y152-M169 HydrophobicContact CD1-SD 4.12Å; Y152-M169 HydrophobicContact CD2-CG 3.97Å; Y152-M169 HydrophobicContact CE1-CG 4.21Å; Y152-M169 HydrophobicContact CE2-CG 4.15Å; Y152-M169 HydrophobicContact CG-CG 3.91Å; Y152-M169 HydrophobicContact CG-SD 4.35Å; L161-M169 HydrophobicContact CD1-CE 3.67Å; L161-M169 HydrophobicContact CD2-CE 4.27Å; D165-M169 HydrophobicContact CB-CE 4.29Å; D165-M169 WeakPolarHBondContact O-CB 3.5Å; D165-M169 WeakPolarHBondContact O-CG 3.33Å; D165-M169 PolarHBondContact O-N 3.06Å; M169-K171 VanDerWaalsContact C-N 3.31Å; M169-K171 PolarHBondContact O-N 3.19Å; M169-L172 PolarHBondContact O-N 2.85Å; M169-L172 VanDerWaalsContact O-N 3.07Å; M169-E173 PolarHBondContact O-N 2.73Å; M169-V178 HydrophobicContact CG-CG1 4.33Å; M169-I204 HydrophobicContact CE-CG1 4.32Å; M169-I209 HydrophobicContact CB-CD1 4.33Å; M169-I209 HydrophobicContact CB-CG2 3.74Å; M169-I209 HydrophobicContact CE-CD1 4.45Å
170	K	95.3	Very high	95.1	Very high	84 Å²	84	34.4 Å²	34.4	37%	0.365	18%	0.183	S	C	.	.	H	α-helix	trans	-61.5	-36.8	176	-168.7	62.8	178.6	163.1	0	112.9	L166 A168 L172 E173 E208 I209	L166-K170 VanDerWaalsContact O-CB 3.26Å; L166-K170 WeakPolarHBondContact O-CB 3.42Å; L166-K170 PolarHBondContact O-N 3.39Å; A168-K170 VanDerWaalsContact C-N 3.28Å; A168-K170 PolarHBondContact O-N 3.35Å; K170-L172 VanDerWaalsContact C-N 3.34Å; K170-E173 WeakPolarHBondContact CE-OE1 3.42Å; K170-E173 IonicContact NZ-OE1 3.67Å; K170-E173 PolarHBondContact NZ-OE1 2.77Å; K170-E173 IonicContact NZ-OE2 2.8Å; K170-E173 PolarHBondContact NZ-OE2 3.08Å; K170-E173 WeakPolarHBondContact O-CG 3.33Å; K170-E208 PolarHBondContact NZ-O 3.06Å; K170-I209 HydrophobicContact CB-CG1 4.39Å; K170-I209 HydrophobicContact CD-CG1 4.1Å
171	K	94.7	Very high	95.3	Very high	96 Å²	96	31.8 Å²	31.8	42%	0.417	17%	0.165	S	C	.	.	H	α-helix	trans	-74.7	-21.7	175.2	-77.9	174.5	171.8	179.2	0	113.6	I114 V167 A168 M169	I114-K171 HydrophobicContact CG2-CB 4.46Å; I114-K171 HydrophobicContact CG2-CD 3.42Å; I114-K171 VanDerWaalsContact CG2-CD 3.42Å; V167-K171 HydrophobicContact CG1-CD 4.3Å; V167-K171 WeakPolarHBondContact O-CG 3.41Å; V167-K171 PolarHBondContact O-N 3.4Å; A168-K171 PolarHBondContact O-N 3.16Å; M169-K171 VanDerWaalsContact C-N 3.31Å; M169-K171 PolarHBondContact O-N 3.19Å
172	L	96.3	Very high	95.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-95	-23.3	-177.8	-69	176.2	0	0	0	114	V47 I114 V117 V118 I121 Y152 A168 M169 K170 N174 K175 V176 V178	V47-L172 HydrophobicContact CG2-CD1 4.47Å; I114-L172 HydrophobicContact CD1-CD1 3.97Å; I114-L172 HydrophobicContact CD1-CD2 4.38Å; I114-L172 HydrophobicContact CD1-CG 4.18Å; I114-L172 HydrophobicContact CG1-CG 4.41Å; V117-L172 HydrophobicContact CG1-CD2 4.08Å; V118-L172 HydrophobicContact CG2-CD2 4.28Å; I121-L172 HydrophobicContact CD1-CD2 3.67Å; Y152-L172 HydrophobicContact CD2-CD1 4.3Å; A168-L172 WeakPolarHBondContact O-CG 3.19Å; A168-L172 PolarHBondContact O-N 3.1Å; A168-L172 VanDerWaalsContact O-N 3.1Å; M169-L172 PolarHBondContact O-N 2.85Å; M169-L172 VanDerWaalsContact O-N 3.07Å; K170-L172 VanDerWaalsContact C-N 3.34Å; L172-N174 VanDerWaalsContact C-N 3.25Å; L172-N174 PolarHBondContact O-N 3.35Å; L172-N174 VanDerWaalsContact O-N 3.08Å; L172-K175 PolarHBondContact O-N 3.31Å; L172-V176 HydrophobicContact CB-CG1 4.05Å; L172-V176 HydrophobicContact CD2-CG1 4.23Å; L172-V176 PolarHBondContact O-N 3.08Å; L172-V176 VanDerWaalsContact O-N 3.08Å; L172-V178 HydrophobicContact CB-CG2 3.69Å
173	E	95.1	Very high	95.7	Very high	25 Å²	25	28.3 Å²	28.3	12%	0.117	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-38.8	-170.8	74.8	-174.6	176.6	0	0	114.5	M169 K170 I209 G210 H293	M169-E173 PolarHBondContact O-N 2.73Å; K170-E173 WeakPolarHBondContact CE-OE1 3.42Å; K170-E173 IonicContact NZ-OE1 3.67Å; K170-E173 PolarHBondContact NZ-OE1 2.77Å; K170-E173 IonicContact NZ-OE2 2.8Å; K170-E173 PolarHBondContact NZ-OE2 3.08Å; K170-E173 WeakPolarHBondContact O-CG 3.33Å; E173-I209 WeakPolarHBondContact OE2-CA 3.45Å; E173-G210 WeakPolarHBondContact CB-O 3.44Å; E173-G210 PolarHBondContact OE2-N 2.81Å; E173-H293 PolarHBondContact O-CE1 2.71Å
174	N	94.2	Very high	95.8	Very high	105 Å²	105	27.4 Å²	27.4	56%	0.561	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-2.7	-177.2	-68.1	-44.6	0	0	0	113.4	L172 H293	L172-N174 VanDerWaalsContact C-N 3.25Å; L172-N174 PolarHBondContact O-N 3.35Å; L172-N174 VanDerWaalsContact O-N 3.08Å; N174-H293 VanDerWaalsContact C-ND1 3.29Å; N174-H293 PolarHBondContact O-ND1 3.36Å
175	K	96.1	Very high	96	Very high	52 Å²	52	26.9 Å²	26.9	23%	0.226	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-24.3	-176.2	-69.8	-174.9	179.2	-84.3	0	113.4	V118 I121 D122 F125 L172	V118-K175 HydrophobicContact CG1-CD 3.77Å; I121-K175 HydrophobicContact CG2-CB 4.14Å; D122-K175 IonicContact OD1-NZ 3.92Å; D122-K175 PolarHBondContact OD1-NZ 3.27Å; D122-K175 IonicContact OD2-NZ 3.42Å; D122-K175 PolarHBondContact OD2-NZ 2.9Å; F125-K175 WeakPolarHBondContact CE2-O 3.5Å; F125-K175 VanDerWaalsContact CZ-O 3.28Å; F125-K175 WeakPolarHBondContact CZ-O 3.39Å; L172-K175 PolarHBondContact O-N 3.31Å
176	V	97.6	Very high	96	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	14%	0.141	C	C	.	.	S	Bend	trans	-155	152.5	-177.4	63.1	0	0	0	0	110.9	I121 V147 C150 L172 V178	I121-V176 HydrophobicContact CD1-CB 4.24Å; I121-V176 HydrophobicContact CD1-CG1 4Å; V147-V176 HydrophobicContact CB-CG2 4.17Å; V147-V176 HydrophobicContact CG1-CG2 3.6Å; C150-V176 HydrophobicContact CB-CB 4.3Å; C150-V176 HydrophobicContact CB-CG1 3.59Å; C150-V176 HydrophobicContact CB-CG2 3.67Å; L172-V176 HydrophobicContact CB-CG1 4.05Å; L172-V176 HydrophobicContact CD2-CG1 4.23Å; L172-V176 PolarHBondContact O-N 3.08Å; L172-V176 VanDerWaalsContact O-N 3.08Å; V176-V178 HydrophobicContact CG1-CG2 3.95Å; V176-V178 PolarHBondContact O-N 3.5Å
177	N	97.5	Very high	96	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.011	16%	0.157	C	C	.	.			trans	-68.2	97.9	171.9	-60.1	-52.9	0	0	0	110.2	H148 C150 Y212 L285 R288 T289 H293	H148-N177 WeakPolarHBondContact O-CB 3.41Å; H148-N177 PolarHBondContact O-ND2 2.86Å; C150-N177 PolarHBondContact N-O 2.93Å; N177-Y212 HydrophobicContact CB-CD2 3.91Å; N177-Y212 HydrophobicContact CB-CG 3.95Å; N177-Y212 WeakPolarHBondContact OD1-CD2 3.24Å; N177-L285 HydrophobicContact CB-CD2 3.62Å; N177-L285 PolarHBondContact ND2-O 3.05Å; N177-R288 WeakPolarHBondContact OD1-CD 3.37Å; N177-R288 WeakPolarHBondContact OD1-CG 3.28Å; N177-R288 PolarHBondContact OD1-NE 3.38Å; N177-T289 PolarHBondContact ND2-OG1 3.36Å; N177-T289 VanDerWaalsContact ND2-OG1 3.15Å; N177-H293 PolarHBondContact N-NE2 3.46Å; N177-H293 PolarHBondContact OD1-NE2 2.79Å
178	V	97.6	Very high	96	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120.2	-179	-177.8	0	0	0	0	110.3	M169 L172 V176 Y212	M169-V178 HydrophobicContact CG-CG1 4.33Å; L172-V178 HydrophobicContact CB-CG2 3.69Å; V176-V178 HydrophobicContact CG1-CG2 3.95Å; V176-V178 PolarHBondContact O-N 3.5Å; V178-Y212 PolarHBondContact O-N 3.25Å
179	I	96.9	Very high	95.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	109.7	172.4	-70.2	161.2	0	0	0	108.5	V149 C150 L151 Y152 V181 Y212 F214 F234 L273 M276 L277 L285	V149-I179 HydrophobicContact CG2-CD1 3.6Å; V149-I179 HydrophobicContact CG2-CG1 4.38Å; C150-I179 PolarHBondContact O-N 3.34Å; L151-I179 HydrophobicContact CD2-CB 4.08Å; L151-I179 HydrophobicContact CD2-CG2 4.14Å; Y152-I179 PolarHBondContact N-O 3.43Å; I179-V181 HydrophobicContact CG2-CG1 4.27Å; I179-Y212 HydrophobicContact CD1-CD1 3.76Å; I179-Y212 HydrophobicContact CD1-CE1 4.31Å; I179-Y212 HydrophobicContact CG1-CD1 3.86Å; I179-Y212 HydrophobicContact CG1-CG 4.48Å; I179-F214 HydrophobicContact CD1-CE1 4.17Å; I179-F214 HydrophobicContact CD1-CZ 4.37Å; I179-F234 HydrophobicContact CG2-CD2 3.99Å; I179-F234 HydrophobicContact CG2-CE2 4.09Å; I179-L273 HydrophobicContact CG2-CD1 4.3Å; I179-M276 HydrophobicContact CD1-CE 3.43Å; I179-M276 VanDerWaalsContact CD1-CE 3.43Å; I179-M276 HydrophobicContact CD1-SD 4.08Å; I179-M276 HydrophobicContact CG1-CE 4.23Å; I179-M276 HydrophobicContact CG2-CE 4Å; I179-L277 HydrophobicContact CD1-CD2 3.85Å; I179-L285 HydrophobicContact CD1-CD2 4.46Å
180	P	97.2	Very high	95.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	133.6	178.4	29.8	-33.1	0	0	0	111	Y152 I154 I204 I211 I232 P233 F234	Y152-P180 WeakPolarHBondContact O-CA 3.25Å; I154-P180 HydrophobicContact CD1-CB 3.77Å; P180-I204 HydrophobicContact CG-CD1 4.35Å; P180-I211 HydrophobicContact CG-CD1 4.04Å; P180-I211 HydrophobicContact CG-CG2 4.37Å; P180-I232 HydrophobicContact CG-CG2 3.67Å; P180-P233 HydrophobicContact CB-CB 3.99Å; P180-P233 HydrophobicContact CG-CB 4.04Å; P180-P233 VanDerWaalsContact O-CA 3.28Å; P180-P233 WeakPolarHBondContact O-CA 3.43Å; P180-P233 WeakPolarHBondContact O-CB 3.47Å; P180-F234 PolarHBondContact O-N 2.79Å
181	V	97.3	Very high	95.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.1	178.5	-58.3	0	0	0	0	109.9	Y152 F153 I154 I179 A183 F234 V236 L273	Y152-V181 PolarHBondContact O-N 2.92Å; F153-V181 CarbonylContact C-O 3.59Å; F153-V181 WeakPolarHBondContact CA-O 3.39Å; F153-V181 HydrophobicContact CB-CG2 4.31Å; F153-V181 HydrophobicContact CD1-CG2 3.93Å; F153-V181 HydrophobicContact CD2-CG2 3.92Å; F153-V181 HydrophobicContact CE1-CG2 4.23Å; F153-V181 HydrophobicContact CE2-CG2 4.21Å; F153-V181 HydrophobicContact CG-CG2 3.77Å; F153-V181 HydrophobicContact CZ-CG2 4.37Å; I154-V181 PolarHBondContact N-O 2.89Å; I179-V181 HydrophobicContact CG2-CG1 4.27Å; V181-A183 PolarHBondContact O-N 3.1Å; V181-F234 CarbonylContact C-O 3.31Å; V181-F234 WeakPolarHBondContact CA-O 3.39Å; V181-F234 HydrophobicContact CG1-CB 4.35Å; V181-V236 HydrophobicContact CB-CG2 4.16Å; V181-V236 HydrophobicContact CG2-CG2 4.44Å; V181-L273 HydrophobicContact CG1-CD1 4.33Å; V181-L273 HydrophobicContact CG1-CD2 4.21Å
182	I	97.5	Very high	95.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	113.5	171.1	-60.8	165.8	0	0	0	107.2	P156 I188 L193 F196 K197 I200 P233 F234 V236	P156-I182 HydrophobicContact CB-CG2 4.32Å; I182-I188 HydrophobicContact CG2-CD1 4.38Å; I182-L193 HydrophobicContact CD1-CD1 3.81Å; I182-F196 HydrophobicContact CD1-CD1 3.82Å; I182-F196 HydrophobicContact CD1-CE1 4.13Å; I182-F196 HydrophobicContact CG1-CD1 4.34Å; I182-F196 HydrophobicContact CG1-CE1 4.13Å; I182-F196 HydrophobicContact CG2-CD1 4.26Å; I182-F196 HydrophobicContact CG2-CE1 3.92Å; I182-K197 HydrophobicContact CD1-CG 3.78Å; I182-I200 HydrophobicContact CD1-CD1 3.83Å; I182-I200 HydrophobicContact CG1-CD1 3.85Å; I182-P233 HydrophobicContact CD1-CB 4.47Å; I182-P233 HydrophobicContact CD1-CG 3.81Å; I182-P233 HydrophobicContact CG1-CB 4.19Å; I182-P233 HydrophobicContact CG1-CG 3.99Å; I182-F234 PolarHBondContact N-O 2.85Å; I182-V236 PolarHBondContact O-N 3.41Å
183	A	96.8	Very high	95.9	Very high	2 Å²	2	38 Å²	38	2%	0.017	20%	0.2	C	C	.	.	S	Bend	trans	-79.2	154.1	-178.2	0	0	0	0	0	112.1	I52 F153 I154 P156 V181 S185	I52-A183 HydrophobicContact CD1-CB 3.8Å; I52-A183 HydrophobicContact CG1-CB 3.46Å; I52-A183 VanDerWaalsContact CG1-CB 3.46Å; F153-A183 HydrophobicContact CB-CB 4.36Å; F153-A183 HydrophobicContact CD1-CB 3.81Å; I154-A183 PolarHBondContact O-N 2.9Å; P156-A183 WeakPolarHBondContact CB-O 3.4Å; P156-A183 WeakPolarHBondContact CD-O 3.04Å; P156-A183 VanDerWaalsContact CG-O 3.27Å; P156-A183 WeakPolarHBondContact CG-O 3.24Å; V181-A183 PolarHBondContact O-N 3.1Å; A183-S185 PolarHBondContact O-N 3.41Å
184	K	95.3	Very high	95.8	Very high	78 Å²	78	44 Å²	44	34%	0.339	23%	0.228	S	C	.	.	S	Bend	trans	46.7	48.3	178.3	-55.8	-178.3	-176.2	176.6	0	111.7	G51 I52 P156 D186 T187 V236	G51-K184 VanDerWaalsContact O-CE 3.27Å; G51-K184 WeakPolarHBondContact O-CE 3.26Å; G51-K184 PolarHBondContact O-NZ 2.93Å; I52-K184 WeakPolarHBondContact O-CE 3.44Å; P156-K184 HydrophobicContact CG-CB 4.26Å; K184-D186 WeakPolarHBondContact CA-OD1 3.37Å; K184-D186 PolarHBondContact O-N 2.64Å; K184-D186 VanDerWaalsContact O-N 3.07Å; K184-T187 HydrophobicContact CB-CG2 4.16Å; K184-T187 WeakPolarHBondContact O-CB 3.43Å; K184-T187 WeakPolarHBondContact O-CG2 3.49Å; K184-T187 PolarHBondContact O-N 2.99Å; K184-T187 PolarHBondContact O-OG1 3.22Å; K184-V236 PolarHBondContact N-O 2.76Å
185	S	96	Very high	95.9	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.042	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-64.4	-13.6	-174.4	62.6	0	0	0	0	113.7	A183 T187 I188 A235 V236 V237	A183-S185 PolarHBondContact O-N 3.41Å; S185-T187 PolarHBondContact O-N 3.42Å; S185-I188 PolarHBondContact O-N 2.93Å; S185-A235 PolarHBondContact OG-O 2.91Å; S185-A235 VanDerWaalsContact OG-O 3.07Å; S185-V236 PolarHBondContact N-O 3.33Å; S185-V236 VanDerWaalsContact N-O 3.16Å; S185-V236 PolarHBondContact OG-N 3.4Å; S185-V236 PolarHBondContact OG-O 2.84Å; S185-V237 VanDerWaalsContact OG-CG2 3.3Å; S185-V237 WeakPolarHBondContact OG-CG2 3.49Å
186	D	95.2	Very high	95.9	Very high	40 Å²	40	43.4 Å²	43.4	21%	0.214	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-65.1	-9.5	169.5	58	-43.6	0	0	0	114.2	K184 V237 R253 Y255 V260	K184-D186 WeakPolarHBondContact CA-OD1 3.37Å; K184-D186 PolarHBondContact O-N 2.64Å; K184-D186 VanDerWaalsContact O-N 3.07Å; D186-V237 HydrophobicContact CB-CG1 4.49Å; D186-V237 HydrophobicContact CB-CG2 3.88Å; D186-R253 WeakPolarHBondContact OD2-CD 3.35Å; D186-R253 IonicContact OD2-NE 3.7Å; D186-R253 PolarHBondContact OD2-NE 3.43Å; D186-Y255 WeakPolarHBondContact OD2-CE2 3.47Å; D186-Y255 PolarHBondContact OD2-OH 3.22Å; D186-V260 HydrophobicContact CB-CG1 4.23Å; D186-V260 HydrophobicContact CB-CG2 4.06Å
187	T	94.5	Very high	95.8	Very high	86 Å²	86	44.8 Å²	44.8	53%	0.528	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-87.9	-8.8	174	61.8	0	0	0	0	114.2	P156 K184 S185	P156-T187 WeakPolarHBondContact CB-OG1 3.23Å; P156-T187 WeakPolarHBondContact CG-OG1 3.33Å; K184-T187 HydrophobicContact CB-CG2 4.16Å; K184-T187 WeakPolarHBondContact O-CB 3.43Å; K184-T187 WeakPolarHBondContact O-CG2 3.49Å; K184-T187 PolarHBondContact O-N 2.99Å; K184-T187 PolarHBondContact O-OG1 3.22Å; S185-T187 PolarHBondContact O-N 3.42Å
188	I	93.8	Very high	95.7	Very high	19 Å²	19	47.6 Å²	47.6	10%	0.097	25%	0.25	C	S	.	.	S	Bend	trans	-117.3	136.4	-176.5	-57.6	-177.7	0	0	0	109.7	P156 I182 S185 E192 L193 F196	P156-I188 HydrophobicContact CB-CD1 3.49Å; P156-I188 VanDerWaalsContact CB-CD1 3.49Å; P156-I188 HydrophobicContact CB-CG1 3.82Å; I182-I188 HydrophobicContact CG2-CD1 4.38Å; S185-I188 PolarHBondContact O-N 2.93Å; I188-E192 HydrophobicContact CG2-CB 3.48Å; I188-E192 VanDerWaalsContact CG2-CB 3.48Å; I188-L193 HydrophobicContact CG2-CB 3.96Å; I188-F196 HydrophobicContact CD1-CD1 3.68Å; I188-F196 HydrophobicContact CD1-CE1 4Å
189	T	94.6	Very high	95.6	Very high	73 Å²	73	51.9 Å²	51.9	45%	0.448	27%	0.266	S	S	.	.			trans	-69.7	156.5	174.5	66.4	0	0	0	0	111.7	S191 E192 L193	T189-S191 VanDerWaalsContact C-N 3.27Å; T189-S191 PolarHBondContact O-N 3.39Å; T189-S191 PolarHBondContact OG1-OG 3.18Å; T189-E192 WeakPolarHBondContact CB-OE2 3.34Å; T189-E192 WeakPolarHBondContact CG2-OE2 3.16Å; T189-E192 PolarHBondContact N-OE2 2.9Å; T189-E192 PolarHBondContact O-N 3.37Å; T189-E192 WeakPolarHBondContact OG1-CB 3.34Å; T189-E192 VanDerWaalsContact OG1-CG 3.23Å; T189-E192 WeakPolarHBondContact OG1-CG 3.41Å; T189-E192 PolarHBondContact OG1-N 3.46Å; T189-E192 PolarHBondContact OG1-OE2 3.23Å; T189-L193 WeakPolarHBondContact O-CB 3.49Å; T189-L193 PolarHBondContact O-N 3.5Å
190	K	94.4	Very high	95.6	Very high	117 Å²	117	51.9 Å²	51.9	51%	0.509	27%	0.266	S	S	.	.	H	α-helix	trans	-58.6	-36.6	-177.6	-64.7	-60.7	-169.6	174.3	0	113.7	Q194 N266 H267	K190-Q194 PolarHBondContact O-N 3.18Å; K190-Q194 VanDerWaalsContact O-N 3.15Å; K190-N266 WeakPolarHBondContact CE-O 3.47Å; K190-N266 PolarHBondContact NZ-O 2.65Å; K190-H267 VanDerWaalsContact NZ-C 3.34Å; K190-H267 PolarHBondContact NZ-O 2.86Å
191	S	94.9	Very high	95.5	Very high	76 Å²	76	55.1 Å²	55.1	53%	0.531	28%	0.283	S	S	.	.	H	α-helix	trans	-70.5	-40.5	178.1	55.4	0	0	0	0	112.3	T189 K195	T189-S191 VanDerWaalsContact C-N 3.27Å; T189-S191 PolarHBondContact O-N 3.39Å; T189-S191 PolarHBondContact OG1-OG 3.18Å; S191-K195 PolarHBondContact O-N 3.2Å
192	E	95.6	Very high	95.4	Very high	98 Å²	98	58.5 Å²	58.5	46%	0.458	31%	0.307	S	S	.	.	H	α-helix	trans	-68.2	-38.9	174	-71.3	165.2	157.9	0	0	111.5	I188 T189 Q194 K195 F196	I188-E192 HydrophobicContact CG2-CB 3.48Å; I188-E192 VanDerWaalsContact CG2-CB 3.48Å; T189-E192 WeakPolarHBondContact CB-OE2 3.34Å; T189-E192 WeakPolarHBondContact CG2-OE2 3.16Å; T189-E192 PolarHBondContact N-OE2 2.9Å; T189-E192 PolarHBondContact O-N 3.37Å; T189-E192 WeakPolarHBondContact OG1-CB 3.34Å; T189-E192 VanDerWaalsContact OG1-CG 3.23Å; T189-E192 WeakPolarHBondContact OG1-CG 3.41Å; T189-E192 PolarHBondContact OG1-N 3.46Å; T189-E192 PolarHBondContact OG1-OE2 3.23Å; E192-Q194 VanDerWaalsContact C-N 3.34Å; E192-Q194 PolarHBondContact O-N 2.78Å; E192-K195 PolarHBondContact O-N 2.98Å; E192-F196 VanDerWaalsContact O-CB 3.27Å; E192-F196 WeakPolarHBondContact O-CB 3.43Å; E192-F196 PolarHBondContact O-N 3.04Å
193	L	95.6	Very high	95.3	Very high	17 Å²	17	60.7 Å²	60.7	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-60.7	-44.3	178.8	-178.4	63.5	0	0	0	111.1	I182 I188 T189 K195 F196 K197 A235	I182-L193 HydrophobicContact CD1-CD1 3.81Å; I188-L193 HydrophobicContact CG2-CB 3.96Å; T189-L193 WeakPolarHBondContact O-CB 3.49Å; T189-L193 PolarHBondContact O-N 3.5Å; L193-K195 PolarHBondContact O-N 3.23Å; L193-F196 PolarHBondContact O-N 3.35Å; L193-K197 HydrophobicContact CD1-CG 4.46Å; L193-K197 WeakPolarHBondContact O-CG 3.41Å; L193-K197 PolarHBondContact O-N 3.47Å; L193-A235 HydrophobicContact CD1-CB 3.76Å; L193-A235 HydrophobicContact CD2-CB 3.68Å; L193-A235 HydrophobicContact CG-CB 4.26Å
194	Q	94.4	Very high	95.3	Very high	151 Å²	151	61 Å²	61	71%	0.706	32%	0.318	S	S	*	.	H	α-helix	trans	-60.3	-46.2	176.2	-171.9	-178.6	6.4	0	0	111.6	K190 E192 F196 A198	K190-Q194 PolarHBondContact O-N 3.18Å; K190-Q194 VanDerWaalsContact O-N 3.15Å; E192-Q194 VanDerWaalsContact C-N 3.34Å; E192-Q194 PolarHBondContact O-N 2.78Å; Q194-F196 VanDerWaalsContact C-N 3.3Å; Q194-F196 PolarHBondContact O-N 2.69Å; Q194-A198 PolarHBondContact O-N 3.33Å; Q194-A198 VanDerWaalsContact O-N 3.16Å
195	K	95.8	Very high	95.3	Very high	144 Å²	144	64.8 Å²	64.8	63%	0.626	34%	0.337	S	S	*	.	H	α-helix	trans	-65.8	-32.6	176	-68.6	178.3	-179.2	177.4	0	112.5	S191 E192 L193 R199	S191-K195 PolarHBondContact O-N 3.2Å; E192-K195 PolarHBondContact O-N 2.98Å; L193-K195 PolarHBondContact O-N 3.23Å; K195-R199 WeakPolarHBondContact O-CG 3.42Å; K195-R199 PolarHBondContact O-N 2.72Å; K195-R199 PolarHBondContact O-NE 3.36Å
196	F	96	Very high	95.3	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-72.9	-46.6	179.7	-173.2	-140.7	0	0	0	111.4	I154 A155 H159 I182 I188 E192 L193 Q194 A198 R199 I200	I154-F196 HydrophobicContact CG2-CE1 4.49Å; I154-F196 HydrophobicContact CG2-CZ 4.02Å; A155-F196 WeakPolarHBondContact O-CZ 3.32Å; H159-F196 WeakPolarHBondContact O-CD2 3.36Å; H159-F196 VanDerWaalsContact O-CE2 3.29Å; H159-F196 WeakPolarHBondContact O-CE2 3.05Å; I182-F196 HydrophobicContact CD1-CD1 3.82Å; I182-F196 HydrophobicContact CD1-CE1 4.13Å; I182-F196 HydrophobicContact CG1-CD1 4.34Å; I182-F196 HydrophobicContact CG1-CE1 4.13Å; I182-F196 HydrophobicContact CG2-CD1 4.26Å; I182-F196 HydrophobicContact CG2-CE1 3.92Å; I188-F196 HydrophobicContact CD1-CD1 3.68Å; I188-F196 HydrophobicContact CD1-CE1 4Å; E192-F196 VanDerWaalsContact O-CB 3.27Å; E192-F196 WeakPolarHBondContact O-CB 3.43Å; E192-F196 PolarHBondContact O-N 3.04Å; L193-F196 PolarHBondContact O-N 3.35Å; Q194-F196 VanDerWaalsContact C-N 3.3Å; Q194-F196 PolarHBondContact O-N 2.69Å; F196-A198 VanDerWaalsContact C-N 3.32Å; F196-A198 PolarHBondContact O-N 2.85Å; F196-R199 PolarHBondContact O-N 3.08Å; F196-I200 HydrophobicContact CD1-CD1 3.96Å; F196-I200 HydrophobicContact CD2-CD1 4Å; F196-I200 HydrophobicContact CD2-CG1 4.18Å; F196-I200 HydrophobicContact CE1-CD1 3.74Å; F196-I200 HydrophobicContact CE2-CD1 3.79Å; F196-I200 HydrophobicContact CE2-CG1 3.95Å; F196-I200 HydrophobicContact CG-CD1 4.1Å; F196-I200 HydrophobicContact CZ-CD1 3.66Å; F196-I200 HydrophobicContact CZ-CG1 4.27Å; F196-I200 WeakPolarHBondContact O-CG1 3.47Å; F196-I200 PolarHBondContact O-N 3.12Å
197	K	95.7	Very high	95.3	Very high	30 Å²	30	70 Å²	70	13%	0.13	37%	0.371	C	S	.	.	H	α-helix	trans	-55	-47.2	173	-73.1	-164.1	-179.6	-161.2	0	111.8	I182 L193 R199 I200 L201 H231 P233 D269	I182-K197 HydrophobicContact CD1-CG 3.78Å; L193-K197 HydrophobicContact CD1-CG 4.46Å; L193-K197 WeakPolarHBondContact O-CG 3.41Å; L193-K197 PolarHBondContact O-N 3.47Å; K197-R199 VanDerWaalsContact C-N 3.33Å; K197-R199 PolarHBondContact O-N 3.08Å; K197-I200 PolarHBondContact O-N 2.94Å; K197-L201 WeakPolarHBondContact O-CG 3.33Å; K197-L201 PolarHBondContact O-N 3.47Å; K197-H231 PolarHBondContact NZ-O 3.01Å; K197-P233 WeakPolarHBondContact CE-O 3.37Å; K197-P233 HydrophobicContact CG-CG 4.18Å; K197-P233 PolarHBondContact NZ-O 2.8Å; K197-P233 VanDerWaalsContact NZ-O 3.15Å; K197-D269 IonicContact NZ-OD2 3.14Å; K197-D269 PolarHBondContact NZ-OD2 3.36Å
198	A	95	Very high	95.4	Very high	62 Å²	62	73.5 Å²	73.5	51%	0.512	38%	0.381	S	S	.	.	H	α-helix	trans	-59.8	-41.5	178.8	0	0	0	0	0	112.7	Q194 F196 S202	Q194-A198 PolarHBondContact O-N 3.33Å; Q194-A198 VanDerWaalsContact O-N 3.16Å; F196-A198 VanDerWaalsContact C-N 3.32Å; F196-A198 PolarHBondContact O-N 2.85Å; A198-S202 WeakPolarHBondContact O-CB 3.4Å; A198-S202 PolarHBondContact O-N 3.17Å
199	R	95.6	Very high	95.5	Very high	90 Å²	90	73.1 Å²	73.1	34%	0.34	38%	0.38	S	S	.	.	H	α-helix	trans	-66.7	-45.4	176.1	-79.3	177.9	-72.3	169.2	3.8	112.5	G158 H159 K195 F196 K197 L201 S202 E203	G158-R199 PolarHBondContact O-NH1 3.33Å; G158-R199 PolarHBondContact O-NH2 3.46Å; H159-R199 VanDerWaalsContact CA-NH1 3.35Å; H159-R199 VanDerWaalsContact O-CZ 3.27Å; H159-R199 PolarHBondContact O-NE 3.13Å; H159-R199 PolarHBondContact O-NH1 3.16Å; K195-R199 WeakPolarHBondContact O-CG 3.42Å; K195-R199 PolarHBondContact O-N 2.72Å; K195-R199 PolarHBondContact O-NE 3.36Å; F196-R199 PolarHBondContact O-N 3.08Å; K197-R199 VanDerWaalsContact C-N 3.33Å; K197-R199 PolarHBondContact O-N 3.08Å; R199-L201 VanDerWaalsContact C-N 3.34Å; R199-L201 PolarHBondContact O-N 3.12Å; R199-S202 PolarHBondContact O-N 3.44Å; R199-E203 WeakPolarHBondContact O-CG 3.47Å; R199-E203 PolarHBondContact O-N 2.89Å
200	I	96.2	Very high	95.4	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-57	-48.9	176.6	-69.7	164.3	0	0	0	110.5	I154 L161 I182 F196 K197 S202 E203 I204 P233	I154-I200 HydrophobicContact CD1-CD1 4.15Å; I154-I200 HydrophobicContact CD1-CG2 3.92Å; I154-I200 HydrophobicContact CG2-CD1 4.14Å; L161-I200 HydrophobicContact CD1-CG2 4.22Å; L161-I200 HydrophobicContact CD2-CG1 3.99Å; L161-I200 HydrophobicContact CD2-CG2 4.08Å; L161-I200 HydrophobicContact CG-CG1 4.17Å; L161-I200 HydrophobicContact CG-CG2 4.29Å; I182-I200 HydrophobicContact CD1-CD1 3.83Å; I182-I200 HydrophobicContact CG1-CD1 3.85Å; F196-I200 HydrophobicContact CD1-CD1 3.96Å; F196-I200 HydrophobicContact CD2-CD1 4Å; F196-I200 HydrophobicContact CD2-CG1 4.18Å; F196-I200 HydrophobicContact CE1-CD1 3.74Å; F196-I200 HydrophobicContact CE2-CD1 3.79Å; F196-I200 HydrophobicContact CE2-CG1 3.95Å; F196-I200 HydrophobicContact CG-CD1 4.1Å; F196-I200 HydrophobicContact CZ-CD1 3.66Å; F196-I200 HydrophobicContact CZ-CG1 4.27Å; F196-I200 WeakPolarHBondContact O-CG1 3.47Å; F196-I200 PolarHBondContact O-N 3.12Å; K197-I200 PolarHBondContact O-N 2.94Å; I200-S202 PolarHBondContact O-N 3.4Å; I200-E203 PolarHBondContact O-N 2.98Å; I200-I204 HydrophobicContact CG2-CD1 3.7Å; I200-I204 HydrophobicContact CG2-CG1 4.38Å; I200-I204 VanDerWaalsContact O-CG1 3.31Å; I200-I204 WeakPolarHBondContact O-CG1 3.49Å; I200-I204 PolarHBondContact O-N 2.84Å; I200-P233 HydrophobicContact CB-CG 4.29Å; I200-P233 HydrophobicContact CD1-CG 3.99Å; I200-P233 HydrophobicContact CG2-CG 3.94Å
201	L	95	Very high	95.5	Very high	68 Å²	68	66.9 Å²	66.9	36%	0.356	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-41.9	179.1	-70.2	176.7	0	0	0	112.1	K197 R199 E203 I204 Q205	K197-L201 WeakPolarHBondContact O-CG 3.33Å; K197-L201 PolarHBondContact O-N 3.47Å; R199-L201 VanDerWaalsContact C-N 3.34Å; R199-L201 PolarHBondContact O-N 3.12Å; L201-E203 VanDerWaalsContact C-N 3.29Å; L201-E203 PolarHBondContact O-N 3.13Å; L201-I204 PolarHBondContact O-N 3.34Å; L201-Q205 WeakPolarHBondContact O-CB 3.39Å; L201-Q205 PolarHBondContact O-N 3.34Å
202	S	95.8	Very high	95.4	Very high	71 Å²	71	63.3 Å²	63.3	50%	0.497	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-38.3	175.8	-175.8	0	0	0	0	112.2	A198 R199 I200 S206	A198-S202 WeakPolarHBondContact O-CB 3.4Å; A198-S202 PolarHBondContact O-N 3.17Å; R199-S202 PolarHBondContact O-N 3.44Å; I200-S202 PolarHBondContact O-N 3.4Å; S202-S206 WeakPolarHBondContact O-CB 3.36Å; S202-S206 PolarHBondContact O-N 2.93Å; S202-S206 PolarHBondContact O-OG 2.76Å
203	E	95.8	Very high	95.3	Very high	47 Å²	47	62.8 Å²	62.8	22%	0.22	33%	0.331	C	S	.	.	H	α-helix	trans	-76.1	-36.6	178.5	-73.1	-175.6	152.6	0	0	113	S160 L161 L166 R199 I200 L201 Q205 S206 N207	S160-E203 VanDerWaalsContact CB-CD 3.5Å; S160-E203 WeakPolarHBondContact CB-OE1 3.41Å; S160-E203 WeakPolarHBondContact CB-OE2 3.48Å; L161-E203 VanDerWaalsContact CB-OE2 3.26Å; L161-E203 WeakPolarHBondContact CB-OE2 3.47Å; L161-E203 HydrophobicContact CD1-CB 4.08Å; L161-E203 PolarHBondContact N-OE2 3.18Å; L166-E203 HydrophobicContact CD2-CB 4.45Å; R199-E203 WeakPolarHBondContact O-CG 3.47Å; R199-E203 PolarHBondContact O-N 2.89Å; I200-E203 PolarHBondContact O-N 2.98Å; L201-E203 VanDerWaalsContact C-N 3.29Å; L201-E203 PolarHBondContact O-N 3.13Å; E203-Q205 VanDerWaalsContact C-N 3.3Å; E203-S206 WeakPolarHBondContact CA-OG 3.38Å; E203-S206 PolarHBondContact O-N 2.86Å; E203-S206 PolarHBondContact O-OG 3.48Å; E203-N207 WeakPolarHBondContact O-CB 3.25Å; E203-N207 PolarHBondContact O-N 2.96Å; E203-N207 VanDerWaalsContact O-N 3.09Å; E203-N207 PolarHBondContact O-ND2 3.1Å
204	I	95.9	Very high	94.9	Very high	8 Å²	8	62.2 Å²	62.2	4%	0.041	33%	0.328	C	S	.	.	H	α-helix	trans	-60.4	-44.6	171.9	-72.8	171.9	0	0	0	109.9	L161 M169 P180 I200 L201 E208 I209 I211	L161-I204 HydrophobicContact CD1-CG1 4.04Å; M169-I204 HydrophobicContact CE-CG1 4.32Å; P180-I204 HydrophobicContact CG-CD1 4.35Å; I200-I204 HydrophobicContact CG2-CD1 3.7Å; I200-I204 HydrophobicContact CG2-CG1 4.38Å; I200-I204 VanDerWaalsContact O-CG1 3.31Å; I200-I204 WeakPolarHBondContact O-CG1 3.49Å; I200-I204 PolarHBondContact O-N 2.84Å; L201-I204 PolarHBondContact O-N 3.34Å; I204-E208 PolarHBondContact O-N 2.78Å; I204-I209 HydrophobicContact CG2-CB 4.04Å; I204-I209 HydrophobicContact CG2-CG2 4.47Å; I204-I209 WeakPolarHBondContact CG2-O 3.07Å; I204-I209 PolarHBondContact O-N 3.2Å; I204-I211 HydrophobicContact CD1-CD1 4.29Å; I204-I211 HydrophobicContact CD1-CG2 4.25Å; I204-I211 HydrophobicContact CG2-CD1 4.24Å; I204-I211 HydrophobicContact CG2-CG1 4.31Å; I204-I211 HydrophobicContact CG2-CG2 4.06Å
205	Q	95.6	Very high	94.6	Very high	158 Å²	158	56.2 Å²	56.2	74%	0.738	30%	0.302	S	S	*	.	H	α-helix	trans	-68.1	-44.5	178.8	-171.3	179.4	14.4	0	0	112.1	L201 E203 N207 E208	L201-Q205 WeakPolarHBondContact O-CB 3.39Å; L201-Q205 PolarHBondContact O-N 3.34Å; E203-Q205 VanDerWaalsContact C-N 3.3Å; Q205-N207 VanDerWaalsContact C-N 3.27Å; Q205-N207 PolarHBondContact O-N 2.89Å; Q205-E208 PolarHBondContact O-N 2.92Å; Q205-E208 VanDerWaalsContact O-N 3.12Å
206	S	96.4	Very high	94.3	Very high	85 Å²	85	52.8 Å²	52.8	59%	0.594	29%	0.293	S	S	*	.	H	α-helix	trans	-68.2	-25.4	-178.5	67.8	0	0	0	0	113.8	S202 E203	S202-S206 WeakPolarHBondContact O-CB 3.36Å; S202-S206 PolarHBondContact O-N 2.93Å; S202-S206 PolarHBondContact O-OG 2.76Å; E203-S206 WeakPolarHBondContact CA-OG 3.38Å; E203-S206 PolarHBondContact O-N 2.86Å; E203-S206 PolarHBondContact O-OG 3.48Å
207	N	95.4	Very high	93.8	Very high	70 Å²	70	59.2 Å²	59.2	37%	0.374	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	7.4	174.5	-69.1	-87.1	0	0	0	113.1	L166 E203 Q205 I209	L166-N207 HydrophobicContact CD2-CB 4.47Å; E203-N207 WeakPolarHBondContact O-CB 3.25Å; E203-N207 PolarHBondContact O-N 2.96Å; E203-N207 VanDerWaalsContact O-N 3.09Å; E203-N207 PolarHBondContact O-ND2 3.1Å; Q205-N207 VanDerWaalsContact C-N 3.27Å; Q205-N207 PolarHBondContact O-N 2.89Å; N207-I209 VanDerWaalsContact C-N 3.28Å; N207-I209 HydrophobicContact CB-CD1 3.93Å; N207-I209 HydrophobicContact CB-CG1 3.91Å; N207-I209 PolarHBondContact O-N 3.08Å
208	E	95.5	Very high	93.2	Very high	159 Å²	159	61.9 Å²	61.9	74%	0.743	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	44.5	179.8	-56.8	179.2	163.8	0	0	112.6	K170 I204 Q205	K170-E208 PolarHBondContact NZ-O 3.06Å; I204-E208 PolarHBondContact O-N 2.78Å; Q205-E208 PolarHBondContact O-N 2.92Å; Q205-E208 VanDerWaalsContact O-N 3.12Å
209	I	95.6	Very high	92.8	Very high	12 Å²	12	68 Å²	68	6%	0.062	36%	0.361	C	S	.	.			trans	-86.6	117.2	-178.8	-62.7	172.7	0	0	0	109.7	L166 M169 K170 E173 I204 N207 I211	L166-I209 HydrophobicContact CD2-CD1 3.73Å; M169-I209 HydrophobicContact CB-CD1 4.33Å; M169-I209 HydrophobicContact CB-CG2 3.74Å; M169-I209 HydrophobicContact CE-CD1 4.45Å; K170-I209 HydrophobicContact CB-CG1 4.39Å; K170-I209 HydrophobicContact CD-CG1 4.1Å; E173-I209 WeakPolarHBondContact OE2-CA 3.45Å; I204-I209 HydrophobicContact CG2-CB 4.04Å; I204-I209 HydrophobicContact CG2-CG2 4.47Å; I204-I209 WeakPolarHBondContact CG2-O 3.07Å; I204-I209 PolarHBondContact O-N 3.2Å; N207-I209 VanDerWaalsContact C-N 3.28Å; N207-I209 HydrophobicContact CB-CD1 3.93Å; N207-I209 HydrophobicContact CB-CG1 3.91Å; N207-I209 PolarHBondContact O-N 3.08Å; I209-I211 HydrophobicContact CG2-CG2 4.14Å; I209-I211 PolarHBondContact O-N 3.26Å
210	G	93.8	Very high	92.2	Very high	42 Å²	42	67.6 Å²	67.6	43%	0.433	38%	0.378	S	S	.	.			trans	-77.5	82.9	178.9	0	0	0	0	0	113.2	E173	E173-G210 WeakPolarHBondContact CB-O 3.44Å; E173-G210 PolarHBondContact OE2-N 2.81Å
211	I	95.1	Very high	91.6	Very high	16 Å²	16	69.4 Å²	69.4	8%	0.082	39%	0.389	C	S	.	.			trans	-78.1	156	170.3	63.5	172.5	0	0	0	111.5	P180 I204 I209 I232	P180-I211 HydrophobicContact CG-CD1 4.04Å; P180-I211 HydrophobicContact CG-CG2 4.37Å; I204-I211 HydrophobicContact CD1-CD1 4.29Å; I204-I211 HydrophobicContact CD1-CG2 4.25Å; I204-I211 HydrophobicContact CG2-CD1 4.24Å; I204-I211 HydrophobicContact CG2-CG1 4.31Å; I204-I211 HydrophobicContact CG2-CG2 4.06Å; I209-I211 HydrophobicContact CG2-CG2 4.14Å; I209-I211 PolarHBondContact O-N 3.26Å; I211-I232 HydrophobicContact CD1-CG2 3.82Å
212	Y	94.6	Very high	91.2	Very high	2 Å²	2	68 Å²	68	1%	0.008	38%	0.384	C	S	.	.			trans	-67.5	136.8	176.1	179.7	-108	0	0	0	110.9	N177 V178 I179 F214 D284 L285	N177-Y212 HydrophobicContact CB-CD2 3.91Å; N177-Y212 HydrophobicContact CB-CG 3.95Å; N177-Y212 WeakPolarHBondContact OD1-CD2 3.24Å; V178-Y212 PolarHBondContact O-N 3.25Å; I179-Y212 HydrophobicContact CD1-CD1 3.76Å; I179-Y212 HydrophobicContact CD1-CE1 4.31Å; I179-Y212 HydrophobicContact CG1-CD1 3.86Å; I179-Y212 HydrophobicContact CG1-CG 4.48Å; Y212-F214 AromaticContact CD1-CD1 3.98Å; Y212-F214 HydrophobicContact CD1-CD1 3.98Å; Y212-F214 AromaticContact CD1-CE1 3.51Å; Y212-F214 HydrophobicContact CD1-CE1 3.51Å; Y212-F214 HydrophobicContact CD1-CZ 4.26Å; Y212-F214 AromaticContact CE1-CD1 3.32Å; Y212-F214 HydrophobicContact CE1-CD1 3.32Å; Y212-F214 AromaticContact CE1-CE1 3.21Å; Y212-F214 HydrophobicContact CE1-CE1 3.21Å; Y212-F214 HydrophobicContact CE1-CG 4.46Å; Y212-F214 HydrophobicContact CE1-CZ 4.34Å; Y212-D284 WeakPolarHBondContact CE2-OD2 3.01Å; Y212-D284 VanDerWaalsContact CZ-OD2 3.31Å; Y212-D284 PolarHBondContact OH-OD2 2.95Å; Y212-L285 HydrophobicContact CD1-CD2 3.82Å; Y212-L285 HydrophobicContact CD2-CD2 4.24Å; Y212-L285 HydrophobicContact CE1-CD2 3.37Å; Y212-L285 HydrophobicContact CE1-CG 4.01Å; Y212-L285 HydrophobicContact CE2-CD2 3.93Å; Y212-L285 HydrophobicContact CG-CD2 4.21Å; Y212-L285 VanDerWaalsContact CZ-CD2 3.48Å
213	Q	91.9	Very high	90.9	Very high	87 Å²	87	72.4 Å²	72.4	41%	0.407	40%	0.397	S	S	.	.			trans	-123.1	133.2	175.8	-66.2	-68.1	-34.8	0	0	107	N229	Q213-N229 VanDerWaalsContact OE1-CG 3.3Å; Q213-N229 PolarHBondContact OE1-OD1 3.05Å
214	F	88.1	Confident	90.5	Very high	4 Å²	4	73.2 Å²	73.2	2%	0.018	41%	0.405	C	S	.	.			trans	-67	140.1	179.1	-51.3	-58.3	0	0	0	110.3	I179 Y212 T216 N225 M228 N229 I232 F234 M276 N281	I179-F214 HydrophobicContact CD1-CE1 4.17Å; I179-F214 HydrophobicContact CD1-CZ 4.37Å; Y212-F214 AromaticContact CD1-CD1 3.98Å; Y212-F214 HydrophobicContact CD1-CD1 3.98Å; Y212-F214 AromaticContact CD1-CE1 3.51Å; Y212-F214 HydrophobicContact CD1-CE1 3.51Å; Y212-F214 HydrophobicContact CD1-CZ 4.26Å; Y212-F214 AromaticContact CE1-CD1 3.32Å; Y212-F214 HydrophobicContact CE1-CD1 3.32Å; Y212-F214 AromaticContact CE1-CE1 3.21Å; Y212-F214 HydrophobicContact CE1-CE1 3.21Å; Y212-F214 HydrophobicContact CE1-CG 4.46Å; Y212-F214 HydrophobicContact CE1-CZ 4.34Å; F214-T216 PolarHBondContact O-N 3.32Å; F214-N225 HydrophobicContact CB-CB 3.72Å; F214-M228 HydrophobicContact CD2-CB 3.83Å; F214-M228 HydrophobicContact CE2-CB 4.16Å; F214-N229 WeakPolarHBondContact CD2-OD1 3.46Å; F214-N229 PolarHBondContact N-OD1 2.79Å; F214-N229 PolarHBondContact O-ND2 2.81Å; F214-I232 HydrophobicContact CE2-CD1 3.7Å; F214-I232 HydrophobicContact CE2-CG1 4.17Å; F214-I232 HydrophobicContact CZ-CD1 4.04Å; F214-F234 HydrophobicContact CE2-CE2 4.14Å; F214-F234 AromaticContact CE2-CZ 3.9Å; F214-F234 HydrophobicContact CE2-CZ 3.9Å; F214-F234 HydrophobicContact CZ-CE2 4.07Å; F214-F234 HydrophobicContact CZ-CZ 4.23Å; F214-M276 HydrophobicContact CD1-CG 3.47Å; F214-M276 VanDerWaalsContact CD1-CG 3.47Å; F214-M276 HydrophobicContact CD1-SD 3.75Å; F214-M276 HydrophobicContact CD2-CG 3.91Å; F214-M276 HydrophobicContact CE1-CE 3.31Å; F214-M276 HydrophobicContact CE1-CG 3.1Å; F214-M276 HydrophobicContact CE1-SD 2.95Å; F214-M276 WeakPolarHBondContact CE1-SD 3.49Å; F214-M276 HydrophobicContact CE2-CE 4.01Å; F214-M276 HydrophobicContact CE2-CG 3.57Å; F214-M276 HydrophobicContact CE2-SD 4.29Å; F214-M276 HydrophobicContact CG-CG 3.94Å; F214-M276 HydrophobicContact CZ-CE 3.03Å; F214-M276 HydrophobicContact CZ-CG 3.23Å; F214-M276 HydrophobicContact CZ-SD 3.36Å; F214-M276 WeakPolarHBondContact CZ-SD 3.32Å; F214-N281 HydrophobicContact CD1-CB 4.22Å; F214-N281 WeakPolarHBondContact CD1-ND2 3.33Å
215	P	87.9	Confident	90.2	Very high	25 Å²	25	72.9 Å²	72.9	16%	0.162	40%	0.404	C	S	.	.			trans	-59.6	135.4	-179.9	22.9	-32.8	0	0	0	111.3	D217 N225 D284	P215-D217 WeakPolarHBondContact CB-OD1 3.37Å; P215-N225 WeakPolarHBondContact O-CB 3.2Å; P215-N225 PolarHBondContact O-ND2 3.16Å; P215-D284 HydrophobicContact CG-CB 4.19Å
216	T	89.2	Confident	90	Very high	72 Å²	72	67.9 Å²	67.9	44%	0.442	39%	0.386	S	S	.	.			trans	-120.5	12.2	176.6	61	0	0	0	0	112.4	F214 S222 N225	F214-T216 PolarHBondContact O-N 3.32Å; T216-S222 WeakPolarHBondContact O-CB 3.29Å; T216-S222 PolarHBondContact O-OG 3.49Å; T216-N225 HydrophobicContact CG2-CB 4.22Å
217	D	86.8	Confident	89.7	Confident	136 Å²	136	66.6 Å²	66.6	73%	0.727	38%	0.375	S	S	*	.			trans	-81.3	-34.5	-179	56.8	-38.7	0	0	0	112.7	P215 E219	P215-D217 WeakPolarHBondContact CB-OD1 3.37Å; D217-E219 PolarHBondContact O-N 3.01Å
218	D	83.1	Confident	89.4	Confident	86 Å²	86	63.5 Å²	63.5	46%	0.46	36%	0.358	S	S	.	.	S	Bend	trans	-79.2	114.6	173.2	-178.3	-3.2	0	0	0	111.2	A220 V221 S222	D218-A220 PolarHBondContact O-N 2.6Å; D218-A220 VanDerWaalsContact O-N 3.11Å; D218-A220 WeakPolarHBondContact OD1-CB 3.37Å; D218-A220 PolarHBondContact OD1-N 2.89Å; D218-V221 HydrophobicContact CB-CG2 3.84Å; D218-V221 PolarHBondContact O-N 3.46Å; D218-V221 VanDerWaalsContact O-N 3.08Å; D218-S222 WeakPolarHBondContact O-CA 3.38Å; D218-S222 VanDerWaalsContact O-CB 3.26Å; D218-S222 WeakPolarHBondContact O-CB 3.5Å; D218-S222 PolarHBondContact O-N 2.76Å
219	E	84.9	Confident	89.2	Confident	189 Å²	189	57.3 Å²	57.3	88%	0.883	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-30.7	177.7	-69.7	-173.3	171.3	0	0	113.1	D217 V221	D217-E219 PolarHBondContact O-N 3.01Å; E219-V221 VanDerWaalsContact C-N 3.28Å; E219-V221 PolarHBondContact O-N 3.31Å
220	A	83	Confident	89.1	Confident	83 Å²	83	63.4 Å²	63.4	69%	0.686	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-27	-178.7	0	0	0	0	0	113.3	D218	D218-A220 PolarHBondContact O-N 2.6Å; D218-A220 VanDerWaalsContact O-N 3.11Å; D218-A220 WeakPolarHBondContact OD1-CB 3.37Å; D218-A220 PolarHBondContact OD1-N 2.89Å
221	V	83.5	Confident	89	Confident	38 Å²	38	64 Å²	64	23%	0.23	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-6.4	-175.5	-63.6	0	0	0	0	113.6	D218 E219 E223 T224 N225 V280	D218-V221 HydrophobicContact CB-CG2 3.84Å; D218-V221 PolarHBondContact O-N 3.46Å; D218-V221 VanDerWaalsContact O-N 3.08Å; E219-V221 VanDerWaalsContact C-N 3.28Å; E219-V221 PolarHBondContact O-N 3.31Å; V221-E223 PolarHBondContact O-N 3.47Å; V221-T224 PolarHBondContact O-N 3.13Å; V221-T224 VanDerWaalsContact O-N 3.16Å; V221-N225 WeakPolarHBondContact O-CB 3.36Å; V221-N225 PolarHBondContact O-N 3.46Å; V221-V280 HydrophobicContact CB-CG1 4.02Å; V221-V280 HydrophobicContact CG1-CG1 3.79Å
222	S	88.5	Confident	89	Confident	37 Å²	37	63.3 Å²	63.3	26%	0.259	35%	0.346	S	S	.	.	H	α-helix	trans	-56.4	-45.9	-174.1	-174	0	0	0	0	113.5	T216 D218 T224 N225 S226	T216-S222 WeakPolarHBondContact O-CB 3.29Å; T216-S222 PolarHBondContact O-OG 3.49Å; D218-S222 WeakPolarHBondContact O-CA 3.38Å; D218-S222 VanDerWaalsContact O-CB 3.26Å; D218-S222 WeakPolarHBondContact O-CB 3.5Å; D218-S222 PolarHBondContact O-N 2.76Å; S222-T224 PolarHBondContact O-N 3.37Å; S222-N225 PolarHBondContact O-N 3.27Å; S222-S226 VanDerWaalsContact O-CB 3.23Å; S222-S226 WeakPolarHBondContact O-CB 3.5Å; S222-S226 PolarHBondContact O-N 3.1Å
223	E	88.6	Confident	89.1	Confident	165 Å²	165	63.2 Å²	63.2	77%	0.771	35%	0.345	S	S	*	.	H	α-helix	trans	-62.4	-44.8	178.7	-174.7	177.6	-171.6	0	0	111.4	V221 V227	V221-E223 PolarHBondContact O-N 3.47Å; E223-V227 WeakPolarHBondContact O-CG2 3.32Å; E223-V227 PolarHBondContact O-N 3.3Å
224	T	87.8	Confident	89.3	Confident	64 Å²	64	59 Å²	59	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-63	-50.8	178.1	-61	0	0	0	0	110	V221 S222 S226 V227 M228	V221-T224 PolarHBondContact O-N 3.13Å; V221-T224 VanDerWaalsContact O-N 3.16Å; S222-T224 PolarHBondContact O-N 3.37Å; T224-S226 VanDerWaalsContact C-N 3.34Å; T224-S226 PolarHBondContact O-N 3.07Å; T224-V227 PolarHBondContact O-N 2.84Å; T224-M228 HydrophobicContact CG2-CE 4Å; T224-M228 HydrophobicContact CG2-CG 4.28Å; T224-M228 WeakPolarHBondContact O-CG 3.41Å; T224-M228 PolarHBondContact O-N 3.4Å
225	N	89.6	Confident	89.7	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-65.9	-34.6	-177.2	-79.1	-13.9	0	0	0	112.8	F214 P215 T216 V221 S222 M228 N229 N281	F214-N225 HydrophobicContact CB-CB 3.72Å; P215-N225 WeakPolarHBondContact O-CB 3.2Å; P215-N225 PolarHBondContact O-ND2 3.16Å; T216-N225 HydrophobicContact CG2-CB 4.22Å; V221-N225 WeakPolarHBondContact O-CB 3.36Å; V221-N225 PolarHBondContact O-N 3.46Å; S222-N225 PolarHBondContact O-N 3.27Å; N225-M228 PolarHBondContact O-N 3.07Å; N225-N229 WeakPolarHBondContact O-CB 2.98Å; N225-N229 VanDerWaalsContact O-CG 3.31Å; N225-N229 PolarHBondContact O-N 3.31Å; N225-N229 PolarHBondContact O-ND2 2.79Å; N225-N281 PolarHBondContact ND2-OD1 2.66Å; N225-N281 VanDerWaalsContact ND2-OD1 3.13Å; N225-N281 PolarHBondContact OD1-ND2 2.91Å
226	S	91.3	Very high	90.2	Very high	53 Å²	53	57.9 Å²	57.9	37%	0.371	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-46.9	173.1	-178	0	0	0	0	111.8	S222 T224 M228 N229 Q230	S222-S226 VanDerWaalsContact O-CB 3.23Å; S222-S226 WeakPolarHBondContact O-CB 3.5Å; S222-S226 PolarHBondContact O-N 3.1Å; T224-S226 VanDerWaalsContact C-N 3.34Å; T224-S226 PolarHBondContact O-N 3.07Å; S226-M228 VanDerWaalsContact C-N 3.34Å; S226-M228 PolarHBondContact O-N 3.49Å; S226-N229 PolarHBondContact O-N 2.8Å; S226-Q230 WeakPolarHBondContact O-CG 3.46Å; S226-Q230 PolarHBondContact O-N 3.29Å
227	V	89.9	Confident	90.5	Very high	58 Å²	58	54.5 Å²	54.5	35%	0.352	30%	0.298	S	S	.	.	H	α-helix	trans	-63.9	-40.4	175	175.1	0	0	0	0	110.9	E223 T224 Q230 H231	E223-V227 WeakPolarHBondContact O-CG2 3.32Å; E223-V227 PolarHBondContact O-N 3.3Å; T224-V227 PolarHBondContact O-N 2.84Å; V227-Q230 WeakPolarHBondContact O-CB 3.15Å; V227-Q230 PolarHBondContact O-N 3.18Å; V227-H231 PolarHBondContact O-ND1 3.36Å
228	M	88.5	Confident	90.9	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-67	-39.7	-179.9	-65	-59.5	166.3	0	0	112.6	F214 T224 N225 S226 Q230 H231 R272	F214-M228 HydrophobicContact CD2-CB 3.83Å; F214-M228 HydrophobicContact CE2-CB 4.16Å; T224-M228 HydrophobicContact CG2-CE 4Å; T224-M228 HydrophobicContact CG2-CG 4.28Å; T224-M228 WeakPolarHBondContact O-CG 3.41Å; T224-M228 PolarHBondContact O-N 3.4Å; N225-M228 PolarHBondContact O-N 3.07Å; S226-M228 VanDerWaalsContact C-N 3.34Å; S226-M228 PolarHBondContact O-N 3.49Å; M228-Q230 PolarHBondContact O-N 3.07Å; M228-H231 PolarHBondContact O-N 3.33Å; M228-R272 HydrophobicContact SD-CB 3.77Å; M228-R272 HydrophobicContact SD-CG 4.26Å
229	N	92	Very high	91.4	Very high	29 Å²	29	44.8 Å²	44.8	16%	0.155	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-34.2	176.2	-77.3	-28.9	0	0	0	111.8	Q213 F214 N225 S226 H231 I232	Q213-N229 VanDerWaalsContact OE1-CG 3.3Å; Q213-N229 PolarHBondContact OE1-OD1 3.05Å; F214-N229 WeakPolarHBondContact CD2-OD1 3.46Å; F214-N229 PolarHBondContact N-OD1 2.79Å; F214-N229 PolarHBondContact O-ND2 2.81Å; N225-N229 WeakPolarHBondContact O-CB 2.98Å; N225-N229 VanDerWaalsContact O-CG 3.31Å; N225-N229 PolarHBondContact O-N 3.31Å; N225-N229 PolarHBondContact O-ND2 2.79Å; S226-N229 PolarHBondContact O-N 2.8Å; N229-H231 PolarHBondContact O-N 3.24Å; N229-I232 WeakPolarHBondContact O-CB 3.13Å; N229-I232 PolarHBondContact O-N 2.75Å
230	Q	92.3	Very high	91.5	Very high	140 Å²	140	38.2 Å²	38.2	65%	0.654	22%	0.224	S	C	*	.	H	α-helix	trans	-66.8	-20.8	175.7	-64.2	169.3	19.3	0	0	113.6	S226 V227 M228	S226-Q230 WeakPolarHBondContact O-CG 3.46Å; S226-Q230 PolarHBondContact O-N 3.29Å; V227-Q230 WeakPolarHBondContact O-CB 3.15Å; V227-Q230 PolarHBondContact O-N 3.18Å; M228-Q230 PolarHBondContact O-N 3.07Å
231	H	93.1	Very high	91.8	Very high	53 Å²	53	39.6 Å²	39.6	25%	0.245	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-10.3	179.6	-71.1	77.3	0	0	0	113.1	K197 V227 M228 N229 P233 F234 D269	K197-H231 PolarHBondContact NZ-O 3.01Å; V227-H231 PolarHBondContact O-ND1 3.36Å; M228-H231 PolarHBondContact O-N 3.33Å; N229-H231 PolarHBondContact O-N 3.24Å; H231-P233 CarbonylContact O-C 3.5Å; H231-F234 HydrophobicContact CB-CD1 4Å; H231-F234 HydrophobicContact CB-CE1 3.81Å; H231-F234 PolarHBondContact O-N 3.5Å; H231-D269 IonicContact CD2-OD1 3.68Å
232	I	94.5	Very high	92.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-67.8	133.4	175	-59.9	178.5	0	0	0	109.4	P180 I211 F214 N229 F234	P180-I232 HydrophobicContact CG-CG2 3.67Å; I211-I232 HydrophobicContact CD1-CG2 3.82Å; F214-I232 HydrophobicContact CE2-CD1 3.7Å; F214-I232 HydrophobicContact CE2-CG1 4.17Å; F214-I232 HydrophobicContact CZ-CD1 4.04Å; N229-I232 WeakPolarHBondContact O-CB 3.13Å; N229-I232 PolarHBondContact O-N 2.75Å; I232-F234 HydrophobicContact CG1-CD2 4.44Å; I232-F234 HydrophobicContact CG1-CE2 3.84Å; I232-F234 HydrophobicContact CG1-CZ 4.13Å
233	P	96.1	Very high	92.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	S	Bend	cis	-74	137	-5.7	31.7	-36.9	0	0	0	112.3	P180 I182 K197 I200 H231 A235	P180-P233 HydrophobicContact CB-CB 3.99Å; P180-P233 HydrophobicContact CG-CB 4.04Å; P180-P233 VanDerWaalsContact O-CA 3.28Å; P180-P233 WeakPolarHBondContact O-CA 3.43Å; P180-P233 WeakPolarHBondContact O-CB 3.47Å; I182-P233 HydrophobicContact CD1-CB 4.47Å; I182-P233 HydrophobicContact CD1-CG 3.81Å; I182-P233 HydrophobicContact CG1-CB 4.19Å; I182-P233 HydrophobicContact CG1-CG 3.99Å; K197-P233 WeakPolarHBondContact CE-O 3.37Å; K197-P233 HydrophobicContact CG-CG 4.18Å; K197-P233 PolarHBondContact NZ-O 2.8Å; K197-P233 VanDerWaalsContact NZ-O 3.15Å; I200-P233 HydrophobicContact CB-CG 4.29Å; I200-P233 HydrophobicContact CD1-CG 3.99Å; I200-P233 HydrophobicContact CG2-CG 3.94Å; H231-P233 CarbonylContact O-C 3.5Å; P233-A235 PolarHBondContact O-N 3.02Å
234	F	96.7	Very high	92.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	127.7	-177.6	-64.8	-77.6	0	0	0	111.2	I179 P180 V181 I182 F214 H231 I232 V236 D269 R272 L273 M276	I179-F234 HydrophobicContact CG2-CD2 3.99Å; I179-F234 HydrophobicContact CG2-CE2 4.09Å; P180-F234 PolarHBondContact O-N 2.79Å; V181-F234 CarbonylContact C-O 3.31Å; V181-F234 WeakPolarHBondContact CA-O 3.39Å; V181-F234 HydrophobicContact CG1-CB 4.35Å; I182-F234 PolarHBondContact N-O 2.85Å; F214-F234 HydrophobicContact CE2-CE2 4.14Å; F214-F234 AromaticContact CE2-CZ 3.9Å; F214-F234 HydrophobicContact CE2-CZ 3.9Å; F214-F234 HydrophobicContact CZ-CE2 4.07Å; F214-F234 HydrophobicContact CZ-CZ 4.23Å; H231-F234 HydrophobicContact CB-CD1 4Å; H231-F234 HydrophobicContact CB-CE1 3.81Å; H231-F234 PolarHBondContact O-N 3.5Å; I232-F234 HydrophobicContact CG1-CD2 4.44Å; I232-F234 HydrophobicContact CG1-CE2 3.84Å; I232-F234 HydrophobicContact CG1-CZ 4.13Å; F234-V236 HydrophobicContact CB-CG1 4.01Å; F234-V236 PolarHBondContact O-N 2.68Å; F234-D269 HydrophobicContact CB-CB 4.21Å; F234-D269 HydrophobicContact CD1-CB 4.04Å; F234-R272 HydrophobicContact CD1-CB 4.15Å; F234-R272 HydrophobicContact CE1-CB 3.9Å; F234-L273 HydrophobicContact CB-CB 4.41Å; F234-L273 HydrophobicContact CD1-CB 4.45Å; F234-L273 HydrophobicContact CD2-CD1 3.7Å; F234-L273 HydrophobicContact CE2-CD1 4.09Å; F234-L273 HydrophobicContact CG-CB 4.22Å; F234-L273 HydrophobicContact CG-CD1 4.2Å; F234-M276 HydrophobicContact CD2-CE 4.41Å; F234-M276 HydrophobicContact CE2-CE 3.54Å; F234-M276 HydrophobicContact CZ-CE 4.05Å
235	A	97.3	Very high	92.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	96.8	179.6	0	0	0	0	0	110.5	S185 L193 P233 C268 D269	S185-A235 PolarHBondContact OG-O 2.91Å; S185-A235 VanDerWaalsContact OG-O 3.07Å; L193-A235 HydrophobicContact CD1-CB 3.76Å; L193-A235 HydrophobicContact CD2-CB 3.68Å; L193-A235 HydrophobicContact CG-CB 4.26Å; P233-A235 PolarHBondContact O-N 3.02Å; A235-C268 WeakPolarHBondContact O-CB 3.33Å; A235-D269 WeakPolarHBondContact CB-OD2 3.47Å; A235-D269 PolarHBondContact N-OD2 2.99Å; A235-D269 PolarHBondContact O-N 2.84Å
236	V	97.2	Very high	92	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.018	26%	0.259	C	S	.	.			trans	-107.9	147.9	-166.5	-61.8	0	0	0	0	114.2	L57 V181 I182 K184 S185 F234 L273	L57-V236 HydrophobicContact CD1-CB 3.97Å; L57-V236 HydrophobicContact CD1-CG2 4Å; L57-V236 HydrophobicContact CD2-CG2 3.99Å; V181-V236 HydrophobicContact CB-CG2 4.16Å; V181-V236 HydrophobicContact CG2-CG2 4.44Å; I182-V236 PolarHBondContact O-N 3.41Å; K184-V236 PolarHBondContact N-O 2.76Å; S185-V236 PolarHBondContact N-O 3.33Å; S185-V236 VanDerWaalsContact N-O 3.16Å; S185-V236 PolarHBondContact OG-N 3.4Å; S185-V236 PolarHBondContact OG-O 2.84Å; F234-V236 HydrophobicContact CB-CG1 4.01Å; F234-V236 PolarHBondContact O-N 2.68Å; V236-L273 HydrophobicContact CG1-CB 4.34Å; V236-L273 HydrophobicContact CG1-CD2 3.74Å
237	V	96.9	Very high	91.8	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.006	28%	0.278	C	S	.	.			trans	-125.4	127.6	172.5	-177.3	0	0	0	0	107.8	S185 D186 R253 V260 V262 C268	S185-V237 VanDerWaalsContact OG-CG2 3.3Å; S185-V237 WeakPolarHBondContact OG-CG2 3.49Å; D186-V237 HydrophobicContact CB-CG1 4.49Å; D186-V237 HydrophobicContact CB-CG2 3.88Å; V237-R253 HydrophobicContact CG1-CG 3.95Å; V237-V260 HydrophobicContact CG1-CG1 4.23Å; V237-V260 HydrophobicContact CG2-CG1 4.32Å; V237-V262 HydrophobicContact CG1-CG2 4.23Å; V237-V262 WeakPolarHBondContact O-CG1 3.32Å; V237-C268 HydrophobicContact CB-CB 4.22Å; V237-C268 HydrophobicContact CG2-CB 3.7Å
238	G	94.2	Very high	91.7	Very high	11 Å²	11	55.5 Å²	55.5	11%	0.113	29%	0.293	C	S	.	.			trans	-105.5	144.9	172.6	0	0	0	0	0	111.2	T60 R253	T60-G238 WeakPolarHBondContact OG1-CA 3.46Å; G238-R253 PolarHBondContact O-NH1 3.22Å; G238-R253 VanDerWaalsContact O-NH1 3.15Å
239	S	93.1	Very high	91.7	Very high	7 Å²	7	59.3 Å²	59.3	5%	0.049	32%	0.317	C	S	.	.			trans	-150.6	137.7	169.8	-169.8	0	0	0	0	112.2	T60 E241 V252	T60-S239 PolarHBondContact OG1-N 2.97Å; T60-S239 PolarHBondContact OG1-O 3Å; S239-E241 PolarHBondContact OG-N 3.08Å; S239-E241 VanDerWaalsContact OG-N 3.07Å; S239-V252 VanDerWaalsContact CB-O 3.28Å; S239-V252 WeakPolarHBondContact CB-O 3.33Å; S239-V252 PolarHBondContact OG-O 3.5Å
240	S	87.5	Confident	91.7	Very high	51 Å²	51	59 Å²	59	36%	0.357	32%	0.316	S	S	.	.			trans	-94.3	-4.1	169.6	-42.1	0	0	0	0	112	E59	E59-S240 PolarHBondContact OE2-OG 3.49Å
241	E	89.8	Confident	91.7	Very high	112 Å²	112	53.7 Å²	53.7	52%	0.523	29%	0.29	S	S	.	.			trans	-89	132.6	178.1	-65.1	179.6	178.5	0	0	111.1	S239 R251 V252	S239-E241 PolarHBondContact OG-N 3.08Å; S239-E241 VanDerWaalsContact OG-N 3.07Å; E241-R251 WeakPolarHBondContact O-CA 3.27Å; E241-V252 PolarHBondContact O-N 3.48Å
242	E	88.9	Confident	91.8	Very high	97 Å²	97	51.2 Å²	51.2	45%	0.453	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136	-178.5	-69.1	178.6	-176.1	0	0	110.7	R251	E242-R251 HydrophobicContact CG-CG 3.7Å; E242-R251 IonicContact OE1-CZ 2.71Å; E242-R251 IonicContact OE1-NE 3.35Å; E242-R251 PolarHBondContact OE1-NE 2.86Å; E242-R251 IonicContact OE1-NH2 3.79Å; E242-R251 PolarHBondContact OE1-NH2 2.8Å
243	V	90.8	Very high	91.8	Very high	35 Å²	35	54.6 Å²	54.6	21%	0.212	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	151.3	173.8	-66.4	0	0	0	0	110.2	I245 T249 V250 V252	V243-I245 HydrophobicContact CG2-CD1 3.84Å; V243-I245 HydrophobicContact CG2-CG1 3.9Å; V243-T249 WeakPolarHBondContact O-CA 3.41Å; V243-V250 PolarHBondContact N-O 2.85Å; V243-V250 PolarHBondContact O-N 3.33Å; V243-V252 HydrophobicContact CB-CG2 4.18Å; V243-V252 HydrophobicContact CG1-CG2 3.67Å; V243-V252 HydrophobicContact CG2-CB 4.1Å; V243-V252 HydrophobicContact CG2-CG1 3.45Å; V243-V252 VanDerWaalsContact CG2-CG1 3.45Å; V243-V252 HydrophobicContact CG2-CG2 3.45Å; V243-V252 VanDerWaalsContact CG2-CG2 3.45Å
244	K	89.4	Confident	91.7	Very high	171 Å²	171	60.1 Å²	60.1	74%	0.743	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.1	172.7	-69.1	-175.6	179.6	-178.9	0	109.7	K248 T249	K244-K248 CarbonylContact C-O 3.59Å; K244-K248 WeakPolarHBondContact CA-O 3.33Å; K244-T249 HydrophobicContact CG-CG2 4.06Å
245	I	85.9	Confident	91.5	Very high	54 Å²	54	63.2 Å²	63.2	28%	0.277	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123.4	172.8	-60	172.9	0	0	0	107	V243 G247 K248 V250 V252 Q261	V243-I245 HydrophobicContact CG2-CD1 3.84Å; V243-I245 HydrophobicContact CG2-CG1 3.9Å; I245-G247 PolarHBondContact O-N 3.2Å; I245-K248 PolarHBondContact N-O 2.9Å; I245-K248 PolarHBondContact O-N 3.3Å; I245-V250 HydrophobicContact CB-CG2 4.45Å; I245-V252 HydrophobicContact CD1-CG1 4.35Å; I245-Q261 HydrophobicContact CD1-CG 4.36Å
246	N	85.8	Confident	91.4	Very high	163 Å²	163	69.3 Å²	69.3	87%	0.872	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	37.3	-178.1	-57.5	-25.9	0	0	0	113.8	K248	N246-K248 PolarHBondContact O-N 3.41Å
247	G	87.2	Confident	91.3	Very high	74 Å²	74	79.2 Å²	79.2	76%	0.763	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	-5.9	-178.6	0	0	0	0	0	115.3	I245	I245-G247 PolarHBondContact O-N 3.2Å
248	K	88.5	Confident	91.1	Very high	156 Å²	156	80.7 Å²	80.7	68%	0.678	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.5	174.7	-64.6	-175.1	179	-177.5	0	110.4	K244 I245 N246 V250	K244-K248 CarbonylContact C-O 3.59Å; K244-K248 WeakPolarHBondContact CA-O 3.33Å; I245-K248 PolarHBondContact N-O 2.9Å; I245-K248 PolarHBondContact O-N 3.3Å; N246-K248 PolarHBondContact O-N 3.41Å; K248-V250 HydrophobicContact CB-CG2 4.41Å; K248-V250 PolarHBondContact O-N 3.2Å
249	T	89	Confident	91	Very high	86 Å²	86	83 Å²	83	53%	0.528	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	116.8	169.4	43.6	0	0	0	0	108.8	V243 K244	V243-T249 WeakPolarHBondContact O-CA 3.41Å; K244-T249 HydrophobicContact CG-CG2 4.06Å
250	V	91.4	Very high	91.1	Very high	21 Å²	21	83.9 Å²	83.9	13%	0.127	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.5	-178.4	-178.2	0	0	0	0	108.8	V243 I245 K248 V252 Q261	V243-V250 PolarHBondContact N-O 2.85Å; V243-V250 PolarHBondContact O-N 3.33Å; I245-V250 HydrophobicContact CB-CG2 4.45Å; K248-V250 HydrophobicContact CB-CG2 4.41Å; K248-V250 PolarHBondContact O-N 3.2Å; V250-V252 HydrophobicContact CG1-CG1 4.26Å; V250-Q261 HydrophobicContact CG1-CB 4.23Å; V250-Q261 HydrophobicContact CG1-CG 4.25Å
251	R	93.3	Very high	91.5	Very high	30 Å²	30	84 Å²	84	11%	0.113	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	127.7	174.5	-73.8	174.5	177.1	-165.3	-20	110.6	E59 T60 N63 E241 E242 V262	E59-R251 PolarHBondContact O-NH1 2.88Å; T60-R251 PolarHBondContact O-NH1 2.8Å; N63-R251 PolarHBondContact OD1-NH2 2.86Å; E241-R251 WeakPolarHBondContact O-CA 3.27Å; E242-R251 HydrophobicContact CG-CG 3.7Å; E242-R251 IonicContact OE1-CZ 2.71Å; E242-R251 IonicContact OE1-NE 3.35Å; E242-R251 PolarHBondContact OE1-NE 2.86Å; E242-R251 IonicContact OE1-NH2 3.79Å; E242-R251 PolarHBondContact OE1-NH2 2.8Å; R251-V262 HydrophobicContact CB-CB 4.12Å; R251-V262 HydrophobicContact CB-CG2 4.18Å; R251-V262 PolarHBondContact O-N 3.39Å
252	V	94.9	Very high	91.7	Very high	0 Å²	0	78.7 Å²	78.7	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	153	-176.3	-59.9	0	0	0	0	111.7	S239 E241 V243 I245 V250 Q254 V260 Q261	S239-V252 VanDerWaalsContact CB-O 3.28Å; S239-V252 WeakPolarHBondContact CB-O 3.33Å; S239-V252 PolarHBondContact OG-O 3.5Å; E241-V252 PolarHBondContact O-N 3.48Å; V243-V252 HydrophobicContact CB-CG2 4.18Å; V243-V252 HydrophobicContact CG1-CG2 3.67Å; V243-V252 HydrophobicContact CG2-CB 4.1Å; V243-V252 HydrophobicContact CG2-CG1 3.45Å; V243-V252 VanDerWaalsContact CG2-CG1 3.45Å; V243-V252 HydrophobicContact CG2-CG2 3.45Å; V243-V252 VanDerWaalsContact CG2-CG2 3.45Å; I245-V252 HydrophobicContact CD1-CG1 4.35Å; V250-V252 HydrophobicContact CG1-CG1 4.26Å; V252-Q254 HydrophobicContact CG2-CG 3.93Å; V252-V260 CarbonylContact C-O 3.49Å; V252-V260 WeakPolarHBondContact CA-O 3.38Å; V252-Q261 HydrophobicContact CG1-CG 4Å
253	R	94.8	Very high	91.9	Very high	74 Å²	74	77.9 Å²	77.9	28%	0.279	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	120.5	158.3	-62	-178.4	68.5	99.5	1.9	108.5	D186 V237 G238 Y255 S259 V260	D186-R253 WeakPolarHBondContact OD2-CD 3.35Å; D186-R253 IonicContact OD2-NE 3.7Å; D186-R253 PolarHBondContact OD2-NE 3.43Å; V237-R253 HydrophobicContact CG1-CG 3.95Å; G238-R253 PolarHBondContact O-NH1 3.22Å; G238-R253 VanDerWaalsContact O-NH1 3.15Å; R253-Y255 HydrophobicContact CB-CE2 3.96Å; R253-Y255 PolarHBondContact NE-OH 2.87Å; R253-Y255 VanDerWaalsContact NE-OH 3.09Å; R253-S259 WeakPolarHBondContact O-CA 3.12Å; R253-V260 HydrophobicContact CB-CB 4.38Å; R253-V260 PolarHBondContact N-O 3.3Å; R253-V260 PolarHBondContact O-N 3.01Å
254	Q	92.3	Very high	92	Very high	115 Å²	115	78 Å²	78	54%	0.537	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	130.3	179.8	-62.2	-171.2	0.6	0	0	111.1	V252	V252-Q254 HydrophobicContact CG2-CG 3.93Å
255	Y	94.5	Very high	92.3	Very high	65 Å²	65	73.8 Å²	73.8	26%	0.255	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	159.6	171.6	-63.4	-73.7	0	0	0	109.8	D186 R253 W257 G258 V260	D186-Y255 WeakPolarHBondContact OD2-CE2 3.47Å; D186-Y255 PolarHBondContact OD2-OH 3.22Å; R253-Y255 HydrophobicContact CB-CE2 3.96Å; R253-Y255 PolarHBondContact NE-OH 2.87Å; R253-Y255 VanDerWaalsContact NE-OH 3.09Å; Y255-W257 VanDerWaalsContact CB-CE2 3.4Å; Y255-W257 AromaticContact CD1-CH2 3.96Å; Y255-W257 HydrophobicContact CD1-CH2 3.96Å; Y255-W257 AromaticContact CD1-CZ2 3.6Å; Y255-W257 HydrophobicContact CD1-CZ2 3.6Å; Y255-W257 HydrophobicContact CD2-CZ2 4.27Å; Y255-W257 HydrophobicContact CE1-CZ2 4.31Å; Y255-W257 AromaticContact CG-CE2 3.75Å; Y255-W257 HydrophobicContact CG-CH2 4.29Å; Y255-W257 AromaticContact CG-CZ2 3.58Å; Y255-W257 HydrophobicContact CG-CZ2 3.58Å; Y255-W257 AromaticContact CG-NE1 3.91Å; Y255-W257 PolarHBondContact O-N 2.97Å; Y255-W257 VanDerWaalsContact O-N 3.08Å; Y255-G258 CarbonylContact C-O 3.56Å; Y255-G258 WeakPolarHBondContact CA-O 3.24Å; Y255-G258 PolarHBondContact N-O 3.09Å; Y255-G258 PolarHBondContact O-N 3.15Å; Y255-G258 VanDerWaalsContact O-N 3.08Å; Y255-V260 HydrophobicContact CD2-CG2 4.2Å; Y255-V260 HydrophobicContact CE2-CG2 4.04Å
256	P	95.2	Very high	92.7	Very high	130 Å²	130	77.4 Å²	77.4	84%	0.844	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-26.5	176.7	-27.1	35.8	0	0	0	114.4
257	W	93.9	Very high	93.1	Very high	210 Å²	210	73 Å²	73	80%	0.795	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-6.5	-179.6	53.3	82.4	0	0	0	114.6	Y255	Y255-W257 VanDerWaalsContact CB-CE2 3.4Å; Y255-W257 AromaticContact CD1-CH2 3.96Å; Y255-W257 HydrophobicContact CD1-CH2 3.96Å; Y255-W257 AromaticContact CD1-CZ2 3.6Å; Y255-W257 HydrophobicContact CD1-CZ2 3.6Å; Y255-W257 HydrophobicContact CD2-CZ2 4.27Å; Y255-W257 HydrophobicContact CE1-CZ2 4.31Å; Y255-W257 AromaticContact CG-CE2 3.75Å; Y255-W257 HydrophobicContact CG-CH2 4.29Å; Y255-W257 AromaticContact CG-CZ2 3.58Å; Y255-W257 HydrophobicContact CG-CZ2 3.58Å; Y255-W257 AromaticContact CG-NE1 3.91Å; Y255-W257 PolarHBondContact O-N 2.97Å; Y255-W257 VanDerWaalsContact O-N 3.08Å
258	G	92.4	Very high	93.5	Very high	33 Å²	33	69.5 Å²	69.5	34%	0.34	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	157.8	-179.2	-178.2	0	0	0	0	0	114.1	Y255	Y255-G258 CarbonylContact C-O 3.56Å; Y255-G258 WeakPolarHBondContact CA-O 3.24Å; Y255-G258 PolarHBondContact N-O 3.09Å; Y255-G258 PolarHBondContact O-N 3.15Å; Y255-G258 VanDerWaalsContact O-N 3.08Å
259	S	92.8	Very high	93.8	Very high	58 Å²	58	63 Å²	63	41%	0.406	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.6	-179.7	-64.6	0	0	0	0	111.2	R253 Q261	R253-S259 WeakPolarHBondContact O-CA 3.12Å; S259-Q261 PolarHBondContact O-N 3.13Å
260	V	95.3	Very high	94.2	Very high	27 Å²	27	59 Å²	59	16%	0.164	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	104.6	175.4	-176.7	0	0	0	0	108.6	D186 V237 V252 R253 Y255 H267	D186-V260 HydrophobicContact CB-CG1 4.23Å; D186-V260 HydrophobicContact CB-CG2 4.06Å; V237-V260 HydrophobicContact CG1-CG1 4.23Å; V237-V260 HydrophobicContact CG2-CG1 4.32Å; V252-V260 CarbonylContact C-O 3.49Å; V252-V260 WeakPolarHBondContact CA-O 3.38Å; R253-V260 HydrophobicContact CB-CB 4.38Å; R253-V260 PolarHBondContact N-O 3.3Å; R253-V260 PolarHBondContact O-N 3.01Å; Y255-V260 HydrophobicContact CD2-CG2 4.2Å; Y255-V260 HydrophobicContact CE2-CG2 4.04Å; V260-H267 HydrophobicContact CG1-CB 4.16Å
261	Q	94.8	Very high	94.3	Very high	53 Å²	53	58.6 Å²	58.6	25%	0.248	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	121.9	172.3	-61.6	169.7	6.8	0	0	110.7	I245 V250 V252 S259 N264 H267	I245-Q261 HydrophobicContact CD1-CG 4.36Å; V250-Q261 HydrophobicContact CG1-CB 4.23Å; V250-Q261 HydrophobicContact CG1-CG 4.25Å; V252-Q261 HydrophobicContact CG1-CG 4Å; S259-Q261 PolarHBondContact O-N 3.13Å; Q261-N264 HydrophobicContact CB-CB 3.72Å; Q261-N264 PolarHBondContact O-N 2.81Å; Q261-N264 PolarHBondContact OE1-ND2 3.32Å; Q261-N264 VanDerWaalsContact OE1-ND2 3.12Å; Q261-H267 PolarHBondContact N-ND1 2.97Å; Q261-H267 WeakPolarHBondContact O-CB 3.36Å; Q261-H267 PolarHBondContact O-ND1 2.87Å
262	V	95.7	Very high	94.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-36.4	-176.1	175	0	0	0	0	112	T60 V237 R251 N264 C268 F270	T60-V262 HydrophobicContact CG2-CG1 3.6Å; V237-V262 HydrophobicContact CG1-CG2 4.23Å; V237-V262 WeakPolarHBondContact O-CG1 3.32Å; R251-V262 HydrophobicContact CB-CB 4.12Å; R251-V262 HydrophobicContact CB-CG2 4.18Å; R251-V262 PolarHBondContact O-N 3.39Å; V262-N264 PolarHBondContact O-N 2.53Å; V262-C268 PolarHBondContact O-SG 3.12Å; V262-F270 HydrophobicContact CG1-CB 3.94Å; V262-F270 HydrophobicContact CG1-CD1 3.52Å; V262-F270 HydrophobicContact CG1-CD2 4.14Å; V262-F270 HydrophobicContact CG1-CE1 4.05Å; V262-F270 HydrophobicContact CG1-CG 3.57Å
263	E	92.7	Very high	94.2	Very high	81 Å²	81	60.1 Å²	60.1	38%	0.379	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	6.3	179.6	-59.4	-169.9	125	0	0	113.6	V271 R274	E263-V271 HydrophobicContact CB-CG2 4.34Å; E263-V271 VanDerWaalsContact O-CG2 3.27Å; E263-V271 WeakPolarHBondContact O-CG2 3.35Å; E263-R274 IonicContact OE1-CZ 2.76Å; E263-R274 IonicContact OE1-NH1 2.64Å; E263-R274 PolarHBondContact OE1-NH1 3.41Å; E263-R274 IonicContact OE1-NH2 3.4Å
264	N	93.3	Very high	94.1	Very high	37 Å²	37	60.3 Å²	60.3	20%	0.198	30%	0.3	C	S	.	.			trans	-94.5	113.6	178.4	-170.3	-27.5	0	0	0	109.9	Q261 V262 N266 H267 C268	Q261-N264 HydrophobicContact CB-CB 3.72Å; Q261-N264 PolarHBondContact O-N 2.81Å; Q261-N264 PolarHBondContact OE1-ND2 3.32Å; Q261-N264 VanDerWaalsContact OE1-ND2 3.12Å; V262-N264 PolarHBondContact O-N 2.53Å; N264-N266 PolarHBondContact O-N 3.4Å; N264-N266 WeakPolarHBondContact OD1-CB 3.45Å; N264-N266 PolarHBondContact OD1-N 3.1Å; N264-N266 PolarHBondContact OD1-ND2 3.19Å; N264-H267 HydrophobicContact CB-CB 4.25Å; N264-H267 WeakPolarHBondContact O-CA 3.17Å; N264-H267 WeakPolarHBondContact O-CB 3.35Å; N264-H267 PolarHBondContact O-N 2.96Å; N264-C268 PolarHBondContact O-N 3.08Å; N264-C268 VanDerWaalsContact O-N 3.13Å
265	E	93.9	Very high	93.9	Very high	83 Å²	83	57.1 Å²	57.1	39%	0.388	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.4	-179.3	-59.9	-174.8	165.9	0	0	113.1	H267 V271 R272	E265-H267 PolarHBondContact O-N 2.86Å; E265-V271 HydrophobicContact CG-CB 4.1Å; E265-V271 HydrophobicContact CG-CG1 4.43Å; E265-V271 HydrophobicContact CG-CG2 4.23Å; E265-R272 VanDerWaalsContact CD-CZ 3.46Å; E265-R272 IonicContact OE1-CZ 2.87Å; E265-R272 IonicContact OE1-NE 3.84Å; E265-R272 PolarHBondContact OE1-NE 2.99Å; E265-R272 IonicContact OE1-NH1 3.56Å; E265-R272 IonicContact OE1-NH2 3.25Å; E265-R272 PolarHBondContact OE1-NH2 2.54Å; E265-R272 IonicContact OE2-CZ 2.6Å; E265-R272 IonicContact OE2-NE 3.22Å; E265-R272 IonicContact OE2-NH2 2.67Å; E265-R272 PolarHBondContact OE2-NH2 3.26Å
266	N	94.3	Very high	93.6	Very high	129 Å²	129	54.1 Å²	54.1	69%	0.69	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-21.8	174	-60.9	-57.4	0	0	0	111.9	K190 N264	K190-N266 WeakPolarHBondContact CE-O 3.47Å; K190-N266 PolarHBondContact NZ-O 2.65Å; N264-N266 PolarHBondContact O-N 3.4Å; N264-N266 WeakPolarHBondContact OD1-CB 3.45Å; N264-N266 PolarHBondContact OD1-N 3.1Å; N264-N266 PolarHBondContact OD1-ND2 3.19Å
267	H	94.4	Very high	93.2	Very high	70 Å²	70	47.9 Å²	47.9	32%	0.324	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-47.8	179.9	-65.3	175.5	0	0	0	112	K190 V260 Q261 N264 E265	K190-H267 VanDerWaalsContact NZ-C 3.34Å; K190-H267 PolarHBondContact NZ-O 2.86Å; V260-H267 HydrophobicContact CG1-CB 4.16Å; Q261-H267 PolarHBondContact N-ND1 2.97Å; Q261-H267 WeakPolarHBondContact O-CB 3.36Å; Q261-H267 PolarHBondContact O-ND1 2.87Å; N264-H267 HydrophobicContact CB-CB 4.25Å; N264-H267 WeakPolarHBondContact O-CA 3.17Å; N264-H267 WeakPolarHBondContact O-CB 3.35Å; N264-H267 PolarHBondContact O-N 2.96Å; E265-H267 PolarHBondContact O-N 2.86Å
268	C	95.6	Very high	92.8	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.014	21%	0.207	C	C	.	.			trans	-154.8	167.3	-177.9	74.2	0	0	0	0	112.8	A235 V237 V262 N264 F270	A235-C268 WeakPolarHBondContact O-CB 3.33Å; V237-C268 HydrophobicContact CB-CB 4.22Å; V237-C268 HydrophobicContact CG2-CB 3.7Å; V262-C268 PolarHBondContact O-SG 3.12Å; N264-C268 PolarHBondContact O-N 3.08Å; N264-C268 VanDerWaalsContact O-N 3.13Å; C268-F270 VanDerWaalsContact C-N 3.26Å; C268-F270 PolarHBondContact O-N 2.9Å
269	D	95.9	Very high	92.3	Very high	19 Å²	19	47.9 Å²	47.9	10%	0.102	23%	0.226	C	C	.	.	S	Bend	trans	-88.6	16.6	-176.3	-53.5	-32.8	0	0	0	112.9	K197 H231 F234 A235 V271 R272 L273	K197-D269 IonicContact NZ-OD2 3.14Å; K197-D269 PolarHBondContact NZ-OD2 3.36Å; H231-D269 IonicContact CD2-OD1 3.68Å; F234-D269 HydrophobicContact CB-CB 4.21Å; F234-D269 HydrophobicContact CD1-CB 4.04Å; A235-D269 WeakPolarHBondContact CB-OD2 3.47Å; A235-D269 PolarHBondContact N-OD2 2.99Å; A235-D269 PolarHBondContact O-N 2.84Å; D269-V271 VanDerWaalsContact C-N 3.34Å; D269-V271 PolarHBondContact O-N 3.09Å; D269-R272 HydrophobicContact CB-CB 4.46Å; D269-R272 WeakPolarHBondContact O-CB 3.37Å; D269-R272 PolarHBondContact O-N 3.37Å; D269-R272 VanDerWaalsContact O-N 3.16Å; D269-L273 PolarHBondContact O-N 3.18Å
270	F	95.9	Very high	91.7	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-42	-175.7	171.5	-96.9	0	0	0	112.6	L57 T60 L61 V262 C268 R272 L273 R274	L57-F270 HydrophobicContact CD1-CD2 3.88Å; L57-F270 HydrophobicContact CD1-CE2 4.11Å; T60-F270 HydrophobicContact CG2-CD2 4.08Å; T60-F270 HydrophobicContact CG2-CE1 3.93Å; T60-F270 HydrophobicContact CG2-CE2 3.44Å; T60-F270 VanDerWaalsContact CG2-CE2 3.44Å; T60-F270 HydrophobicContact CG2-CZ 3.35Å; L61-F270 HydrophobicContact CB-CE2 4.38Å; L61-F270 HydrophobicContact CD1-CE2 4.36Å; L61-F270 HydrophobicContact CD1-CZ 4.47Å; V262-F270 HydrophobicContact CG1-CB 3.94Å; V262-F270 HydrophobicContact CG1-CD1 3.52Å; V262-F270 HydrophobicContact CG1-CD2 4.14Å; V262-F270 HydrophobicContact CG1-CE1 4.05Å; V262-F270 HydrophobicContact CG1-CG 3.57Å; C268-F270 VanDerWaalsContact C-N 3.26Å; C268-F270 PolarHBondContact O-N 2.9Å; F270-R272 VanDerWaalsContact C-N 3.29Å; F270-R272 PolarHBondContact O-N 3.41Å; F270-L273 PolarHBondContact O-N 3.44Å; F270-R274 WeakPolarHBondContact O-CB 3.26Å; F270-R274 PolarHBondContact O-N 2.67Å
271	V	93.7	Very high	91.3	Very high	13 Å²	13	46.4 Å²	46.4	8%	0.079	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-43.8	177.3	179.9	0	0	0	0	110.4	E263 E265 D269 R274 E275	E263-V271 HydrophobicContact CB-CG2 4.34Å; E263-V271 VanDerWaalsContact O-CG2 3.27Å; E263-V271 WeakPolarHBondContact O-CG2 3.35Å; E265-V271 HydrophobicContact CG-CB 4.1Å; E265-V271 HydrophobicContact CG-CG1 4.43Å; E265-V271 HydrophobicContact CG-CG2 4.23Å; D269-V271 VanDerWaalsContact C-N 3.34Å; D269-V271 PolarHBondContact O-N 3.09Å; V271-R274 PolarHBondContact O-N 3.4Å; V271-E275 HydrophobicContact CG1-CG 4.37Å; V271-E275 WeakPolarHBondContact O-CG 3.26Å; V271-E275 PolarHBondContact O-N 2.84Å
272	R	93.5	Very high	91.1	Very high	62 Å²	62	45.5 Å²	45.5	23%	0.234	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-44.9	178.1	-55.1	-58.2	-179.6	-177.3	3.6	111.4	M228 F234 E265 D269 F270 E275 M276	M228-R272 HydrophobicContact SD-CB 3.77Å; M228-R272 HydrophobicContact SD-CG 4.26Å; F234-R272 HydrophobicContact CD1-CB 4.15Å; F234-R272 HydrophobicContact CE1-CB 3.9Å; E265-R272 VanDerWaalsContact CD-CZ 3.46Å; E265-R272 IonicContact OE1-CZ 2.87Å; E265-R272 IonicContact OE1-NE 3.84Å; E265-R272 PolarHBondContact OE1-NE 2.99Å; E265-R272 IonicContact OE1-NH1 3.56Å; E265-R272 IonicContact OE1-NH2 3.25Å; E265-R272 PolarHBondContact OE1-NH2 2.54Å; E265-R272 IonicContact OE2-CZ 2.6Å; E265-R272 IonicContact OE2-NE 3.22Å; E265-R272 IonicContact OE2-NH2 2.67Å; E265-R272 PolarHBondContact OE2-NH2 3.26Å; D269-R272 HydrophobicContact CB-CB 4.46Å; D269-R272 WeakPolarHBondContact O-CB 3.37Å; D269-R272 PolarHBondContact O-N 3.37Å; D269-R272 VanDerWaalsContact O-N 3.16Å; F270-R272 VanDerWaalsContact C-N 3.29Å; F270-R272 PolarHBondContact O-N 3.41Å; R272-E275 IonicContact NH1-OE2 3.91Å; R272-M276 WeakPolarHBondContact O-CB 3.45Å; R272-M276 PolarHBondContact O-N 3.07Å; R272-M276 VanDerWaalsContact O-N 3.07Å
273	L	94.3	Very high	90.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-44.7	174.3	-179.2	66.5	0	0	0	112	L57 L151 I179 V181 F234 V236 D269 F270 M276 L277	L57-L273 HydrophobicContact CD2-CD2 4.14Å; L151-L273 HydrophobicContact CD2-CD1 4.37Å; I179-L273 HydrophobicContact CG2-CD1 4.3Å; V181-L273 HydrophobicContact CG1-CD1 4.33Å; V181-L273 HydrophobicContact CG1-CD2 4.21Å; F234-L273 HydrophobicContact CB-CB 4.41Å; F234-L273 HydrophobicContact CD1-CB 4.45Å; F234-L273 HydrophobicContact CD2-CD1 3.7Å; F234-L273 HydrophobicContact CE2-CD1 4.09Å; F234-L273 HydrophobicContact CG-CB 4.22Å; F234-L273 HydrophobicContact CG-CD1 4.2Å; V236-L273 HydrophobicContact CG1-CB 4.34Å; V236-L273 HydrophobicContact CG1-CD2 3.74Å; D269-L273 PolarHBondContact O-N 3.18Å; F270-L273 PolarHBondContact O-N 3.44Å; L273-M276 HydrophobicContact CD1-CE 3.81Å; L273-M276 PolarHBondContact O-N 3.22Å; L273-L277 HydrophobicContact CD1-CD1 3.68Å; L273-L277 HydrophobicContact CD1-CG 3.99Å; L273-L277 HydrophobicContact CD2-CD1 4.38Å; L273-L277 HydrophobicContact CG-CD1 3.78Å; L273-L277 HydrophobicContact CG-CG 4.39Å; L273-L277 WeakPolarHBondContact O-CB 3.34Å; L273-L277 WeakPolarHBondContact O-CG 2.96Å; L273-L277 PolarHBondContact O-N 3.02Å
274	R	92.7	Very high	90.6	Very high	78 Å²	78	50.5 Å²	50.5	29%	0.294	24%	0.235	S	C	.	.	H	α-helix	trans	-64.1	-48.7	-178.7	179.3	178.2	70.1	-171.4	-1.5	112	L61 E263 F270 V271 M276 L277 L278	L61-R274 HydrophobicContact CD1-CB 3.74Å; L61-R274 HydrophobicContact CD1-CG 3.82Å; E263-R274 IonicContact OE1-CZ 2.76Å; E263-R274 IonicContact OE1-NH1 2.64Å; E263-R274 PolarHBondContact OE1-NH1 3.41Å; E263-R274 IonicContact OE1-NH2 3.4Å; F270-R274 WeakPolarHBondContact O-CB 3.26Å; F270-R274 PolarHBondContact O-N 2.67Å; V271-R274 PolarHBondContact O-N 3.4Å; R274-M276 VanDerWaalsContact C-N 3.3Å; R274-M276 PolarHBondContact O-N 2.79Å; R274-L277 PolarHBondContact O-N 2.95Å; R274-L278 HydrophobicContact CG-CD1 4.32Å; R274-L278 WeakPolarHBondContact O-CB 3.49Å; R274-L278 PolarHBondContact O-N 3.01Å; R274-L278 VanDerWaalsContact O-N 3.08Å
275	E	88.2	Confident	90.7	Very high	49 Å²	49	48.8 Å²	48.8	23%	0.229	23%	0.226	C	C	.	.	I	π-helix	trans	-60.4	-44.7	178.5	-72.5	-169.8	141.1	0	0	111	V271 R272 R279 V280	V271-E275 HydrophobicContact CG1-CG 4.37Å; V271-E275 WeakPolarHBondContact O-CG 3.26Å; V271-E275 PolarHBondContact O-N 2.84Å; R272-E275 IonicContact NH1-OE2 3.91Å; E275-R279 WeakPolarHBondContact O-CA 3.45Å; E275-R279 WeakPolarHBondContact O-CB 3.37Å; E275-R279 PolarHBondContact O-N 2.92Å; E275-R279 IonicContact OE1-NH1 2.65Å; E275-R279 PolarHBondContact OE1-NH1 3.08Å; E275-V280 PolarHBondContact O-N 3.39Å
276	M	86.5	Confident	90.7	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	22%	0.22	C	C	.	.	I	π-helix	trans	-61.4	-50.5	179.1	176.7	-79.9	-87.2	0	0	112.3	I179 F214 F234 R272 L273 R274 N281	I179-M276 HydrophobicContact CD1-CE 3.43Å; I179-M276 VanDerWaalsContact CD1-CE 3.43Å; I179-M276 HydrophobicContact CD1-SD 4.08Å; I179-M276 HydrophobicContact CG1-CE 4.23Å; I179-M276 HydrophobicContact CG2-CE 4Å; F214-M276 HydrophobicContact CD1-CG 3.47Å; F214-M276 VanDerWaalsContact CD1-CG 3.47Å; F214-M276 HydrophobicContact CD1-SD 3.75Å; F214-M276 HydrophobicContact CD2-CG 3.91Å; F214-M276 HydrophobicContact CE1-CE 3.31Å; F214-M276 HydrophobicContact CE1-CG 3.1Å; F214-M276 HydrophobicContact CE1-SD 2.95Å; F214-M276 WeakPolarHBondContact CE1-SD 3.49Å; F214-M276 HydrophobicContact CE2-CE 4.01Å; F214-M276 HydrophobicContact CE2-CG 3.57Å; F214-M276 HydrophobicContact CE2-SD 4.29Å; F214-M276 HydrophobicContact CG-CG 3.94Å; F214-M276 HydrophobicContact CZ-CE 3.03Å; F214-M276 HydrophobicContact CZ-CG 3.23Å; F214-M276 HydrophobicContact CZ-SD 3.36Å; F214-M276 WeakPolarHBondContact CZ-SD 3.32Å; F234-M276 HydrophobicContact CD2-CE 4.41Å; F234-M276 HydrophobicContact CE2-CE 3.54Å; F234-M276 HydrophobicContact CZ-CE 4.05Å; R272-M276 WeakPolarHBondContact O-CB 3.45Å; R272-M276 PolarHBondContact O-N 3.07Å; R272-M276 VanDerWaalsContact O-N 3.07Å; L273-M276 HydrophobicContact CD1-CE 3.81Å; L273-M276 PolarHBondContact O-N 3.22Å; R274-M276 VanDerWaalsContact C-N 3.3Å; R274-M276 PolarHBondContact O-N 2.79Å; M276-N281 WeakPolarHBondContact O-CB 3.42Å; M276-N281 PolarHBondContact O-N 2.99Å; M276-N281 VanDerWaalsContact O-N 3.11Å
277	L	87.9	Confident	90.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-72	-40.7	-172.4	-74.4	174.7	0	0	0	113.1	L61 V149 L151 I179 L273 R274 L285	L61-L277 HydrophobicContact CD2-CD1 3.93Å; V149-L277 HydrophobicContact CG1-CD2 4.41Å; V149-L277 HydrophobicContact CG2-CD2 3.91Å; L151-L277 HydrophobicContact CD1-CD1 4.19Å; L151-L277 HydrophobicContact CD2-CD1 4.02Å; L151-L277 HydrophobicContact CD2-CD2 4.3Å; I179-L277 HydrophobicContact CD1-CD2 3.85Å; L273-L277 HydrophobicContact CD1-CD1 3.68Å; L273-L277 HydrophobicContact CD1-CG 3.99Å; L273-L277 HydrophobicContact CD2-CD1 4.38Å; L273-L277 HydrophobicContact CG-CD1 3.78Å; L273-L277 HydrophobicContact CG-CG 4.39Å; L273-L277 WeakPolarHBondContact O-CB 3.34Å; L273-L277 WeakPolarHBondContact O-CG 2.96Å; L273-L277 PolarHBondContact O-N 3.02Å; R274-L277 PolarHBondContact O-N 2.95Å; L277-L285 HydrophobicContact CD2-CD1 4.09Å
278	L	84.9	Confident	90.6	Very high	48 Å²	48	49.5 Å²	49.5	25%	0.251	22%	0.218	S	C	.	.	I	π-helix	trans	-106.6	-31.4	-166.6	-58.7	-176.4	0	0	0	113.3	F42 L61 F62 R274 M282	F42-L278 HydrophobicContact CE1-CD2 4.34Å; L61-L278 HydrophobicContact CD1-CD1 4.05Å; L61-L278 HydrophobicContact CG-CD1 4.09Å; F62-L278 HydrophobicContact CD1-CD1 4.35Å; F62-L278 HydrophobicContact CE1-CD1 3.94Å; F62-L278 HydrophobicContact CE1-CD2 3.68Å; F62-L278 HydrophobicContact CE1-CG 4.49Å; F62-L278 HydrophobicContact CZ-CD1 4.5Å; F62-L278 HydrophobicContact CZ-CD2 3.85Å; R274-L278 HydrophobicContact CG-CD1 4.32Å; R274-L278 WeakPolarHBondContact O-CB 3.49Å; R274-L278 PolarHBondContact O-N 3.01Å; R274-L278 VanDerWaalsContact O-N 3.08Å; L278-M282 HydrophobicContact CB-CE 4.39Å; L278-M282 HydrophobicContact CD2-CE 3.86Å
279	R	81.5	Confident	90.7	Very high	195 Å²	195	49.4 Å²	49.4	74%	0.736	22%	0.217	S	C	*	.	I	π-helix	trans	-96.3	-42.2	-171.4	-172.8	-178.7	178.9	-173.8	-1.3	113	E275	E275-R279 WeakPolarHBondContact O-CA 3.45Å; E275-R279 WeakPolarHBondContact O-CB 3.37Å; E275-R279 PolarHBondContact O-N 2.92Å; E275-R279 IonicContact OE1-NH1 2.65Å; E275-R279 PolarHBondContact OE1-NH1 3.08Å
280	V	81.1	Confident	90.6	Very high	50 Å²	50	52.1 Å²	52.1	30%	0.303	23%	0.229	S	C	.	.	I	π-helix	trans	-106	-51.7	-170.1	-171.5	0	0	0	0	112	V221 E275	V221-V280 HydrophobicContact CB-CG1 4.02Å; V221-V280 HydrophobicContact CG1-CG1 3.79Å; E275-V280 PolarHBondContact O-N 3.39Å
281	N	87	Confident	90.6	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	25%	0.253	C	S	.	.	S	Bend	trans	-110.7	14.6	-162.9	-58.5	-51.5	0	0	0	114.2	F214 N225 M276 E283 D284 L285	F214-N281 HydrophobicContact CD1-CB 4.22Å; F214-N281 WeakPolarHBondContact CD1-ND2 3.33Å; N225-N281 PolarHBondContact ND2-OD1 2.66Å; N225-N281 VanDerWaalsContact ND2-OD1 3.13Å; N225-N281 PolarHBondContact OD1-ND2 2.91Å; M276-N281 WeakPolarHBondContact O-CB 3.42Å; M276-N281 PolarHBondContact O-N 2.99Å; M276-N281 VanDerWaalsContact O-N 3.11Å; N281-E283 VanDerWaalsContact C-N 3.3Å; N281-E283 PolarHBondContact O-N 2.83Å; N281-D284 PolarHBondContact O-N 3.18Å; N281-L285 WeakPolarHBondContact O-CB 3.46Å; N281-L285 WeakPolarHBondContact O-CD1 3.48Å; N281-L285 VanDerWaalsContact O-CG 3.25Å; N281-L285 WeakPolarHBondContact O-CG 3.38Å; N281-L285 PolarHBondContact O-N 2.77Å
282	M	90	Very high	90.7	Very high	33 Å²	33	57.1 Å²	57.1	16%	0.163	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-41.9	179.8	-171	-172.8	-63.8	0	0	111.7	F42 L94 L278 R286	F42-M282 HydrophobicContact CB-SD 4.23Å; F42-M282 HydrophobicContact CD2-CG 3.51Å; F42-M282 HydrophobicContact CD2-SD 4.23Å; F42-M282 HydrophobicContact CE2-CG 3.64Å; F42-M282 HydrophobicContact CG-CG 4Å; F42-M282 HydrophobicContact CG-SD 4.18Å; F42-M282 HydrophobicContact CZ-CG 4.19Å; L94-M282 HydrophobicContact CD1-SD 4.1Å; L94-M282 HydrophobicContact CD2-CE 4.26Å; L278-M282 HydrophobicContact CB-CE 4.39Å; L278-M282 HydrophobicContact CD2-CE 3.86Å; M282-R286 WeakPolarHBondContact O-CG 3.33Å; M282-R286 PolarHBondContact O-N 2.98Å
283	E	88	Confident	90.9	Very high	141 Å²	141	54.6 Å²	54.6	66%	0.659	26%	0.261	S	S	*	.	H	α-helix	trans	-71.5	-44.8	179.3	-172.9	162.6	-160.4	0	0	111.9	N281 L285 R286 E287	N281-E283 VanDerWaalsContact C-N 3.3Å; N281-E283 PolarHBondContact O-N 2.83Å; E283-L285 VanDerWaalsContact C-N 3.33Å; E283-L285 PolarHBondContact O-N 3.3Å; E283-R286 WeakPolarHBondContact O-CA 3.15Å; E283-R286 WeakPolarHBondContact O-CB 3.48Å; E283-R286 PolarHBondContact O-N 2.95Å; E283-E287 PolarHBondContact O-N 2.92Å
284	D	90.9	Very high	91	Very high	46 Å²	46	54.6 Å²	54.6	25%	0.246	26%	0.261	C	S	.	.	H	α-helix	trans	-58.3	-43.6	175.6	-178.9	80	0	0	0	112.1	Y212 P215 N281 R286 E287 R288	Y212-D284 WeakPolarHBondContact CE2-OD2 3.01Å; Y212-D284 VanDerWaalsContact CZ-OD2 3.31Å; Y212-D284 PolarHBondContact OH-OD2 2.95Å; P215-D284 HydrophobicContact CG-CB 4.19Å; N281-D284 PolarHBondContact O-N 3.18Å; D284-R286 VanDerWaalsContact C-N 3.26Å; D284-R286 PolarHBondContact O-N 3.39Å; D284-E287 PolarHBondContact O-N 3.25Å; D284-R288 VanDerWaalsContact O-CB 3.31Å; D284-R288 WeakPolarHBondContact O-CB 3.29Å; D284-R288 PolarHBondContact O-N 3.5Å
285	L	94.9	Very high	91.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-56.9	-40.9	174.9	-77	166.9	0	0	0	111.8	F42 V149 N177 I179 Y212 L277 N281 E283 T289	F42-L285 HydrophobicContact CE2-CB 4.27Å; F42-L285 HydrophobicContact CE2-CD1 4.2Å; F42-L285 HydrophobicContact CZ-CD1 3.89Å; V149-L285 HydrophobicContact CB-CD1 4.24Å; V149-L285 HydrophobicContact CB-CD2 4.22Å; V149-L285 HydrophobicContact CG2-CD2 4.48Å; N177-L285 HydrophobicContact CB-CD2 3.62Å; N177-L285 PolarHBondContact ND2-O 3.05Å; I179-L285 HydrophobicContact CD1-CD2 4.46Å; Y212-L285 HydrophobicContact CD1-CD2 3.82Å; Y212-L285 HydrophobicContact CD2-CD2 4.24Å; Y212-L285 HydrophobicContact CE1-CD2 3.37Å; Y212-L285 HydrophobicContact CE1-CG 4.01Å; Y212-L285 HydrophobicContact CE2-CD2 3.93Å; Y212-L285 HydrophobicContact CG-CD2 4.21Å; Y212-L285 VanDerWaalsContact CZ-CD2 3.48Å; L277-L285 HydrophobicContact CD2-CD1 4.09Å; N281-L285 WeakPolarHBondContact O-CB 3.46Å; N281-L285 WeakPolarHBondContact O-CD1 3.48Å; N281-L285 VanDerWaalsContact O-CG 3.25Å; N281-L285 WeakPolarHBondContact O-CG 3.38Å; N281-L285 PolarHBondContact O-N 2.77Å; E283-L285 VanDerWaalsContact C-N 3.33Å; E283-L285 PolarHBondContact O-N 3.3Å; L285-T289 WeakPolarHBondContact O-CB 3.45Å; L285-T289 PolarHBondContact O-N 3.25Å; L285-T289 VanDerWaalsContact O-N 3.08Å; L285-T289 PolarHBondContact O-OG1 3.16Å; L285-T289 VanDerWaalsContact O-OG1 3.1Å
286	R	93.7	Very high	91.5	Very high	70 Å²	70	55 Å²	55	26%	0.264	27%	0.271	S	S	.	.	H	α-helix	trans	-70	-44.7	177.3	-68.8	177.2	67	-145.2	-3.5	111.6	V41 F42 H148 M282 E283 D284 T289 H290	V41-R286 WeakPolarHBondContact O-CD 3.33Å; V41-R286 PolarHBondContact O-NE 3.29Å; F42-R286 HydrophobicContact CD2-CG 4.34Å; H148-R286 HydrophobicContact CB-CG 4.3Å; M282-R286 WeakPolarHBondContact O-CG 3.33Å; M282-R286 PolarHBondContact O-N 2.98Å; E283-R286 WeakPolarHBondContact O-CA 3.15Å; E283-R286 WeakPolarHBondContact O-CB 3.48Å; E283-R286 PolarHBondContact O-N 2.95Å; D284-R286 VanDerWaalsContact C-N 3.26Å; D284-R286 PolarHBondContact O-N 3.39Å; R286-T289 PolarHBondContact O-N 3.49Å; R286-H290 PolarHBondContact O-N 3.48Å
287	E	92.5	Very high	91.9	Very high	133 Å²	133	55.9 Å²	55.9	62%	0.621	28%	0.275	S	S	*	.	H	α-helix	trans	-62.7	-47.2	179.7	-176.2	169.1	-173.5	0	0	110.9	E283 D284 T289 H290 G291	E283-E287 PolarHBondContact O-N 2.92Å; D284-E287 PolarHBondContact O-N 3.25Å; E287-T289 VanDerWaalsContact C-N 3.35Å; E287-T289 PolarHBondContact O-N 3.44Å; E287-H290 CarbonylContact O-C 3.06Å; E287-H290 WeakPolarHBondContact O-CA 3.21Å; E287-H290 PolarHBondContact O-N 3.09Å; E287-G291 PolarHBondContact O-N 2.94Å
288	R	94.5	Very high	92.3	Very high	94 Å²	94	58.7 Å²	58.7	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-62.4	-40.6	175.8	-172.7	170.8	178.1	139.1	1.6	112.5	N177 D284 H290 V292 H293	N177-R288 WeakPolarHBondContact OD1-CD 3.37Å; N177-R288 WeakPolarHBondContact OD1-CG 3.28Å; N177-R288 PolarHBondContact OD1-NE 3.38Å; D284-R288 VanDerWaalsContact O-CB 3.31Å; D284-R288 WeakPolarHBondContact O-CB 3.29Å; D284-R288 PolarHBondContact O-N 3.5Å; R288-H290 VanDerWaalsContact C-N 3.26Å; R288-H290 PolarHBondContact O-N 3.27Å; R288-V292 HydrophobicContact CG-CB 4.26Å; R288-V292 HydrophobicContact CG-CG2 4.05Å; R288-V292 WeakPolarHBondContact O-CA 3.26Å; R288-V292 VanDerWaalsContact O-CB 3.31Å; R288-V292 WeakPolarHBondContact O-CB 3.24Å; R288-V292 PolarHBondContact O-N 2.77Å; R288-H293 PolarHBondContact O-N 3.12Å
289	T	96.8	Very high	92.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.304	C	S	.	.	I	π-helix	trans	-59	-40.3	172	-73.1	0	0	0	0	111.5	F125 R146 V147 H148 N177 L285 R286 E287 Y294	F125-T289 HydrophobicContact CE1-CG2 4.09Å; R146-T289 HydrophobicContact CB-CG2 4.16Å; V147-T289 WeakPolarHBondContact O-CG2 3.5Å; V147-T289 PolarHBondContact O-OG1 2.89Å; H148-T289 WeakPolarHBondContact CA-OG1 3.26Å; H148-T289 PolarHBondContact O-OG1 3.17Å; N177-T289 PolarHBondContact ND2-OG1 3.36Å; N177-T289 VanDerWaalsContact ND2-OG1 3.15Å; L285-T289 WeakPolarHBondContact O-CB 3.45Å; L285-T289 PolarHBondContact O-N 3.25Å; L285-T289 VanDerWaalsContact O-N 3.08Å; L285-T289 PolarHBondContact O-OG1 3.16Å; L285-T289 VanDerWaalsContact O-OG1 3.1Å; R286-T289 PolarHBondContact O-N 3.49Å; E287-T289 VanDerWaalsContact C-N 3.35Å; E287-T289 PolarHBondContact O-N 3.44Å; T289-Y294 WeakPolarHBondContact O-CB 3.5Å; T289-Y294 PolarHBondContact O-N 2.84Å
290	H	95.5	Very high	93.1	Very high	76 Å²	76	60.1 Å²	60.1	35%	0.352	29%	0.292	S	S	.	.	I	π-helix	trans	-74.1	-52.1	179.2	-174.5	26	0	0	0	113.1	R146 R286 E287 R288 Y294 E295	R146-H290 PolarHBondContact NH1-ND1 3.12Å; R286-H290 PolarHBondContact O-N 3.48Å; E287-H290 CarbonylContact O-C 3.06Å; E287-H290 WeakPolarHBondContact O-CA 3.21Å; E287-H290 PolarHBondContact O-N 3.09Å; R288-H290 VanDerWaalsContact C-N 3.26Å; R288-H290 PolarHBondContact O-N 3.27Å; H290-Y294 AromaticContact CE1-CD1 3.88Å; H290-Y294 AromaticContact ND1-CD1 3.46Å; H290-Y294 WeakPolarHBondContact ND1-CD1 3.34Å; H290-Y294 WeakPolarHBondContact O-CB 3.3Å; H290-E295 PolarHBondContact O-N 2.86Å
291	G	94.7	Very high	93.6	Very high	48 Å²	48	61.9 Å²	61.9	50%	0.495	29%	0.293	S	S	.	.	I	π-helix	trans	-82.2	-21.2	-170.6	0	0	0	0	0	114.8	E287 E295	E287-G291 PolarHBondContact O-N 2.94Å; G291-E295 WeakPolarHBondContact O-CB 3.41Å
292	V	95.8	Very high	93.8	Very high	71 Å²	71	62.8 Å²	62.8	43%	0.43	30%	0.298	S	S	.	.	I	π-helix	trans	-112.5	-65.1	-178.8	-176.2	0	0	0	0	111	R288 T296	R288-V292 HydrophobicContact CG-CB 4.26Å; R288-V292 HydrophobicContact CG-CG2 4.05Å; R288-V292 WeakPolarHBondContact O-CA 3.26Å; R288-V292 VanDerWaalsContact O-CB 3.31Å; R288-V292 WeakPolarHBondContact O-CB 3.24Å; R288-V292 PolarHBondContact O-N 2.77Å; V292-T296 WeakPolarHBondContact O-CB 3.5Å; V292-T296 PolarHBondContact O-N 3.46Å; V292-T296 PolarHBondContact O-OG1 3.24Å
293	H	97.4	Very high	93.7	Very high	10 Å²	10	65.4 Å²	65.4	5%	0.046	31%	0.311	C	S	.	.	I	π-helix	trans	-69.3	-50.1	-171.6	-62.4	-50.2	0	0	0	112.1	F125 E173 N174 N177 R288 T296 Y297	F125-H293 HydrophobicContact CZ-CB 3.88Å; E173-H293 PolarHBondContact O-CE1 2.71Å; N174-H293 VanDerWaalsContact C-ND1 3.29Å; N174-H293 PolarHBondContact O-ND1 3.36Å; N177-H293 PolarHBondContact N-NE2 3.46Å; N177-H293 PolarHBondContact OD1-NE2 2.79Å; R288-H293 PolarHBondContact O-N 3.12Å; H293-T296 PolarHBondContact O-N 3.22Å; H293-Y297 PolarHBondContact O-N 2.96Å; H293-Y297 VanDerWaalsContact O-N 3.09Å
294	Y	97.6	Very high	93.8	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.301	C	S	.	.	I	π-helix	trans	-65.6	-43.9	178	170.2	-102.1	0	0	0	111.7	F125 Y128 L129 E132 T289 H290 T296 Y297 R298	F125-Y294 HydrophobicContact CB-CD2 4.2Å; F125-Y294 AromaticContact CD1-CD2 3.79Å; F125-Y294 HydrophobicContact CD1-CD2 3.79Å; F125-Y294 HydrophobicContact CD1-CG 4.42Å; F125-Y294 HydrophobicContact CG-CD2 4.27Å; Y128-Y294 HydrophobicContact CD1-CD2 4.26Å; Y128-Y294 AromaticContact CD1-CE1 3.97Å; Y128-Y294 HydrophobicContact CD1-CE1 3.97Å; Y128-Y294 AromaticContact CD1-CE2 3.58Å; Y128-Y294 HydrophobicContact CD1-CE2 3.58Å; Y128-Y294 AromaticContact CD1-CZ 3.41Å; Y128-Y294 VanDerWaalsContact CD1-CZ 3.41Å; Y128-Y294 WeakPolarHBondContact CD1-OH 3.34Å; Y128-Y294 AromaticContact CE1-CE1 3.96Å; Y128-Y294 HydrophobicContact CE1-CE1 3.96Å; Y128-Y294 HydrophobicContact CE1-CE2 4.39Å; Y128-Y294 AromaticContact CE1-CZ 3.87Å; Y128-Y294 HydrophobicContact CG-CE2 4.27Å; L129-Y294 VanDerWaalsContact CA-OH 3.32Å; L129-Y294 WeakPolarHBondContact CA-OH 3.3Å; L129-Y294 HydrophobicContact CB-CE2 4.19Å; L129-Y294 WeakPolarHBondContact CD1-OH 3.4Å; E132-Y294 PolarHBondContact OE2-OH 2.89Å; T289-Y294 WeakPolarHBondContact O-CB 3.5Å; T289-Y294 PolarHBondContact O-N 2.84Å; H290-Y294 AromaticContact CE1-CD1 3.88Å; H290-Y294 AromaticContact ND1-CD1 3.46Å; H290-Y294 WeakPolarHBondContact ND1-CD1 3.34Å; H290-Y294 WeakPolarHBondContact O-CB 3.3Å; Y294-T296 VanDerWaalsContact C-N 3.29Å; Y294-T296 PolarHBondContact O-N 3.17Å; Y294-Y297 PolarHBondContact O-N 3.35Å; Y294-R298 HydrophobicContact CE1-CB 4.32Å; Y294-R298 WeakPolarHBondContact O-CB 3.42Å; Y294-R298 PolarHBondContact O-N 3.14Å
295	E	95.3	Very high	93.5	Very high	58 Å²	58	62.3 Å²	62.3	27%	0.271	30%	0.296	S	S	.	.	H	α-helix	trans	-62.4	-35.2	176.8	-76.1	-53	135.4	0	0	112.9	H290 G291 R298 R299	H290-E295 PolarHBondContact O-N 2.86Å; G291-E295 WeakPolarHBondContact O-CB 3.41Å; E295-R298 PolarHBondContact O-N 2.63Å; E295-R298 IonicContact OE2-NH1 3.72Å; E295-R298 PolarHBondContact OE2-NH1 3.17Å; E295-R299 WeakPolarHBondContact O-CB 3.22Å; E295-R299 PolarHBondContact O-N 3.04Å
296	T	94.9	Very high	92.8	Very high	77 Å²	77	63.9 Å²	63.9	47%	0.472	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-47.4	173.5	-60	0	0	0	0	110.9	V292 H293 Y294 Q300	V292-T296 WeakPolarHBondContact O-CB 3.5Å; V292-T296 PolarHBondContact O-N 3.46Å; V292-T296 PolarHBondContact O-OG1 3.24Å; H293-T296 PolarHBondContact O-N 3.22Å; Y294-T296 VanDerWaalsContact C-N 3.29Å; Y294-T296 PolarHBondContact O-N 3.17Å; T296-Q300 PolarHBondContact O-N 2.86Å
297	Y	96.2	Very high	91.8	Very high	20 Å²	20	62.1 Å²	62.1	8%	0.078	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-47	175.6	179.1	-90.5	0	0	0	111.9	D122 F125 E126 L129 H293 Y294 R299 Q300 R301	D122-Y297 HydrophobicContact CB-CD2 4.46Å; D122-Y297 HydrophobicContact CB-CE2 3.76Å; D122-Y297 PolarHBondContact O-OH 2.6Å; F125-Y297 HydrophobicContact CB-CD1 3.38Å; F125-Y297 HydrophobicContact CB-CD2 4.17Å; F125-Y297 HydrophobicContact CB-CE1 3.64Å; F125-Y297 HydrophobicContact CB-CE2 4.4Å; F125-Y297 HydrophobicContact CB-CG 3.67Å; F125-Y297 HydrophobicContact CD2-CD1 4.48Å; F125-Y297 HydrophobicContact CD2-CD2 4.06Å; F125-Y297 AromaticContact CD2-CG 3.89Å; F125-Y297 HydrophobicContact CD2-CG 3.89Å; F125-Y297 HydrophobicContact CG-CD1 4.27Å; F125-Y297 HydrophobicContact CG-CG 4.12Å; E126-Y297 HydrophobicContact CB-CE1 4.46Å; E126-Y297 WeakPolarHBondContact OE2-CE1 3.37Å; E126-Y297 PolarHBondContact OE2-OH 3.07Å; L129-Y297 HydrophobicContact CD2-CE1 4.36Å; H293-Y297 PolarHBondContact O-N 2.96Å; H293-Y297 VanDerWaalsContact O-N 3.09Å; Y294-Y297 PolarHBondContact O-N 3.35Å; Y297-R299 PolarHBondContact O-N 3.01Å; Y297-Q300 PolarHBondContact O-N 2.78Å; Y297-R301 HydrophobicContact CD1-CG 3.91Å; Y297-R301 HydrophobicContact CE1-CB 4.38Å; Y297-R301 HydrophobicContact CE1-CG 3.39Å; Y297-R301 HydrophobicContact CE2-CG 4.07Å; Y297-R301 HydrophobicContact CG-CG 4.46Å; Y297-R301 VanDerWaalsContact CZ-CG 3.47Å; Y297-R301 WeakPolarHBondContact O-CB 3.36Å; Y297-R301 PolarHBondContact O-N 3.09Å; Y297-R301 PolarHBondContact OH-NE 3.31Å; Y297-R301 PolarHBondContact OH-NH2 2.84Å
298	R	94.6	Very high	90.6	Very high	58 Å²	58	64.1 Å²	64.1	22%	0.219	31%	0.308	C	S	.	.	H	α-helix	trans	-59.3	-47.4	-179.5	176.2	172.7	-177.8	-75.7	-3.9	111.4	L129 E132 Y294 E295 Q300 R301 L302	L129-R298 HydrophobicContact CD1-CG 3.91Å; E132-R298 IonicContact OE1-CZ 2.84Å; E132-R298 IonicContact OE1-NE 2.89Å; E132-R298 PolarHBondContact OE1-NE 3.01Å; E132-R298 IonicContact OE1-NH2 3.72Å; E132-R298 PolarHBondContact OE1-NH2 3.33Å; E132-R298 VanDerWaalsContact OE1-NH2 3.12Å; E132-R298 IonicContact OE2-NE 2.78Å; E132-R298 PolarHBondContact OE2-NE 2.92Å; E132-R298 VanDerWaalsContact OE2-NE 3.1Å; Y294-R298 HydrophobicContact CE1-CB 4.32Å; Y294-R298 WeakPolarHBondContact O-CB 3.42Å; Y294-R298 PolarHBondContact O-N 3.14Å; E295-R298 PolarHBondContact O-N 2.63Å; E295-R298 IonicContact OE2-NH1 3.72Å; E295-R298 PolarHBondContact OE2-NH1 3.17Å; R298-Q300 PolarHBondContact O-N 3.49Å; R298-R301 PolarHBondContact O-N 3.08Å; R298-L302 HydrophobicContact CG-CD1 3.85Å; R298-L302 HydrophobicContact CG-CG 4.32Å; R298-L302 WeakPolarHBondContact O-CB 3.44Å; R298-L302 VanDerWaalsContact O-CG 3.24Å; R298-L302 WeakPolarHBondContact O-CG 3.45Å; R298-L302 PolarHBondContact O-N 2.72Å
299	R	92.1	Very high	89.1	Confident	171 Å²	171	67.3 Å²	67.3	65%	0.645	33%	0.332	S	S	*	.	H	α-helix	trans	-57.1	-50.3	176.6	-174	-174.2	-57.7	173.1	3.1	111.4	E295 Y297 R301 L302 I303	E295-R299 WeakPolarHBondContact O-CB 3.22Å; E295-R299 PolarHBondContact O-N 3.04Å; Y297-R299 PolarHBondContact O-N 3.01Å; R299-R301 PolarHBondContact O-N 3.36Å; R299-L302 PolarHBondContact O-N 3.08Å; R299-I303 HydrophobicContact CG-CD1 4.25Å; R299-I303 WeakPolarHBondContact O-CG1 3.46Å; R299-I303 PolarHBondContact O-N 3.08Å; R299-I303 VanDerWaalsContact O-N 3.13Å
300	Q	92.5	Very high	87.3	Confident	103 Å²	103	74.8 Å²	74.8	48%	0.481	37%	0.372	S	S	.	.	H	α-helix	trans	-61.3	-44.4	179.8	-178.2	58.5	33.3	0	0	111.6	T296 Y297 R298 I303 E304	T296-Q300 PolarHBondContact O-N 2.86Å; Y297-Q300 PolarHBondContact O-N 2.78Å; R298-Q300 PolarHBondContact O-N 3.49Å; Q300-I303 PolarHBondContact O-N 3.05Å; Q300-E304 PolarHBondContact NE2-OE1 2.83Å; Q300-E304 WeakPolarHBondContact O-CG 3.41Å; Q300-E304 PolarHBondContact O-N 2.85Å; Q300-E304 VanDerWaalsContact O-N 3.08Å
301	R	91.7	Very high	85.4	Confident	86 Å²	86	75.9 Å²	75.9	33%	0.325	38%	0.377	S	S	.	.	H	α-helix	trans	-66.4	-39.6	177.7	-77.7	-53.8	-170.3	-177.8	3.1	113.7	E126 L129 Y297 R298 R299 I303 E304 M305	E126-R301 IonicContact OE2-NE 3.39Å; L129-R301 HydrophobicContact CD2-CB 3.72Å; L129-R301 HydrophobicContact CD2-CG 4.25Å; Y297-R301 HydrophobicContact CD1-CG 3.91Å; Y297-R301 HydrophobicContact CE1-CB 4.38Å; Y297-R301 HydrophobicContact CE1-CG 3.39Å; Y297-R301 HydrophobicContact CE2-CG 4.07Å; Y297-R301 HydrophobicContact CG-CG 4.46Å; Y297-R301 VanDerWaalsContact CZ-CG 3.47Å; Y297-R301 WeakPolarHBondContact O-CB 3.36Å; Y297-R301 PolarHBondContact O-N 3.09Å; Y297-R301 PolarHBondContact OH-NE 3.31Å; Y297-R301 PolarHBondContact OH-NH2 2.84Å; R298-R301 PolarHBondContact O-N 3.08Å; R299-R301 PolarHBondContact O-N 3.36Å; R301-I303 VanDerWaalsContact C-N 3.31Å; R301-I303 PolarHBondContact O-N 3.28Å; R301-E304 WeakPolarHBondContact CD-OE2 3.21Å; R301-E304 IonicContact CZ-OE2 2.93Å; R301-E304 IonicContact NE-OE2 2.69Å; R301-E304 IonicContact NH1-OE2 2.98Å; R301-E304 PolarHBondContact NH1-OE2 3.41Å; R301-E304 CarbonylContact O-C 3.54Å; R301-E304 PolarHBondContact O-N 2.88Å; R301-M305 WeakPolarHBondContact O-CB 3.36Å; R301-M305 VanDerWaalsContact O-CG 3.23Å; R301-M305 WeakPolarHBondContact O-CG 3.47Å; R301-M305 PolarHBondContact O-N 2.93Å
302	L	89.6	Confident	83.5	Confident	24 Å²	24	83.9 Å²	83.9	13%	0.126	40%	0.399	C	S	.	.	H	α-helix	trans	-62.4	-41.2	176.5	-73.4	174.7	0	0	0	110.9	L133 R298 R299 E304 M305 G306 F307	L133-L302 HydrophobicContact CD2-CD2 4.49Å; R298-L302 HydrophobicContact CG-CD1 3.85Å; R298-L302 HydrophobicContact CG-CG 4.32Å; R298-L302 WeakPolarHBondContact O-CB 3.44Å; R298-L302 VanDerWaalsContact O-CG 3.24Å; R298-L302 WeakPolarHBondContact O-CG 3.45Å; R298-L302 PolarHBondContact O-N 2.72Å; R299-L302 PolarHBondContact O-N 3.08Å; L302-E304 PolarHBondContact O-N 2.92Å; L302-M305 CarbonylContact O-C 3.5Å; L302-M305 VanDerWaalsContact O-C 3.31Å; L302-M305 WeakPolarHBondContact O-CA 3.35Å; L302-M305 WeakPolarHBondContact O-CB 3.39Å; L302-M305 PolarHBondContact O-N 3.1Å; L302-M305 VanDerWaalsContact O-N 3.08Å; L302-G306 PolarHBondContact O-N 3.02Å; L302-G306 VanDerWaalsContact O-N 3.1Å; L302-F307 HydrophobicContact CB-CB 4.08Å; L302-F307 HydrophobicContact CB-CD2 4.15Å; L302-F307 HydrophobicContact CB-CG 4.41Å; L302-F307 HydrophobicContact CD2-CD2 3.6Å; L302-F307 HydrophobicContact CD2-CE2 3.86Å; L302-F307 HydrophobicContact CD2-CG 4.17Å; L302-F307 HydrophobicContact CG-CD2 4.49Å; L302-F307 WeakPolarHBondContact O-CB 3.37Å; L302-F307 WeakPolarHBondContact O-CD2 3.27Å; L302-F307 PolarHBondContact O-N 3.39Å
303	I	89.3	Confident	81.4	Confident	88 Å²	88	83.9 Å²	83.9	45%	0.451	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-45.8	174.4	-65.8	166.9	0	0	0	111.4	R299 Q300 R301 M305 G306 F307	R299-I303 HydrophobicContact CG-CD1 4.25Å; R299-I303 WeakPolarHBondContact O-CG1 3.46Å; R299-I303 PolarHBondContact O-N 3.08Å; R299-I303 VanDerWaalsContact O-N 3.13Å; Q300-I303 PolarHBondContact O-N 3.05Å; R301-I303 VanDerWaalsContact C-N 3.31Å; R301-I303 PolarHBondContact O-N 3.28Å; I303-M305 PolarHBondContact O-N 3.15Å; I303-G306 WeakPolarHBondContact O-CA 3.42Å; I303-G306 PolarHBondContact O-N 2.96Å; I303-F307 WeakPolarHBondContact CA-O 3.28Å
304	E	89.4	Confident	79.7	Confident	96 Å²	96	86.5 Å²	86.5	45%	0.449	41%	0.414	S	S	.	.	H	α-helix	trans	-63.7	-30.3	174.1	-69.9	170	-167	0	0	112.3	Q300 R301 L302 G306 R322	Q300-E304 PolarHBondContact NE2-OE1 2.83Å; Q300-E304 WeakPolarHBondContact O-CG 3.41Å; Q300-E304 PolarHBondContact O-N 2.85Å; Q300-E304 VanDerWaalsContact O-N 3.08Å; R301-E304 WeakPolarHBondContact CD-OE2 3.21Å; R301-E304 IonicContact CZ-OE2 2.93Å; R301-E304 IonicContact NE-OE2 2.69Å; R301-E304 IonicContact NH1-OE2 2.98Å; R301-E304 PolarHBondContact NH1-OE2 3.41Å; R301-E304 CarbonylContact O-C 3.54Å; R301-E304 PolarHBondContact O-N 2.88Å; L302-E304 PolarHBondContact O-N 2.92Å; E304-G306 PolarHBondContact O-N 3.44Å; E304-R322 PolarHBondContact O-NH2 2.79Å
305	M	84.6	Confident	78	Confident	26 Å²	26	90.3 Å²	90.3	13%	0.128	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	3	171.2	-68.1	-178.8	-167.9	0	0	113.7	L129 L133 R301 L302 I303 F307 R322	L129-M305 HydrophobicContact CD2-CE 4.31Å; L133-M305 HydrophobicContact CD1-SD 4.45Å; R301-M305 WeakPolarHBondContact O-CB 3.36Å; R301-M305 VanDerWaalsContact O-CG 3.23Å; R301-M305 WeakPolarHBondContact O-CG 3.47Å; R301-M305 PolarHBondContact O-N 2.93Å; L302-M305 CarbonylContact O-C 3.5Å; L302-M305 VanDerWaalsContact O-C 3.31Å; L302-M305 WeakPolarHBondContact O-CA 3.35Å; L302-M305 WeakPolarHBondContact O-CB 3.39Å; L302-M305 PolarHBondContact O-N 3.1Å; L302-M305 VanDerWaalsContact O-N 3.08Å; I303-M305 PolarHBondContact O-N 3.15Å; M305-F307 HydrophobicContact CB-CD2 3.74Å; M305-F307 HydrophobicContact CB-CE2 3.79Å; M305-R322 VanDerWaalsContact CA-CZ 3.44Å; M305-R322 VanDerWaalsContact CA-NH1 3.3Å; M305-R322 VanDerWaalsContact CA-NH2 3.28Å; M305-R322 PolarHBondContact O-NE 3.07Å; M305-R322 VanDerWaalsContact O-NE 3.14Å; M305-R322 PolarHBondContact O-NH2 3.08Å
306	G	80.8	Confident	76.5	Confident	33 Å²	33	92.7 Å²	92.7	34%	0.34	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	9.5	174.9	0	0	0	0	0	114.3	L302 I303 E304 R308	L302-G306 PolarHBondContact O-N 3.02Å; L302-G306 VanDerWaalsContact O-N 3.1Å; I303-G306 WeakPolarHBondContact O-CA 3.42Å; I303-G306 PolarHBondContact O-N 2.96Å; E304-G306 PolarHBondContact O-N 3.44Å; G306-R308 PolarHBondContact O-N 3.04Å
307	F	71.2	Confident	75.1	Confident	32 Å²	32	93.3 Å²	93.3	14%	0.14	44%	0.443	C	S	.	.			trans	-77.5	113.8	169.3	-61.8	-86.9	0	0	0	108.3	L302 I303 M305 L315 T318 Y319	L302-F307 HydrophobicContact CB-CB 4.08Å; L302-F307 HydrophobicContact CB-CD2 4.15Å; L302-F307 HydrophobicContact CB-CG 4.41Å; L302-F307 HydrophobicContact CD2-CD2 3.6Å; L302-F307 HydrophobicContact CD2-CE2 3.86Å; L302-F307 HydrophobicContact CD2-CG 4.17Å; L302-F307 HydrophobicContact CG-CD2 4.49Å; L302-F307 WeakPolarHBondContact O-CB 3.37Å; L302-F307 WeakPolarHBondContact O-CD2 3.27Å; L302-F307 PolarHBondContact O-N 3.39Å; I303-F307 WeakPolarHBondContact CA-O 3.28Å; M305-F307 HydrophobicContact CB-CD2 3.74Å; M305-F307 HydrophobicContact CB-CE2 3.79Å; F307-L315 HydrophobicContact CD1-CD1 4.33Å; F307-L315 HydrophobicContact CE1-CD1 3.67Å; F307-L315 HydrophobicContact CE1-CG 4.25Å; F307-L315 HydrophobicContact CZ-CD1 3.93Å; F307-L315 HydrophobicContact CZ-CG 4.46Å; F307-T318 HydrophobicContact CD1-CG2 3.82Å; F307-T318 HydrophobicContact CE1-CG2 3.55Å; F307-T318 HydrophobicContact CE2-CG2 4.3Å; F307-T318 HydrophobicContact CG-CG2 4.29Å; F307-T318 HydrophobicContact CZ-CG2 3.81Å; F307-Y319 HydrophobicContact CE2-CE2 4.34Å; F307-Y319 HydrophobicContact CZ-CD2 4.07Å; F307-Y319 AromaticContact CZ-CE2 3.62Å; F307-Y319 HydrophobicContact CZ-CE2 3.62Å
308	R	67.7	Low	73.7	Confident	175 Å²	175	93.3 Å²	93.3	66%	0.66	45%	0.445	S	S	*	.			trans	-111	137.5	171.8	-65.1	-176.9	178.2	-169	-0.4	108.2	G306 D310 E311	G306-R308 PolarHBondContact O-N 3.04Å; R308-D310 PolarHBondContact O-N 3.34Å; R308-E311 PolarHBondContact O-N 3.09Å
309	D	64.1	Low	72.3	Confident	162 Å²	162	93.3 Å²	93.3	87%	0.866	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.1	-179.4	-68.9	-26.4	0	0	0	113	E311	D309-E311 VanDerWaalsContact C-N 3.33Å; D309-E311 PolarHBondContact O-N 3.3Å
310	D	59.4	Low	71.3	Confident	156 Å²	156	89.1 Å²	89.1	83%	0.834	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-18.4	179.4	-62.9	-33.9	0	0	0	113.9	R308	R308-D310 PolarHBondContact O-N 3.34Å
311	E	55.2	Low	70.5	Confident	100 Å²	100	90 Å²	90	47%	0.467	44%	0.435	S	S	.	.			trans	-96.4	110.2	179.1	-68	-170	177.8	0	0	109.6	R308 D309 M313	R308-E311 PolarHBondContact O-N 3.09Å; D309-E311 VanDerWaalsContact C-N 3.33Å; D309-E311 PolarHBondContact O-N 3.3Å; E311-M313 HydrophobicContact CB-CB 4.31Å; E311-M313 HydrophobicContact CB-CG 3.93Å; E311-M313 PolarHBondContact O-N 3.16Å
312	K	53.9	Low	69.5	Low	216 Å²	216	90.4 Å²	90.4	94%	0.939	44%	0.437	S	S	*	.			trans	-65.2	24.1	168.5	-65.3	-175.1	178.6	179.8	0	113.4
313	M	51.8	Low	68.7	Low	71 Å²	71	96.2 Å²	96.2	35%	0.35	46%	0.457	S	S	.	.			trans	-72.7	128	177.8	-67.8	-73.3	-67.8	0	0	107.8	E311 E317	E311-M313 HydrophobicContact CB-CB 4.31Å; E311-M313 HydrophobicContact CB-CG 3.93Å; E311-M313 PolarHBondContact O-N 3.16Å; M313-E317 WeakPolarHBondContact CA-OE2 3.36Å; M313-E317 HydrophobicContact CE-CB 3.57Å; M313-E317 HydrophobicContact CE-CG 4.48Å
314	S	62.1	Low	68.3	Low	64 Å²	64	96.5 Å²	96.5	45%	0.448	46%	0.456	S	S	.	.			trans	-59.6	146.6	175.3	176.5	0	0	0	0	109.3	Q316 E317 T318	S314-Q316 PolarHBondContact O-N 3.39Å; S314-E317 PolarHBondContact N-OE2 3.43Å; S314-E317 PolarHBondContact O-N 3.38Å; S314-T318 PolarHBondContact O-N 3.04Å
315	L	60.8	Low	67.9	Low	81 Å²	81	96.6 Å²	96.6	42%	0.424	46%	0.459	S	S	.	.	H	α-helix	trans	-44	-40.9	174.4	-167.3	86.3	0	0	0	110.6	L133 F307 Y319	L133-L315 HydrophobicContact CD2-CD1 4.15Å; L133-L315 HydrophobicContact CD2-CD2 4.14Å; F307-L315 HydrophobicContact CD1-CD1 4.33Å; F307-L315 HydrophobicContact CE1-CD1 3.67Å; F307-L315 HydrophobicContact CE1-CG 4.25Å; F307-L315 HydrophobicContact CZ-CD1 3.93Å; F307-L315 HydrophobicContact CZ-CG 4.46Å; L315-Y319 HydrophobicContact CD1-CE2 4.21Å; L315-Y319 HydrophobicContact CD2-CE2 4.15Å; L315-Y319 HydrophobicContact CG-CD2 4.04Å; L315-Y319 HydrophobicContact CG-CE2 3.82Å; L315-Y319 WeakPolarHBondContact O-CD2 3.5Å; L315-Y319 PolarHBondContact O-N 3.43Å
316	Q	64.2	Low	67.5	Low	107 Å²	107	100.5 Å²	100.5	50%	0.5	48%	0.477	S	S	.	.	H	α-helix	trans	-62.6	-44.7	178.6	-176.7	164.2	-8.3	0	0	114	S314 T318 Y319 E320	S314-Q316 PolarHBondContact O-N 3.39Å; Q316-T318 VanDerWaalsContact C-N 3.34Å; Q316-T318 PolarHBondContact O-N 2.94Å; Q316-Y319 PolarHBondContact O-N 3.4Å; Q316-E320 WeakPolarHBondContact CG-OE1 3.31Å; Q316-E320 PolarHBondContact NE2-OE1 2.75Å; Q316-E320 WeakPolarHBondContact O-CB 3.38Å; Q316-E320 WeakPolarHBondContact O-CG 3.42Å; Q316-E320 PolarHBondContact O-N 3.34Å
317	E	64.9	Low	67.5	Low	91 Å²	91	105.5 Å²	105.5	43%	0.425	49%	0.486	S	S	.	.	H	α-helix	trans	-67.7	-37.2	-177.9	-64.7	172.2	147.4	0	0	111	M313 S314 E320 K321	M313-E317 WeakPolarHBondContact CA-OE2 3.36Å; M313-E317 HydrophobicContact CE-CB 3.57Å; M313-E317 HydrophobicContact CE-CG 4.48Å; S314-E317 PolarHBondContact N-OE2 3.43Å; S314-E317 PolarHBondContact O-N 3.38Å; E317-E320 PolarHBondContact O-N 2.72Å; E317-K321 WeakPolarHBondContact O-CB 3.35Å; E317-K321 PolarHBondContact O-N 3.2Å
318	T	67.4	Low	68.2	Low	20 Å²	20	109.5 Å²	109.5	12%	0.123	50%	0.503	C	S	.	.	H	α-helix	trans	-66.3	-41	175.3	-46.2	0	0	0	0	111.4	F307 S314 Q316 R322	F307-T318 HydrophobicContact CD1-CG2 3.82Å; F307-T318 HydrophobicContact CE1-CG2 3.55Å; F307-T318 HydrophobicContact CE2-CG2 4.3Å; F307-T318 HydrophobicContact CG-CG2 4.29Å; F307-T318 HydrophobicContact CZ-CG2 3.81Å; S314-T318 PolarHBondContact O-N 3.04Å; Q316-T318 VanDerWaalsContact C-N 3.34Å; Q316-T318 PolarHBondContact O-N 2.94Å; T318-R322 VanDerWaalsContact O-CB 3.25Å; T318-R322 WeakPolarHBondContact O-CB 3.33Å; T318-R322 PolarHBondContact O-N 3.21Å
319	Y	66.1	Low	69.1	Low	58 Å²	58	105.6 Å²	105.6	23%	0.227	49%	0.493	C	S	.	.	H	α-helix	trans	-65	-42.3	174.5	-87.9	-68.2	0	0	0	112.8	L133 F307 L315 Q316 R323	L133-Y319 WeakPolarHBondContact CD1-OH 3.27Å; L133-Y319 HydrophobicContact CD2-CE2 3.9Å; L133-Y319 WeakPolarHBondContact CD2-OH 3.36Å; L133-Y319 WeakPolarHBondContact CG-OH 3.44Å; F307-Y319 HydrophobicContact CE2-CE2 4.34Å; F307-Y319 HydrophobicContact CZ-CD2 4.07Å; F307-Y319 AromaticContact CZ-CE2 3.62Å; F307-Y319 HydrophobicContact CZ-CE2 3.62Å; L315-Y319 HydrophobicContact CD1-CE2 4.21Å; L315-Y319 HydrophobicContact CD2-CE2 4.15Å; L315-Y319 HydrophobicContact CG-CD2 4.04Å; L315-Y319 HydrophobicContact CG-CE2 3.82Å; L315-Y319 WeakPolarHBondContact O-CD2 3.5Å; L315-Y319 PolarHBondContact O-N 3.43Å; Q316-Y319 PolarHBondContact O-N 3.4Å; Y319-R323 WeakPolarHBondContact O-CB 3.46Å; Y319-R323 WeakPolarHBondContact O-CG 3.14Å; Y319-R323 PolarHBondContact O-N 3.29Å
320	E	71.6	Confident	70.1	Confident	82 Å²	82	103.6 Å²	103.6	38%	0.383	48%	0.481	S	S	.	.	H	α-helix	trans	-64.9	-48.2	176.7	-74.7	173.5	-171.9	0	0	110.7	Q316 E317 R322 R323 E324	Q316-E320 WeakPolarHBondContact CG-OE1 3.31Å; Q316-E320 PolarHBondContact NE2-OE1 2.75Å; Q316-E320 WeakPolarHBondContact O-CB 3.38Å; Q316-E320 WeakPolarHBondContact O-CG 3.42Å; Q316-E320 PolarHBondContact O-N 3.34Å; E317-E320 PolarHBondContact O-N 2.72Å; E320-R322 VanDerWaalsContact C-N 3.34Å; E320-R322 PolarHBondContact O-N 2.95Å; E320-R323 PolarHBondContact O-N 3.42Å; E320-E324 WeakPolarHBondContact O-CB 3.48Å; E320-E324 WeakPolarHBondContact O-CG 3.29Å; E320-E324 PolarHBondContact O-N 2.89Å
321	K	73.9	Confident	71.4	Confident	123 Å²	123	101.3 Å²	101.3	54%	0.535	47%	0.466	S	S	.	.	H	α-helix	trans	-60.7	-40.7	177.2	-167.5	177.1	-177.8	-176.5	0	112.2	E317 E324 L325	E317-K321 WeakPolarHBondContact O-CB 3.35Å; E317-K321 PolarHBondContact O-N 3.2Å; K321-E324 PolarHBondContact O-N 2.71Å; K321-L325 WeakPolarHBondContact O-CB 3.34Å; K321-L325 PolarHBondContact O-N 3.36Å
322	R	70.6	Confident	73	Confident	94 Å²	94	102.4 Å²	102.4	36%	0.355	47%	0.471	S	S	.	.	H	α-helix	trans	-71.8	-39.3	176.7	-176.4	174.3	-89.1	-140.9	-8.8	112.5	E304 M305 T318 E320 E324 L325 Q326	E304-R322 PolarHBondContact O-NH2 2.79Å; M305-R322 VanDerWaalsContact CA-CZ 3.44Å; M305-R322 VanDerWaalsContact CA-NH1 3.3Å; M305-R322 VanDerWaalsContact CA-NH2 3.28Å; M305-R322 PolarHBondContact O-NE 3.07Å; M305-R322 VanDerWaalsContact O-NE 3.14Å; M305-R322 PolarHBondContact O-NH2 3.08Å; T318-R322 VanDerWaalsContact O-CB 3.25Å; T318-R322 WeakPolarHBondContact O-CB 3.33Å; T318-R322 PolarHBondContact O-N 3.21Å; E320-R322 VanDerWaalsContact C-N 3.34Å; E320-R322 PolarHBondContact O-N 2.95Å; R322-E324 VanDerWaalsContact C-N 3.3Å; R322-E324 PolarHBondContact O-N 3.18Å; R322-L325 PolarHBondContact O-N 3.45Å; R322-Q326 PolarHBondContact O-N 3.22Å
323	R	74.6	Confident	74.6	Confident	146 Å²	146	98.6 Å²	98.6	55%	0.551	45%	0.454	S	S	*	.	H	α-helix	trans	-61.4	-40.6	171.2	-82.6	-170.2	-65.7	-174.4	-0.2	111.2	Y319 E320 R327	Y319-R323 WeakPolarHBondContact O-CB 3.46Å; Y319-R323 WeakPolarHBondContact O-CG 3.14Å; Y319-R323 PolarHBondContact O-N 3.29Å; E320-R323 PolarHBondContact O-N 3.42Å; R323-R327 VanDerWaalsContact O-CB 3.23Å; R323-R327 WeakPolarHBondContact O-CB 3.49Å; R323-R327 PolarHBondContact O-N 3.18Å
324	E	79.6	Confident	76.1	Confident	93 Å²	93	101.4 Å²	101.4	44%	0.435	47%	0.466	S	S	.	.	H	α-helix	trans	-65.2	-40.3	173.5	-75.3	-165.3	156.4	0	0	112.3	E320 K321 R322 R327 K328	E320-E324 WeakPolarHBondContact O-CB 3.48Å; E320-E324 WeakPolarHBondContact O-CG 3.29Å; E320-E324 PolarHBondContact O-N 2.89Å; K321-E324 PolarHBondContact O-N 2.71Å; R322-E324 VanDerWaalsContact C-N 3.3Å; R322-E324 PolarHBondContact O-N 3.18Å; E324-R327 PolarHBondContact O-N 2.83Å; E324-K328 WeakPolarHBondContact O-CB 3.47Å; E324-K328 VanDerWaalsContact O-CG 3.3Å; E324-K328 WeakPolarHBondContact O-CG 3.42Å; E324-K328 PolarHBondContact O-N 2.87Å
325	L	82.1	Confident	77.4	Confident	98 Å²	98	102.3 Å²	102.3	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-63	-50.2	176.3	-158.9	96.5	0	0	0	111	K321 R322 R327 K328 E329	K321-L325 WeakPolarHBondContact O-CB 3.34Å; K321-L325 PolarHBondContact O-N 3.36Å; R322-L325 PolarHBondContact O-N 3.45Å; L325-R327 VanDerWaalsContact C-N 3.32Å; L325-R327 PolarHBondContact O-N 3.49Å; L325-K328 CarbonylContact O-C 3.53Å; L325-K328 WeakPolarHBondContact O-CB 3.47Å; L325-K328 PolarHBondContact O-N 3.2Å; L325-K328 VanDerWaalsContact O-N 3.14Å; L325-E329 WeakPolarHBondContact O-CG 3.45Å; L325-E329 PolarHBondContact O-N 3.06Å
326	Q	76	Confident	78.7	Confident	109 Å²	109	103.9 Å²	103.9	51%	0.509	47%	0.469	S	S	.	.	H	α-helix	trans	-60.6	-40.9	175.7	-79.2	-175.7	-5.1	0	0	111.7	R322 K328 E329 L330	R322-Q326 PolarHBondContact O-N 3.22Å; Q326-K328 VanDerWaalsContact C-N 3.34Å; Q326-E329 PolarHBondContact O-N 3.24Å; Q326-L330 WeakPolarHBondContact O-CB 3.45Å; Q326-L330 PolarHBondContact O-N 3.37Å
327	R	81	Confident	79.8	Confident	138 Å²	138	104.8 Å²	104.8	52%	0.521	47%	0.474	S	S	.	.	H	α-helix	trans	-63	-41.6	175.1	-170.7	179.9	71.9	-166.4	-3.6	111.3	R323 E324 L325 Q331	R323-R327 VanDerWaalsContact O-CB 3.23Å; R323-R327 WeakPolarHBondContact O-CB 3.49Å; R323-R327 PolarHBondContact O-N 3.18Å; E324-R327 PolarHBondContact O-N 2.83Å; L325-R327 VanDerWaalsContact C-N 3.32Å; L325-R327 PolarHBondContact O-N 3.49Å; R327-Q331 WeakPolarHBondContact O-CB 3.22Å; R327-Q331 VanDerWaalsContact O-CG 3.25Å; R327-Q331 WeakPolarHBondContact O-CG 3.29Å; R327-Q331 PolarHBondContact O-N 3.45Å
328	K	86	Confident	81	Confident	115 Å²	115	108.3 Å²	108.3	50%	0.5	48%	0.484	S	S	.	.	H	α-helix	trans	-65	-42.6	175.2	-78.3	176.5	-179.6	175.9	0	111.7	E324 L325 Q326 Q331 Q332	E324-K328 WeakPolarHBondContact O-CB 3.47Å; E324-K328 VanDerWaalsContact O-CG 3.3Å; E324-K328 WeakPolarHBondContact O-CG 3.42Å; E324-K328 PolarHBondContact O-N 2.87Å; L325-K328 CarbonylContact O-C 3.53Å; L325-K328 WeakPolarHBondContact O-CB 3.47Å; L325-K328 PolarHBondContact O-N 3.2Å; L325-K328 VanDerWaalsContact O-N 3.14Å; Q326-K328 VanDerWaalsContact C-N 3.34Å; K328-Q331 PolarHBondContact O-N 2.78Å; K328-Q332 WeakPolarHBondContact O-CB 3.43Å; K328-Q332 VanDerWaalsContact O-CG 3.31Å; K328-Q332 WeakPolarHBondContact O-CG 3.37Å; K328-Q332 PolarHBondContact O-N 3.18Å
329	E	85.7	Confident	82	Confident	94 Å²	94	112.9 Å²	112.9	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-42.5	175.9	-75.2	-178.1	174.4	0	0	112.1	L325 Q326 Q332 K333	L325-E329 WeakPolarHBondContact O-CG 3.45Å; L325-E329 PolarHBondContact O-N 3.06Å; Q326-E329 PolarHBondContact O-N 3.24Å; E329-Q332 PolarHBondContact O-N 3.24Å; E329-K333 WeakPolarHBondContact O-CB 3.37Å; E329-K333 WeakPolarHBondContact O-CG 3.32Å; E329-K333 PolarHBondContact O-N 3.39Å
330	L	85.9	Confident	83.1	Confident	120 Å²	120	115 Å²	115	63%	0.628	52%	0.517	S	S	*	.	H	α-helix	trans	-61.2	-45.7	173.2	-92.5	148	0	0	0	111.3	Q326 K333 E334	Q326-L330 WeakPolarHBondContact O-CB 3.45Å; Q326-L330 PolarHBondContact O-N 3.37Å; L330-K333 PolarHBondContact O-N 3.39Å; L330-E334 VanDerWaalsContact O-CB 3.3Å; L330-E334 WeakPolarHBondContact O-CB 3.47Å; L330-E334 PolarHBondContact O-N 3.16Å
331	Q	86.3	Confident	84	Confident	108 Å²	108	117.9 Å²	117.9	51%	0.505	53%	0.528	S	S	.	.	H	α-helix	trans	-64.2	-39.8	176.2	-77.4	176.1	-15.5	0	0	112.5	R327 K328 E334 E335	R327-Q331 WeakPolarHBondContact O-CB 3.22Å; R327-Q331 VanDerWaalsContact O-CG 3.25Å; R327-Q331 WeakPolarHBondContact O-CG 3.29Å; R327-Q331 PolarHBondContact O-N 3.45Å; K328-Q331 PolarHBondContact O-N 2.78Å; Q331-E334 PolarHBondContact O-N 2.95Å; Q331-E335 VanDerWaalsContact O-CB 3.27Å; Q331-E335 WeakPolarHBondContact O-CB 3.45Å; Q331-E335 PolarHBondContact O-N 2.97Å
332	Q	88.6	Confident	84.8	Confident	123 Å²	123	116 Å²	116	58%	0.575	53%	0.527	S	S	*	.	H	α-helix	trans	-64.2	-46.4	175.1	-79	177.2	-4.7	0	0	111.1	K328 E329 E334 E335 E336	K328-Q332 WeakPolarHBondContact O-CB 3.43Å; K328-Q332 VanDerWaalsContact O-CG 3.31Å; K328-Q332 WeakPolarHBondContact O-CG 3.37Å; K328-Q332 PolarHBondContact O-N 3.18Å; E329-Q332 PolarHBondContact O-N 3.24Å; Q332-E334 VanDerWaalsContact C-N 3.33Å; Q332-E334 PolarHBondContact O-N 3.44Å; Q332-E335 PolarHBondContact O-N 3.3Å; Q332-E336 WeakPolarHBondContact O-CB 3.45Å; Q332-E336 VanDerWaalsContact O-CG 3.31Å; Q332-E336 WeakPolarHBondContact O-CG 3.28Å; Q332-E336 PolarHBondContact O-N 2.83Å
333	K	86.8	Confident	85.7	Confident	135 Å²	135	116.1 Å²	116.1	59%	0.587	53%	0.532	S	S	*	.	H	α-helix	trans	-62.7	-39.1	175.4	-75.8	179	178.2	174.1	0	112.2	E329 L330 M337	E329-K333 WeakPolarHBondContact O-CB 3.37Å; E329-K333 WeakPolarHBondContact O-CG 3.32Å; E329-K333 PolarHBondContact O-N 3.39Å; L330-K333 PolarHBondContact O-N 3.39Å; K333-M337 WeakPolarHBondContact O-CB 3.36Å; K333-M337 VanDerWaalsContact O-CG 3.28Å; K333-M337 WeakPolarHBondContact O-CG 3.32Å; K333-M337 PolarHBondContact O-N 2.84Å
334	E	83.9	Confident	86.5	Confident	131 Å²	131	117.2 Å²	117.2	61%	0.612	54%	0.536	S	S	*	.	H	α-helix	trans	-66	-43.3	176	-170	178.9	176.4	0	0	111.4	L330 Q331 Q332 M337 R338	L330-E334 VanDerWaalsContact O-CB 3.3Å; L330-E334 WeakPolarHBondContact O-CB 3.47Å; L330-E334 PolarHBondContact O-N 3.16Å; Q331-E334 PolarHBondContact O-N 2.95Å; Q332-E334 VanDerWaalsContact C-N 3.33Å; Q332-E334 PolarHBondContact O-N 3.44Å; E334-M337 PolarHBondContact O-N 2.97Å; E334-R338 VanDerWaalsContact O-CB 3.3Å; E334-R338 WeakPolarHBondContact O-CB 3.48Å; E334-R338 PolarHBondContact O-N 3.39Å
335	E	88.7	Confident	87	Confident	82 Å²	82	115.4 Å²	115.4	38%	0.383	53%	0.531	S	S	.	.	H	α-helix	trans	-68.3	-40.3	176.8	-176.6	58.1	-156.5	0	0	111.8	Q331 Q332 R338 Q339	Q331-E335 VanDerWaalsContact O-CB 3.27Å; Q331-E335 WeakPolarHBondContact O-CB 3.45Å; Q331-E335 PolarHBondContact O-N 2.97Å; Q332-E335 PolarHBondContact O-N 3.3Å; E335-R338 CarbonylContact O-C 3.51Å; E335-R338 WeakPolarHBondContact O-CB 3.39Å; E335-R338 PolarHBondContact O-N 2.88Å; E335-Q339 WeakPolarHBondContact O-CB 3.17Å; E335-Q339 VanDerWaalsContact O-CG 3.29Å; E335-Q339 WeakPolarHBondContact O-CG 3.39Å; E335-Q339 PolarHBondContact O-N 2.93Å; E335-Q339 PolarHBondContact OE1-NE2 2.94Å
336	E	89.3	Confident	87.5	Confident	115 Å²	115	116.1 Å²	116.1	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-61	-45.6	171.6	-77.9	176.8	179.8	0	0	111.2	Q332 R338 Q339 M340	Q332-E336 WeakPolarHBondContact O-CB 3.45Å; Q332-E336 VanDerWaalsContact O-CG 3.31Å; Q332-E336 WeakPolarHBondContact O-CG 3.28Å; Q332-E336 PolarHBondContact O-N 2.83Å; E336-R338 VanDerWaalsContact C-N 3.3Å; E336-R338 PolarHBondContact O-N 2.93Å; E336-Q339 PolarHBondContact O-N 2.64Å; E336-M340 WeakPolarHBondContact O-CB 3.48Å; E336-M340 WeakPolarHBondContact O-CG 3.43Å; E336-M340 PolarHBondContact O-N 2.98Å
337	M	87.5	Confident	88.2	Confident	125 Å²	125	115.4 Å²	115.4	62%	0.616	53%	0.527	S	S	*	.	H	α-helix	trans	-61.4	-39.9	174.3	-78.4	-161.9	-65.9	0	0	111.6	K333 E334 M340 F341	K333-M337 WeakPolarHBondContact O-CB 3.36Å; K333-M337 VanDerWaalsContact O-CG 3.28Å; K333-M337 WeakPolarHBondContact O-CG 3.32Å; K333-M337 PolarHBondContact O-N 2.84Å; E334-M337 PolarHBondContact O-N 2.97Å; M337-M340 HydrophobicContact CG-CE 4.34Å; M337-F341 WeakPolarHBondContact O-CB 3.4Å; M337-F341 PolarHBondContact O-N 3.08Å
338	R	89.1	Confident	88.6	Confident	166 Å²	166	116.3 Å²	116.3	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-67.2	-43.2	177.2	-169.5	-179.2	-176.2	-173.2	2.2	111.9	E334 E335 E336 F341 V342	E334-R338 VanDerWaalsContact O-CB 3.3Å; E334-R338 WeakPolarHBondContact O-CB 3.48Å; E334-R338 PolarHBondContact O-N 3.39Å; E335-R338 CarbonylContact O-C 3.51Å; E335-R338 WeakPolarHBondContact O-CB 3.39Å; E335-R338 PolarHBondContact O-N 2.88Å; E336-R338 VanDerWaalsContact C-N 3.3Å; E336-R338 PolarHBondContact O-N 2.93Å; R338-F341 WeakPolarHBondContact O-CB 3.5Å; R338-F341 PolarHBondContact O-N 3.04Å; R338-V342 WeakPolarHBondContact O-CG2 3.38Å; R338-V342 PolarHBondContact O-N 3.41Å
339	Q	89.1	Confident	88.8	Confident	115 Å²	115	116.8 Å²	116.8	54%	0.537	54%	0.538	S	S	.	.	H	α-helix	trans	-64.9	-43.9	176.2	-74.4	178.4	13.6	0	0	111.2	E335 E336 F341 V342 Q343	E335-Q339 WeakPolarHBondContact O-CB 3.17Å; E335-Q339 VanDerWaalsContact O-CG 3.29Å; E335-Q339 WeakPolarHBondContact O-CG 3.39Å; E335-Q339 PolarHBondContact O-N 2.93Å; E335-Q339 PolarHBondContact OE1-NE2 2.94Å; E336-Q339 PolarHBondContact O-N 2.64Å; Q339-F341 VanDerWaalsContact C-N 3.29Å; Q339-F341 PolarHBondContact O-N 2.92Å; Q339-V342 PolarHBondContact O-N 3.09Å; Q339-Q343 VanDerWaalsContact O-CB 3.25Å; Q339-Q343 WeakPolarHBondContact O-CB 3.3Å; Q339-Q343 PolarHBondContact O-N 3.42Å
340	M	89.6	Confident	89.1	Confident	103 Å²	103	117.4 Å²	117.4	51%	0.507	54%	0.541	S	S	.	.	H	α-helix	trans	-59.4	-40.2	172.3	-77.4	-164.5	-72	0	0	111.8	E336 M337 R344	E336-M340 WeakPolarHBondContact O-CB 3.48Å; E336-M340 WeakPolarHBondContact O-CG 3.43Å; E336-M340 PolarHBondContact O-N 2.98Å; M337-M340 HydrophobicContact CG-CE 4.34Å; M340-R344 WeakPolarHBondContact O-CB 3.42Å; M340-R344 WeakPolarHBondContact O-CG 3.13Å; M340-R344 PolarHBondContact O-N 3.37Å
341	F	88.8	Confident	89.4	Confident	142 Å²	142	115.9 Å²	115.9	62%	0.623	54%	0.536	S	S	*	.	H	α-helix	trans	-65.8	-48.6	176.5	-177.6	-97	0	0	0	111.9	M337 R338 Q339 Q343 R344 V345	M337-F341 WeakPolarHBondContact O-CB 3.4Å; M337-F341 PolarHBondContact O-N 3.08Å; R338-F341 WeakPolarHBondContact O-CB 3.5Å; R338-F341 PolarHBondContact O-N 3.04Å; Q339-F341 VanDerWaalsContact C-N 3.29Å; Q339-F341 PolarHBondContact O-N 2.92Å; F341-Q343 VanDerWaalsContact C-N 3.33Å; F341-Q343 PolarHBondContact O-N 2.92Å; F341-R344 PolarHBondContact O-N 3.34Å; F341-V345 HydrophobicContact CD1-CG2 4.09Å; F341-V345 HydrophobicContact CE1-CG2 3.7Å; F341-V345 HydrophobicContact CE2-CG2 4.33Å; F341-V345 HydrophobicContact CZ-CG2 3.83Å; F341-V345 WeakPolarHBondContact O-CG2 3.46Å; F341-V345 PolarHBondContact O-N 3.19Å
342	V	91.4	Very high	89.6	Confident	84 Å²	84	115.8 Å²	115.8	51%	0.509	54%	0.539	S	S	.	.	H	α-helix	trans	-61.1	-42	177.9	171.1	0	0	0	0	111.1	R338 Q339 V345 K346	R338-V342 WeakPolarHBondContact O-CG2 3.38Å; R338-V342 PolarHBondContact O-N 3.41Å; Q339-V342 PolarHBondContact O-N 3.09Å; V342-V345 PolarHBondContact O-N 3.41Å; V342-K346 WeakPolarHBondContact O-CB 3.4Å; V342-K346 PolarHBondContact O-N 2.9Å
343	Q	89.8	Confident	89.8	Confident	96 Å²	96	115.6 Å²	115.6	45%	0.449	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-45.8	176.6	-175.6	60.2	28.4	0	0	111.3	Q339 F341 V345 K346 E347	Q339-Q343 VanDerWaalsContact O-CB 3.25Å; Q339-Q343 WeakPolarHBondContact O-CB 3.3Å; Q339-Q343 PolarHBondContact O-N 3.42Å; F341-Q343 VanDerWaalsContact C-N 3.33Å; F341-Q343 PolarHBondContact O-N 2.92Å; Q343-V345 PolarHBondContact O-N 3.27Å; Q343-K346 PolarHBondContact O-N 3.24Å; Q343-E347 WeakPolarHBondContact CG-OE1 3.48Å; Q343-E347 PolarHBondContact NE2-OE1 3.08Å; Q343-E347 WeakPolarHBondContact O-CB 3.33Å; Q343-E347 WeakPolarHBondContact O-CG 3.31Å; Q343-E347 PolarHBondContact O-N 3.48Å
344	R	90.4	Very high	90	Very high	170 Å²	170	114.9 Å²	114.9	64%	0.642	54%	0.535	S	S	*	.	H	α-helix	trans	-62.2	-39.8	174.7	-77.2	-176.3	-168.2	171.4	6	112.9	M340 F341 K348	M340-R344 WeakPolarHBondContact O-CB 3.42Å; M340-R344 WeakPolarHBondContact O-CG 3.13Å; M340-R344 PolarHBondContact O-N 3.37Å; F341-R344 PolarHBondContact O-N 3.34Å; R344-K348 WeakPolarHBondContact O-CB 3.33Å; R344-K348 WeakPolarHBondContact O-CG 3.28Å; R344-K348 PolarHBondContact O-N 3.47Å
345	V	91.6	Very high	90.3	Very high	54 Å²	54	111.1 Å²	111.1	33%	0.327	53%	0.526	S	S	.	.	H	α-helix	trans	-64.2	-46.5	176.1	170.3	0	0	0	0	110	F341 V342 Q343 E347 K348 E349	F341-V345 HydrophobicContact CD1-CG2 4.09Å; F341-V345 HydrophobicContact CE1-CG2 3.7Å; F341-V345 HydrophobicContact CE2-CG2 4.33Å; F341-V345 HydrophobicContact CZ-CG2 3.83Å; F341-V345 WeakPolarHBondContact O-CG2 3.46Å; F341-V345 PolarHBondContact O-N 3.19Å; V342-V345 PolarHBondContact O-N 3.41Å; Q343-V345 PolarHBondContact O-N 3.27Å; V345-E347 PolarHBondContact O-N 2.99Å; V345-K348 PolarHBondContact O-N 3.33Å; V345-E349 HydrophobicContact CG1-CG 4.36Å; V345-E349 WeakPolarHBondContact O-CB 3.34Å; V345-E349 WeakPolarHBondContact O-CG 3.47Å; V345-E349 PolarHBondContact O-N 3.43Å
346	K	92.3	Very high	90.3	Very high	114 Å²	114	112.9 Å²	112.9	50%	0.496	54%	0.535	S	S	.	.	H	α-helix	trans	-62	-42.5	178.3	-172.3	179.2	179.3	-176.9	0	112.4	V342 Q343 E349 Q350	V342-K346 WeakPolarHBondContact O-CB 3.4Å; V342-K346 PolarHBondContact O-N 2.9Å; Q343-K346 PolarHBondContact O-N 3.24Å; K346-E349 PolarHBondContact O-N 3.38Å; K346-Q350 WeakPolarHBondContact O-CB 3.23Å; K346-Q350 WeakPolarHBondContact O-CG 3.42Å; K346-Q350 PolarHBondContact O-N 2.95Å
347	E	90.7	Very high	90.4	Very high	94 Å²	94	115 Å²	115	44%	0.439	54%	0.537	S	S	.	.	H	α-helix	trans	-62.3	-44.6	174	-75.3	168.9	-169.8	0	0	111.3	Q343 V345 Q350 V351	Q343-E347 WeakPolarHBondContact CG-OE1 3.48Å; Q343-E347 PolarHBondContact NE2-OE1 3.08Å; Q343-E347 WeakPolarHBondContact O-CB 3.33Å; Q343-E347 WeakPolarHBondContact O-CG 3.31Å; Q343-E347 PolarHBondContact O-N 3.48Å; V345-E347 PolarHBondContact O-N 2.99Å; E347-Q350 PolarHBondContact O-N 2.84Å; E347-V351 WeakPolarHBondContact O-CG2 3.5Å; E347-V351 PolarHBondContact O-N 3.21Å
348	K	89.6	Confident	90.6	Very high	156 Å²	156	114.4 Å²	114.4	68%	0.678	53%	0.533	S	S	*	.	H	α-helix	trans	-65.2	-40	176.7	-81.7	-73.8	-178.5	-179.7	0	112.9	R344 V345 V351 L352	R344-K348 WeakPolarHBondContact O-CB 3.33Å; R344-K348 WeakPolarHBondContact O-CG 3.28Å; R344-K348 PolarHBondContact O-N 3.47Å; V345-K348 PolarHBondContact O-N 3.33Å; K348-V351 PolarHBondContact O-N 3.03Å; K348-L352 WeakPolarHBondContact O-CB 3.33Å; K348-L352 PolarHBondContact O-N 3.29Å
349	E	90.3	Very high	90.7	Very high	125 Å²	125	112.3 Å²	112.3	58%	0.584	53%	0.534	S	S	*	.	H	α-helix	trans	-65	-39.4	174.3	-77.8	-175.6	166	0	0	111.9	V345 K346 L352 K353	V345-E349 HydrophobicContact CG1-CG 4.36Å; V345-E349 WeakPolarHBondContact O-CB 3.34Å; V345-E349 WeakPolarHBondContact O-CG 3.47Å; V345-E349 PolarHBondContact O-N 3.43Å; K346-E349 PolarHBondContact O-N 3.38Å; E349-L352 PolarHBondContact O-N 3.38Å; E349-K353 VanDerWaalsContact O-CB 3.29Å; E349-K353 WeakPolarHBondContact O-CB 3.48Å; E349-K353 PolarHBondContact O-N 3.16Å
350	Q	91.4	Very high	90.7	Very high	107 Å²	107	111.5 Å²	111.5	50%	0.5	53%	0.53	S	S	.	.	H	α-helix	trans	-63	-47.6	174.9	-78.4	-180	-17.5	0	0	111.6	K346 E347 L352 K353 E354	K346-Q350 WeakPolarHBondContact O-CB 3.23Å; K346-Q350 WeakPolarHBondContact O-CG 3.42Å; K346-Q350 PolarHBondContact O-N 2.95Å; E347-Q350 PolarHBondContact O-N 2.84Å; Q350-L352 VanDerWaalsContact C-N 3.31Å; Q350-L352 PolarHBondContact O-N 3.13Å; Q350-K353 PolarHBondContact O-N 3.37Å; Q350-E354 WeakPolarHBondContact O-CG 3.43Å; Q350-E354 PolarHBondContact O-N 2.97Å
351	V	91.8	Very high	90.8	Very high	88 Å²	88	111 Å²	111	53%	0.533	53%	0.533	S	S	.	.	H	α-helix	trans	-60.3	-42.1	175.7	171.9	0	0	0	0	111.2	E347 K348 E354 A355	E347-V351 WeakPolarHBondContact O-CG2 3.5Å; E347-V351 PolarHBondContact O-N 3.21Å; K348-V351 PolarHBondContact O-N 3.03Å; V351-E354 PolarHBondContact O-N 2.87Å; V351-A355 WeakPolarHBondContact O-CB 3.41Å; V351-A355 PolarHBondContact O-N 2.46Å
352	L	90.6	Very high	90.9	Very high	106 Å²	106	110.2 Å²	110.2	56%	0.555	53%	0.529	S	S	*	.	H	α-helix	trans	-63	-43.7	177.2	-171.9	69.9	0	0	0	111.3	K348 E349 Q350 A355 E356	K348-L352 WeakPolarHBondContact O-CB 3.33Å; K348-L352 PolarHBondContact O-N 3.29Å; E349-L352 PolarHBondContact O-N 3.38Å; Q350-L352 VanDerWaalsContact C-N 3.31Å; Q350-L352 PolarHBondContact O-N 3.13Å; L352-A355 PolarHBondContact O-N 3.33Å; L352-E356 WeakPolarHBondContact O-CG 3.48Å; L352-E356 PolarHBondContact O-N 2.79Å
353	K	92.3	Very high	90.9	Very high	119 Å²	119	112.2 Å²	112.2	52%	0.517	53%	0.531	S	S	.	.	H	α-helix	trans	-66.7	-36.3	179	-170.8	175	-175.2	172.3	0	112.8	E349 Q350 R357	E349-K353 VanDerWaalsContact O-CB 3.29Å; E349-K353 WeakPolarHBondContact O-CB 3.48Å; E349-K353 PolarHBondContact O-N 3.16Å; Q350-K353 PolarHBondContact O-N 3.37Å; K353-R357 WeakPolarHBondContact O-CB 3.42Å; K353-R357 WeakPolarHBondContact O-CG 3.4Å; K353-R357 PolarHBondContact O-N 2.84Å
354	E	90.9	Very high	90.9	Very high	121 Å²	121	113 Å²	113	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-66.3	-44.7	172.6	-74.2	176.1	178.7	0	0	111	Q350 V351 E356 R357 E358	Q350-E354 WeakPolarHBondContact O-CG 3.43Å; Q350-E354 PolarHBondContact O-N 2.97Å; V351-E354 PolarHBondContact O-N 2.87Å; E354-E356 PolarHBondContact O-N 2.78Å; E354-R357 PolarHBondContact O-N 2.69Å; E354-E358 PolarHBondContact O-N 3.15Å
355	A	90.6	Very high	90.9	Very high	52 Å²	52	108.3 Å²	108.3	43%	0.43	53%	0.528	S	S	.	.	H	α-helix	trans	-61.8	-40.8	175.2	0	0	0	0	0	112.6	V351 L352 E358 L359	V351-A355 WeakPolarHBondContact O-CB 3.41Å; V351-A355 PolarHBondContact O-N 2.46Å; L352-A355 PolarHBondContact O-N 3.33Å; A355-E358 PolarHBondContact O-N 2.8Å; A355-L359 VanDerWaalsContact O-CB 3.31Å; A355-L359 WeakPolarHBondContact O-CB 3.39Å; A355-L359 PolarHBondContact O-N 2.86Å
356	E	89.9	Confident	90.8	Very high	119 Å²	119	110.7 Å²	110.7	56%	0.556	54%	0.539	S	S	*	.	H	α-helix	trans	-63.6	-42.3	174.3	-77.8	-179	169.7	0	0	112.1	L352 E354 L359 Q360	L352-E356 WeakPolarHBondContact O-CG 3.48Å; L352-E356 PolarHBondContact O-N 2.79Å; E354-E356 PolarHBondContact O-N 2.78Å; E356-L359 PolarHBondContact O-N 2.84Å; E356-Q360 WeakPolarHBondContact O-CB 3.27Å; E356-Q360 PolarHBondContact O-N 3.15Å
357	R	91.4	Very high	90.8	Very high	158 Å²	158	112 Å²	112	60%	0.596	54%	0.544	S	S	*	.	H	α-helix	trans	-64.4	-42.4	175.7	-78.8	175.9	174.4	178.9	-3.1	112.2	K353 E354 L359 Q360 T361	K353-R357 WeakPolarHBondContact O-CB 3.42Å; K353-R357 WeakPolarHBondContact O-CG 3.4Å; K353-R357 PolarHBondContact O-N 2.84Å; E354-R357 PolarHBondContact O-N 2.69Å; R357-L359 VanDerWaalsContact C-N 3.34Å; R357-Q360 PolarHBondContact O-N 3.27Å; R357-T361 WeakPolarHBondContact O-CB 3.34Å; R357-T361 PolarHBondContact O-N 3.07Å; R357-T361 PolarHBondContact O-OG1 3.4Å
358	E	90.7	Very high	90.8	Very high	113 Å²	113	114 Å²	114	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-62.8	-43	174.7	-77.3	-169.1	-169.7	0	0	111.5	E354 A355 T361 K362	E354-E358 PolarHBondContact O-N 3.15Å; A355-E358 PolarHBondContact O-N 2.8Å; E358-T361 PolarHBondContact O-N 2.91Å; E358-K362 WeakPolarHBondContact O-CB 3.49Å; E358-K362 VanDerWaalsContact O-CG 3.29Å; E358-K362 WeakPolarHBondContact O-CG 3.48Å; E358-K362 PolarHBondContact O-N 3Å; E358-K362 IonicContact OE2-NZ 3.57Å
359	L	90.5	Very high	90.9	Very high	122 Å²	122	109.4 Å²	109.4	64%	0.639	54%	0.537	S	S	*	.	H	α-helix	trans	-63.2	-43.5	177.7	-171.9	66.9	0	0	0	110.9	A355 E356 R357 K362 F363	A355-L359 VanDerWaalsContact O-CB 3.31Å; A355-L359 WeakPolarHBondContact O-CB 3.39Å; A355-L359 PolarHBondContact O-N 2.86Å; E356-L359 PolarHBondContact O-N 2.84Å; R357-L359 VanDerWaalsContact C-N 3.34Å; L359-K362 PolarHBondContact O-N 3.48Å; L359-F363 VanDerWaalsContact O-CB 3.32Å; L359-F363 WeakPolarHBondContact O-CB 3.48Å; L359-F363 PolarHBondContact O-N 3.27Å
360	Q	90.4	Very high	90.8	Very high	99 Å²	99	108.9 Å²	108.9	46%	0.463	53%	0.534	S	S	.	.	H	α-helix	trans	-63.2	-44.4	176.5	-174.7	63	21.3	0	0	111.7	E356 R357 F363 E364	E356-Q360 WeakPolarHBondContact O-CB 3.27Å; E356-Q360 PolarHBondContact O-N 3.15Å; R357-Q360 PolarHBondContact O-N 3.27Å; Q360-F363 PolarHBondContact O-N 3.01Å; Q360-E364 PolarHBondContact NE2-OE1 3.28Å; Q360-E364 WeakPolarHBondContact O-CG 3.17Å; Q360-E364 PolarHBondContact O-N 2.92Å
361	T	91.8	Very high	90.8	Very high	91 Å²	91	106.5 Å²	106.5	56%	0.558	53%	0.533	S	S	*	.	H	α-helix	trans	-64.4	-42.2	177.5	-52.4	0	0	0	0	111.2	R357 E358 E364 S365	R357-T361 WeakPolarHBondContact O-CB 3.34Å; R357-T361 PolarHBondContact O-N 3.07Å; R357-T361 PolarHBondContact O-OG1 3.4Å; E358-T361 PolarHBondContact O-N 2.91Å; T361-E364 PolarHBondContact O-N 3.22Å; T361-S365 WeakPolarHBondContact O-CB 3.38Å; T361-S365 PolarHBondContact O-N 2.85Å
362	K	90.7	Very high	90.7	Very high	127 Å²	127	106.7 Å²	106.7	55%	0.552	53%	0.528	S	S	*	.	H	α-helix	trans	-61.5	-44	173.5	-76.7	169.3	-178.8	159.9	0	110.7	E358 L359 S365 L366	E358-K362 WeakPolarHBondContact O-CB 3.49Å; E358-K362 VanDerWaalsContact O-CG 3.29Å; E358-K362 WeakPolarHBondContact O-CG 3.48Å; E358-K362 PolarHBondContact O-N 3Å; E358-K362 IonicContact OE2-NZ 3.57Å; L359-K362 PolarHBondContact O-N 3.48Å; K362-S365 PolarHBondContact O-N 2.69Å; K362-L366 WeakPolarHBondContact O-CB 3.44Å; K362-L366 PolarHBondContact O-N 3.41Å
363	F	90.3	Very high	90.6	Very high	126 Å²	126	107.3 Å²	107.3	55%	0.553	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-44.1	178.2	-176.7	-97.6	0	0	0	112.4	L359 Q360 L366 K367	L359-F363 VanDerWaalsContact O-CB 3.32Å; L359-F363 WeakPolarHBondContact O-CB 3.48Å; L359-F363 PolarHBondContact O-N 3.27Å; Q360-F363 PolarHBondContact O-N 3.01Å; F363-L366 PolarHBondContact O-N 3.39Å; F363-K367 HydrophobicContact CE1-CD 4.44Å; F363-K367 VanDerWaalsContact O-CB 3.25Å; F363-K367 WeakPolarHBondContact O-CB 3.42Å; F363-K367 PolarHBondContact O-N 3.18Å
364	E	90.7	Very high	90.5	Very high	111 Å²	111	108 Å²	108	52%	0.519	53%	0.531	S	S	.	.	H	α-helix	trans	-65.5	-41.5	176.7	-75.2	175.7	-168.4	0	0	112.3	Q360 T361 K367 K368	Q360-E364 PolarHBondContact NE2-OE1 3.28Å; Q360-E364 WeakPolarHBondContact O-CG 3.17Å; Q360-E364 PolarHBondContact O-N 2.92Å; T361-E364 PolarHBondContact O-N 3.22Å; E364-K367 PolarHBondContact O-N 3.45Å; E364-K368 WeakPolarHBondContact O-CB 3.49Å; E364-K368 PolarHBondContact O-N 2.82Å
365	S	89.5	Confident	90.6	Very high	72 Å²	72	108.2 Å²	108.2	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-60.7	-47.9	173	-176	0	0	0	0	111.3	T361 K362 K367 K368 T369	T361-S365 WeakPolarHBondContact O-CB 3.38Å; T361-S365 PolarHBondContact O-N 2.85Å; K362-S365 PolarHBondContact O-N 2.69Å; S365-K367 VanDerWaalsContact C-N 3.32Å; S365-K367 PolarHBondContact O-N 2.9Å; S365-K368 PolarHBondContact O-N 2.8Å; S365-T369 PolarHBondContact O-N 3.12Å; S365-T369 PolarHBondContact O-OG1 2.92Å; S365-T369 VanDerWaalsContact O-OG1 3.14Å
366	L	90.8	Very high	90.6	Very high	104 Å²	104	111.7 Å²	111.7	55%	0.545	54%	0.535	S	S	.	.	H	α-helix	trans	-63	-38.8	178	-139.5	93.1	0	0	0	111.9	K362 F363 T369 H370	K362-L366 WeakPolarHBondContact O-CB 3.44Å; K362-L366 PolarHBondContact O-N 3.41Å; F363-L366 PolarHBondContact O-N 3.39Å; L366-T369 WeakPolarHBondContact CA-OG1 3.21Å; L366-T369 PolarHBondContact O-OG1 2.88Å; L366-H370 VanDerWaalsContact O-CB 3.31Å; L366-H370 WeakPolarHBondContact O-CB 3.47Å; L366-H370 PolarHBondContact O-CD2 3.01Å; L366-H370 VanDerWaalsContact O-CD2 3.3Å; L366-H370 PolarHBondContact O-N 3.47Å
367	K	92.2	Very high	90.5	Very high	142 Å²	142	112.1 Å²	112.1	62%	0.617	54%	0.541	S	S	*	.	H	α-helix	trans	-65.8	-39.6	176.4	-174.1	178.9	178.9	-178.2	0	111	F363 E364 S365 A371	F363-K367 HydrophobicContact CE1-CD 4.44Å; F363-K367 VanDerWaalsContact O-CB 3.25Å; F363-K367 WeakPolarHBondContact O-CB 3.42Å; F363-K367 PolarHBondContact O-N 3.18Å; E364-K367 PolarHBondContact O-N 3.45Å; S365-K367 VanDerWaalsContact C-N 3.32Å; S365-K367 PolarHBondContact O-N 2.9Å; K367-A371 WeakPolarHBondContact O-CB 3.34Å; K367-A371 PolarHBondContact O-N 3.11Å
368	K	91.2	Very high	90.4	Very high	135 Å²	135	109.8 Å²	109.8	59%	0.587	54%	0.537	S	S	*	.	H	α-helix	trans	-68.8	-46.1	176.9	-171.1	-178.3	177.6	-172.6	0	111.6	E364 S365 H370 A371 E372	E364-K368 WeakPolarHBondContact O-CB 3.49Å; E364-K368 PolarHBondContact O-N 2.82Å; S365-K368 PolarHBondContact O-N 2.8Å; K368-H370 PolarHBondContact O-N 3.18Å; K368-A371 PolarHBondContact O-N 3.4Å; K368-E372 VanDerWaalsContact CE-OE1 3.25Å; K368-E372 WeakPolarHBondContact CE-OE1 3.49Å; K368-E372 WeakPolarHBondContact O-CG 3.44Å; K368-E372 PolarHBondContact O-N 3.35Å
369	T	90.7	Very high	90.5	Very high	61 Å²	61	109.2 Å²	109.2	37%	0.374	53%	0.534	S	S	.	.	H	α-helix	trans	-61.9	-43.7	175.7	48.9	0	0	0	0	111.2	S365 L366 A371 E372 E373	S365-T369 PolarHBondContact O-N 3.12Å; S365-T369 PolarHBondContact O-OG1 2.92Å; S365-T369 VanDerWaalsContact O-OG1 3.14Å; L366-T369 WeakPolarHBondContact CA-OG1 3.21Å; L366-T369 PolarHBondContact O-OG1 2.88Å; T369-A371 VanDerWaalsContact C-N 3.33Å; T369-A371 PolarHBondContact O-N 2.88Å; T369-E372 PolarHBondContact O-N 3.03Å; T369-E373 WeakPolarHBondContact O-CB 3.38Å; T369-E373 WeakPolarHBondContact O-CG 3.35Å; T369-E373 PolarHBondContact O-N 3.2Å
370	H	88.6	Confident	90.4	Very high	113 Å²	113	110.3 Å²	110.3	52%	0.523	53%	0.534	S	S	.	.	H	α-helix	trans	-61.6	-37.8	173.8	-88.7	-55.5	0	0	0	113.2	L366 K368 E373 K374	L366-H370 VanDerWaalsContact O-CB 3.31Å; L366-H370 WeakPolarHBondContact O-CB 3.47Å; L366-H370 PolarHBondContact O-CD2 3.01Å; L366-H370 VanDerWaalsContact O-CD2 3.3Å; L366-H370 PolarHBondContact O-N 3.47Å; K368-H370 PolarHBondContact O-N 3.18Å; H370-E373 IonicContact ND1-OE2 3.19Å; H370-K374 WeakPolarHBondContact O-CB 3.25Å; H370-K374 PolarHBondContact O-N 3.07Å
371	A	90.9	Very high	90.4	Very high	58 Å²	58	111.8 Å²	111.8	48%	0.479	54%	0.539	S	S	.	.	H	α-helix	trans	-67.5	-40.8	175.8	0	0	0	0	0	112.2	K367 K368 T369 K374 K375	K367-A371 WeakPolarHBondContact O-CB 3.34Å; K367-A371 PolarHBondContact O-N 3.11Å; K368-A371 PolarHBondContact O-N 3.4Å; T369-A371 VanDerWaalsContact C-N 3.33Å; T369-A371 PolarHBondContact O-N 2.88Å; A371-K374 PolarHBondContact O-N 3.04Å; A371-K375 WeakPolarHBondContact O-CB 3.49Å; A371-K375 PolarHBondContact O-N 2.79Å
372	E	90.6	Very high	90.3	Very high	92 Å²	92	114.6 Å²	114.6	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-67	-42.3	175.4	-73.1	176.9	-170.3	0	0	112.1	K368 T369 K375 K376	K368-E372 VanDerWaalsContact CE-OE1 3.25Å; K368-E372 WeakPolarHBondContact CE-OE1 3.49Å; K368-E372 WeakPolarHBondContact O-CG 3.44Å; K368-E372 PolarHBondContact O-N 3.35Å; T369-E372 PolarHBondContact O-N 3.03Å; E372-K375 PolarHBondContact O-N 3Å; E372-K376 WeakPolarHBondContact O-CB 3.41Å; E372-K376 WeakPolarHBondContact O-CG 3.34Å; E372-K376 PolarHBondContact O-N 3.31Å
373	E	88.8	Confident	90.3	Very high	118 Å²	118	114.5 Å²	114.5	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-62.8	-45.1	173.9	-76.7	-175.8	167.1	0	0	111.3	T369 H370 K375 K376 L377	T369-E373 WeakPolarHBondContact O-CB 3.38Å; T369-E373 WeakPolarHBondContact O-CG 3.35Å; T369-E373 PolarHBondContact O-N 3.2Å; H370-E373 IonicContact ND1-OE2 3.19Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.3Å; E373-K376 PolarHBondContact O-N 3.29Å; E373-L377 WeakPolarHBondContact O-CB 3.48Å; E373-L377 PolarHBondContact O-N 2.86Å
374	K	90.2	Very high	90.2	Very high	134 Å²	134	113 Å²	113	58%	0.583	54%	0.536	S	S	*	.	H	α-helix	trans	-59.4	-45	175.6	-174.7	179.7	175.9	-175.1	0	111.1	H370 A371 L377 E378	H370-K374 WeakPolarHBondContact O-CB 3.25Å; H370-K374 PolarHBondContact O-N 3.07Å; A371-K374 PolarHBondContact O-N 3.04Å; K374-L377 WeakPolarHBondContact O-CB 3.4Å; K374-L377 PolarHBondContact O-N 3.13Å; K374-E378 WeakPolarHBondContact CE-OE1 2.95Å; K374-E378 WeakPolarHBondContact O-CB 3.35Å; K374-E378 WeakPolarHBondContact O-CG 3.42Å; K374-E378 PolarHBondContact O-N 2.93Å
375	K	91.6	Very high	90.1	Very high	125 Å²	125	112.6 Å²	112.6	54%	0.543	53%	0.534	S	S	.	.	H	α-helix	trans	-62.8	-45.1	176.8	-173.1	-178.5	175.8	-171.8	0	111.9	A371 E372 E373 L377 E378 E379	A371-K375 WeakPolarHBondContact O-CB 3.49Å; A371-K375 PolarHBondContact O-N 2.79Å; E372-K375 PolarHBondContact O-N 3Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.3Å; K375-L377 VanDerWaalsContact C-N 3.28Å; K375-L377 PolarHBondContact O-N 3.47Å; K375-E378 PolarHBondContact O-N 3.48Å; K375-E379 WeakPolarHBondContact CE-OE1 3.45Å; K375-E379 IonicContact NZ-OE1 3.1Å; K375-E379 WeakPolarHBondContact O-CB 3.36Å; K375-E379 WeakPolarHBondContact O-CG 3.24Å; K375-E379 PolarHBondContact O-N 3.28Å
376	K	90.6	Very high	90.1	Very high	125 Å²	125	113.7 Å²	113.7	54%	0.543	53%	0.531	S	S	.	.	H	α-helix	trans	-61.3	-37.8	174.5	-75.2	173.4	-178.2	171.6	0	111.8	E372 E373 K380	E372-K376 WeakPolarHBondContact O-CB 3.41Å; E372-K376 WeakPolarHBondContact O-CG 3.34Å; E372-K376 PolarHBondContact O-N 3.31Å; E373-K376 PolarHBondContact O-N 3.29Å; K376-K380 WeakPolarHBondContact O-CB 3.31Å; K376-K380 VanDerWaalsContact O-CG 3.3Å; K376-K380 WeakPolarHBondContact O-CG 3.1Å; K376-K380 PolarHBondContact O-N 3.02Å
377	L	88.8	Confident	89.9	Confident	128 Å²	128	113.7 Å²	113.7	67%	0.67	53%	0.528	S	S	*	.	H	α-helix	trans	-67.7	-42.1	177	-150.5	91.1	0	0	0	111	E373 K374 K375 K380 K381	E373-L377 WeakPolarHBondContact O-CB 3.48Å; E373-L377 PolarHBondContact O-N 2.86Å; K374-L377 WeakPolarHBondContact O-CB 3.4Å; K374-L377 PolarHBondContact O-N 3.13Å; K375-L377 VanDerWaalsContact C-N 3.28Å; K375-L377 PolarHBondContact O-N 3.47Å; L377-K380 PolarHBondContact O-N 3.27Å; L377-K381 VanDerWaalsContact O-CB 3.25Å; L377-K381 WeakPolarHBondContact O-CB 3.34Å; L377-K381 PolarHBondContact O-N 3.49Å
378	E	89.7	Confident	89.7	Confident	110 Å²	110	111.5 Å²	111.5	51%	0.514	52%	0.523	S	S	.	.	H	α-helix	trans	-65.6	-41.4	175.3	-75.6	174.7	179.5	0	0	112	K374 K375 K381 R382	K374-E378 WeakPolarHBondContact CE-OE1 2.95Å; K374-E378 WeakPolarHBondContact O-CB 3.35Å; K374-E378 WeakPolarHBondContact O-CG 3.42Å; K374-E378 PolarHBondContact O-N 2.93Å; K375-E378 PolarHBondContact O-N 3.48Å; E378-K381 PolarHBondContact O-N 3.39Å; E378-R382 WeakPolarHBondContact O-CB 3.07Å; E378-R382 PolarHBondContact O-N 2.89Å
379	E	90.9	Very high	89.6	Confident	100 Å²	100	106.7 Å²	106.7	47%	0.467	51%	0.508	S	S	.	.	H	α-helix	trans	-65	-44.8	174.6	-75.2	173.6	177.7	0	0	111.8	K375 K381 R382 F383	K375-E379 WeakPolarHBondContact CE-OE1 3.45Å; K375-E379 IonicContact NZ-OE1 3.1Å; K375-E379 WeakPolarHBondContact O-CB 3.36Å; K375-E379 WeakPolarHBondContact O-CG 3.24Å; K375-E379 PolarHBondContact O-N 3.28Å; E379-K381 VanDerWaalsContact C-N 3.32Å; E379-K381 PolarHBondContact O-N 3.34Å; E379-R382 PolarHBondContact O-N 3.35Å; E379-F383 WeakPolarHBondContact O-CB 3.48Å; E379-F383 PolarHBondContact O-N 2.83Å
380	K	90	Very high	89.5	Confident	146 Å²	146	105.5 Å²	105.5	64%	0.635	50%	0.504	S	S	*	.	H	α-helix	trans	-61.5	-41.1	173.2	-77.9	-180	178.8	-176.5	0	111.6	K376 L377 F383 L384	K376-K380 WeakPolarHBondContact O-CB 3.31Å; K376-K380 VanDerWaalsContact O-CG 3.3Å; K376-K380 WeakPolarHBondContact O-CG 3.1Å; K376-K380 PolarHBondContact O-N 3.02Å; L377-K380 PolarHBondContact O-N 3.27Å; K380-F383 PolarHBondContact O-N 3.21Å; K380-L384 WeakPolarHBondContact O-CB 2.94Å; K380-L384 VanDerWaalsContact O-CG 3.28Å; K380-L384 WeakPolarHBondContact O-CG 3.31Å; K380-L384 PolarHBondContact O-N 3.21Å
381	K	89.7	Confident	89.4	Confident	130 Å²	130	106.9 Å²	106.9	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-61.6	-45.2	175.5	-172.4	-175.9	177.4	-163.7	0	110.7	L377 E378 E379 L384 E385	L377-K381 VanDerWaalsContact O-CB 3.25Å; L377-K381 WeakPolarHBondContact O-CB 3.34Å; L377-K381 PolarHBondContact O-N 3.49Å; E378-K381 PolarHBondContact O-N 3.39Å; E379-K381 VanDerWaalsContact C-N 3.32Å; E379-K381 PolarHBondContact O-N 3.34Å; K381-L384 PolarHBondContact O-N 3.02Å; K381-E385 WeakPolarHBondContact CE-OE1 3.49Å; K381-E385 IonicContact NZ-OE1 3.12Å; K381-E385 WeakPolarHBondContact O-CB 3.32Å; K381-E385 WeakPolarHBondContact O-CG 3.35Å; K381-E385 PolarHBondContact O-N 2.9Å
382	R	90.7	Very high	89.1	Confident	150 Å²	150	109.2 Å²	109.2	57%	0.566	51%	0.51	S	S	*	.	H	α-helix	trans	-63.9	-42.9	177.3	-159.3	-173.2	94.4	-158.5	2.2	112.1	E378 E379 E385 E386	E378-R382 WeakPolarHBondContact O-CB 3.07Å; E378-R382 PolarHBondContact O-N 2.89Å; E379-R382 PolarHBondContact O-N 3.35Å; R382-E385 PolarHBondContact O-N 3.2Å; R382-E386 IonicContact CZ-OE1 3.77Å; R382-E386 IonicContact NE-OE1 3.22Å; R382-E386 PolarHBondContact NE-OE1 2.67Å; R382-E386 IonicContact NH2-OE1 3.52Å; R382-E386 PolarHBondContact NH2-OE1 3.25Å; R382-E386 WeakPolarHBondContact O-CB 3.41Å; R382-E386 WeakPolarHBondContact O-CG 3.5Å; R382-E386 PolarHBondContact O-N 3.32Å
383	F	88.8	Confident	88.9	Confident	124 Å²	124	112.4 Å²	112.4	54%	0.544	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-42.5	176.6	-171.2	-94.6	0	0	0	111.5	E379 K380 E386 E387	E379-F383 WeakPolarHBondContact O-CB 3.48Å; E379-F383 PolarHBondContact O-N 2.83Å; K380-F383 PolarHBondContact O-N 3.21Å; F383-E386 PolarHBondContact O-N 3.4Å; F383-E387 HydrophobicContact CD1-CG 4.1Å; F383-E387 HydrophobicContact CE1-CG 3.72Å; F383-E387 WeakPolarHBondContact CE1-OE2 3.38Å; F383-E387 HydrophobicContact CZ-CG 4.19Å; F383-E387 WeakPolarHBondContact O-CB 3.27Å; F383-E387 PolarHBondContact O-N 2.73Å
384	L	88.8	Confident	88.7	Confident	96 Å²	96	115.8 Å²	115.8	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-64	-40.9	174.2	-74.6	168.2	0	0	0	111.7	K380 K381 E387 I388	K380-L384 WeakPolarHBondContact O-CB 2.94Å; K380-L384 VanDerWaalsContact O-CG 3.28Å; K380-L384 WeakPolarHBondContact O-CG 3.31Å; K380-L384 PolarHBondContact O-N 3.21Å; K381-L384 PolarHBondContact O-N 3.02Å; L384-E387 PolarHBondContact O-N 3.4Å; L384-I388 VanDerWaalsContact O-CB 3.32Å; L384-I388 WeakPolarHBondContact O-CB 3.21Å; L384-I388 WeakPolarHBondContact O-CD1 3.34Å; L384-I388 WeakPolarHBondContact O-CG1 3.44Å; L384-I388 PolarHBondContact O-N 2.84Å
385	E	88.3	Confident	88.5	Confident	102 Å²	102	115 Å²	115	48%	0.477	52%	0.522	S	S	.	.	H	α-helix	trans	-63.9	-40.5	174.3	-75.6	172.3	177.4	0	0	111.8	K381 R382 I388 A389	K381-E385 WeakPolarHBondContact CE-OE1 3.49Å; K381-E385 IonicContact NZ-OE1 3.12Å; K381-E385 WeakPolarHBondContact O-CB 3.32Å; K381-E385 WeakPolarHBondContact O-CG 3.35Å; K381-E385 PolarHBondContact O-N 2.9Å; R382-E385 PolarHBondContact O-N 3.2Å; E385-I388 PolarHBondContact O-N 2.95Å; E385-A389 VanDerWaalsContact O-CB 3.26Å; E385-A389 WeakPolarHBondContact O-CB 3.2Å; E385-A389 PolarHBondContact O-N 2.86Å
386	E	89.4	Confident	88.1	Confident	94 Å²	94	114.2 Å²	114.2	44%	0.439	52%	0.521	S	S	.	.	H	α-helix	trans	-65.9	-42.2	174.4	-74.9	173.8	-156	0	0	111.8	R382 F383 A389 A390	R382-E386 IonicContact CZ-OE1 3.77Å; R382-E386 IonicContact NE-OE1 3.22Å; R382-E386 PolarHBondContact NE-OE1 2.67Å; R382-E386 IonicContact NH2-OE1 3.52Å; R382-E386 PolarHBondContact NH2-OE1 3.25Å; R382-E386 WeakPolarHBondContact O-CB 3.41Å; R382-E386 WeakPolarHBondContact O-CG 3.5Å; R382-E386 PolarHBondContact O-N 3.32Å; F383-E386 PolarHBondContact O-N 3.4Å; E386-A389 PolarHBondContact O-N 3.24Å; E386-A390 WeakPolarHBondContact O-CB 2.95Å; E386-A390 PolarHBondContact O-N 3.16Å
387	E	87.8	Confident	87.7	Confident	104 Å²	104	113.4 Å²	113.4	49%	0.486	52%	0.522	S	S	.	.	H	α-helix	trans	-65.2	-42.6	174.5	-82.5	-163.1	121.7	0	0	111.9	F383 L384 A390 F391	F383-E387 HydrophobicContact CD1-CG 4.1Å; F383-E387 HydrophobicContact CE1-CG 3.72Å; F383-E387 WeakPolarHBondContact CE1-OE2 3.38Å; F383-E387 HydrophobicContact CZ-CG 4.19Å; F383-E387 WeakPolarHBondContact O-CB 3.27Å; F383-E387 PolarHBondContact O-N 2.73Å; L384-E387 PolarHBondContact O-N 3.4Å; E387-A390 PolarHBondContact O-N 3.18Å; E387-F391 WeakPolarHBondContact O-CB 3.21Å; E387-F391 PolarHBondContact O-N 3.35Å
388	I	86.7	Confident	87.3	Confident	97 Å²	97	110 Å²	110	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-47.8	174.8	-70.5	163.8	0	0	0	109.5	L384 E385 A390 F391 E392	L384-I388 VanDerWaalsContact O-CB 3.32Å; L384-I388 WeakPolarHBondContact O-CB 3.21Å; L384-I388 WeakPolarHBondContact O-CD1 3.34Å; L384-I388 WeakPolarHBondContact O-CG1 3.44Å; L384-I388 PolarHBondContact O-N 2.84Å; E385-I388 PolarHBondContact O-N 2.95Å; I388-A390 VanDerWaalsContact C-N 3.34Å; I388-A390 PolarHBondContact O-N 2.83Å; I388-F391 WeakPolarHBondContact O-CB 3.45Å; I388-F391 PolarHBondContact O-N 3.4Å; I388-E392 WeakPolarHBondContact O-CB 3.44Å; I388-E392 WeakPolarHBondContact O-CG 3.16Å; I388-E392 PolarHBondContact O-N 2.75Å
389	A	89.1	Confident	86.7	Confident	33 Å²	33	109.7 Å²	109.7	27%	0.273	51%	0.511	S	S	.	.	H	α-helix	trans	-66.4	-33.7	178.4	0	0	0	0	0	112.9	E385 E386 R393	E385-A389 VanDerWaalsContact O-CB 3.26Å; E385-A389 WeakPolarHBondContact O-CB 3.2Å; E385-A389 PolarHBondContact O-N 2.86Å; E386-A389 PolarHBondContact O-N 3.24Å; A389-R393 WeakPolarHBondContact O-CB 3.41Å; A389-R393 WeakPolarHBondContact O-CG 3.46Å; A389-R393 PolarHBondContact O-N 2.87Å; A389-R393 PolarHBondContact O-NE 3.46Å
390	A	88.6	Confident	86	Confident	36 Å²	36	110.5 Å²	110.5	30%	0.298	51%	0.514	S	S	.	.	H	α-helix	trans	-71.2	-39.3	173.9	0	0	0	0	0	111.3	E386 E387 I388 R393 R394	E386-A390 WeakPolarHBondContact O-CB 2.95Å; E386-A390 PolarHBondContact O-N 3.16Å; E387-A390 PolarHBondContact O-N 3.18Å; I388-A390 VanDerWaalsContact C-N 3.34Å; I388-A390 PolarHBondContact O-N 2.83Å; A390-R393 PolarHBondContact O-N 3.26Å; A390-R394 WeakPolarHBondContact O-CB 3.25Å; A390-R394 WeakPolarHBondContact O-CG 3.49Å; A390-R394 PolarHBondContact O-N 3.3Å
391	F	87.3	Confident	85.3	Confident	143 Å²	143	106.4 Å²	106.4	63%	0.627	51%	0.508	S	S	*	.	H	α-helix	trans	-63.9	-44.3	173.9	-177.9	-97.7	0	0	0	111	E387 I388 R394 K395	E387-F391 WeakPolarHBondContact O-CB 3.21Å; E387-F391 PolarHBondContact O-N 3.35Å; I388-F391 WeakPolarHBondContact O-CB 3.45Å; I388-F391 PolarHBondContact O-N 3.4Å; F391-R394 PolarHBondContact O-N 3.44Å; F391-K395 VanDerWaalsContact O-CB 3.3Å; F391-K395 WeakPolarHBondContact O-CB 3.19Å; F391-K395 PolarHBondContact O-N 3.14Å
392	E	85.2	Confident	84.5	Confident	107 Å²	107	110.1 Å²	110.1	50%	0.5	52%	0.519	S	S	.	.	H	α-helix	trans	-61.8	-43.8	173.9	-76.3	-177.4	168.4	0	0	111.9	I388 K395 Q396	I388-E392 WeakPolarHBondContact O-CB 3.44Å; I388-E392 WeakPolarHBondContact O-CG 3.16Å; I388-E392 PolarHBondContact O-N 2.75Å; E392-K395 PolarHBondContact O-N 2.87Å; E392-Q396 WeakPolarHBondContact O-CB 3.2Å; E392-Q396 WeakPolarHBondContact O-CG 3.37Å; E392-Q396 PolarHBondContact O-N 3.27Å
393	R	85.7	Confident	83.3	Confident	159 Å²	159	109.9 Å²	109.9	60%	0.6	52%	0.524	S	S	*	.	H	α-helix	trans	-62.4	-43.1	174	-82.9	-175.1	-87.6	-170.5	-6.7	112.6	A389 A390 K395 Q396 L397	A389-R393 WeakPolarHBondContact O-CB 3.41Å; A389-R393 WeakPolarHBondContact O-CG 3.46Å; A389-R393 PolarHBondContact O-N 2.87Å; A389-R393 PolarHBondContact O-NE 3.46Å; A390-R393 PolarHBondContact O-N 3.26Å; R393-K395 VanDerWaalsContact C-N 3.35Å; R393-Q396 PolarHBondContact O-N 2.86Å; R393-L397 WeakPolarHBondContact O-CB 3.41Å; R393-L397 WeakPolarHBondContact O-CG 3.45Å; R393-L397 PolarHBondContact O-N 2.93Å
394	R	85.3	Confident	81.9	Confident	189 Å²	189	105.4 Å²	105.4	71%	0.713	51%	0.513	S	S	*	.	H	α-helix	trans	-64.5	-39.8	175.5	-75.8	177.8	-175.1	177.4	4	111.6	A390 F391 L397 A398	A390-R394 WeakPolarHBondContact O-CB 3.25Å; A390-R394 WeakPolarHBondContact O-CG 3.49Å; A390-R394 PolarHBondContact O-N 3.3Å; F391-R394 PolarHBondContact O-N 3.44Å; R394-L397 PolarHBondContact O-N 3.22Å; R394-A398 VanDerWaalsContact O-CB 3.23Å; R394-A398 WeakPolarHBondContact O-CB 3.12Å; R394-A398 PolarHBondContact O-N 3.46Å
395	K	85	Confident	80.4	Confident	117 Å²	117	107.1 Å²	107.1	51%	0.509	52%	0.522	S	S	.	.	H	α-helix	trans	-62.3	-47.4	175	-173.6	-176.8	174.4	-172	0	110.9	F391 E392 R393 A398 E399	F391-K395 VanDerWaalsContact O-CB 3.3Å; F391-K395 WeakPolarHBondContact O-CB 3.19Å; F391-K395 PolarHBondContact O-N 3.14Å; E392-K395 PolarHBondContact O-N 2.87Å; R393-K395 VanDerWaalsContact C-N 3.35Å; K395-A398 PolarHBondContact O-N 3.37Å; K395-E399 WeakPolarHBondContact CE-OE1 3.3Å; K395-E399 WeakPolarHBondContact O-CB 3.23Å; K395-E399 WeakPolarHBondContact O-CG 3.28Å; K395-E399 PolarHBondContact O-N 3.16Å
396	Q	83.4	Confident	79	Confident	108 Å²	108	108.6 Å²	108.6	51%	0.505	53%	0.533	S	S	.	.	H	α-helix	trans	-62.4	-43.9	176.3	-73.9	176.6	0.6	0	0	112.3	E392 R393 E399 Q400	E392-Q396 WeakPolarHBondContact O-CB 3.2Å; E392-Q396 WeakPolarHBondContact O-CG 3.37Å; E392-Q396 PolarHBondContact O-N 3.27Å; R393-Q396 PolarHBondContact O-N 2.86Å; Q396-E399 PolarHBondContact O-N 3.5Å; Q396-Q400 WeakPolarHBondContact O-CB 3.34Å; Q396-Q400 VanDerWaalsContact O-CG 3.31Å; Q396-Q400 WeakPolarHBondContact O-CG 3.44Å; Q396-Q400 PolarHBondContact O-N 3.08Å
397	L	82.6	Confident	77.5	Confident	108 Å²	108	108.9 Å²	108.9	57%	0.565	54%	0.541	S	S	*	.	H	α-helix	trans	-67.1	-38.1	177	-74.4	169.4	0	0	0	112.4	R393 R394 Q400 A401	R393-L397 WeakPolarHBondContact O-CB 3.41Å; R393-L397 WeakPolarHBondContact O-CG 3.45Å; R393-L397 PolarHBondContact O-N 2.93Å; R394-L397 PolarHBondContact O-N 3.22Å; L397-Q400 PolarHBondContact O-N 3.11Å; L397-A401 VanDerWaalsContact O-CB 3.28Å; L397-A401 WeakPolarHBondContact O-CB 3.36Å; L397-A401 PolarHBondContact O-N 3.28Å
398	A	79.6	Confident	76	Confident	58 Å²	58	111 Å²	111	48%	0.479	55%	0.553	S	S	.	*	H	α-helix	trans	-67.3	-36.8	175.1	0	0	0	0	0	111.8	R394 K395 R402	R394-A398 VanDerWaalsContact O-CB 3.23Å; R394-A398 WeakPolarHBondContact O-CB 3.12Å; R394-A398 PolarHBondContact O-N 3.46Å; K395-A398 PolarHBondContact O-N 3.37Å; A398-R402 WeakPolarHBondContact O-CB 3.34Å; A398-R402 PolarHBondContact O-N 2.84Å; A398-R402 VanDerWaalsContact O-N 3.09Å
399	E	78.1	Confident	74.5	Confident	102 Å²	102	115.9 Å²	115.9	48%	0.477	57%	0.57	S	S	.	*	H	α-helix	trans	-66.3	-42.5	171.5	-77.6	172.3	-179.2	0	0	111.5	K395 Q396 R402 Q403	K395-E399 WeakPolarHBondContact CE-OE1 3.3Å; K395-E399 WeakPolarHBondContact O-CB 3.23Å; K395-E399 WeakPolarHBondContact O-CG 3.28Å; K395-E399 PolarHBondContact O-N 3.16Å; Q396-E399 PolarHBondContact O-N 3.5Å; E399-R402 WeakPolarHBondContact O-CB 3.49Å; E399-R402 PolarHBondContact O-N 3.37Å; E399-Q403 WeakPolarHBondContact O-CG 3.26Å; E399-Q403 PolarHBondContact O-N 3.27Å; E399-Q403 VanDerWaalsContact O-N 3.14Å
400	Q	76.6	Confident	73	Confident	117 Å²	117	123.3 Å²	123.3	55%	0.547	60%	0.596	S	S	.	*	H	α-helix	trans	-68.7	-40.4	176.5	-74.2	177.5	10	0	0	113.1	Q396 L397 R402 Q403 G404	Q396-Q400 WeakPolarHBondContact O-CB 3.34Å; Q396-Q400 VanDerWaalsContact O-CG 3.31Å; Q396-Q400 WeakPolarHBondContact O-CG 3.44Å; Q396-Q400 PolarHBondContact O-N 3.08Å; L397-Q400 PolarHBondContact O-N 3.11Å; Q400-R402 VanDerWaalsContact C-N 3.3Å; Q400-R402 PolarHBondContact O-N 2.9Å; Q400-Q403 CarbonylContact O-C 3.55Å; Q400-Q403 WeakPolarHBondContact O-CA 3.36Å; Q400-Q403 PolarHBondContact O-N 3.32Å; Q400-G404 PolarHBondContact O-N 3.32Å
401	A	75.2	Confident	71.1	Confident	60 Å²	60	132.5 Å²	132.5	50%	0.496	62%	0.623	S	S	.	*	H	α-helix	trans	-66.2	-34.6	176	0	0	0	0	0	111.8	L397 Q403 G404 N405	L397-A401 VanDerWaalsContact O-CB 3.28Å; L397-A401 WeakPolarHBondContact O-CB 3.36Å; L397-A401 PolarHBondContact O-N 3.28Å; A401-Q403 VanDerWaalsContact C-N 3.29Å; A401-Q403 PolarHBondContact O-N 3.38Å; A401-G404 PolarHBondContact O-N 2.66Å; A401-N405 PolarHBondContact O-N 3.06Å
402	R	71.8	Confident	69.1	Low	209 Å²	209	139 Å²	139	79%	0.789	65%	0.652	S	S	*	*	H	α-helix	trans	-62.3	-35	168.8	-93.4	-177.7	167.6	179.2	-2.7	112.2	A398 E399 Q400 L406	A398-R402 WeakPolarHBondContact O-CB 3.34Å; A398-R402 PolarHBondContact O-N 2.84Å; A398-R402 VanDerWaalsContact O-N 3.09Å; E399-R402 WeakPolarHBondContact O-CB 3.49Å; E399-R402 PolarHBondContact O-N 3.37Å; Q400-R402 VanDerWaalsContact C-N 3.3Å; Q400-R402 PolarHBondContact O-N 2.9Å; R402-L406 WeakPolarHBondContact O-CD1 3.42Å
403	Q	65.4	Low	68.3	Low	145 Å²	145	140.7 Å²	140.7	68%	0.678	66%	0.659	S	S	*	*	H	α-helix	trans	-79.9	-33.6	176.5	-69.5	-179.7	2.1	0	0	113.3	E399 Q400 A401 L406	E399-Q403 WeakPolarHBondContact O-CG 3.26Å; E399-Q403 PolarHBondContact O-N 3.27Å; E399-Q403 VanDerWaalsContact O-N 3.14Å; Q400-Q403 CarbonylContact O-C 3.55Å; Q400-Q403 WeakPolarHBondContact O-CA 3.36Å; Q400-Q403 PolarHBondContact O-N 3.32Å; A401-Q403 VanDerWaalsContact C-N 3.29Å; A401-Q403 PolarHBondContact O-N 3.38Å; Q403-L406 PolarHBondContact O-N 3.27Å
404	G	60.9	Low	67.4	Low	30 Å²	30	139.7 Å²	139.7	31%	0.309	66%	0.662	S	S	.	*	H	α-helix	trans	-78.8	-30.4	-175.4	0	0	0	0	0	115.8	Q400 A401 L406 T407 M408	Q400-G404 PolarHBondContact O-N 3.32Å; A401-G404 PolarHBondContact O-N 2.66Å; G404-L406 PolarHBondContact O-N 3.33Å; G404-T407 WeakPolarHBondContact CA-OG1 3.11Å; G404-T407 PolarHBondContact O-N 3.25Å; G404-T407 PolarHBondContact O-OG1 3.47Å; G404-M408 PolarHBondContact O-N 3.47Å
405	N	57.2	Low	66.4	Low	131 Å²	131	136.9 Å²	136.9	70%	0.701	66%	0.659	S	S	*	*	H	α-helix	trans	-66.3	-16.1	173.2	-94.7	-17.5	0	0	0	112.9	A401	A401-N405 PolarHBondContact O-N 3.06Å
406	L	57.3	Low	65.3	Low	134 Å²	134	138.1 Å²	138.1	70%	0.702	67%	0.668	S	S	*	*	H	α-helix	trans	-79.8	-20.9	171.4	-80.4	96.2	0	0	0	113.5	R402 Q403 G404	R402-L406 WeakPolarHBondContact O-CD1 3.42Å; Q403-L406 PolarHBondContact O-N 3.27Å; G404-L406 PolarHBondContact O-N 3.33Å
407	T	59.2	Low	64.1	Low	99 Å²	99	140 Å²	140	61%	0.607	68%	0.678	S	S	*	*	H	α-helix	trans	-95.4	-29.3	-175.8	32.2	0	0	0	0	114.3	G404 K410	G404-T407 WeakPolarHBondContact CA-OG1 3.11Å; G404-T407 PolarHBondContact O-N 3.25Å; G404-T407 PolarHBondContact O-OG1 3.47Å; T407-K410 PolarHBondContact O-N 3.44Å
408	M	55.6	Low	62.9	Low	149 Å²	149	142.1 Å²	142.1	73%	0.734	69%	0.686	S	S	*	*	H	α-helix	trans	-75.1	-28.7	179.9	-78.7	-86.3	-79.1	0	0	114.1	G404 K410 R411	G404-M408 PolarHBondContact O-N 3.47Å; M408-K410 PolarHBondContact O-N 3.13Å; M408-K410 VanDerWaalsContact O-N 3.08Å; M408-R411 PolarHBondContact O-N 2.94Å
409	K	56.2	Low	61.7	Low	199 Å²	199	148.1 Å²	148.1	87%	0.865	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-6.4	175.2	-86.6	-174.6	175.5	179.5	0	114.2
410	K	57.6	Low	60.5	Low	189 Å²	189	151.7 Å²	151.7	82%	0.822	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	0.5	176.8	-91.9	-174.1	174.2	-179.1	0	115	T407 M408	T407-K410 PolarHBondContact O-N 3.44Å; M408-K410 PolarHBondContact O-N 3.13Å; M408-K410 VanDerWaalsContact O-N 3.08Å
411	R	48.1	Very low	59.1	Low	230 Å²	230	154.6 Å²	154.6	87%	0.868	73%	0.732	S	S	*	*			trans	-117.9	97.4	172.5	-81.3	-178.7	159.5	-179	-6.1	110.1	M408	M408-R411 PolarHBondContact O-N 2.94Å
412	K	44.9	Very low	57.6	Low	280 Å²	280	163.2 Å²	163.2	100%	1.217	75%	0.754	S	S	*	*			trans	-83.5	0	153	-101.7	-174.8	174.5	-177.1	0	109

Retrieved 412 of 412 residues in 754.9 ms (Link to these results)

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