A0A087XC24_POEFO Loading...

Glutamate metabotropic receptor 7

AlphaFold DB , UniProt , Accession A0A087XC24, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 915 aa.

						>A0A087XC24_POEFO|A0A087XC24
HQSTPSFLQKLSMARPGVCVWRLFWLLSAVVDFALLQETYAPHSIRTQGHLTLGGLFPVHSRGPDGTPCGDLKKENGIQRLEAMMYALDQINQDEQLLPNITLGARVLDTCSRDTYALEQSLTFVQALITKDTSDVRCTNGEPPVFVKPEKVVGVIGASASSVSIMVANILRLFQIPQISYASTAPELSDDRRYDFFSRVVPPDSFQAQAMVDIIQALNWTYVSTVASEGSYGEKGVEAFTQLSREAGGICIAQSLKIPHNPKMEDYDKIIQQLLETHNARAIIIFASEEDIRGVLNATKRANQVGHFLWIGSDSWGSKSSPIHQLEDVAVGAVTILPKRSSIEGFDEYFTGLTLENNRRNVWFAEFWEENFDCRLLSASKREDSSRKCTGQERIGIDSKYEQEGKVQFVIDAVYAMAHALHNMHRDLCPNHPGVCPQMESTDGKMLLKYIRNASFNGSAGTSVVFNKNGDAPGRYDLFQFQVTNSSDPEYKVVGQWADTLQLRLEELQWPDGEQEVPNSVCSLPCKTGERKKKVKGMPCCWICELCDGYQYQYDETSCRLCAYYMRPNSNRTACQPIPIIKLEWHSPWAIIPVFLAMLGIIATIFVMATFVRYNDTPIVRASGRELSYVLLTGIFLCYIITFLMIAKPDVAVCAFRRIFLGLGMCISYAALLTKTNRIYRIFEQGKQTVTAPRFISPTSQIAITSSLISMQLLGVLVWFAVDPPNTIVDYDEQKTINPMLARGVLKCDITDLQIICSLGYSILLMVTCTIYAIKTRDVPEDFNEAKPIGFTMYTTCIVWLAFIPIFFGTAQSAEKLYIQTTTLTVSMNLSASVALGMLYMPKVYIIIFHPELNVQKRKRSFKAVVTAATMSSRLSQKPSERPNGEAKTELCENPAADPMTQHLFWMRNGSWASV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	H	30.5	Very low	30.2	Very low	227 Å²	227	159 Å²	159	100%	1.051	83%	0.831	S	S	*	*				0	120.5	0	-107.3	-65.1	0	0	0	108.3
2	Q	28.7	Very low	29.9	Very low	177 Å²	177	153.4 Å²	153.4	83%	0.827	82%	0.815	S	S	*	*			trans	34.6	130.5	153.5	-73.6	163	-27.2	0	0	118.7
3	S	28.3	Very low	29.9	Very low	114 Å²	114	155.9 Å²	155.9	80%	0.797	82%	0.823	S	S	*	*			cis	-170.8	140.8	38.1	41.2	0	0	0	0	113.2
4	T	31.9	Very low	29.7	Very low	134 Å²	134	152.5 Å²	152.5	82%	0.822	83%	0.828	S	S	*	*			trans	-110.8	175.8	139.1	44.6	0	0	0	0	106.2
5	P	49.5	Very low	30.1	Very low	110 Å²	110	157.7 Å²	157.7	71%	0.714	83%	0.831	S	S	*	*			cis	-153	179.2	21.8	39.4	-15	0	0	0	119.4
6	S	30.2	Very low	31.1	Very low	102 Å²	102	154.8 Å²	154.8	71%	0.713	82%	0.823	S	S	*	*			trans	65.7	128.3	140.1	65.7	0	0	0	0	123.1
7	F	24.6	Very low	31.2	Very low	187 Å²	187	149.2 Å²	149.2	82%	0.82	81%	0.811	S	S	*	*				-158.6	135.3	120.6	-132.6	-99.6	0	0	0	112.7
8	L	28.7	Very low	32.1	Very low	163 Å²	163	147.4 Å²	147.4	85%	0.853	81%	0.806	S	S	*	*			trans	-119.2	124.5	178	-123.5	165.7	0	0	0	106.2
9	Q	26	Very low	32.7	Very low	174 Å²	174	145.5 Å²	145.5	81%	0.813	80%	0.803	S	S	*	*			trans	-151.6	137.2	158.7	-148.5	161.3	-2.1	0	0	113.2
10	K	27.4	Very low	33.6	Very low	186 Å²	186	143.4 Å²	143.4	81%	0.809	79%	0.794	S	S	*	*			trans	-69.8	160.4	-174	-70.1	165	167.8	174.1	0	115.1
11	L	26.2	Very low	34.2	Very low	175 Å²	175	145.1 Å²	145.1	92%	0.916	79%	0.789	S	S	*	*			trans	140.4	133.4	141.7	-83.6	138.4	0	0	0	107.6
12	S	26.9	Very low	34.9	Very low	92 Å²	92	143.8 Å²	143.8	64%	0.643	77%	0.774	S	S	*	*			cis	-178.9	138.9	-2.5	160.9	0	0	0	0	108.4
13	M	29.6	Very low	36	Very low	186 Å²	186	141.1 Å²	141.1	92%	0.916	77%	0.765	S	S	*	*			trans	29	122	150.9	-67.7	171.6	148.4	0	0	121.7
14	A	27.8	Very low	37.2	Very low	108 Å²	108	143.2 Å²	143.2	89%	0.893	76%	0.76	S	S	*	*				-169.6	135.1	112.8	0	0	0	0	0	112.6
15	R	35.1	Very low	38.3	Very low	231 Å²	231	145.2 Å²	145.2	87%	0.872	75%	0.753	S	S	*	*			trans	-131	166.5	164.8	-104.9	-172	-175.2	-172.5	3	105.9
16	P	45.6	Very low	38.3	Very low	110 Å²	110	145.7 Å²	145.7	71%	0.714	75%	0.749	S	S	*	*			cis	-139.5	172	-6.2	31.8	-10	0	0	0	114.8
17	G	33	Very low	39.3	Very low	60 Å²	60	146 Å²	146	62%	0.619	74%	0.742	S	S	*	*			trans	-130.3	112.9	162.6	0	0	0	0	0	110.5	C19	G17-C19 VanDerWaalsContact C-N 3.3Å; G17-C19 PolarHBondContact O-N 3.46Å
18	V	47.8	Very low	40.5	Very low	117 Å²	117	139.6 Å²	139.6	71%	0.709	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-1.1	-164.3	172.2	0	0	0	0	114.7
19	C	43.5	Very low	41.4	Very low	112 Å²	112	134 Å²	134	76%	0.757	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-21.6	-179.1	-86.4	0	0	0	0	115.3	G17	G17-C19 VanDerWaalsContact C-N 3.3Å; G17-C19 PolarHBondContact O-N 3.46Å
20	V	50	Low	42.4	Very low	103 Å²	103	130.5 Å²	130.5	62%	0.624	69%	0.688	S	S	*	*	H	α-helix	trans	-78.3	-28.1	-175.4	-175.2	0	0	0	0	111.9	R22 F24	V20-R22 PolarHBondContact O-N 3.19Å; V20-F24 PolarHBondContact O-N 3.05Å
21	W	46.8	Very low	43.1	Very low	180 Å²	180	125.4 Å²	125.4	68%	0.682	67%	0.672	S	S	*	*	H	α-helix	trans	-72.6	-28	-177.1	-105.5	65.5	0	0	0	114.3	W25	W21-W25 AromaticContact CE3-CD1 3.91Å; W21-W25 AromaticContact CZ3-NE1 3.71Å; W21-W25 PolarHBondContact O-N 3.09Å
22	R	45.9	Very low	43.6	Very low	198 Å²	198	121.8 Å²	121.8	75%	0.747	65%	0.654	S	S	*	*	H	α-helix	trans	-78.6	-32.6	177.6	-75.5	-172.2	176.5	-129	0.7	112.9	V20 L26	V20-R22 PolarHBondContact O-N 3.19Å; R22-L26 PolarHBondContact O-N 3.5Å; R22-L26 VanDerWaalsContact O-N 3.16Å
23	L	51.3	Low	43.8	Very low	121 Å²	121	126.5 Å²	126.5	63%	0.634	66%	0.663	S	S	*	*	H	α-helix	trans	-69.8	-39.4	173.7	-122.8	91.9	0	0	0	111.1	L26 L27	L23-L26 PolarHBondContact O-N 2.72Å; L23-L27 HydrophobicContact CD2-CD1 4.31Å; L23-L27 WeakPolarHBondContact O-CB 3.38Å; L23-L27 PolarHBondContact O-N 3.22Å
24	F	54.3	Low	43.9	Very low	159 Å²	159	121.6 Å²	121.6	70%	0.697	65%	0.652	S	S	*	*	H	α-helix	trans	-67.7	-35.5	178.2	-130.7	-92	0	0	0	112.4	V20 S28	V20-F24 PolarHBondContact O-N 3.05Å; F24-S28 WeakPolarHBondContact O-CB 3.48Å; F24-S28 PolarHBondContact O-N 3.43Å
25	W	53.5	Low	44.2	Very low	175 Å²	175	123 Å²	123	66%	0.663	64%	0.644	S	S	*	*	H	α-helix	trans	-72.5	-34.4	175.2	-103.5	88.7	0	0	0	113.7	W21 A29	W21-W25 AromaticContact CE3-CD1 3.91Å; W21-W25 AromaticContact CZ3-NE1 3.71Å; W21-W25 PolarHBondContact O-N 3.09Å; W25-A29 WeakPolarHBondContact O-CB 3.4Å; W25-A29 PolarHBondContact O-N 2.85Å
26	L	50.7	Low	44.1	Very low	121 Å²	121	119.4 Å²	119.4	63%	0.634	64%	0.641	S	S	*	*	H	α-helix	trans	-75	-35.7	175.7	-81.9	158.7	0	0	0	112.2	R22 L23 V30	R22-L26 PolarHBondContact O-N 3.5Å; R22-L26 VanDerWaalsContact O-N 3.16Å; L23-L26 PolarHBondContact O-N 2.72Å; L26-V30 WeakPolarHBondContact O-CB 3.36Å; L26-V30 WeakPolarHBondContact O-CG2 3.32Å; L26-V30 PolarHBondContact O-N 3.07Å
27	L	51.2	Low	43.2	Very low	108 Å²	108	122.3 Å²	122.3	57%	0.565	65%	0.645	S	S	*	*	H	α-helix	trans	-71.9	-37.8	172	-91.9	136.1	0	0	0	112.1	L23 V30 V31	L23-L27 HydrophobicContact CD2-CD1 4.31Å; L23-L27 WeakPolarHBondContact O-CB 3.38Å; L23-L27 PolarHBondContact O-N 3.22Å; L27-V30 PolarHBondContact O-N 3.27Å; L27-V31 VanDerWaalsContact O-CB 3.31Å; L27-V31 WeakPolarHBondContact O-CB 3.21Å; L27-V31 WeakPolarHBondContact O-CG2 3.43Å; L27-V31 PolarHBondContact O-N 2.62Å
28	S	49.1	Very low	42.9	Very low	52 Å²	52	127.6 Å²	127.6	36%	0.364	65%	0.654	S	S	.	*	H	α-helix	trans	-66.5	-43.2	172.8	-154.8	0	0	0	0	110.7	F24 V30 V31 D32	F24-S28 WeakPolarHBondContact O-CB 3.48Å; F24-S28 PolarHBondContact O-N 3.43Å; S28-V30 VanDerWaalsContact C-N 3.34Å; S28-V30 PolarHBondContact O-N 2.73Å; S28-V31 PolarHBondContact O-N 2.96Å; S28-D32 WeakPolarHBondContact O-CB 3.43Å; S28-D32 PolarHBondContact O-N 3.34Å; S28-D32 PolarHBondContact OG-OD2 3.04Å
29	A	48.8	Very low	41.8	Very low	46 Å²	46	127.7 Å²	127.7	38%	0.38	66%	0.655	S	S	.	*	H	α-helix	trans	-65.5	-33.1	177.8	0	0	0	0	0	113.3	W25 F33	W25-A29 WeakPolarHBondContact O-CB 3.4Å; W25-A29 PolarHBondContact O-N 2.85Å; A29-F33 WeakPolarHBondContact O-CB 3.49Å; A29-F33 PolarHBondContact O-N 3.34Å
30	V	45	Very low	41.2	Very low	101 Å²	101	131.9 Å²	131.9	61%	0.612	66%	0.656	S	S	*	*	H	α-helix	trans	-78.7	-32	175.9	173.2	0	0	0	0	111.9	L26 L27 S28 A34	L26-V30 WeakPolarHBondContact O-CB 3.36Å; L26-V30 WeakPolarHBondContact O-CG2 3.32Å; L26-V30 PolarHBondContact O-N 3.07Å; L27-V30 PolarHBondContact O-N 3.27Å; S28-V30 VanDerWaalsContact C-N 3.34Å; S28-V30 PolarHBondContact O-N 2.73Å; V30-A34 VanDerWaalsContact O-CB 3.23Å; V30-A34 WeakPolarHBondContact O-CB 3.27Å; V30-A34 PolarHBondContact O-N 2.86Å; V30-A34 VanDerWaalsContact O-N 3.1Å
31	V	44.1	Very low	40.4	Very low	78 Å²	78	130.3 Å²	130.3	47%	0.473	65%	0.654	S	S	.	*	H	α-helix	trans	-73.4	-36.9	172.1	173.6	0	0	0	0	110.8	L27 S28 A34 L35	L27-V31 VanDerWaalsContact O-CB 3.31Å; L27-V31 WeakPolarHBondContact O-CB 3.21Å; L27-V31 WeakPolarHBondContact O-CG2 3.43Å; L27-V31 PolarHBondContact O-N 2.62Å; S28-V31 PolarHBondContact O-N 2.96Å; V31-A34 PolarHBondContact O-N 2.77Å; V31-L35 WeakPolarHBondContact O-CB 3.36Å; V31-L35 PolarHBondContact O-N 3.41Å
32	D	34.8	Very low	40.3	Very low	100 Å²	100	124.3 Å²	124.3	54%	0.535	64%	0.639	S	S	.	*	H	α-helix	trans	-73.5	-28.9	176.7	-68.9	-36.5	0	0	0	112.1	S28	S28-D32 WeakPolarHBondContact O-CB 3.43Å; S28-D32 PolarHBondContact O-N 3.34Å; S28-D32 PolarHBondContact OG-OD2 3.04Å
33	F	32.7	Very low	41.5	Very low	190 Å²	190	121.8 Å²	121.8	83%	0.833	64%	0.635	S	S	*	*	H	α-helix	trans	-79.7	-21.9	170.7	-128	-95.1	0	0	0	113.2	A29	A29-F33 WeakPolarHBondContact O-CB 3.49Å; A29-F33 PolarHBondContact O-N 3.34Å
34	A	31	Very low	43	Very low	83 Å²	83	116.8 Å²	116.8	69%	0.686	61%	0.61	S	S	*	*	H	α-helix	trans	-91	-14.8	176.5	0	0	0	0	0	113.5	V30 V31	V30-A34 VanDerWaalsContact O-CB 3.23Å; V30-A34 WeakPolarHBondContact O-CB 3.27Å; V30-A34 PolarHBondContact O-N 2.86Å; V30-A34 VanDerWaalsContact O-N 3.1Å; V31-A34 PolarHBondContact O-N 2.77Å
35	L	33.7	Very low	44.7	Very low	139 Å²	139	109.3 Å²	109.3	73%	0.728	58%	0.577	S	S	*	*	S	Bend	trans	-106.9	10.3	178.7	-131.5	108.8	0	0	0	114.5	V31	V31-L35 WeakPolarHBondContact O-CB 3.36Å; V31-L35 PolarHBondContact O-N 3.41Å
36	L	34.1	Very low	46.5	Very low	154 Å²	154	106.9 Å²	106.9	81%	0.806	57%	0.568	S	S	*	*	S	Bend	trans	-122.8	55.7	176.4	-143.2	87.8	0	0	0	112.1
37	Q	26.7	Very low	48.4	Very low	171 Å²	171	102.5 Å²	102.5	80%	0.799	55%	0.546	S	S	*	.			trans	-147	44.5	159.5	-155.6	155.9	-13.5	0	0	112.1	T39	Q37-T39 PolarHBondContact O-N 3.27Å
38	E	25.8	Very low	50.2	Low	171 Å²	171	106.1 Å²	106.1	80%	0.799	56%	0.56	S	S	*	*			trans	-75.5	104.7	146.4	-93.4	-165.8	171.4	0	0	106.9	Y40	E38-Y40 VanDerWaalsContact C-N 3.32Å; E38-Y40 PolarHBondContact O-N 2.7Å
39	T	25.8	Very low	52.1	Low	120 Å²	120	105 Å²	105	74%	0.736	56%	0.557	S	S	*	*			trans	-69.5	96.2	173.6	-30.2	0	0	0	0	105.5	Q37 A41	Q37-T39 PolarHBondContact O-N 3.27Å; T39-A41 PolarHBondContact O-N 3.05Å
40	Y	30.6	Very low	54	Low	199 Å²	199	108.5 Å²	108.5	78%	0.78	57%	0.565	S	S	*	*			trans	-68.3	72.1	177.1	-131.8	-96	0	0	0	109.1	E38	E38-Y40 VanDerWaalsContact C-N 3.32Å; E38-Y40 PolarHBondContact O-N 2.7Å
41	A	32.1	Very low	56.3	Low	71 Å²	71	104.5 Å²	104.5	59%	0.587	54%	0.541	S	S	*	.			trans	-81.2	117.5	164.8	0	0	0	0	0	106.5	T39 H43	T39-A41 PolarHBondContact O-N 3.05Å; A41-H43 PolarHBondContact O-N 3.25Å; A41-H43 VanDerWaalsContact O-N 3.15Å
42	P	44.8	Very low	58.6	Low	54 Å²	54	101.3 Å²	101.3	35%	0.351	52%	0.521	S	S	.	.			trans	-62.1	123	179.4	23.4	-31.1	0	0	0	109.3	S44	P42-S44 PolarHBondContact O-N 3.5Å; P42-S44 PolarHBondContact O-OG 3.24Å; P42-S44 VanDerWaalsContact O-OG 3.1Å
43	H	70.8	Confident	61.5	Low	144 Å²	144	96.6 Å²	96.6	67%	0.667	50%	0.496	S	S	*	.			trans	-57	87.4	167.2	-71.2	-97.1	0	0	0	108.3	A41 W363	A41-H43 PolarHBondContact O-N 3.25Å; A41-H43 VanDerWaalsContact O-N 3.15Å; H43-W363 HydrophobicContact CB-CZ2 4.09Å; H43-W363 WeakPolarHBondContact O-CZ2 3.19Å
44	S	84.2	Confident	64.4	Low	16 Å²	16	87.5 Å²	87.5	11%	0.112	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	137.1	-175.9	59.5	0	0	0	0	108.7	P42 R46 V107 L108	P42-S44 PolarHBondContact O-N 3.5Å; P42-S44 PolarHBondContact O-OG 3.24Å; P42-S44 VanDerWaalsContact O-OG 3.1Å; S44-R46 PolarHBondContact OG-NE 2.89Å; S44-V107 WeakPolarHBondContact CA-O 3.38Å; S44-L108 VanDerWaalsContact CB-CD2 3.42Å
45	I	89.9	Confident	67.5	Low	2 Å²	2	83.6 Å²	83.6	1%	0.01	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	134.4	173.3	-59	167.7	0	0	0	107.9	L81 M85 R106 V107 R360 N361 V362 W363	I45-L81 HydrophobicContact CD1-CD1 3.84Å; I45-L81 HydrophobicContact CD1-CD2 3.78Å; I45-L81 HydrophobicContact CD1-CG 4.3Å; I45-M85 HydrophobicContact CB-CE 4.19Å; I45-M85 HydrophobicContact CD1-CE 4.07Å; I45-M85 HydrophobicContact CG2-CE 3.61Å; I45-R106 CarbonylContact O-C 3.55Å; I45-R106 VanDerWaalsContact O-CA 3.31Å; I45-R106 WeakPolarHBondContact O-CA 3.38Å; I45-V107 HydrophobicContact CB-CB 4.17Å; I45-V107 PolarHBondContact N-O 3.27Å; I45-V107 PolarHBondContact O-N 3.17Å; I45-R360 WeakPolarHBondContact CG2-O 3.47Å; I45-N361 HydrophobicContact CD1-CB 4.05Å; I45-V362 HydrophobicContact CG1-CG2 4.07Å; I45-W363 HydrophobicContact CD1-CE3 3.74Å; I45-W363 HydrophobicContact CD1-CZ3 3.56Å; I45-W363 HydrophobicContact CG1-CE3 4.1Å; I45-W363 HydrophobicContact CG1-CH2 4.5Å; I45-W363 HydrophobicContact CG1-CZ3 3.7Å
46	R	90.2	Very high	70.5	Confident	124 Å²	124	77 Å²	77	47%	0.468	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.5	176.7	-59.1	-175	-167.9	178.3	1.4	109.9	S44 A105 R106	S44-R46 PolarHBondContact OG-NE 2.89Å; R46-A105 CarbonylContact C-O 3.6Å; R46-A105 WeakPolarHBondContact CA-O 3.23Å; R46-R106 HydrophobicContact CG-CG 4.45Å
47	T	90.9	Very high	73.5	Confident	30 Å²	30	69.6 Å²	69.6	18%	0.184	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.9	170.4	55.7	0	0	0	0	108.9	M85 G104 A105	T47-M85 HydrophobicContact CG2-SD 4.48Å; T47-G104 VanDerWaalsContact O-CA 3.26Å; T47-G104 WeakPolarHBondContact O-CA 3.43Å; T47-A105 PolarHBondContact N-O 3.47Å; T47-A105 PolarHBondContact O-N 3.42Å; T47-A105 VanDerWaalsContact O-N 3.11Å; T47-A105 WeakPolarHBondContact OG1-CA 3.48Å; T47-A105 WeakPolarHBondContact OG1-CB 3.46Å; T47-A105 PolarHBondContact OG1-N 3.04Å; T47-A105 PolarHBondContact OG1-O 3.38Å
48	Q	88.6	Confident	76.6	Confident	184 Å²	184	61.8 Å²	61.8	86%	0.86	31%	0.314	S	S	*	.			trans	-76.1	139.7	-177.3	-66.9	-176.2	-7.5	0	0	110.7
49	G	88.9	Confident	79.8	Confident	29 Å²	29	53.6 Å²	53.6	30%	0.299	28%	0.276	S	S	.	.			trans	-160.5	172.1	173.3	0	0	0	0	0	110.8	L51 T102	G49-L51 VanDerWaalsContact C-N 3.3Å; G49-T102 CarbonylContact C-O 3.5Å
50	H	90.2	Very high	82.9	Confident	118 Å²	118	48.6 Å²	48.6	55%	0.546	24%	0.244	S	C	.	.	S	Bend	trans	-67.4	-33.5	174.7	-65.6	89.3	0	0	0	111.8	I101 T102 V435	H50-I101 HydrophobicContact CB-CG2 4.35Å; H50-T102 PolarHBondContact N-O 3.49Å; H50-T102 PolarHBondContact N-OG1 2.98Å; H50-T102 PolarHBondContact ND1-N 2.94Å; H50-T102 PolarHBondContact ND1-OG1 3.23Å; H50-V435 HydrophobicContact CB-CG2 3.89Å
51	L	91.7	Very high	85.5	Confident	18 Å²	18	40.2 Å²	40.2	9%	0.094	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.9	173.8	-57.9	172.4	0	0	0	109.2	G49 I101 T102 L103 G104 V153 L421 V435 M439	G49-L51 VanDerWaalsContact C-N 3.3Å; L51-I101 HydrophobicContact CD1-CG2 4Å; L51-I101 HydrophobicContact CG-CG2 4.33Å; L51-T102 PolarHBondContact N-O 3.21Å; L51-L103 HydrophobicContact CB-CD2 3.95Å; L51-L103 HydrophobicContact CD1-CD2 4.23Å; L51-L103 WeakPolarHBondContact O-CA 3.47Å; L51-G104 PolarHBondContact O-N 2.67Å; L51-V153 HydrophobicContact CB-CG2 4.42Å; L51-V153 HydrophobicContact CD2-CG1 4.23Å; L51-L421 HydrophobicContact CD1-CD1 4.08Å; L51-L421 HydrophobicContact CD1-CD2 4.18Å; L51-V435 HydrophobicContact CD1-CG2 4.2Å; L51-V435 HydrophobicContact CD2-CG1 4.15Å; L51-V435 HydrophobicContact CD2-CG2 3.93Å; L51-V435 HydrophobicContact CG-CG2 3.88Å; L51-M439 HydrophobicContact CD1-CE 3.64Å
52	T	92.7	Very high	87.9	Confident	11 Å²	11	41.4 Å²	41.4	7%	0.067	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.2	-177.8	-55.7	0	0	0	0	111.5	G104 R106 V152 V153	T52-G104 WeakPolarHBondContact CA-O 3.26Å; T52-R106 HydrophobicContact CG2-CB 4.03Å; T52-V152 WeakPolarHBondContact O-CA 3.48Å; T52-V153 PolarHBondContact O-N 2.95Å
53	L	95.6	Very high	89.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.9	171	-57.6	-172.1	0	0	0	111.1	M84 L88 L103 G104 A105 R106 V153 V414 M417	L53-M84 HydrophobicContact CB-CE 3.93Å; L53-L88 HydrophobicContact CD1-CD2 4.26Å; L53-L103 HydrophobicContact CD1-CD1 4.45Å; L53-G104 PolarHBondContact N-O 3.27Å; L53-A105 CarbonylContact O-C 3.56Å; L53-A105 WeakPolarHBondContact O-CA 3.3Å; L53-R106 PolarHBondContact O-N 3.47Å; L53-V153 HydrophobicContact CD2-CG2 3.6Å; L53-V414 HydrophobicContact CD1-CG1 4.48Å; L53-M417 HydrophobicContact CD1-CB 4.42Å; L53-M417 HydrophobicContact CD1-CG 4.04Å; L53-M417 HydrophobicContact CD2-CG 3.69Å
54	G	95.3	Very high	89.9	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	140.8	170	0	0	0	0	0	110.3	R106 V152 G154 V155 I156	G54-R106 CarbonylContact C-O 3.49Å; G54-R106 WeakPolarHBondContact CA-O 3.25Å; G54-V152 VanDerWaalsContact N-CG1 3.35Å; G54-G154 PolarHBondContact N-O 2.97Å; G54-V155 CarbonylContact O-C 3.29Å; G54-V155 WeakPolarHBondContact O-CA 2.88Å; G54-I156 PolarHBondContact O-N 2.67Å
55	G	96	Very high	89.3	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132	173.2	0	0	0	0	0	111.2	R106 V107 L108 I156	G55-R106 PolarHBondContact N-O 3.05Å; G55-V107 WeakPolarHBondContact O-CA 3.33Å; G55-L108 PolarHBondContact O-N 3Å; G55-I156 WeakPolarHBondContact CA-O 3.45Å
56	L	96.2	Very high	88.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	104.6	176.6	-71.1	172.8	0	0	0	110.1	L108 T110 F124 V155 I156 A158 V167 Y181	L56-L108 HydrophobicContact CD2-CB 4.07Å; L56-T110 HydrophobicContact CB-CG2 3.78Å; L56-T110 HydrophobicContact CD2-CG2 4Å; L56-T110 HydrophobicContact CG-CG2 4.43Å; L56-F124 HydrophobicContact CD1-CE2 4.13Å; L56-F124 HydrophobicContact CD2-CE2 3.8Å; L56-F124 HydrophobicContact CD2-CZ 4.1Å; L56-F124 HydrophobicContact CG-CE2 3.81Å; L56-F124 HydrophobicContact CG-CZ 4.24Å; L56-V155 HydrophobicContact CD1-CG1 3.84Å; L56-V155 HydrophobicContact CG-CG1 4.14Å; L56-I156 PolarHBondContact N-O 2.95Å; L56-A158 HydrophobicContact CB-CB 4.11Å; L56-A158 HydrophobicContact CD1-CB 4.41Å; L56-V167 HydrophobicContact CD1-CB 4.37Å; L56-V167 HydrophobicContact CD1-CG1 3.67Å; L56-V167 HydrophobicContact CD1-CG2 4Å; L56-Y181 PolarHBondContact O-OH 3.2Å
57	F	95.6	Very high	88.3	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	147.8	-178.9	-61.7	-86.1	0	0	0	111.3	V59 R80 L81 M84 V107 L108 D109 T110 Y181 V410	F57-V59 VanDerWaalsContact C-N 3.31Å; F57-V59 HydrophobicContact CB-CG2 4.37Å; F57-V59 PolarHBondContact O-N 2.88Å; F57-V59 VanDerWaalsContact O-N 3.14Å; F57-R80 HydrophobicContact CD1-CB 3.74Å; F57-R80 HydrophobicContact CE1-CB 4.05Å; F57-R80 VanDerWaalsContact CE1-O 3.28Å; F57-R80 WeakPolarHBondContact CE1-O 3.22Å; F57-L81 HydrophobicContact CB-CB 4.31Å; F57-L81 HydrophobicContact CD1-CB 4.46Å; F57-L81 HydrophobicContact CD2-CB 4.2Å; F57-L81 HydrophobicContact CD2-CG 4.34Å; F57-L81 HydrophobicContact CG-CB 4.05Å; F57-M84 HydrophobicContact CE2-CB 4.16Å; F57-M84 HydrophobicContact CE2-CG 4.5Å; F57-M84 HydrophobicContact CE2-SD 3.53Å; F57-M84 VanDerWaalsContact CE2-SD 3.53Å; F57-M84 HydrophobicContact CZ-CB 3.67Å; F57-M84 HydrophobicContact CZ-CG 4.29Å; F57-M84 HydrophobicContact CZ-SD 3.69Å; F57-V107 HydrophobicContact CD2-CG1 3.51Å; F57-V107 HydrophobicContact CE2-CG1 3.98Å; F57-V107 HydrophobicContact CE2-CG2 4.5Å; F57-L108 PolarHBondContact N-O 3.29Å; F57-D109 WeakPolarHBondContact O-CA 3.42Å; F57-D109 VanDerWaalsContact O-OD1 3.11Å; F57-T110 VanDerWaalsContact C-OG1 3.31Å; F57-T110 PolarHBondContact O-N 3.5Å; F57-T110 PolarHBondContact O-OG1 3.42Å; F57-Y181 AromaticContact CD1-CE1 3.96Å; F57-Y181 HydrophobicContact CD1-CE1 3.96Å; F57-Y181 AromaticContact CD1-CZ 3.76Å; F57-Y181 WeakPolarHBondContact CD1-OH 3.49Å; F57-Y181 HydrophobicContact CE1-CD1 4.39Å; F57-Y181 AromaticContact CE1-CE1 3.6Å; F57-Y181 HydrophobicContact CE1-CE1 3.6Å; F57-Y181 AromaticContact CE1-CZ 3.81Å; F57-Y181 HydrophobicContact CZ-CE1 4.3Å; F57-V410 HydrophobicContact CE1-CG1 3.96Å; F57-V410 HydrophobicContact CE1-CG2 4.25Å; F57-V410 HydrophobicContact CZ-CG1 4.13Å
58	P	93.3	Very high	87.6	Confident	6 Å²	6	46.6 Å²	46.6	4%	0.039	27%	0.273	C	S	.	.			trans	-85	75	173.6	34.6	-33	0	0	0	109.5	H60 G77 T110	P58-H60 VanDerWaalsContact C-N 3.26Å; P58-H60 PolarHBondContact O-N 3.44Å; P58-G77 WeakPolarHBondContact O-CA 3.46Å; P58-T110 WeakPolarHBondContact CA-OG1 3.43Å
59	V	93.1	Very high	87.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.243	C	C	.	.			trans	-64.4	-39.2	-179.9	-177.2	0	0	0	0	109.6	F57 L72 K73 I78 L81 D109 W363	F57-V59 VanDerWaalsContact C-N 3.31Å; F57-V59 HydrophobicContact CB-CG2 4.37Å; F57-V59 PolarHBondContact O-N 2.88Å; F57-V59 VanDerWaalsContact O-N 3.14Å; V59-L72 HydrophobicContact CG1-CD1 4.33Å; V59-K73 PolarHBondContact O-N 3.44Å; V59-I78 HydrophobicContact CG1-CD1 3.68Å; V59-I78 HydrophobicContact CG1-CG1 4.47Å; V59-L81 HydrophobicContact CG2-CD1 3.76Å; V59-D109 HydrophobicContact CB-CB 4.25Å; V59-D109 HydrophobicContact CG2-CB 4.26Å; V59-D109 PolarHBondContact N-OD1 3.06Å; V59-W363 HydrophobicContact CG1-CB 3.95Å; V59-W363 HydrophobicContact CG1-CD2 3.99Å; V59-W363 HydrophobicContact CG1-CE3 4.37Å; V59-W363 HydrophobicContact CG1-CG 3.81Å; V59-W363 HydrophobicContact CG2-CD2 4.32Å; V59-W363 HydrophobicContact CG2-CE3 4.01Å; V59-W363 HydrophobicContact CG2-CZ3 4.16Å
60	H	90.5	Very high	87.5	Confident	15 Å²	15	39 Å²	39	7%	0.069	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	157.5	174.3	-62.4	91.2	0	0	0	113.6	P58 C69 G70 D71 D109 C111 S112 W363 E366	P58-H60 VanDerWaalsContact C-N 3.26Å; P58-H60 PolarHBondContact O-N 3.44Å; H60-C69 HydrophobicContact CB-CB 3.85Å; H60-G70 PolarHBondContact CD2-O 2.92Å; H60-D71 WeakPolarHBondContact CA-O 3.26Å; H60-D109 IonicContact CE1-OD2 3.51Å; H60-D109 IonicContact CG-OD2 3.72Å; H60-D109 PolarHBondContact N-OD1 2.86Å; H60-D109 PolarHBondContact N-OD2 3.1Å; H60-D109 IonicContact ND1-OD2 3.25Å; H60-D109 PolarHBondContact ND1-OD2 3.02Å; H60-C111 CarbonylContact O-C 3.6Å; H60-C111 WeakPolarHBondContact O-CA 3.4Å; H60-S112 PolarHBondContact O-OG 2.79Å; H60-S112 VanDerWaalsContact O-OG 3.09Å; H60-W363 AromaticContact CE1-CD1 3.71Å; H60-W363 AromaticContact CE1-NE1 3.92Å; H60-E366 IonicContact CD2-OE1 2.73Å; H60-E366 IonicContact CE1-OE2 3.89Å; H60-E366 IonicContact NE2-OE1 3.15Å; H60-E366 PolarHBondContact NE2-OE1 3.45Å; H60-E366 VanDerWaalsContact NE2-OE1 3.16Å; H60-E366 IonicContact NE2-OE2 3.16Å; H60-E366 PolarHBondContact NE2-OE2 2.66Å
61	S	85	Confident	87.4	Confident	23 Å²	23	39.5 Å²	39.5	16%	0.161	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	172.2	164.2	67.1	0	0	0	0	111.2	G63 G70 D71 C111	S61-G63 PolarHBondContact O-N 2.98Å; S61-G70 PolarHBondContact O-N 3.25Å; S61-D71 WeakPolarHBondContact CB-O 3.37Å; S61-D71 PolarHBondContact N-O 3.47Å; S61-D71 PolarHBondContact OG-N 3.46Å; S61-D71 PolarHBondContact OG-O 2.78Å; S61-D71 VanDerWaalsContact OG-O 3.06Å; S61-C111 CarbonylContact C-O 3.36Å
62	R	82.1	Confident	87.3	Confident	96 Å²	96	39.5 Å²	39.5	36%	0.362	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	128.5	177.7	-176.9	-175.5	-176.4	166.1	10.5	109.3	C111 H260 N261	R62-C111 WeakPolarHBondContact CA-O 3.5Å; R62-H260 PolarHBondContact NH1-CD2 2.77Å; R62-H260 VanDerWaalsContact NH1-CD2 3.26Å; R62-H260 PolarHBondContact NH1-NE2 3.47Å; R62-H260 PolarHBondContact NH2-NE2 3.23Å; R62-N261 PolarHBondContact NH1-OD1 3.29Å
63	G	80.7	Confident	87	Confident	7 Å²	7	41.3 Å²	41.3	7%	0.072	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-73.4	154.3	176.8	0	0	0	0	0	113.2	S61 C69	S61-G63 PolarHBondContact O-N 2.98Å; G63-C69 VanDerWaalsContact CA-C 3.46Å
64	P	77.4	Confident	86.6	Confident	98 Å²	98	44.7 Å²	44.7	64%	0.636	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-62.9	167.3	169.1	26.7	-33.7	0	0	0	111.9	G66 T67	P64-G66 PolarHBondContact O-N 3.47Å; P64-G66 VanDerWaalsContact O-N 3.11Å; P64-T67 VanDerWaalsContact CD-OG1 3.3Å; P64-T67 WeakPolarHBondContact CD-OG1 3.43Å; P64-T67 PolarHBondContact O-N 3.45Å; P64-T67 VanDerWaalsContact O-O 3.14Å; P64-T67 PolarHBondContact O-OG1 3.04Å
65	D	72.4	Confident	86.1	Confident	162 Å²	162	49.5 Å²	49.5	87%	0.866	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	118	-176.6	-69.9	-31.3	0	0	0	112
66	G	74.5	Confident	85.5	Confident	84 Å²	84	51 Å²	51	87%	0.866	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	107	-19.6	-178.9	0	0	0	0	0	115	P64	P64-G66 PolarHBondContact O-N 3.47Å; P64-G66 VanDerWaalsContact O-N 3.11Å
67	T	82.8	Confident	85.2	Confident	65 Å²	65	51 Å²	51	40%	0.399	30%	0.298	S	S	.	.			trans	-114.9	132.4	175.6	47.9	0	0	0	0	111	P64	P64-T67 VanDerWaalsContact CD-OG1 3.3Å; P64-T67 WeakPolarHBondContact CD-OG1 3.43Å; P64-T67 PolarHBondContact O-N 3.45Å; P64-T67 VanDerWaalsContact O-O 3.14Å; P64-T67 PolarHBondContact O-OG1 3.04Å
68	P	77.9	Confident	85.2	Confident	62 Å²	62	51 Å²	51	40%	0.403	30%	0.298	S	S	.	.	S	Bend	trans	-69	-35.2	-176.1	25.3	-32.2	0	0	0	113.1	Y116	P68-Y116 HydrophobicContact CB-CD2 3.6Å; P68-Y116 HydrophobicContact CB-CE2 3.74Å; P68-Y116 HydrophobicContact CB-CG 4.27Å; P68-Y116 HydrophobicContact CG-CE2 4.21Å
69	C	87.6	Confident	85.2	Confident	34 Å²	34	51.1 Å²	51.1	23%	0.23	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	145.8	-170.6	-47.9	0	0	0	0	110.1	H60 G63 C111	H60-C69 HydrophobicContact CB-CB 3.85Å; G63-C69 VanDerWaalsContact CA-C 3.46Å; C69-C111 HydrophobicContact CB-CB 3.72Å; C69-C111 WeakPolarHBondContact CB-SG 3.23Å; C69-C111 WeakPolarHBondContact SG-CB 3.3Å; C69-C111 CovalentContact SG-SG 2.01Å; C69-C111 PolarHBondContact SG-SG 3.34Å
70	G	87.3	Confident	85.3	Confident	21 Å²	21	51.6 Å²	51.6	22%	0.216	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-147.2	175.7	0	0	0	0	0	111.4	H60 S61	H60-G70 PolarHBondContact CD2-O 2.92Å; S61-G70 PolarHBondContact O-N 3.25Å
71	D	87.1	Confident	85.6	Confident	128 Å²	128	50.9 Å²	50.9	68%	0.684	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	151.6	-177.6	-53.5	-35.9	0	0	0	113.4	H60 S61	H60-D71 WeakPolarHBondContact CA-O 3.26Å; S61-D71 WeakPolarHBondContact CB-O 3.37Å; S61-D71 PolarHBondContact N-O 3.47Å; S61-D71 PolarHBondContact OG-N 3.46Å; S61-D71 PolarHBondContact OG-O 2.78Å; S61-D71 VanDerWaalsContact OG-O 3.06Å
72	L	89.4	Confident	86.1	Confident	17 Å²	17	49.8 Å²	49.8	9%	0.089	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	135	-178.9	-179.3	140.1	0	0	0	112.5	V59 K74 I78 E366 F367	V59-L72 HydrophobicContact CG1-CD1 4.33Å; L72-K74 HydrophobicContact CD2-CG 4.14Å; L72-K74 PolarHBondContact O-N 2.78Å; L72-I78 HydrophobicContact CD1-CD1 4.2Å; L72-I78 HydrophobicContact CD1-CG1 4.22Å; L72-I78 HydrophobicContact CD2-CG1 4.01Å; L72-I78 HydrophobicContact CG-CG1 4.29Å; L72-E366 HydrophobicContact CD1-CB 4.01Å; L72-E366 HydrophobicContact CD1-CG 3.78Å; L72-F367 HydrophobicContact CD1-CB 4.32Å; L72-F367 HydrophobicContact CD2-CB 4.14Å; L72-F367 HydrophobicContact CD2-CD2 4.11Å
73	K	87.8	Confident	86.8	Confident	49 Å²	49	45.2 Å²	45.2	21%	0.213	27%	0.272	C	S	.	.			trans	-94.1	94.7	178.2	-71.2	-176.9	168.3	178.7	0	110.9	V59 N76 G77 I78 S112	V59-K73 PolarHBondContact O-N 3.44Å; K73-N76 HydrophobicContact CB-CB 4.38Å; K73-N76 HydrophobicContact CD-CB 4.38Å; K73-G77 WeakPolarHBondContact O-CA 3.29Å; K73-G77 PolarHBondContact O-N 3.37Å; K73-I78 PolarHBondContact O-N 3.46Å; K73-S112 PolarHBondContact NZ-OG 3.39Å
74	K	86.9	Confident	87.6	Confident	72 Å²	72	44.9 Å²	44.9	31%	0.313	27%	0.268	S	S	.	.	I	π-helix	trans	-51.5	-60.8	179.1	-61.8	177.4	-174.9	176.8	0	112.8	L72 I78 Q79 F367 E370	L72-K74 HydrophobicContact CD2-CG 4.14Å; L72-K74 PolarHBondContact O-N 2.78Å; K74-I78 PolarHBondContact O-N 3.27Å; K74-Q79 PolarHBondContact O-N 3Å; K74-F367 HydrophobicContact CB-CD2 4.37Å; K74-F367 HydrophobicContact CB-CE2 4.05Å; K74-F367 HydrophobicContact CG-CD2 4.24Å; K74-F367 HydrophobicContact CG-CE2 4.19Å; K74-E370 WeakPolarHBondContact CE-O 3.27Å; K74-E370 PolarHBondContact NZ-O 3.19Å
75	E	84.1	Confident	88.5	Confident	100 Å²	100	40.2 Å²	40.2	47%	0.467	24%	0.238	S	C	.	.	I	π-helix	trans	-80.9	-58.8	-176.1	-63.9	172.2	-166.9	0	0	111.4	G77 Q79 E404	E75-G77 PolarHBondContact O-N 3.1Å; E75-Q79 WeakPolarHBondContact O-CB 3.23Å; E75-E404 HydrophobicContact CB-CB 4.28Å; E75-E404 HydrophobicContact CB-CG 4.22Å
76	N	83.9	Confident	89.7	Confident	33 Å²	33	33.8 Å²	33.8	18%	0.176	20%	0.202	C	C	.	.	I	π-helix	trans	-70.1	-15	-172.7	-75.3	-49.2	0	0	0	114.8	K73 R80	K73-N76 HydrophobicContact CB-CB 4.38Å; K73-N76 HydrophobicContact CD-CB 4.38Å; N76-R80 VanDerWaalsContact O-CD 3.27Å; N76-R80 WeakPolarHBondContact O-CD 3.48Å; N76-R80 PolarHBondContact O-NH1 3.39Å; N76-R80 PolarHBondContact OD1-NH2 3.3Å
77	G	90.6	Very high	90.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.161	C	C	.	.	I	π-helix	trans	-113.1	-72.3	-177.1	0	0	0	0	0	112	P58 K73 E75 R80 L81	P58-G77 WeakPolarHBondContact O-CA 3.46Å; K73-G77 WeakPolarHBondContact O-CA 3.29Å; K73-G77 PolarHBondContact O-N 3.37Å; E75-G77 PolarHBondContact O-N 3.1Å; G77-R80 PolarHBondContact O-N 3.2Å; G77-L81 PolarHBondContact O-N 3.49Å
78	I	93.9	Very high	91.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	I	π-helix	trans	-65.6	-45.8	-170.9	-63.4	-67.5	0	0	0	112.5	V59 L72 K73 K74 R80 L81 E82 F350 W363 F367	V59-I78 HydrophobicContact CG1-CD1 3.68Å; V59-I78 HydrophobicContact CG1-CG1 4.47Å; L72-I78 HydrophobicContact CD1-CD1 4.2Å; L72-I78 HydrophobicContact CD1-CG1 4.22Å; L72-I78 HydrophobicContact CD2-CG1 4.01Å; L72-I78 HydrophobicContact CG-CG1 4.29Å; K73-I78 PolarHBondContact O-N 3.46Å; K74-I78 PolarHBondContact O-N 3.27Å; I78-R80 VanDerWaalsContact C-N 3.28Å; I78-R80 PolarHBondContact O-N 3.15Å; I78-L81 PolarHBondContact O-N 3.11Å; I78-E82 HydrophobicContact CG2-CG 4.24Å; I78-E82 WeakPolarHBondContact O-CB 3.21Å; I78-E82 WeakPolarHBondContact O-CG 3.4Å; I78-E82 PolarHBondContact O-N 3.37Å; I78-F350 HydrophobicContact CG2-CE2 4.23Å; I78-F350 HydrophobicContact CG2-CZ 4.35Å; I78-W363 HydrophobicContact CD1-CB 3.93Å; I78-F367 HydrophobicContact CB-CD2 4.12Å; I78-F367 HydrophobicContact CB-CG 4.47Å; I78-F367 HydrophobicContact CD1-CB 4.44Å; I78-F367 HydrophobicContact CG1-CB 4.09Å; I78-F367 HydrophobicContact CG1-CD2 4.08Å; I78-F367 HydrophobicContact CG1-CG 4.29Å; I78-F367 HydrophobicContact CG2-CB 4.4Å; I78-F367 HydrophobicContact CG2-CD1 4.4Å; I78-F367 HydrophobicContact CG2-CD2 4.02Å; I78-F367 HydrophobicContact CG2-CE2 4.44Å; I78-F367 HydrophobicContact CG2-CG 3.99Å
79	Q	95.1	Very high	92.2	Very high	8 Å²	8	26.2 Å²	26.2	4%	0.037	14%	0.135	C	C	.	.	I	π-helix	trans	-60.4	-39.6	177.5	-64.1	-172.4	15.3	0	0	111.9	K74 E75 E82 A83 F346 F350 E402 V407	K74-Q79 PolarHBondContact O-N 3Å; E75-Q79 WeakPolarHBondContact O-CB 3.23Å; Q79-E82 PolarHBondContact O-N 3.49Å; Q79-A83 WeakPolarHBondContact O-CB 3.34Å; Q79-A83 PolarHBondContact O-N 3.39Å; Q79-F346 HydrophobicContact CB-CE1 4.46Å; Q79-F346 HydrophobicContact CB-CZ 4.42Å; Q79-F346 VanDerWaalsContact O-CZ 3.32Å; Q79-F346 WeakPolarHBondContact O-CZ 3.2Å; Q79-F350 HydrophobicContact CB-CE2 4.45Å; Q79-F350 HydrophobicContact CG-CE1 4.13Å; Q79-F350 HydrophobicContact CG-CE2 3.97Å; Q79-F350 HydrophobicContact CG-CZ 3.74Å; Q79-E402 PolarHBondContact NE2-O 3.45Å; Q79-E402 PolarHBondContact OE1-O 3.18Å; Q79-V407 HydrophobicContact CB-CG2 4.32Å
80	R	95.2	Very high	92.6	Very high	9 Å²	9	27.8 Å²	27.8	3%	0.034	14%	0.139	C	C	.	.	H	α-helix	trans	-67.1	-40.7	177.7	-63	-168.3	-175.2	140.9	-3.9	112.5	F57 N76 G77 I78 A83 M84 S159 E404 V410	F57-R80 HydrophobicContact CD1-CB 3.74Å; F57-R80 HydrophobicContact CE1-CB 4.05Å; F57-R80 VanDerWaalsContact CE1-O 3.28Å; F57-R80 WeakPolarHBondContact CE1-O 3.22Å; N76-R80 VanDerWaalsContact O-CD 3.27Å; N76-R80 WeakPolarHBondContact O-CD 3.48Å; N76-R80 PolarHBondContact O-NH1 3.39Å; N76-R80 PolarHBondContact OD1-NH2 3.3Å; G77-R80 PolarHBondContact O-N 3.2Å; I78-R80 VanDerWaalsContact C-N 3.28Å; I78-R80 PolarHBondContact O-N 3.15Å; R80-A83 WeakPolarHBondContact O-CB 3.27Å; R80-A83 PolarHBondContact O-N 3.43Å; R80-M84 PolarHBondContact O-N 3.5Å; R80-S159 PolarHBondContact NH1-OG 3.14Å; R80-E404 IonicContact CZ-OE1 3.66Å; R80-E404 IonicContact CZ-OE2 2.71Å; R80-E404 IonicContact NE-OE1 3.83Å; R80-E404 IonicContact NE-OE2 3.95Å; R80-E404 PolarHBondContact NE-OE2 3.12Å; R80-E404 IonicContact NH2-OE1 3.23Å; R80-E404 PolarHBondContact NH2-OE1 2.99Å; R80-E404 IonicContact NH2-OE2 3.21Å; R80-E404 PolarHBondContact NH2-OE2 2.8Å; R80-V410 HydrophobicContact CB-CG2 4.09Å; R80-V410 HydrophobicContact CG-CG2 4.36Å
81	L	95.8	Very high	93.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-48.5	175	-179.9	159.4	0	0	0	110.6	I45 F57 V59 G77 I78 A83 M84 M85 V107 W363	I45-L81 HydrophobicContact CD1-CD1 3.84Å; I45-L81 HydrophobicContact CD1-CD2 3.78Å; I45-L81 HydrophobicContact CD1-CG 4.3Å; F57-L81 HydrophobicContact CB-CB 4.31Å; F57-L81 HydrophobicContact CD1-CB 4.46Å; F57-L81 HydrophobicContact CD2-CB 4.2Å; F57-L81 HydrophobicContact CD2-CG 4.34Å; F57-L81 HydrophobicContact CG-CB 4.05Å; V59-L81 HydrophobicContact CG2-CD1 3.76Å; G77-L81 PolarHBondContact O-N 3.49Å; I78-L81 PolarHBondContact O-N 3.11Å; L81-A83 VanDerWaalsContact C-N 3.25Å; L81-A83 PolarHBondContact O-N 3.39Å; L81-M84 WeakPolarHBondContact O-CB 3.25Å; L81-M84 PolarHBondContact O-N 2.84Å; L81-M84 VanDerWaalsContact O-N 3.16Å; L81-M85 HydrophobicContact CD2-CE 4.14Å; L81-M85 HydrophobicContact CD2-CG 4.17Å; L81-M85 PolarHBondContact O-N 3.05Å; L81-V107 HydrophobicContact CD1-CG1 3.86Å; L81-V107 HydrophobicContact CG-CG1 4.09Å; L81-W363 HydrophobicContact CD1-CE3 3.72Å; L81-W363 HydrophobicContact CD1-CZ3 3.69Å
82	E	96.3	Very high	93.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-65.1	-29.2	178	-74.2	-60.6	157.6	0	0	112.2	I78 Q79 M84 M85 Y86 F346 Y349 F350 L353 N358 N361	I78-E82 HydrophobicContact CG2-CG 4.24Å; I78-E82 WeakPolarHBondContact O-CB 3.21Å; I78-E82 WeakPolarHBondContact O-CG 3.4Å; I78-E82 PolarHBondContact O-N 3.37Å; Q79-E82 PolarHBondContact O-N 3.49Å; E82-M84 VanDerWaalsContact C-N 3.33Å; E82-M84 PolarHBondContact O-N 3.3Å; E82-M85 PolarHBondContact O-N 3.08Å; E82-Y86 WeakPolarHBondContact O-CB 3.49Å; E82-Y86 PolarHBondContact O-N 3.01Å; E82-F346 HydrophobicContact CB-CE2 4.3Å; E82-F346 HydrophobicContact CB-CZ 4.34Å; E82-Y349 HydrophobicContact CB-CE1 4.23Å; E82-Y349 PolarHBondContact OE2-OH 3.06Å; E82-F350 HydrophobicContact CB-CD2 4Å; E82-F350 HydrophobicContact CB-CE2 4.04Å; E82-F350 HydrophobicContact CG-CD2 4.29Å; E82-F350 HydrophobicContact CG-CE2 3.99Å; E82-L353 HydrophobicContact CG-CD1 4.17Å; E82-N358 PolarHBondContact OE1-ND2 3.19Å; E82-N361 VanDerWaalsContact OE1-CB 3.32Å; E82-N361 WeakPolarHBondContact OE1-CB 3.4Å; E82-N361 PolarHBondContact OE1-ND2 3.39Å
83	A	96.9	Very high	93.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.4	-37.6	173.1	0	0	0	0	0	112.4	Q79 R80 L81 A87 F346 V407 V410 I411	Q79-A83 WeakPolarHBondContact O-CB 3.34Å; Q79-A83 PolarHBondContact O-N 3.39Å; R80-A83 WeakPolarHBondContact O-CB 3.27Å; R80-A83 PolarHBondContact O-N 3.43Å; L81-A83 VanDerWaalsContact C-N 3.25Å; L81-A83 PolarHBondContact O-N 3.39Å; A83-A87 WeakPolarHBondContact O-CB 3.47Å; A83-A87 PolarHBondContact O-N 3.15Å; A83-F346 VanDerWaalsContact CA-CE2 3.42Å; A83-F346 HydrophobicContact CB-CD2 4.32Å; A83-F346 HydrophobicContact CB-CE2 3.85Å; A83-F346 HydrophobicContact CB-CZ 4.12Å; A83-V407 HydrophobicContact CB-CB 4.41Å; A83-V407 HydrophobicContact CB-CG1 3.92Å; A83-V407 HydrophobicContact CB-CG2 4.3Å; A83-V410 HydrophobicContact CB-CB 4.15Å; A83-V410 HydrophobicContact CB-CG1 4.09Å; A83-I411 HydrophobicContact CB-CG1 4.21Å
84	M	97.1	Very high	94.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-41.4	171.7	175.8	175.5	-179	0	0	111.4	L53 F57 R80 L81 E82 A87 L88 A105 V107 I156 V410 V414	L53-M84 HydrophobicContact CB-CE 3.93Å; F57-M84 HydrophobicContact CE2-CB 4.16Å; F57-M84 HydrophobicContact CE2-CG 4.5Å; F57-M84 HydrophobicContact CE2-SD 3.53Å; F57-M84 VanDerWaalsContact CE2-SD 3.53Å; F57-M84 HydrophobicContact CZ-CB 3.67Å; F57-M84 HydrophobicContact CZ-CG 4.29Å; F57-M84 HydrophobicContact CZ-SD 3.69Å; R80-M84 PolarHBondContact O-N 3.5Å; L81-M84 WeakPolarHBondContact O-CB 3.25Å; L81-M84 PolarHBondContact O-N 2.84Å; L81-M84 VanDerWaalsContact O-N 3.16Å; E82-M84 VanDerWaalsContact C-N 3.33Å; E82-M84 PolarHBondContact O-N 3.3Å; M84-A87 PolarHBondContact O-N 3.05Å; M84-L88 HydrophobicContact CE-CD1 4.19Å; M84-L88 HydrophobicContact CG-CD1 4.07Å; M84-L88 VanDerWaalsContact O-CG 3.26Å; M84-L88 WeakPolarHBondContact O-CG 3.29Å; M84-L88 PolarHBondContact O-N 3.23Å; M84-A105 HydrophobicContact CE-CB 3.83Å; M84-V107 HydrophobicContact SD-CG2 4.16Å; M84-I156 HydrophobicContact CE-CG1 4.46Å; M84-I156 HydrophobicContact SD-CB 4.44Å; M84-V410 HydrophobicContact CB-CG1 4Å; M84-V414 HydrophobicContact CB-CG2 4.26Å; M84-V414 HydrophobicContact CG-CG2 3.87Å
85	M	96.2	Very high	94.3	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-65	-44.4	178.3	-61.8	-61.3	173	0	0	111.9	I45 T47 L81 E82 L88 D89 V107	I45-M85 HydrophobicContact CB-CE 4.19Å; I45-M85 HydrophobicContact CD1-CE 4.07Å; I45-M85 HydrophobicContact CG2-CE 3.61Å; T47-M85 HydrophobicContact CG2-SD 4.48Å; L81-M85 HydrophobicContact CD2-CE 4.14Å; L81-M85 HydrophobicContact CD2-CG 4.17Å; L81-M85 PolarHBondContact O-N 3.05Å; E82-M85 PolarHBondContact O-N 3.08Å; M85-L88 PolarHBondContact O-N 3.22Å; M85-D89 VanDerWaalsContact O-CG 3.25Å; M85-D89 PolarHBondContact O-N 3.06Å; M85-V107 HydrophobicContact CE-CB 4.26Å; M85-V107 HydrophobicContact CE-CG2 3.51Å
86	Y	96.4	Very high	94.7	Very high	27 Å²	27	38.2 Å²	38.2	11%	0.106	18%	0.184	C	C	.	.	H	α-helix	trans	-56.9	-49.9	172.9	170.8	-102.6	0	0	0	111.5	E82 L88 D89 Q90 F346 Y349 I411	E82-Y86 WeakPolarHBondContact O-CB 3.49Å; E82-Y86 PolarHBondContact O-N 3.01Å; Y86-L88 VanDerWaalsContact C-N 3.32Å; Y86-L88 PolarHBondContact O-N 3.26Å; Y86-D89 PolarHBondContact O-N 3.05Å; Y86-Q90 HydrophobicContact CD1-CG 4.4Å; Y86-Q90 HydrophobicContact CD2-CG 4.28Å; Y86-Q90 HydrophobicContact CE1-CG 3.98Å; Y86-Q90 HydrophobicContact CE2-CG 3.86Å; Y86-Q90 WeakPolarHBondContact O-CG 3.09Å; Y86-Q90 PolarHBondContact O-N 3.49Å; Y86-F346 HydrophobicContact CD1-CB 4.38Å; Y86-F346 HydrophobicContact CD1-CD2 4.02Å; Y86-F346 HydrophobicContact CE1-CB 4.32Å; Y86-F346 AromaticContact CG-CD2 3.93Å; Y86-F346 HydrophobicContact CG-CD2 3.93Å; Y86-Y349 AromaticContact CD2-CD1 3.91Å; Y86-Y349 HydrophobicContact CD2-CD1 3.91Å; Y86-Y349 AromaticContact CD2-CD2 3.87Å; Y86-Y349 HydrophobicContact CD2-CD2 3.87Å; Y86-Y349 AromaticContact CD2-CG 3.5Å; Y86-Y349 HydrophobicContact CD2-CG 3.5Å; Y86-Y349 HydrophobicContact CE2-CG 4.27Å; Y86-Y349 HydrophobicContact CG-CD1 4.18Å; Y86-Y349 HydrophobicContact CG-CG 4.24Å; Y86-I411 HydrophobicContact CD1-CD1 3.98Å; Y86-I411 HydrophobicContact CD1-CG1 4.45Å; Y86-I411 HydrophobicContact CE1-CD1 4.16Å
87	A	97.1	Very high	95.1	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.7	-42.2	179.3	0	0	0	0	0	112.1	A83 M84 Q90 I91 I411 V414 Y415	A83-A87 WeakPolarHBondContact O-CB 3.47Å; A83-A87 PolarHBondContact O-N 3.15Å; M84-A87 PolarHBondContact O-N 3.05Å; A87-Q90 PolarHBondContact O-N 2.89Å; A87-I91 WeakPolarHBondContact O-CB 3.36Å; A87-I91 VanDerWaalsContact O-CD1 3.31Å; A87-I91 WeakPolarHBondContact O-CD1 3.49Å; A87-I91 WeakPolarHBondContact O-CG1 3.24Å; A87-I91 PolarHBondContact O-N 3Å; A87-I411 HydrophobicContact CB-CG1 4.36Å; A87-I411 HydrophobicContact CB-CG2 4.24Å; A87-V414 HydrophobicContact CB-CB 3.93Å; A87-V414 HydrophobicContact CB-CG1 3.91Å; A87-V414 HydrophobicContact CB-CG2 4.32Å; A87-Y415 HydrophobicContact CB-CD2 4.5Å; A87-Y415 HydrophobicContact CB-CE2 4.3Å
88	L	96.7	Very high	95.2	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-42.2	175.9	-70.9	166.1	0	0	0	112.3	L53 M84 M85 Y86 Q90 I91 N92 L103 A105 V414	L53-L88 HydrophobicContact CD1-CD2 4.26Å; M84-L88 HydrophobicContact CE-CD1 4.19Å; M84-L88 HydrophobicContact CG-CD1 4.07Å; M84-L88 VanDerWaalsContact O-CG 3.26Å; M84-L88 WeakPolarHBondContact O-CG 3.29Å; M84-L88 PolarHBondContact O-N 3.23Å; M85-L88 PolarHBondContact O-N 3.22Å; Y86-L88 VanDerWaalsContact C-N 3.32Å; Y86-L88 PolarHBondContact O-N 3.26Å; L88-Q90 VanDerWaalsContact C-N 3.34Å; L88-I91 PolarHBondContact O-N 3.42Å; L88-N92 VanDerWaalsContact O-CB 3.27Å; L88-N92 WeakPolarHBondContact O-CB 3.4Å; L88-N92 PolarHBondContact O-N 2.96Å; L88-N92 PolarHBondContact O-ND2 3.11Å; L88-L103 HydrophobicContact CD2-CB 3.68Å; L88-L103 HydrophobicContact CD2-CD1 4.36Å; L88-A105 HydrophobicContact CD1-CB 3.53Å; L88-V414 HydrophobicContact CD2-CG1 4.12Å; L88-V414 HydrophobicContact CG-CG1 4.31Å
89	D	95.5	Very high	95.1	Very high	47 Å²	47	39.8 Å²	39.8	25%	0.251	20%	0.195	S	C	.	.	H	α-helix	trans	-63.6	-41.8	177.2	-66.1	-23.1	0	0	0	111.2	M85 Y86 Q93 R360	M85-D89 VanDerWaalsContact O-CG 3.25Å; M85-D89 PolarHBondContact O-N 3.06Å; Y86-D89 PolarHBondContact O-N 3.05Å; D89-Q93 WeakPolarHBondContact O-CB 3.44Å; D89-Q93 WeakPolarHBondContact O-CG 3.46Å; D89-Q93 PolarHBondContact O-N 3.42Å; D89-R360 VanDerWaalsContact CG-NH1 3.27Å; D89-R360 IonicContact OD1-CZ 3.62Å; D89-R360 IonicContact OD1-NH1 3.96Å; D89-R360 PolarHBondContact OD1-NH1 3.13Å; D89-R360 IonicContact OD2-CZ 2.92Å; D89-R360 VanDerWaalsContact OD2-CZ 3.23Å; D89-R360 IonicContact OD2-NH1 2.67Å; D89-R360 PolarHBondContact OD2-NH1 3.08Å; D89-R360 IonicContact OD2-NH2 3.73Å; D89-R360 PolarHBondContact OD2-NH2 3.47Å
90	Q	95.8	Very high	94.8	Very high	67 Å²	67	45.3 Å²	45.3	31%	0.313	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-46	176.2	-66.9	-56.4	-71.5	0	0	111.9	Y86 A87 L88 N92 Q93 D94 Y415	Y86-Q90 HydrophobicContact CD1-CG 4.4Å; Y86-Q90 HydrophobicContact CD2-CG 4.28Å; Y86-Q90 HydrophobicContact CE1-CG 3.98Å; Y86-Q90 HydrophobicContact CE2-CG 3.86Å; Y86-Q90 WeakPolarHBondContact O-CG 3.09Å; Y86-Q90 PolarHBondContact O-N 3.49Å; A87-Q90 PolarHBondContact O-N 2.89Å; L88-Q90 VanDerWaalsContact C-N 3.34Å; Q90-N92 PolarHBondContact O-N 3.35Å; Q90-Q93 PolarHBondContact O-N 3.35Å; Q90-D94 PolarHBondContact O-N 3.1Å; Q90-D94 VanDerWaalsContact O-N 3.13Å; Q90-Y415 WeakPolarHBondContact CB-OH 3.31Å
91	I	96.5	Very high	94.7	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-64.5	-41.9	179.3	-67.9	158.6	0	0	0	110.9	A87 L88 Q93 D94 L97 L98 L103 V414 Y415 A418	A87-I91 WeakPolarHBondContact O-CB 3.36Å; A87-I91 VanDerWaalsContact O-CD1 3.31Å; A87-I91 WeakPolarHBondContact O-CD1 3.49Å; A87-I91 WeakPolarHBondContact O-CG1 3.24Å; A87-I91 PolarHBondContact O-N 3Å; L88-I91 PolarHBondContact O-N 3.42Å; I91-Q93 PolarHBondContact O-N 2.77Å; I91-D94 PolarHBondContact O-N 3.2Å; I91-D94 VanDerWaalsContact O-N 3.16Å; I91-L97 HydrophobicContact CG1-CD2 4.22Å; I91-L97 HydrophobicContact CG2-CD2 4.26Å; I91-L97 HydrophobicContact CG2-CG 4.5Å; I91-L98 HydrophobicContact CG2-CD1 4.44Å; I91-L103 HydrophobicContact CG2-CD1 4.02Å; I91-V414 HydrophobicContact CD1-CG1 3.72Å; I91-Y415 HydrophobicContact CD1-CD1 4.29Å; I91-Y415 HydrophobicContact CD1-CD2 4.28Å; I91-Y415 HydrophobicContact CD1-CE1 4.33Å; I91-Y415 HydrophobicContact CD1-CE2 4.33Å; I91-Y415 HydrophobicContact CD1-CG 4.27Å; I91-Y415 HydrophobicContact CG1-CD1 4.12Å; I91-Y415 HydrophobicContact CG1-CE1 3.74Å; I91-Y415 HydrophobicContact CG1-CE2 4.26Å; I91-A418 HydrophobicContact CD1-CB 3.79Å; I91-A418 HydrophobicContact CG1-CB 4.36Å; I91-A418 HydrophobicContact CG2-CB 4.07Å
92	N	96.2	Very high	94.6	Very high	62 Å²	62	47.8 Å²	47.8	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-69.9	-16.4	179.3	-72.3	-34.3	0	0	0	113.2	L88 Q90 T102 L103	L88-N92 VanDerWaalsContact O-CB 3.27Å; L88-N92 WeakPolarHBondContact O-CB 3.4Å; L88-N92 PolarHBondContact O-N 2.96Å; L88-N92 PolarHBondContact O-ND2 3.11Å; Q90-N92 PolarHBondContact O-N 3.35Å; N92-T102 WeakPolarHBondContact OD1-CA 3.37Å; N92-L103 PolarHBondContact ND2-O 3.32Å; N92-L103 PolarHBondContact OD1-N 3.17Å
93	Q	95.1	Very high	94.6	Very high	139 Å²	139	47.9 Å²	47.9	65%	0.65	24%	0.242	S	C	*	.	H	α-helix	trans	-93.5	-13.5	173.6	-70.7	170.5	25.8	0	0	112.8	D89 Q90 I91	D89-Q93 WeakPolarHBondContact O-CB 3.44Å; D89-Q93 WeakPolarHBondContact O-CG 3.46Å; D89-Q93 PolarHBondContact O-N 3.42Å; Q90-Q93 PolarHBondContact O-N 3.35Å; I91-Q93 PolarHBondContact O-N 2.77Å
94	D	94	Very high	94.5	Very high	61 Å²	61	47.9 Å²	47.9	33%	0.326	24%	0.242	S	C	.	.			trans	-79.1	120.2	-179.3	-170.7	-13.6	0	0	0	110.9	Q90 I91 Q96 L97	Q90-D94 PolarHBondContact O-N 3.1Å; Q90-D94 VanDerWaalsContact O-N 3.13Å; I91-D94 PolarHBondContact O-N 3.2Å; I91-D94 VanDerWaalsContact O-N 3.16Å; D94-Q96 VanDerWaalsContact C-N 3.31Å; D94-Q96 WeakPolarHBondContact OD1-CB 3.39Å; D94-Q96 PolarHBondContact OD1-N 3.14Å; D94-L97 HydrophobicContact CB-CB 4.25Å; D94-L97 PolarHBondContact OD1-N 3.35Å; D94-L97 WeakPolarHBondContact OD2-CB 3.12Å
95	E	91.8	Very high	94.4	Very high	177 Å²	177	47.9 Å²	47.9	83%	0.827	24%	0.242	S	C	*	.	S	Bend	trans	-76.7	-17.5	177.9	-63	-172.7	170.1	0	0	113.1
96	Q	92.5	Very high	94.2	Very high	165 Å²	165	48.4 Å²	48.4	77%	0.771	24%	0.243	S	C	*	.	S	Bend	trans	-89.9	-37.6	-178.9	-58.1	-171.2	1.2	0	0	112	D94 H422	D94-Q96 VanDerWaalsContact C-N 3.31Å; D94-Q96 WeakPolarHBondContact OD1-CB 3.39Å; D94-Q96 PolarHBondContact OD1-N 3.14Å; Q96-H422 PolarHBondContact O-CE1 3.4Å; Q96-H422 VanDerWaalsContact O-CE1 3.26Å
97	L	93.1	Very high	94.1	Very high	8 Å²	8	47.1 Å²	47.1	4%	0.042	24%	0.238	C	C	.	.	S	Bend	trans	-98.3	114.5	-176.8	-172.2	62.9	0	0	0	110.9	I91 D94 Y415 A418 H422	I91-L97 HydrophobicContact CG1-CD2 4.22Å; I91-L97 HydrophobicContact CG2-CD2 4.26Å; I91-L97 HydrophobicContact CG2-CG 4.5Å; D94-L97 HydrophobicContact CB-CB 4.25Å; D94-L97 PolarHBondContact OD1-N 3.35Å; D94-L97 WeakPolarHBondContact OD2-CB 3.12Å; L97-Y415 HydrophobicContact CD2-CD1 3.99Å; L97-Y415 HydrophobicContact CD2-CE1 4.1Å; L97-A418 HydrophobicContact CD2-CB 3.97Å; L97-A418 HydrophobicContact CG-CB 4.44Å; L97-H422 HydrophobicContact CD1-CB 3.68Å
98	L	92.6	Very high	94	Very high	6 Å²	6	47.1 Å²	47.1	3%	0.031	24%	0.238	C	C	.	.	S	Bend	trans	58	54.8	-178.2	-66.9	172.1	0	0	0	114.5	I91 N100 I101 L103 A418 L421 H422	I91-L98 HydrophobicContact CG2-CD1 4.44Å; L98-N100 PolarHBondContact O-N 2.97Å; L98-I101 HydrophobicContact CB-CB 4.25Å; L98-I101 HydrophobicContact CD2-CD1 4.31Å; L98-I101 PolarHBondContact O-N 3.46Å; L98-I101 VanDerWaalsContact O-N 3.08Å; L98-L103 HydrophobicContact CD1-CD1 3.76Å; L98-L103 HydrophobicContact CD1-CD2 4Å; L98-L103 HydrophobicContact CD1-CG 3.94Å; L98-A418 HydrophobicContact CD1-CB 4.06Å; L98-L421 HydrophobicContact CD1-CB 4.3Å; L98-L421 HydrophobicContact CD2-CB 4.02Å; L98-H422 HydrophobicContact CD2-CB 3.94Å; L98-H422 HydrophobicContact CG-CB 4.12Å; L98-H422 PolarHBondContact N-ND1 2.03Å
99	P	90.7	Very high	93.8	Very high	53 Å²	53	47.3 Å²	47.3	34%	0.344	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	135.6	179.6	26.5	-34.9	0	0	0	111.6	I101	P99-I101 PolarHBondContact O-N 3.38Å
100	N	89.7	Confident	93.7	Very high	123 Å²	123	45.2 Å²	45.2	66%	0.658	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	16.9	-176.7	-55.2	-54.4	0	0	0	115.3	L98 G434	L98-N100 PolarHBondContact O-N 2.97Å; N100-G434 WeakPolarHBondContact O-CA 3.46Å
101	I	92.6	Very high	93.4	Very high	6 Å²	6	42 Å²	42	3%	0.031	21%	0.213	C	C	.	.			trans	-124.2	119.8	173.1	-62.4	174.8	0	0	0	108	H50 L51 L98 P99 H425 V435	H50-I101 HydrophobicContact CB-CG2 4.35Å; L51-I101 HydrophobicContact CD1-CG2 4Å; L51-I101 HydrophobicContact CG-CG2 4.33Å; L98-I101 HydrophobicContact CB-CB 4.25Å; L98-I101 HydrophobicContact CD2-CD1 4.31Å; L98-I101 PolarHBondContact O-N 3.46Å; L98-I101 VanDerWaalsContact O-N 3.08Å; P99-I101 PolarHBondContact O-N 3.38Å; I101-H425 VanDerWaalsContact CD1-CD2 3.49Å; I101-H425 WeakPolarHBondContact CD1-CD2 3.47Å; I101-V435 HydrophobicContact CD1-CG2 4.14Å; I101-V435 HydrophobicContact CG1-CG2 4.11Å; I101-V435 HydrophobicContact CG2-CG2 3.98Å
102	T	94.3	Very high	92.8	Very high	56 Å²	56	43.6 Å²	43.6	34%	0.344	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-96.4	133.7	174	58.5	0	0	0	0	110.9	G49 H50 L51 N92	G49-T102 CarbonylContact C-O 3.5Å; H50-T102 PolarHBondContact N-O 3.49Å; H50-T102 PolarHBondContact N-OG1 2.98Å; H50-T102 PolarHBondContact ND1-N 2.94Å; H50-T102 PolarHBondContact ND1-OG1 3.23Å; L51-T102 PolarHBondContact N-O 3.21Å; N92-T102 WeakPolarHBondContact OD1-CA 3.37Å
103	L	95.4	Very high	92.3	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.8	173	-61.5	-175.6	0	0	0	109.9	L51 L53 L88 I91 N92 L98 A418 L421	L51-L103 HydrophobicContact CB-CD2 3.95Å; L51-L103 HydrophobicContact CD1-CD2 4.23Å; L51-L103 WeakPolarHBondContact O-CA 3.47Å; L53-L103 HydrophobicContact CD1-CD1 4.45Å; L88-L103 HydrophobicContact CD2-CB 3.68Å; L88-L103 HydrophobicContact CD2-CD1 4.36Å; I91-L103 HydrophobicContact CG2-CD1 4.02Å; N92-L103 PolarHBondContact ND2-O 3.32Å; N92-L103 PolarHBondContact OD1-N 3.17Å; L98-L103 HydrophobicContact CD1-CD1 3.76Å; L98-L103 HydrophobicContact CD1-CD2 4Å; L98-L103 HydrophobicContact CD1-CG 3.94Å; L103-A418 HydrophobicContact CD1-CB 4.06Å; L103-L421 HydrophobicContact CD2-CD1 3.88Å
104	G	95.1	Very high	91.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	173.9	169.2	0	0	0	0	0	111.3	T47 L51 T52 L53	T47-G104 VanDerWaalsContact O-CA 3.26Å; T47-G104 WeakPolarHBondContact O-CA 3.43Å; L51-G104 PolarHBondContact O-N 2.67Å; T52-G104 WeakPolarHBondContact CA-O 3.26Å; L53-G104 PolarHBondContact N-O 3.27Å
105	A	94.6	Very high	91.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	147.9	-179.5	0	0	0	0	0	113	R46 T47 L53 M84 L88 V107	R46-A105 CarbonylContact C-O 3.6Å; R46-A105 WeakPolarHBondContact CA-O 3.23Å; T47-A105 PolarHBondContact N-O 3.47Å; T47-A105 PolarHBondContact O-N 3.42Å; T47-A105 VanDerWaalsContact O-N 3.11Å; T47-A105 WeakPolarHBondContact OG1-CA 3.48Å; T47-A105 WeakPolarHBondContact OG1-CB 3.46Å; T47-A105 PolarHBondContact OG1-N 3.04Å; T47-A105 PolarHBondContact OG1-O 3.38Å; L53-A105 CarbonylContact O-C 3.56Å; L53-A105 WeakPolarHBondContact O-CA 3.3Å; M84-A105 HydrophobicContact CE-CB 3.83Å; L88-A105 HydrophobicContact CD1-CB 3.53Å; A105-V107 HydrophobicContact CB-CG2 4.34Å
106	R	93.4	Very high	91.5	Very high	11 Å²	11	34.7 Å²	34.7	4%	0.042	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	106.2	168.5	-174.8	170.9	177.8	-169.8	-3.2	109	I45 R46 T52 L53 G54 G55 T123 F124	I45-R106 CarbonylContact O-C 3.55Å; I45-R106 VanDerWaalsContact O-CA 3.31Å; I45-R106 WeakPolarHBondContact O-CA 3.38Å; R46-R106 HydrophobicContact CG-CG 4.45Å; T52-R106 HydrophobicContact CG2-CB 4.03Å; L53-R106 PolarHBondContact O-N 3.47Å; G54-R106 CarbonylContact C-O 3.49Å; G54-R106 WeakPolarHBondContact CA-O 3.25Å; G55-R106 PolarHBondContact N-O 3.05Å; R106-T123 PolarHBondContact NH1-O 3.21Å; R106-T123 VanDerWaalsContact NH2-CB 3.33Å; R106-T123 PolarHBondContact NH2-OG1 3.2Å; R106-F124 HydrophobicContact CB-CE1 4.34Å; R106-F124 HydrophobicContact CG-CE1 4.16Å; R106-F124 WeakPolarHBondContact O-CE1 3.25Å
107	V	94.6	Very high	91.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.8	-174.7	-176.8	0	0	0	0	111.1	S44 I45 G55 F57 L81 M84 M85 A105	S44-V107 WeakPolarHBondContact CA-O 3.38Å; I45-V107 HydrophobicContact CB-CB 4.17Å; I45-V107 PolarHBondContact N-O 3.27Å; I45-V107 PolarHBondContact O-N 3.17Å; G55-V107 WeakPolarHBondContact O-CA 3.33Å; F57-V107 HydrophobicContact CD2-CG1 3.51Å; F57-V107 HydrophobicContact CE2-CG1 3.98Å; F57-V107 HydrophobicContact CE2-CG2 4.5Å; L81-V107 HydrophobicContact CD1-CG1 3.86Å; L81-V107 HydrophobicContact CG-CG1 4.09Å; M84-V107 HydrophobicContact SD-CG2 4.16Å; M85-V107 HydrophobicContact CE-CB 4.26Å; M85-V107 HydrophobicContact CE-CG2 3.51Å; A105-V107 HydrophobicContact CB-CG2 4.34Å
108	L	93.8	Very high	91.2	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.4	-179.5	-55.8	175.2	0	0	0	110.1	S44 G55 L56 F57 Q120 T123 F124	S44-L108 VanDerWaalsContact CB-CD2 3.42Å; G55-L108 PolarHBondContact O-N 3Å; L56-L108 HydrophobicContact CD2-CB 4.07Å; F57-L108 PolarHBondContact N-O 3.29Å; L108-Q120 HydrophobicContact CB-CB 4.38Å; L108-Q120 HydrophobicContact CD1-CB 4.05Å; L108-Q120 VanDerWaalsContact CD1-O 3.25Å; L108-Q120 WeakPolarHBondContact CD1-O 3.38Å; L108-T123 WeakPolarHBondContact CD1-OG1 3.49Å; L108-F124 HydrophobicContact CD1-CD1 4.06Å; L108-F124 HydrophobicContact CD1-CE1 3.49Å; L108-F124 VanDerWaalsContact CD1-CE1 3.49Å; L108-F124 HydrophobicContact CD1-CE2 4.03Å; L108-F124 HydrophobicContact CD1-CZ 3.48Å; L108-F124 VanDerWaalsContact CD1-CZ 3.48Å; L108-F124 HydrophobicContact CG-CE1 3.91Å; L108-F124 HydrophobicContact CG-CZ 3.88Å
109	D	93.5	Very high	91	Very high	8 Å²	8	34 Å²	34	4%	0.043	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	138.7	171.4	-168.9	6.1	0	0	0	111	F57 V59 H60 C111 Y116 W363	F57-D109 WeakPolarHBondContact O-CA 3.42Å; F57-D109 VanDerWaalsContact O-OD1 3.11Å; V59-D109 HydrophobicContact CB-CB 4.25Å; V59-D109 HydrophobicContact CG2-CB 4.26Å; V59-D109 PolarHBondContact N-OD1 3.06Å; H60-D109 IonicContact CE1-OD2 3.51Å; H60-D109 IonicContact CG-OD2 3.72Å; H60-D109 PolarHBondContact N-OD1 2.86Å; H60-D109 PolarHBondContact N-OD2 3.1Å; H60-D109 IonicContact ND1-OD2 3.25Å; H60-D109 PolarHBondContact ND1-OD2 3.02Å; D109-C111 PolarHBondContact OD1-N 3.03Å; D109-C111 PolarHBondContact OD2-SG 3.16Å; D109-Y116 WeakPolarHBondContact O-CE1 3.2Å; D109-W363 HydrophobicContact CB-CH2 4.27Å; D109-W363 HydrophobicContact CB-CZ2 3.93Å
110	T	92.1	Very high	90.8	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.018	17%	0.168	C	C	.	.			trans	-96.9	-16	175.5	58.8	0	0	0	0	112.8	L56 F57 P58 S112 R113 A117 A158 V163	L56-T110 HydrophobicContact CB-CG2 3.78Å; L56-T110 HydrophobicContact CD2-CG2 4Å; L56-T110 HydrophobicContact CG-CG2 4.43Å; F57-T110 VanDerWaalsContact C-OG1 3.31Å; F57-T110 PolarHBondContact O-N 3.5Å; F57-T110 PolarHBondContact O-OG1 3.42Å; P58-T110 WeakPolarHBondContact CA-OG1 3.43Å; T110-S112 PolarHBondContact O-N 3.4Å; T110-R113 PolarHBondContact O-N 3.24Å; T110-A117 HydrophobicContact CG2-CB 3.96Å; T110-A158 HydrophobicContact CG2-CB 4.39Å; T110-V163 HydrophobicContact CG2-CG1 4.31Å
111	C	89.3	Confident	90.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	26.8	-175.2	-58.9	0	0	0	0	114	H60 S61 R62 C69 D109 R113 Y116	H60-C111 CarbonylContact O-C 3.6Å; H60-C111 WeakPolarHBondContact O-CA 3.4Å; S61-C111 CarbonylContact C-O 3.36Å; R62-C111 WeakPolarHBondContact CA-O 3.5Å; C69-C111 HydrophobicContact CB-CB 3.72Å; C69-C111 WeakPolarHBondContact CB-SG 3.23Å; C69-C111 WeakPolarHBondContact SG-CB 3.3Å; C69-C111 CovalentContact SG-SG 2.01Å; C69-C111 PolarHBondContact SG-SG 3.34Å; D109-C111 PolarHBondContact OD1-N 3.03Å; D109-C111 PolarHBondContact OD2-SG 3.16Å; C111-R113 PolarHBondContact O-N 3.45Å; C111-Y116 HydrophobicContact CB-CD1 3.88Å; C111-Y116 HydrophobicContact CB-CE1 4.18Å; C111-Y116 WeakPolarHBondContact SG-CE1 3.19Å
112	S	85.4	Confident	90.6	Very high	35 Å²	35	30.8 Å²	30.8	25%	0.245	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	23.2	-173.8	-48.8	0	0	0	0	114.1	H60 K73 T110	H60-S112 PolarHBondContact O-OG 2.79Å; H60-S112 VanDerWaalsContact O-OG 3.09Å; K73-S112 PolarHBondContact NZ-OG 3.39Å; T110-S112 PolarHBondContact O-N 3.4Å
113	R	85.9	Confident	90.2	Very high	75 Å²	75	29.4 Å²	29.4	28%	0.283	15%	0.149	S	C	.	.			trans	-125.3	123.6	-173.7	-177.1	175	170.8	164.8	-2.2	110.3	T110 C111 T115 Y116 A117	T110-R113 PolarHBondContact O-N 3.24Å; C111-R113 PolarHBondContact O-N 3.45Å; R113-T115 PolarHBondContact NE-OG1 3.17Å; R113-Y116 PolarHBondContact O-N 2.96Å; R113-A117 WeakPolarHBondContact O-CB 3.36Å; R113-A117 PolarHBondContact O-N 3.44Å
114	D	86.8	Confident	89.9	Confident	54 Å²	54	29.4 Å²	29.4	29%	0.289	15%	0.149	S	C	.	.	H	α-helix	trans	-62.3	-45.6	-174.7	60.5	-13.5	0	0	0	113.4	Y116 L118 V163 M166	D114-Y116 VanDerWaalsContact C-N 3.34Å; D114-Y116 PolarHBondContact O-N 3.26Å; D114-L118 WeakPolarHBondContact O-CB 3.5Å; D114-L118 PolarHBondContact O-N 3.45Å; D114-V163 HydrophobicContact CB-CG2 4.36Å; D114-M166 HydrophobicContact CB-CG 3.97Å
115	T	87.2	Confident	89.4	Confident	76 Å²	76	29.4 Å²	29.4	47%	0.466	15%	0.149	S	C	.	.	H	α-helix	trans	-64.2	-38.9	178.3	63.7	0	0	0	0	112.6	R113 E119	R113-T115 PolarHBondContact NE-OG1 3.17Å; T115-E119 PolarHBondContact O-N 3.35Å
116	Y	88.8	Confident	88.7	Confident	48 Å²	48	34.4 Å²	34.4	19%	0.188	17%	0.173	C	C	.	.	H	α-helix	trans	-72.3	-46.8	-179	-178	-99.9	0	0	0	110.8	P68 D109 C111 R113 D114 L118 E119 Q120	P68-Y116 HydrophobicContact CB-CD2 3.6Å; P68-Y116 HydrophobicContact CB-CE2 3.74Å; P68-Y116 HydrophobicContact CB-CG 4.27Å; P68-Y116 HydrophobicContact CG-CE2 4.21Å; D109-Y116 WeakPolarHBondContact O-CE1 3.2Å; C111-Y116 HydrophobicContact CB-CD1 3.88Å; C111-Y116 HydrophobicContact CB-CE1 4.18Å; C111-Y116 WeakPolarHBondContact SG-CE1 3.19Å; R113-Y116 PolarHBondContact O-N 2.96Å; D114-Y116 VanDerWaalsContact C-N 3.34Å; D114-Y116 PolarHBondContact O-N 3.26Å; Y116-L118 VanDerWaalsContact C-N 3.26Å; Y116-L118 PolarHBondContact O-N 3.1Å; Y116-E119 WeakPolarHBondContact O-CB 3.42Å; Y116-E119 PolarHBondContact O-N 3.3Å; Y116-E119 VanDerWaalsContact O-N 3.14Å; Y116-Q120 HydrophobicContact CD1-CG 4.04Å; Y116-Q120 HydrophobicContact CE1-CG 3.66Å; Y116-Q120 HydrophobicContact CE2-CG 4.48Å; Y116-Q120 WeakPolarHBondContact O-CG 3.46Å; Y116-Q120 PolarHBondContact O-N 2.86Å
117	A	90.5	Very high	87.5	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-35.6	176	0	0	0	0	0	112.9	T110 R113 Q120 S121 V163 V167	T110-A117 HydrophobicContact CG2-CB 3.96Å; R113-A117 WeakPolarHBondContact O-CB 3.36Å; R113-A117 PolarHBondContact O-N 3.44Å; A117-Q120 PolarHBondContact O-N 3.14Å; A117-S121 VanDerWaalsContact O-CB 3.28Å; A117-S121 WeakPolarHBondContact O-CB 3.45Å; A117-S121 PolarHBondContact O-N 3.45Å; A117-S121 PolarHBondContact O-OG 2.88Å; A117-V163 HydrophobicContact CB-CG1 3.36Å; A117-V167 HydrophobicContact CB-CG2 4.49Å
118	L	89.4	Confident	86.4	Confident	52 Å²	52	38.7 Å²	38.7	27%	0.272	20%	0.199	S	C	.	.	H	α-helix	trans	-60.6	-48.8	173.3	-172.6	75.4	0	0	0	111.3	D114 Y116 S121 L122 M166 I170	D114-L118 WeakPolarHBondContact O-CB 3.5Å; D114-L118 PolarHBondContact O-N 3.45Å; Y116-L118 VanDerWaalsContact C-N 3.26Å; Y116-L118 PolarHBondContact O-N 3.1Å; L118-S121 PolarHBondContact O-N 2.9Å; L118-L122 PolarHBondContact O-N 3.33Å; L118-M166 HydrophobicContact CD1-CB 4.15Å; L118-M166 VanDerWaalsContact CD1-O 3.26Å; L118-M166 WeakPolarHBondContact CD1-O 3.37Å; L118-I170 HydrophobicContact CD1-CD1 3.16Å; L118-I170 HydrophobicContact CD1-CG1 3.6Å; L118-I170 HydrophobicContact CG-CD1 3.68Å
119	E	88.4	Confident	85.3	Confident	113 Å²	113	43.4 Å²	43.4	53%	0.528	22%	0.223	S	C	.	.	H	α-helix	trans	-59.7	-46.6	176.9	-175.8	-176.8	178.1	0	0	111.2	T115 Y116 S121 L122	T115-E119 PolarHBondContact O-N 3.35Å; Y116-E119 WeakPolarHBondContact O-CB 3.42Å; Y116-E119 PolarHBondContact O-N 3.3Å; Y116-E119 VanDerWaalsContact O-N 3.14Å; E119-S121 VanDerWaalsContact C-N 3.32Å; E119-S121 PolarHBondContact O-N 3.33Å; E119-L122 WeakPolarHBondContact O-CB 3.28Å; E119-L122 PolarHBondContact O-N 3.47Å
120	Q	87.1	Confident	83.7	Confident	24 Å²	24	46.8 Å²	46.8	11%	0.112	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-39.5	176.9	-65.1	-48.1	-51.4	0	0	111.9	L108 Y116 A117 L122 T123	L108-Q120 HydrophobicContact CB-CB 4.38Å; L108-Q120 HydrophobicContact CD1-CB 4.05Å; L108-Q120 VanDerWaalsContact CD1-O 3.25Å; L108-Q120 WeakPolarHBondContact CD1-O 3.38Å; Y116-Q120 HydrophobicContact CD1-CG 4.04Å; Y116-Q120 HydrophobicContact CE1-CG 3.66Å; Y116-Q120 HydrophobicContact CE2-CG 4.48Å; Y116-Q120 WeakPolarHBondContact O-CG 3.46Å; Y116-Q120 PolarHBondContact O-N 2.86Å; A117-Q120 PolarHBondContact O-N 3.14Å; Q120-L122 VanDerWaalsContact C-N 3.25Å; Q120-L122 PolarHBondContact O-N 2.91Å; Q120-T123 WeakPolarHBondContact O-CB 3.4Å; Q120-T123 WeakPolarHBondContact O-CG2 3.4Å; Q120-T123 PolarHBondContact O-N 3.48Å; Q120-T123 PolarHBondContact O-OG1 2.94Å
121	S	89.4	Confident	81.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.7	-22.9	-179.2	-61.9	0	0	0	0	113.6	A117 L118 E119 T123 F124 V167	A117-S121 VanDerWaalsContact O-CB 3.28Å; A117-S121 WeakPolarHBondContact O-CB 3.45Å; A117-S121 PolarHBondContact O-N 3.45Å; A117-S121 PolarHBondContact O-OG 2.88Å; L118-S121 PolarHBondContact O-N 2.9Å; E119-S121 VanDerWaalsContact C-N 3.32Å; E119-S121 PolarHBondContact O-N 3.33Å; S121-T123 PolarHBondContact O-N 3.14Å; S121-F124 WeakPolarHBondContact O-CB 3.4Å; S121-F124 PolarHBondContact O-N 2.93Å; S121-F124 VanDerWaalsContact O-N 3.11Å; S121-V167 WeakPolarHBondContact OG-CG2 3.48Å
122	L	87.4	Confident	80.1	Confident	89 Å²	89	62.9 Å²	62.9	47%	0.466	32%	0.321	S	S	.	.	H	α-helix	trans	-59.3	-26.2	171	-70.7	170.5	0	0	0	112	L118 E119 Q120 F124 V125 Q126 I170	L118-L122 PolarHBondContact O-N 3.33Å; E119-L122 WeakPolarHBondContact O-CB 3.28Å; E119-L122 PolarHBondContact O-N 3.47Å; Q120-L122 VanDerWaalsContact C-N 3.25Å; Q120-L122 PolarHBondContact O-N 2.91Å; L122-F124 VanDerWaalsContact C-N 3.28Å; L122-F124 PolarHBondContact O-N 3.37Å; L122-V125 HydrophobicContact CD2-CG2 4.49Å; L122-V125 WeakPolarHBondContact O-CG2 3.26Å; L122-V125 PolarHBondContact O-N 2.7Å; L122-Q126 PolarHBondContact O-N 2.76Å; L122-I170 HydrophobicContact CD2-CD1 3.76Å; L122-I170 HydrophobicContact CD2-CG2 4.41Å; L122-I170 HydrophobicContact CG-CD1 4.2Å
123	T	86.4	Confident	78.8	Confident	28 Å²	28	64.1 Å²	64.1	17%	0.172	33%	0.327	C	S	.	.	H	α-helix	trans	-73.6	-18	179.3	75.8	0	0	0	0	113.5	R106 L108 Q120 S121	R106-T123 PolarHBondContact NH1-O 3.21Å; R106-T123 VanDerWaalsContact NH2-CB 3.33Å; R106-T123 PolarHBondContact NH2-OG1 3.2Å; L108-T123 WeakPolarHBondContact CD1-OG1 3.49Å; Q120-T123 WeakPolarHBondContact O-CB 3.4Å; Q120-T123 WeakPolarHBondContact O-CG2 3.4Å; Q120-T123 PolarHBondContact O-N 3.48Å; Q120-T123 PolarHBondContact O-OG1 2.94Å; S121-T123 PolarHBondContact O-N 3.14Å
124	F	88.2	Confident	77.5	Confident	1 Å²	1	64.7 Å²	64.7	0%	0.004	34%	0.343	C	S	.	.	H	α-helix	trans	-72.9	-32.5	171.9	-65.9	-35.7	0	0	0	112.4	L56 R106 L108 S121 L122 V152 V155	L56-F124 HydrophobicContact CD1-CE2 4.13Å; L56-F124 HydrophobicContact CD2-CE2 3.8Å; L56-F124 HydrophobicContact CD2-CZ 4.1Å; L56-F124 HydrophobicContact CG-CE2 3.81Å; L56-F124 HydrophobicContact CG-CZ 4.24Å; R106-F124 HydrophobicContact CB-CE1 4.34Å; R106-F124 HydrophobicContact CG-CE1 4.16Å; R106-F124 WeakPolarHBondContact O-CE1 3.25Å; L108-F124 HydrophobicContact CD1-CD1 4.06Å; L108-F124 HydrophobicContact CD1-CE1 3.49Å; L108-F124 VanDerWaalsContact CD1-CE1 3.49Å; L108-F124 HydrophobicContact CD1-CE2 4.03Å; L108-F124 HydrophobicContact CD1-CZ 3.48Å; L108-F124 VanDerWaalsContact CD1-CZ 3.48Å; L108-F124 HydrophobicContact CG-CE1 3.91Å; L108-F124 HydrophobicContact CG-CZ 3.88Å; S121-F124 WeakPolarHBondContact O-CB 3.4Å; S121-F124 PolarHBondContact O-N 2.93Å; S121-F124 VanDerWaalsContact O-N 3.11Å; L122-F124 VanDerWaalsContact C-N 3.28Å; L122-F124 PolarHBondContact O-N 3.37Å; F124-V152 HydrophobicContact CB-CB 4.4Å; F124-V152 HydrophobicContact CB-CG2 4.24Å; F124-V152 HydrophobicContact CD1-CG2 3.76Å; F124-V152 HydrophobicContact CE1-CG2 4.49Å; F124-V152 HydrophobicContact CG-CG2 4.29Å; F124-V155 HydrophobicContact CD2-CG2 3.91Å; F124-V155 HydrophobicContact CE2-CG1 4.11Å; F124-V155 HydrophobicContact CE2-CG2 4.09Å
125	V	85.2	Confident	76.2	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-93.4	-8.3	-177.2	-60.5	0	0	0	0	112.7	L122 A127 L128 I129 L171 F174 I176	L122-V125 HydrophobicContact CD2-CG2 4.49Å; L122-V125 WeakPolarHBondContact O-CG2 3.26Å; L122-V125 PolarHBondContact O-N 2.7Å; V125-A127 PolarHBondContact O-N 3.39Å; V125-A127 VanDerWaalsContact O-N 3.1Å; V125-L128 WeakPolarHBondContact O-CB 3.36Å; V125-L128 PolarHBondContact O-N 3.03Å; V125-I129 HydrophobicContact CB-CD1 4.35Å; V125-I129 HydrophobicContact CG2-CD1 3.82Å; V125-I129 WeakPolarHBondContact O-CG1 3.14Å; V125-I129 PolarHBondContact O-N 2.99Å; V125-L171 HydrophobicContact CG1-CD2 4.42Å; V125-F174 HydrophobicContact CB-CD1 4.13Å; V125-F174 HydrophobicContact CB-CD2 3.78Å; V125-F174 HydrophobicContact CB-CE1 4.24Å; V125-F174 HydrophobicContact CB-CE2 3.89Å; V125-F174 HydrophobicContact CB-CG 3.89Å; V125-F174 HydrophobicContact CB-CZ 4.13Å; V125-F174 HydrophobicContact CG1-CB 3.9Å; V125-F174 HydrophobicContact CG1-CD1 4.33Å; V125-F174 HydrophobicContact CG1-CD2 3.4Å; V125-F174 VanDerWaalsContact CG1-CD2 3.4Å; V125-F174 HydrophobicContact CG1-CE2 3.97Å; V125-F174 HydrophobicContact CG1-CG 3.61Å; V125-F174 HydrophobicContact CG2-CD2 4.16Å; V125-F174 HydrophobicContact CG2-CE2 3.83Å; V125-F174 HydrophobicContact CG2-CZ 4.11Å; V125-I176 HydrophobicContact CG1-CD1 3.83Å
126	Q	79.8	Confident	75.1	Confident	106 Å²	106	69.3 Å²	69.3	50%	0.495	37%	0.367	S	S	.	.	H	α-helix	trans	-52.4	-36.2	179.8	-170.4	174.7	8	0	0	112.6	L122 L128 I129 T130	L122-Q126 PolarHBondContact O-N 2.76Å; Q126-L128 VanDerWaalsContact C-N 3.29Å; Q126-L128 PolarHBondContact O-N 3.38Å; Q126-I129 PolarHBondContact O-N 3.3Å; Q126-T130 PolarHBondContact O-N 2.92Å; Q126-T130 PolarHBondContact O-OG1 3.42Å
127	A	68.8	Low	73.9	Confident	24 Å²	24	76.8 Å²	76.8	20%	0.198	40%	0.395	C	S	.	.	H	α-helix	trans	-66.7	-25.6	176.8	0	0	0	0	0	114.7	V125 P149 E150	V125-A127 PolarHBondContact O-N 3.39Å; V125-A127 VanDerWaalsContact O-N 3.1Å; A127-P149 HydrophobicContact CB-CB 3.74Å; A127-P149 HydrophobicContact CB-CG 3.86Å; A127-P149 WeakPolarHBondContact CB-O 3.33Å; A127-E150 WeakPolarHBondContact CB-O 3.42Å
128	L	71.5	Confident	72.8	Confident	76 Å²	76	79.4 Å²	79.4	40%	0.398	41%	0.413	S	S	.	.	H	α-helix	trans	-90	-16.8	179.3	-59.9	173.3	0	0	0	112.2	V125 Q126 K151 F174 I176	V125-L128 WeakPolarHBondContact O-CB 3.36Å; V125-L128 PolarHBondContact O-N 3.03Å; Q126-L128 VanDerWaalsContact C-N 3.29Å; Q126-L128 PolarHBondContact O-N 3.38Å; L128-K151 HydrophobicContact CD2-CG 4.43Å; L128-F174 HydrophobicContact CB-CD1 4.11Å; L128-F174 HydrophobicContact CD1-CB 3.89Å; L128-F174 HydrophobicContact CD1-CD1 4.18Å; L128-F174 HydrophobicContact CD1-CG 4.4Å; L128-I176 HydrophobicContact CD1-CD1 3.97Å; L128-I176 HydrophobicContact CD1-CG1 4.33Å
129	I	71.1	Confident	72	Confident	99 Å²	99	83.9 Å²	83.9	51%	0.508	44%	0.442	S	S	.	.	H	α-helix	trans	-93.4	-26	-178	-61.6	166.7	0	0	0	111.5	V125 Q126 K131 F174	V125-I129 HydrophobicContact CB-CD1 4.35Å; V125-I129 HydrophobicContact CG2-CD1 3.82Å; V125-I129 WeakPolarHBondContact O-CG1 3.14Å; V125-I129 PolarHBondContact O-N 2.99Å; Q126-I129 PolarHBondContact O-N 3.3Å; I129-K131 PolarHBondContact O-N 3.07Å; I129-K131 VanDerWaalsContact O-N 3.09Å; I129-F174 HydrophobicContact CD1-CE1 4.03Å; I129-F174 HydrophobicContact CD1-CZ 3.72Å; I129-F174 HydrophobicContact CG1-CE1 3.61Å; I129-F174 HydrophobicContact CG1-CZ 3.83Å
130	T	59.9	Low	71.1	Confident	79 Å²	79	84.5 Å²	84.5	49%	0.485	45%	0.449	S	S	.	.			trans	-72	107.4	-177	1.5	0	0	0	0	110.8	Q126 P149	Q126-T130 PolarHBondContact O-N 2.92Å; Q126-T130 PolarHBondContact O-OG1 3.42Å; T130-P149 WeakPolarHBondContact OG1-CG 3.32Å
131	K	52.8	Low	70.2	Confident	192 Å²	192	86.1 Å²	86.1	84%	0.835	47%	0.473	S	S	*	.			trans	-75.3	158	171.4	-94.2	-175.6	172.8	-178.4	0	111.9	I129 T133	I129-K131 PolarHBondContact O-N 3.07Å; I129-K131 VanDerWaalsContact O-N 3.09Å; K131-T133 PolarHBondContact O-N 3.33Å
132	D	53.3	Low	69.2	Low	149 Å²	149	92.3 Å²	92.3	80%	0.797	50%	0.502	S	S	*	.			trans	-28.8	111.7	174.5	-94.4	-38.8	0	0	0	113.5	S134	D132-S134 PolarHBondContact O-N 3.35Å
133	T	57.8	Low	68.1	Low	61 Å²	61	93.5 Å²	93.5	37%	0.374	52%	0.515	S	S	.	.			trans	-88.3	16.1	176.7	51.3	0	0	0	0	112.7	K131 D135 V136 F146	K131-T133 PolarHBondContact O-N 3.33Å; T133-D135 PolarHBondContact O-N 3.09Å; T133-D135 VanDerWaalsContact O-N 3.08Å; T133-V136 PolarHBondContact O-N 3.35Å; T133-V136 VanDerWaalsContact O-N 3.15Å; T133-F146 HydrophobicContact CG2-CD1 4.5Å; T133-F146 HydrophobicContact CG2-CD2 4.38Å; T133-F146 HydrophobicContact CG2-CE1 4.22Å; T133-F146 HydrophobicContact CG2-CE2 4.07Å; T133-F146 HydrophobicContact CG2-CZ 3.99Å
134	S	58.5	Low	67	Low	87 Å²	87	93.6 Å²	93.6	61%	0.608	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.1	-178.3	52.2	0	0	0	0	114.3	D132	D132-S134 PolarHBondContact O-N 3.35Å
135	D	58.4	Low	65.7	Low	150 Å²	150	100.5 Å²	100.5	80%	0.802	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-5.7	-178.4	-70.1	-17.4	0	0	0	114.2	T133	T133-D135 PolarHBondContact O-N 3.09Å; T133-D135 VanDerWaalsContact O-N 3.08Å
136	V	63.6	Low	64.5	Low	78 Å²	78	105 Å²	105	47%	0.473	58%	0.578	S	S	.	*			trans	-91.4	115.8	-179.2	-171.3	0	0	0	0	109.5	T133 P144 F146	T133-V136 PolarHBondContact O-N 3.35Å; T133-V136 VanDerWaalsContact O-N 3.15Å; V136-P144 HydrophobicContact CB-CG 4.16Å; V136-P144 HydrophobicContact CG1-CG 3.9Å; V136-P144 WeakPolarHBondContact O-CD 3.37Å; V136-P144 WeakPolarHBondContact O-CG 3.36Å; V136-F146 HydrophobicContact CB-CE2 4.29Å; V136-F146 HydrophobicContact CB-CZ 3.84Å; V136-F146 HydrophobicContact CG1-CZ 3.92Å; V136-F146 HydrophobicContact CG2-CZ 4.2Å
137	R	64.7	Low	63.6	Low	205 Å²	205	106 Å²	106	77%	0.774	59%	0.59	S	S	*	*			trans	-114.4	137.9	172.1	-63.5	-170	-179.7	-165.6	-0	110
138	C	68.1	Low	63.2	Low	54 Å²	54	113.7 Å²	113.7	37%	0.365	62%	0.619	S	S	.	*			trans	-64.7	154.5	170	-67.3	0	0	0	0	109.6	N140 G141 E142	C138-N140 PolarHBondContact O-N 3.2Å; C138-G141 PolarHBondContact O-N 3.41Å; C138-E142 WeakPolarHBondContact CB-O 3.36Å; C138-E142 PolarHBondContact N-O 3.49Å
139	T	70.9	Confident	62.9	Low	146 Å²	146	112.4 Å²	112.4	90%	0.896	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	-18	175.9	40.8	0	0	0	0	113.8
140	N	70.3	Confident	63	Low	126 Å²	126	110.3 Å²	110.3	67%	0.674	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	2.6	-175.1	-48.7	3.4	0	0	0	112.3	C138 E142	C138-N140 PolarHBondContact O-N 3.2Å; N140-E142 PolarHBondContact O-N 2.98Å
141	G	68.2	Low	64.1	Low	59 Å²	59	111.2 Å²	111.2	61%	0.608	60%	0.601	S	S	*	*	S	Bend	trans	78.4	-5.4	-178	0	0	0	0	0	115.2	C138	C138-G141 PolarHBondContact O-N 3.41Å
142	E	69	Low	65.9	Low	130 Å²	130	102.3 Å²	102.3	61%	0.607	56%	0.562	S	S	*	*	S	Bend	trans	-74.2	148.7	174.1	-67.1	-174.6	162.2	0	0	111.9	C138 N140	C138-E142 WeakPolarHBondContact CB-O 3.36Å; C138-E142 PolarHBondContact N-O 3.49Å; N140-E142 PolarHBondContact O-N 2.98Å
143	P	62.7	Low	67.8	Low	113 Å²	113	96.7 Å²	96.7	73%	0.734	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-63.8	135.1	170.1	26.3	-31.5	0	0	0	109.5	V145	P143-V145 PolarHBondContact O-N 3.11Å
144	P	64.3	Low	69.5	Low	30 Å²	30	93.8 Å²	93.8	20%	0.195	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-65.1	135.7	177.2	-9.5	22.5	0	0	0	110.1	V136 F146	V136-P144 HydrophobicContact CB-CG 4.16Å; V136-P144 HydrophobicContact CG1-CG 3.9Å; V136-P144 WeakPolarHBondContact O-CD 3.37Å; V136-P144 WeakPolarHBondContact O-CG 3.36Å; P144-F146 VanDerWaalsContact C-N 3.32Å; P144-F146 HydrophobicContact CB-CD2 3.91Å; P144-F146 HydrophobicContact CB-CE1 4.3Å; P144-F146 HydrophobicContact CB-CE2 3.44Å; P144-F146 VanDerWaalsContact CB-CE2 3.44Å; P144-F146 HydrophobicContact CB-CZ 3.66Å; P144-F146 HydrophobicContact CG-CD2 4.31Å; P144-F146 HydrophobicContact CG-CE2 3.45Å; P144-F146 VanDerWaalsContact CG-CE2 3.45Å; P144-F146 HydrophobicContact CG-CZ 3.74Å; P144-F146 WeakPolarHBondContact O-CD2 3.49Å; P144-F146 PolarHBondContact O-N 3.4Å
145	V	61.3	Low	71.3	Confident	146 Å²	146	89.7 Å²	89.7	89%	0.885	49%	0.487	S	S	*	.			trans	-74.2	90.6	169.4	-176.7	0	0	0	0	107.8	P143	P143-V145 PolarHBondContact O-N 3.11Å
146	F	60.1	Low	73.2	Confident	96 Å²	96	82.5 Å²	82.5	42%	0.421	45%	0.449	S	S	.	.			trans	-83.5	120.9	168.9	-65.7	-72.7	0	0	0	109.2	T133 V136 P144 K148	T133-F146 HydrophobicContact CG2-CD1 4.5Å; T133-F146 HydrophobicContact CG2-CD2 4.38Å; T133-F146 HydrophobicContact CG2-CE1 4.22Å; T133-F146 HydrophobicContact CG2-CE2 4.07Å; T133-F146 HydrophobicContact CG2-CZ 3.99Å; V136-F146 HydrophobicContact CB-CE2 4.29Å; V136-F146 HydrophobicContact CB-CZ 3.84Å; V136-F146 HydrophobicContact CG1-CZ 3.92Å; V136-F146 HydrophobicContact CG2-CZ 4.2Å; P144-F146 VanDerWaalsContact C-N 3.32Å; P144-F146 HydrophobicContact CB-CD2 3.91Å; P144-F146 HydrophobicContact CB-CE1 4.3Å; P144-F146 HydrophobicContact CB-CE2 3.44Å; P144-F146 VanDerWaalsContact CB-CE2 3.44Å; P144-F146 HydrophobicContact CB-CZ 3.66Å; P144-F146 HydrophobicContact CG-CD2 4.31Å; P144-F146 HydrophobicContact CG-CE2 3.45Å; P144-F146 VanDerWaalsContact CG-CE2 3.45Å; P144-F146 HydrophobicContact CG-CZ 3.74Å; P144-F146 WeakPolarHBondContact O-CD2 3.49Å; P144-F146 PolarHBondContact O-N 3.4Å; F146-K148 PolarHBondContact O-N 3.18Å
147	V	59.4	Low	74.7	Confident	125 Å²	125	78.8 Å²	78.8	76%	0.758	43%	0.426	S	S	*	.			trans	-66	108.1	162.5	-177.8	0	0	0	0	106.1	P149	V147-P149 VanDerWaalsContact O-CD 3.3Å; V147-P149 WeakPolarHBondContact O-CD 3.28Å; V147-P149 VanDerWaalsContact O-N 3.13Å
148	K	60.5	Low	76	Confident	186 Å²	186	69 Å²	69	81%	0.809	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-57.5	120.5	175.4	-85.6	-174.1	177.1	-178.7	0	107.9	F146 E150	F146-K148 PolarHBondContact O-N 3.18Å; K148-E150 PolarHBondContact O-N 3Å
149	P	65.8	Low	77.1	Confident	49 Å²	49	67.3 Å²	67.3	32%	0.318	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-62.4	131.5	176.6	25.8	-34.4	0	0	0	109.4	A127 T130 V147 K151	A127-P149 HydrophobicContact CB-CB 3.74Å; A127-P149 HydrophobicContact CB-CG 3.86Å; A127-P149 WeakPolarHBondContact CB-O 3.33Å; T130-P149 WeakPolarHBondContact OG1-CG 3.32Å; V147-P149 VanDerWaalsContact O-CD 3.3Å; V147-P149 WeakPolarHBondContact O-CD 3.28Å; V147-P149 VanDerWaalsContact O-N 3.13Å; P149-K151 PolarHBondContact O-N 2.94Å
150	E	73.1	Confident	77.9	Confident	55 Å²	55	62.2 Å²	62.2	26%	0.257	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-64.8	129.4	-179.1	-69.4	170.3	-175.2	0	0	110.5	A127 K148 V152	A127-E150 WeakPolarHBondContact CB-O 3.42Å; K148-E150 PolarHBondContact O-N 3Å; E150-V152 PolarHBondContact O-N 3.03Å
151	K	83.9	Confident	78.9	Confident	99 Å²	99	56.6 Å²	56.6	43%	0.43	32%	0.321	S	S	.	.			trans	-80.9	114.8	176.6	-175.9	-177.1	176.3	-174.4	0	109.4	L128 P149 E440	L128-K151 HydrophobicContact CD2-CG 4.43Å; P149-K151 PolarHBondContact O-N 2.94Å; K151-E440 PolarHBondContact NZ-O 3.16Å
152	V	90.3	Very high	79.8	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.024	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	123.9	173.5	174.9	0	0	0	0	109.7	T52 G54 F124 E150 G154 V155	T52-V152 WeakPolarHBondContact O-CA 3.48Å; G54-V152 VanDerWaalsContact N-CG1 3.35Å; F124-V152 HydrophobicContact CB-CB 4.4Å; F124-V152 HydrophobicContact CB-CG2 4.24Å; F124-V152 HydrophobicContact CD1-CG2 3.76Å; F124-V152 HydrophobicContact CE1-CG2 4.49Å; F124-V152 HydrophobicContact CG-CG2 4.29Å; E150-V152 PolarHBondContact O-N 3.03Å; V152-G154 VanDerWaalsContact CG1-O 3.27Å; V152-G154 WeakPolarHBondContact CG1-O 3.34Å; V152-V155 HydrophobicContact CG1-CG2 4Å
153	V	91.9	Very high	80.9	Confident	32 Å²	32	50 Å²	50	19%	0.194	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-24.4	-177.5	-60.9	0	0	0	0	113.6	L51 T52 L53 L447	L51-V153 HydrophobicContact CB-CG2 4.42Å; L51-V153 HydrophobicContact CD2-CG1 4.23Å; T52-V153 PolarHBondContact O-N 2.95Å; L53-V153 HydrophobicContact CD2-CG2 3.6Å; V153-L447 WeakPolarHBondContact O-CD2 3.39Å
154	G	94.6	Very high	82.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	158.8	178.8	0	0	0	0	0	110.3	G54 V152 P177	G54-G154 PolarHBondContact N-O 2.97Å; V152-G154 VanDerWaalsContact CG1-O 3.27Å; V152-G154 WeakPolarHBondContact CG1-O 3.34Å; G154-P177 WeakPolarHBondContact CA-O 3.31Å
155	V	96.8	Very high	83.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.7	-176.2	177.5	0	0	0	0	110.6	G54 L56 F124 V152 L171 I176 P177 Q178 I179	G54-V155 CarbonylContact O-C 3.29Å; G54-V155 WeakPolarHBondContact O-CA 2.88Å; L56-V155 HydrophobicContact CD1-CG1 3.84Å; L56-V155 HydrophobicContact CG-CG1 4.14Å; F124-V155 HydrophobicContact CD2-CG2 3.91Å; F124-V155 HydrophobicContact CE2-CG1 4.11Å; F124-V155 HydrophobicContact CE2-CG2 4.09Å; V152-V155 HydrophobicContact CG1-CG2 4Å; V155-L171 HydrophobicContact CB-CD1 3.83Å; V155-L171 HydrophobicContact CG1-CD1 4.22Å; V155-L171 HydrophobicContact CG2-CD1 3.72Å; V155-L171 HydrophobicContact CG2-CD2 4.18Å; V155-I176 HydrophobicContact CG2-CG2 4.01Å; V155-P177 PolarHBondContact N-O 3.2Å; V155-Q178 HydrophobicContact CB-CG 4.49Å; V155-Q178 CarbonylContact O-C 3.56Å; V155-Q178 VanDerWaalsContact O-CA 3.3Å; V155-Q178 WeakPolarHBondContact O-CA 3.32Å; V155-I179 PolarHBondContact O-N 2.84Å
156	I	98	Very high	85.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.9	170.4	-53.9	-57.7	0	0	0	108.9	G54 G55 L56 M84 I179 Y181 A413 V414 M417	G54-I156 PolarHBondContact O-N 2.67Å; G55-I156 WeakPolarHBondContact CA-O 3.45Å; L56-I156 PolarHBondContact N-O 2.95Å; M84-I156 HydrophobicContact CE-CG1 4.46Å; M84-I156 HydrophobicContact SD-CB 4.44Å; I156-I179 WeakPolarHBondContact CA-O 3.47Å; I156-I179 HydrophobicContact CD1-CB 4.09Å; I156-Y181 HydrophobicContact CG2-CD1 4.04Å; I156-A413 HydrophobicContact CD1-CB 4.31Å; I156-A413 HydrophobicContact CG2-CB 4.07Å; I156-V414 HydrophobicContact CG1-CG2 4.23Å; I156-V414 HydrophobicContact CG2-CG2 4.42Å; I156-M417 HydrophobicContact CD1-CB 4.38Å; I156-M417 HydrophobicContact CD1-CE 4.35Å
157	G	94.3	Very high	86.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.			trans	109.5	-167.3	-173.4	0	0	0	0	0	112.4	Q178 I179	G157-Q178 WeakPolarHBondContact O-CG 3.44Å; G157-Q178 PolarHBondContact O-NE2 3.34Å; G157-I179 PolarHBondContact N-O 3.48Å
158	A	93.1	Very high	88.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.157	C	C	.	.			cis	-78.6	178.3	-7.1	0	0	0	0	0	111.7	L56 T110 V163 S164 S180 S183	L56-A158 HydrophobicContact CB-CB 4.11Å; L56-A158 HydrophobicContact CD1-CB 4.41Å; T110-A158 HydrophobicContact CG2-CB 4.39Å; A158-V163 HydrophobicContact CB-CB 4.05Å; A158-V163 HydrophobicContact CB-CG1 3.49Å; A158-V163 VanDerWaalsContact CB-CG1 3.49Å; A158-S164 PolarHBondContact N-OG 3.33Å; A158-S164 PolarHBondContact O-OG 3.5Å; A158-S180 PolarHBondContact O-OG 3.42Å; A158-S183 PolarHBondContact O-OG 3.19Å; A158-S183 VanDerWaalsContact O-OG 3.13Å
159	S	90.3	Very high	90	Very high	17 Å²	17	23.4 Å²	23.4	12%	0.119	13%	0.133	C	C	.	.	S	Bend	trans	-76.6	-56.9	178.6	-170.6	0	0	0	0	112.8	R80 Y181 A182 S183	R80-S159 PolarHBondContact NH1-OG 3.14Å; S159-Y181 WeakPolarHBondContact CB-OH 3.44Å; S159-A182 CarbonylContact O-C 3.54Å; S159-A182 VanDerWaalsContact O-C 3.28Å; S159-S183 PolarHBondContact O-N 3.4Å; S159-S183 PolarHBondContact O-OG 3.15Å
160	A	87.9	Confident	91.2	Very high	40 Å²	40	22.3 Å²	22.3	33%	0.331	13%	0.125	S	C	.	.	S	Bend	trans	-80	138.2	-175	0	0	0	0	0	111.3	S162 V163 S164 S183	A160-S162 PolarHBondContact O-N 2.86Å; A160-V163 HydrophobicContact CB-CB 4.31Å; A160-V163 HydrophobicContact CB-CG2 3.95Å; A160-V163 WeakPolarHBondContact O-CB 3.44Å; A160-V163 PolarHBondContact O-N 2.63Å; A160-V163 VanDerWaalsContact O-N 3.12Å; A160-S164 PolarHBondContact O-N 3.17Å; A160-S183 PolarHBondContact O-OG 3.08Å
161	S	90.9	Very high	92.1	Very high	8 Å²	8	19.8 Å²	19.8	6%	0.056	11%	0.113	C	C	.	.	H	α-helix	trans	-58.3	-43.9	-177.3	-59.4	0	0	0	0	113.1	V163 S164 I165 T184 A185	S161-V163 VanDerWaalsContact C-N 3.3Å; S161-V163 PolarHBondContact O-N 2.92Å; S161-S164 PolarHBondContact O-N 3.29Å; S161-I165 VanDerWaalsContact O-CD1 3.28Å; S161-I165 WeakPolarHBondContact O-CD1 3.45Å; S161-I165 VanDerWaalsContact O-CG1 3.22Å; S161-I165 WeakPolarHBondContact O-CG1 3.36Å; S161-I165 PolarHBondContact O-N 3.09Å; S161-T184 PolarHBondContact OG-N 3.28Å; S161-A185 PolarHBondContact OG-N 3.22Å
162	S	88.6	Confident	92.5	Very high	48 Å²	48	19.5 Å²	19.5	34%	0.336	11%	0.109	S	C	.	.	H	α-helix	trans	-58.7	-40.4	176.7	50.8	0	0	0	0	112.7	A160 M166	A160-S162 PolarHBondContact O-N 2.86Å; S162-M166 PolarHBondContact O-N 2.66Å
163	V	90.7	Very high	92.6	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-67.2	-47.9	176.4	179.3	0	0	0	0	110.4	T110 D114 A117 A158 A160 S161 I165 M166 V167	T110-V163 HydrophobicContact CG2-CG1 4.31Å; D114-V163 HydrophobicContact CB-CG2 4.36Å; A117-V163 HydrophobicContact CB-CG1 3.36Å; A158-V163 HydrophobicContact CB-CB 4.05Å; A158-V163 HydrophobicContact CB-CG1 3.49Å; A158-V163 VanDerWaalsContact CB-CG1 3.49Å; A160-V163 HydrophobicContact CB-CB 4.31Å; A160-V163 HydrophobicContact CB-CG2 3.95Å; A160-V163 WeakPolarHBondContact O-CB 3.44Å; A160-V163 PolarHBondContact O-N 2.63Å; A160-V163 VanDerWaalsContact O-N 3.12Å; S161-V163 VanDerWaalsContact C-N 3.3Å; S161-V163 PolarHBondContact O-N 2.92Å; V163-I165 VanDerWaalsContact C-N 3.27Å; V163-I165 PolarHBondContact O-N 3.45Å; V163-M166 PolarHBondContact O-N 3.27Å; V163-M166 VanDerWaalsContact O-N 3.15Å; V163-V167 HydrophobicContact CG1-CG2 4.2Å; V163-V167 WeakPolarHBondContact O-CG2 3.25Å; V163-V167 PolarHBondContact O-N 2.92Å
164	S	94.6	Very high	92.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-37	178.7	-73.3	0	0	0	0	112.6	A158 A160 S161 V167 A168 S183	A158-S164 PolarHBondContact N-OG 3.33Å; A158-S164 PolarHBondContact O-OG 3.5Å; A160-S164 PolarHBondContact O-N 3.17Å; S161-S164 PolarHBondContact O-N 3.29Å; S164-V167 PolarHBondContact O-N 3.04Å; S164-A168 WeakPolarHBondContact O-CB 3.42Å; S164-A168 PolarHBondContact O-N 3.15Å; S164-S183 VanDerWaalsContact CB-OG 3.32Å; S164-S183 WeakPolarHBondContact CB-OG 3.23Å; S164-S183 PolarHBondContact OG-OG 3.44Å
165	I	93.2	Very high	92.4	Very high	9 Å²	9	29.9 Å²	29.9	5%	0.046	16%	0.157	C	C	.	.	H	α-helix	trans	-62.4	-45.9	175.5	-69.6	155.9	0	0	0	111.3	S161 V163 N169 E187 L188 Y194 S231	S161-I165 VanDerWaalsContact O-CD1 3.28Å; S161-I165 WeakPolarHBondContact O-CD1 3.45Å; S161-I165 VanDerWaalsContact O-CG1 3.22Å; S161-I165 WeakPolarHBondContact O-CG1 3.36Å; S161-I165 PolarHBondContact O-N 3.09Å; V163-I165 VanDerWaalsContact C-N 3.27Å; V163-I165 PolarHBondContact O-N 3.45Å; I165-N169 PolarHBondContact O-N 3.05Å; I165-N169 PolarHBondContact O-ND2 3.41Å; I165-N169 VanDerWaalsContact O-ND2 3.11Å; I165-E187 HydrophobicContact CD1-CG 4.17Å; I165-E187 WeakPolarHBondContact CD1-OE1 3.28Å; I165-L188 HydrophobicContact CG1-CD1 4.23Å; I165-L188 HydrophobicContact CG1-CD2 3.64Å; I165-L188 HydrophobicContact CG1-CG 3.88Å; I165-Y194 HydrophobicContact CG2-CE1 4.13Å; I165-Y194 WeakPolarHBondContact CG2-OH 3.25Å; I165-S231 WeakPolarHBondContact CD1-OG 3.26Å
166	M	92.1	Very high	92.3	Very high	65 Å²	65	30.1 Å²	30.1	32%	0.32	16%	0.159	S	C	.	.	H	α-helix	trans	-63.8	-45.1	177.8	-75.8	-58	100.2	0	0	111.8	D114 L118 S162 V163 N169	D114-M166 HydrophobicContact CB-CG 3.97Å; L118-M166 HydrophobicContact CD1-CB 4.15Å; L118-M166 VanDerWaalsContact CD1-O 3.26Å; L118-M166 WeakPolarHBondContact CD1-O 3.37Å; S162-M166 PolarHBondContact O-N 2.66Å; V163-M166 PolarHBondContact O-N 3.27Å; V163-M166 VanDerWaalsContact O-N 3.15Å; M166-N169 PolarHBondContact O-N 3.44Å
167	V	93.5	Very high	92.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.5	-44.9	-180	174.2	0	0	0	0	111.8	L56 A117 S121 V163 S164 N169 I170 L171	L56-V167 HydrophobicContact CD1-CB 4.37Å; L56-V167 HydrophobicContact CD1-CG1 3.67Å; L56-V167 HydrophobicContact CD1-CG2 4Å; A117-V167 HydrophobicContact CB-CG2 4.49Å; S121-V167 WeakPolarHBondContact OG-CG2 3.48Å; V163-V167 HydrophobicContact CG1-CG2 4.2Å; V163-V167 WeakPolarHBondContact O-CG2 3.25Å; V163-V167 PolarHBondContact O-N 2.92Å; S164-V167 PolarHBondContact O-N 3.04Å; V167-N169 PolarHBondContact O-N 3.3Å; V167-I170 PolarHBondContact O-N 3.45Å; V167-L171 HydrophobicContact CG1-CD1 3.58Å; V167-L171 HydrophobicContact CG1-CG 3.87Å; V167-L171 WeakPolarHBondContact O-CG 3.24Å; V167-L171 PolarHBondContact O-N 3Å
168	A	94.3	Very high	92.3	Very high	6 Å²	6	30.4 Å²	30.4	5%	0.05	16%	0.16	C	C	.	.	H	α-helix	trans	-58.8	-35.8	179.8	0	0	0	0	0	112.2	S164 I170 L171 R172 Y194 F197	S164-A168 WeakPolarHBondContact O-CB 3.42Å; S164-A168 PolarHBondContact O-N 3.15Å; A168-I170 VanDerWaalsContact C-N 3.27Å; A168-I170 PolarHBondContact O-N 2.83Å; A168-L171 PolarHBondContact O-N 2.92Å; A168-R172 WeakPolarHBondContact O-CB 3.46Å; A168-R172 WeakPolarHBondContact O-CG 3.4Å; A168-R172 PolarHBondContact O-N 3.21Å; A168-Y194 HydrophobicContact CB-CD1 3.99Å; A168-F197 HydrophobicContact CB-CD2 4.45Å
169	N	91.9	Very high	92.5	Very high	59 Å²	59	30.4 Å²	30.4	32%	0.316	16%	0.16	S	C	.	.	H	α-helix	trans	-62.5	-30.5	176.4	-77.8	-33.4	0	0	0	113.5	I165 M166 V167 R172	I165-N169 PolarHBondContact O-N 3.05Å; I165-N169 PolarHBondContact O-ND2 3.41Å; I165-N169 VanDerWaalsContact O-ND2 3.11Å; M166-N169 PolarHBondContact O-N 3.44Å; V167-N169 PolarHBondContact O-N 3.3Å; N169-R172 WeakPolarHBondContact O-CG 3.22Å
170	I	91.4	Very high	92.9	Very high	26 Å²	26	29.6 Å²	29.6	13%	0.133	16%	0.155	C	C	.	.	H	α-helix	trans	-82.9	-50.5	173.3	-66.7	-169.1	0	0	0	110.4	L118 L122 V167 A168 R172 L173 F174	L118-I170 HydrophobicContact CD1-CD1 3.16Å; L118-I170 HydrophobicContact CD1-CG1 3.6Å; L118-I170 HydrophobicContact CG-CD1 3.68Å; L122-I170 HydrophobicContact CD2-CD1 3.76Å; L122-I170 HydrophobicContact CD2-CG2 4.41Å; L122-I170 HydrophobicContact CG-CD1 4.2Å; V167-I170 PolarHBondContact O-N 3.45Å; A168-I170 VanDerWaalsContact C-N 3.27Å; A168-I170 PolarHBondContact O-N 2.83Å; I170-R172 VanDerWaalsContact C-N 3.25Å; I170-R172 PolarHBondContact O-N 3.15Å; I170-L173 WeakPolarHBondContact O-CB 3.5Å; I170-L173 PolarHBondContact O-N 3.37Å; I170-F174 HydrophobicContact CG2-CD2 4.31Å; I170-F174 HydrophobicContact CG2-CE2 4.25Å; I170-F174 WeakPolarHBondContact O-CD2 3.36Å
171	L	92.6	Very high	93.2	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-36.1	-173	-67.2	-176.7	0	0	0	112.5	V125 V155 V167 A168 L173 F174 Q175 I176 Q178	V125-L171 HydrophobicContact CG1-CD2 4.42Å; V155-L171 HydrophobicContact CB-CD1 3.83Å; V155-L171 HydrophobicContact CG1-CD1 4.22Å; V155-L171 HydrophobicContact CG2-CD1 3.72Å; V155-L171 HydrophobicContact CG2-CD2 4.18Å; V167-L171 HydrophobicContact CG1-CD1 3.58Å; V167-L171 HydrophobicContact CG1-CG 3.87Å; V167-L171 WeakPolarHBondContact O-CG 3.24Å; V167-L171 PolarHBondContact O-N 3Å; A168-L171 PolarHBondContact O-N 2.92Å; L171-L173 PolarHBondContact O-N 2.78Å; L171-F174 CarbonylContact O-C 3.49Å; L171-F174 PolarHBondContact O-N 3.46Å; L171-F174 VanDerWaalsContact O-N 3.11Å; L171-Q175 PolarHBondContact O-N 2.96Å; L171-I176 HydrophobicContact CB-CB 4.25Å; L171-I176 HydrophobicContact CD2-CB 4.16Å; L171-I176 HydrophobicContact CD2-CD1 4.2Å; L171-I176 HydrophobicContact CD2-CG2 4.28Å; L171-I176 PolarHBondContact O-N 3.12Å; L171-Q178 HydrophobicContact CD1-CB 4Å; L171-Q178 HydrophobicContact CD1-CG 4.27Å
172	R	92.1	Very high	93.2	Very high	93 Å²	93	27.5 Å²	27.5	35%	0.351	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-60.5	-31.8	176	74.6	177.4	-146.5	149.7	14.7	113.4	A168 N169 I170 F174 Q175 R193 F196	A168-R172 WeakPolarHBondContact O-CB 3.46Å; A168-R172 WeakPolarHBondContact O-CG 3.4Å; A168-R172 PolarHBondContact O-N 3.21Å; N169-R172 WeakPolarHBondContact O-CG 3.22Å; I170-R172 VanDerWaalsContact C-N 3.25Å; I170-R172 PolarHBondContact O-N 3.15Å; R172-F174 PolarHBondContact O-N 3.1Å; R172-Q175 PolarHBondContact O-N 2.86Å; R172-R193 PolarHBondContact NH1-O 3.4Å; R172-F196 HydrophobicContact CB-CB 4.49Å; R172-F196 HydrophobicContact CB-CD2 3.89Å
173	L	91.2	Very high	93.4	Very high	124 Å²	124	25.2 Å²	25.2	65%	0.649	12%	0.122	S	C	*	.	G	3₁₀ helix	trans	-67.9	-28.8	179.4	-61.1	175.6	0	0	0	111.7	I170 L171	I170-L173 WeakPolarHBondContact O-CB 3.5Å; I170-L173 PolarHBondContact O-N 3.37Å; L171-L173 PolarHBondContact O-N 2.78Å
174	F	90.5	Very high	93.5	Very high	65 Å²	65	25.5 Å²	25.5	29%	0.285	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-102.4	9	177.6	-63.5	-83.3	0	0	0	112.6	V125 L128 I129 I170 L171 R172 I176	V125-F174 HydrophobicContact CB-CD1 4.13Å; V125-F174 HydrophobicContact CB-CD2 3.78Å; V125-F174 HydrophobicContact CB-CE1 4.24Å; V125-F174 HydrophobicContact CB-CE2 3.89Å; V125-F174 HydrophobicContact CB-CG 3.89Å; V125-F174 HydrophobicContact CB-CZ 4.13Å; V125-F174 HydrophobicContact CG1-CB 3.9Å; V125-F174 HydrophobicContact CG1-CD1 4.33Å; V125-F174 HydrophobicContact CG1-CD2 3.4Å; V125-F174 VanDerWaalsContact CG1-CD2 3.4Å; V125-F174 HydrophobicContact CG1-CE2 3.97Å; V125-F174 HydrophobicContact CG1-CG 3.61Å; V125-F174 HydrophobicContact CG2-CD2 4.16Å; V125-F174 HydrophobicContact CG2-CE2 3.83Å; V125-F174 HydrophobicContact CG2-CZ 4.11Å; L128-F174 HydrophobicContact CB-CD1 4.11Å; L128-F174 HydrophobicContact CD1-CB 3.89Å; L128-F174 HydrophobicContact CD1-CD1 4.18Å; L128-F174 HydrophobicContact CD1-CG 4.4Å; I129-F174 HydrophobicContact CD1-CE1 4.03Å; I129-F174 HydrophobicContact CD1-CZ 3.72Å; I129-F174 HydrophobicContact CG1-CE1 3.61Å; I129-F174 HydrophobicContact CG1-CZ 3.83Å; I170-F174 HydrophobicContact CG2-CD2 4.31Å; I170-F174 HydrophobicContact CG2-CE2 4.25Å; I170-F174 WeakPolarHBondContact O-CD2 3.36Å; L171-F174 CarbonylContact O-C 3.49Å; L171-F174 PolarHBondContact O-N 3.46Å; L171-F174 VanDerWaalsContact O-N 3.11Å; R172-F174 PolarHBondContact O-N 3.1Å; F174-I176 HydrophobicContact CB-CD1 4.25Å; F174-I176 HydrophobicContact CB-CG1 4.16Å; F174-I176 PolarHBondContact O-N 3.01Å
175	Q	92.6	Very high	93.4	Very high	65 Å²	65	25.5 Å²	25.5	30%	0.304	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	31.8	179.1	-51.4	179.4	-83.8	0	0	113.5	L171 R172 P177 F196 D443 G444 K445	L171-Q175 PolarHBondContact O-N 2.96Å; R172-Q175 PolarHBondContact O-N 2.86Å; Q175-P177 WeakPolarHBondContact O-CD 3.27Å; Q175-F196 HydrophobicContact CB-CE1 3.71Å; Q175-F196 HydrophobicContact CB-CE2 4.42Å; Q175-F196 HydrophobicContact CB-CZ 3.57Å; Q175-F196 HydrophobicContact CG-CE1 4.45Å; Q175-F196 HydrophobicContact CG-CE2 4.42Å; Q175-F196 HydrophobicContact CG-CZ 3.81Å; Q175-F196 WeakPolarHBondContact O-CE1 3.48Å; Q175-D443 WeakPolarHBondContact CB-OD1 3.48Å; Q175-D443 VanDerWaalsContact NE2-CG 3.3Å; Q175-D443 PolarHBondContact NE2-OD1 2.88Å; Q175-D443 PolarHBondContact NE2-OD2 3.39Å; Q175-D443 PolarHBondContact OE1-OD1 2.95Å; Q175-G444 WeakPolarHBondContact O-CA 3.42Å; Q175-K445 VanDerWaalsContact NE2-CE 3.31Å
176	I	94.1	Very high	93.3	Very high	6 Å²	6	26.5 Å²	26.5	3%	0.031	13%	0.13	C	C	.	.			trans	-90.4	117.3	178.6	-59	179.1	0	0	0	108.8	V125 L128 V155 L171 F174	V125-I176 HydrophobicContact CG1-CD1 3.83Å; L128-I176 HydrophobicContact CD1-CD1 3.97Å; L128-I176 HydrophobicContact CD1-CG1 4.33Å; V155-I176 HydrophobicContact CG2-CG2 4.01Å; L171-I176 HydrophobicContact CB-CB 4.25Å; L171-I176 HydrophobicContact CD2-CB 4.16Å; L171-I176 HydrophobicContact CD2-CD1 4.2Å; L171-I176 HydrophobicContact CD2-CG2 4.28Å; L171-I176 PolarHBondContact O-N 3.12Å; F174-I176 HydrophobicContact CB-CD1 4.25Å; F174-I176 HydrophobicContact CB-CG1 4.16Å; F174-I176 PolarHBondContact O-N 3.01Å
177	P	96.1	Very high	93.2	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.013	12%	0.122	C	C	.	.			trans	-69.2	142	176.5	28.4	-33.4	0	0	0	111.7	G154 V155 Q175 F196 L447 L448 I451	G154-P177 WeakPolarHBondContact CA-O 3.31Å; V155-P177 PolarHBondContact N-O 3.2Å; Q175-P177 WeakPolarHBondContact O-CD 3.27Å; P177-F196 WeakPolarHBondContact CA-O 3.44Å; P177-L447 HydrophobicContact CG-CB 4.46Å; P177-L447 HydrophobicContact CG-CD2 3.81Å; P177-L447 HydrophobicContact CG-CG 4.07Å; P177-L448 HydrophobicContact CB-CD1 4.28Å; P177-I451 HydrophobicContact CB-CD1 3.68Å; P177-I451 HydrophobicContact CG-CD1 3.84Å
178	Q	96.7	Very high	93.2	Very high	3 Å²	3	25 Å²	25	1%	0.014	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.9	180	-178.5	-173.3	-23.3	0	0	110	V155 G157 L171 F196 F197 S198	V155-Q178 HydrophobicContact CB-CG 4.49Å; V155-Q178 CarbonylContact O-C 3.56Å; V155-Q178 VanDerWaalsContact O-CA 3.3Å; V155-Q178 WeakPolarHBondContact O-CA 3.32Å; G157-Q178 WeakPolarHBondContact O-CG 3.44Å; G157-Q178 PolarHBondContact O-NE2 3.34Å; L171-Q178 HydrophobicContact CD1-CB 4Å; L171-Q178 HydrophobicContact CD1-CG 4.27Å; Q178-F196 PolarHBondContact N-O 2.88Å; Q178-F197 HydrophobicContact CB-CD2 4.48Å; Q178-F197 HydrophobicContact CG-CD2 4.27Å; Q178-S198 PolarHBondContact O-N 2.75Å
179	I	97.9	Very high	93.1	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	109.9	171.8	-51.7	179.6	0	0	0	109	V155 I156 G157 S198 V200 A413 A416 M417 I451	V155-I179 PolarHBondContact O-N 2.84Å; I156-I179 WeakPolarHBondContact CA-O 3.47Å; I156-I179 HydrophobicContact CD1-CB 4.09Å; G157-I179 PolarHBondContact N-O 3.48Å; I179-S198 CarbonylContact C-O 3.57Å; I179-S198 VanDerWaalsContact CA-O 3.26Å; I179-S198 WeakPolarHBondContact CA-O 3.33Å; I179-V200 HydrophobicContact CG2-CG1 4.09Å; I179-A413 HydrophobicContact CG2-CB 3.82Å; I179-A416 HydrophobicContact CD1-CB 4.21Å; I179-M417 HydrophobicContact CD1-CB 4.38Å; I179-M417 HydrophobicContact CD1-CE 3.81Å; I179-M417 HydrophobicContact CG1-CE 4.05Å; I179-I451 HydrophobicContact CD1-CD1 4.22Å; I179-I451 HydrophobicContact CD1-CG1 4.31Å; I179-I451 HydrophobicContact CD1-CG2 3.61Å; I179-I451 HydrophobicContact CG1-CG2 4.06Å
180	S	97.1	Very high	93.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	142	174.7	-178	0	0	0	0	111.7	A158 A182 S183 S198 R199 V200	A158-S180 PolarHBondContact O-OG 3.42Å; S180-A182 PolarHBondContact OG-N 3.28Å; S180-S183 VanDerWaalsContact OG-CB 3.26Å; S180-S183 WeakPolarHBondContact OG-CB 3.19Å; S180-S183 PolarHBondContact OG-N 3.11Å; S180-S183 PolarHBondContact OG-OG 3.47Å; S180-S198 PolarHBondContact N-O 2.94Å; S180-R199 VanDerWaalsContact O-CA 3.23Å; S180-R199 WeakPolarHBondContact O-CA 3.42Å; S180-R199 VanDerWaalsContact O-CB 3.31Å; S180-R199 WeakPolarHBondContact O-CB 3.39Å; S180-V200 PolarHBondContact O-N 3.12Å
181	Y	94.8	Very high	93.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-99.1	-5.1	176	59	-98.9	0	0	0	113.4	L56 F57 I156 S159 V201 F409 V410	L56-Y181 PolarHBondContact O-OH 3.2Å; F57-Y181 AromaticContact CD1-CE1 3.96Å; F57-Y181 HydrophobicContact CD1-CE1 3.96Å; F57-Y181 AromaticContact CD1-CZ 3.76Å; F57-Y181 WeakPolarHBondContact CD1-OH 3.49Å; F57-Y181 HydrophobicContact CE1-CD1 4.39Å; F57-Y181 AromaticContact CE1-CE1 3.6Å; F57-Y181 HydrophobicContact CE1-CE1 3.6Å; F57-Y181 AromaticContact CE1-CZ 3.81Å; F57-Y181 HydrophobicContact CZ-CE1 4.3Å; I156-Y181 HydrophobicContact CG2-CD1 4.04Å; S159-Y181 WeakPolarHBondContact CB-OH 3.44Å; Y181-V201 WeakPolarHBondContact O-CG1 3.44Å; Y181-F409 WeakPolarHBondContact O-CB 3.43Å; Y181-V410 HydrophobicContact CD1-CG2 3.99Å; Y181-V410 HydrophobicContact CD2-CG2 3.58Å; Y181-V410 HydrophobicContact CE1-CG2 4.37Å; Y181-V410 HydrophobicContact CE2-CG2 4.04Å; Y181-V410 HydrophobicContact CG-CB 4.49Å; Y181-V410 HydrophobicContact CG-CG2 3.57Å
182	A	92.3	Very high	93	Very high	4 Å²	4	38 Å²	38	3%	0.033	18%	0.176	C	C	.	.	S	Bend	trans	-152.2	-7.4	-172.7	0	0	0	0	0	116.3	S159 S180 T184 K406	S159-A182 CarbonylContact O-C 3.54Å; S159-A182 VanDerWaalsContact O-C 3.28Å; S180-A182 PolarHBondContact OG-N 3.28Å; A182-T184 PolarHBondContact O-N 2.9Å; A182-K406 HydrophobicContact CB-CD 3.61Å
183	S	92.6	Very high	93	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.179	C	C	.	.			trans	-83.4	109.8	179.9	-63.7	0	0	0	0	111.4	A158 S159 A160 S164 S180 R199	A158-S183 PolarHBondContact O-OG 3.19Å; A158-S183 VanDerWaalsContact O-OG 3.13Å; S159-S183 PolarHBondContact O-N 3.4Å; S159-S183 PolarHBondContact O-OG 3.15Å; A160-S183 PolarHBondContact O-OG 3.08Å; S164-S183 VanDerWaalsContact CB-OG 3.32Å; S164-S183 WeakPolarHBondContact CB-OG 3.23Å; S164-S183 PolarHBondContact OG-OG 3.44Å; S180-S183 VanDerWaalsContact OG-CB 3.26Å; S180-S183 WeakPolarHBondContact OG-CB 3.19Å; S180-S183 PolarHBondContact OG-N 3.11Å; S180-S183 PolarHBondContact OG-OG 3.47Å; S183-R199 WeakPolarHBondContact O-CD 3.47Å; S183-R199 PolarHBondContact O-NH1 3.47Å
184	T	92.8	Very high	93.1	Very high	7 Å²	7	33.4 Å²	33.4	4%	0.043	15%	0.151	C	C	.	.			trans	-107.4	-0.5	-169.9	56.4	0	0	0	0	114	S161 A182 R199 V201 P203 D204 Y232	S161-T184 PolarHBondContact OG-N 3.28Å; A182-T184 PolarHBondContact O-N 2.9Å; T184-R199 PolarHBondContact O-NH1 3.14Å; T184-R199 VanDerWaalsContact O-NH1 3.12Å; T184-V201 HydrophobicContact CG2-CB 4.3Å; T184-V201 HydrophobicContact CG2-CG2 3.82Å; T184-P203 CarbonylContact O-C 3.28Å; T184-P203 WeakPolarHBondContact O-CA 3.06Å; T184-D204 VanDerWaalsContact C-OD2 3.23Å; T184-D204 WeakPolarHBondContact CB-OD1 3.46Å; T184-D204 PolarHBondContact O-N 3.3Å; T184-D204 VanDerWaalsContact OG1-CG 3.31Å; T184-D204 PolarHBondContact OG1-OD1 3.03Å; T184-D204 PolarHBondContact OG1-OD2 3.19Å; T184-Y232 WeakPolarHBondContact OG1-CE2 3.47Å
185	A	91.3	Very high	93.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.151	C	C	.	.			trans	-55.4	135.2	-178.5	0	0	0	0	0	112.3	S161 E187 L188 R199 D204	S161-A185 PolarHBondContact OG-N 3.22Å; A185-E187 VanDerWaalsContact C-N 3.27Å; A185-E187 HydrophobicContact CB-CG 4.33Å; A185-E187 PolarHBondContact O-N 2.85Å; A185-L188 HydrophobicContact CB-CD1 4.37Å; A185-L188 PolarHBondContact O-N 2.82Å; A185-R199 PolarHBondContact O-NH1 2.97Å; A185-D204 WeakPolarHBondContact CA-OD2 3.14Å; A185-D204 PolarHBondContact N-OD2 3.22Å
186	P	91.2	Very high	93.3	Very high	29 Å²	29	30.2 Å²	30.2	19%	0.188	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-63.6	-29	-177.5	-25.2	34.7	0	0	0	114	L188 S189 D204 K235	P186-L188 PolarHBondContact O-N 3.35Å; P186-S189 WeakPolarHBondContact O-CB 3.49Å; P186-S189 PolarHBondContact O-N 2.98Å; P186-S189 VanDerWaalsContact O-N 3.16Å; P186-D204 HydrophobicContact CG-CB 4.04Å; P186-K235 HydrophobicContact CG-CB 4.31Å
187	E	90.6	Very high	93.5	Very high	31 Å²	31	30 Å²	30	15%	0.145	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-68.4	-20.8	-176.1	61.8	-176.5	-162.2	0	0	114.4	I165 A185 S189 D190 Y194 S231 K235	I165-E187 HydrophobicContact CD1-CG 4.17Å; I165-E187 WeakPolarHBondContact CD1-OE1 3.28Å; A185-E187 VanDerWaalsContact C-N 3.27Å; A185-E187 HydrophobicContact CB-CG 4.33Å; A185-E187 PolarHBondContact O-N 2.85Å; E187-S189 PolarHBondContact O-N 3.42Å; E187-D190 WeakPolarHBondContact O-CB 3.5Å; E187-D190 PolarHBondContact O-N 3.41Å; E187-Y194 VanDerWaalsContact O-CD2 3.27Å; E187-Y194 WeakPolarHBondContact O-CD2 3.41Å; E187-Y194 VanDerWaalsContact O-CE2 3.25Å; E187-Y194 WeakPolarHBondContact O-CE2 3.42Å; E187-S231 WeakPolarHBondContact OE1-CB 3.44Å; E187-S231 PolarHBondContact OE1-OG 3.08Å; E187-K235 VanDerWaalsContact OE2-CE 3.23Å; E187-K235 WeakPolarHBondContact OE2-CE 3.36Å
188	L	93	Very high	93.5	Very high	2 Å²	2	30 Å²	30	1%	0.01	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-70.6	-15.7	175.1	-75.7	165.7	0	0	0	113.1	I165 A185 P186 D190 Y194 F197	I165-L188 HydrophobicContact CG1-CD1 4.23Å; I165-L188 HydrophobicContact CG1-CD2 3.64Å; I165-L188 HydrophobicContact CG1-CG 3.88Å; A185-L188 HydrophobicContact CB-CD1 4.37Å; A185-L188 PolarHBondContact O-N 2.82Å; P186-L188 PolarHBondContact O-N 3.35Å; L188-D190 VanDerWaalsContact C-N 3.25Å; L188-D190 PolarHBondContact O-N 3.35Å; L188-Y194 HydrophobicContact CD2-CD1 4.2Å; L188-Y194 HydrophobicContact CD2-CD2 4.27Å; L188-Y194 HydrophobicContact CD2-CE1 4.41Å; L188-Y194 HydrophobicContact CD2-CE2 4.48Å; L188-Y194 HydrophobicContact CD2-CG 4.12Å; L188-F197 HydrophobicContact CB-CD1 3.89Å; L188-F197 HydrophobicContact CB-CE1 3.66Å; L188-F197 HydrophobicContact CB-CZ 4.26Å; L188-F197 HydrophobicContact CD1-CE1 4.02Å; L188-F197 HydrophobicContact CD1-CE2 4.32Å; L188-F197 HydrophobicContact CD1-CZ 3.75Å; L188-F197 HydrophobicContact CD2-CD1 4.24Å; L188-F197 HydrophobicContact CD2-CD2 4.22Å; L188-F197 HydrophobicContact CD2-CE1 4.25Å; L188-F197 HydrophobicContact CD2-CE2 4.22Å; L188-F197 HydrophobicContact CD2-CG 4.23Å; L188-F197 HydrophobicContact CD2-CZ 4.24Å; L188-F197 HydrophobicContact CG-CE1 4.2Å; L188-F197 HydrophobicContact CG-CZ 4.31Å
189	S	93.2	Very high	93.5	Very high	19 Å²	19	29.8 Å²	29.8	13%	0.133	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-77.1	-8.1	173.6	-63.1	0	0	0	0	113.6	P186 E187 D191 R199 D471	P186-S189 WeakPolarHBondContact O-CB 3.49Å; P186-S189 PolarHBondContact O-N 2.98Å; P186-S189 VanDerWaalsContact O-N 3.16Å; E187-S189 PolarHBondContact O-N 3.42Å; S189-D191 PolarHBondContact O-N 2.9Å; S189-R199 PolarHBondContact OG-NH2 3.13Å; S189-D471 WeakPolarHBondContact CB-OD2 3.27Å; S189-D471 VanDerWaalsContact OG-CG 3.23Å; S189-D471 PolarHBondContact OG-OD1 3.25Å; S189-D471 VanDerWaalsContact OG-OD1 3.1Å; S189-D471 PolarHBondContact OG-OD2 3.3Å
190	D	92.9	Very high	93.3	Very high	55 Å²	55	30.3 Å²	30.3	29%	0.294	14%	0.139	S	C	.	.			trans	-76	91.6	178.3	-178.4	8.2	0	0	0	110.9	E187 L188 R192 R193 Y194	E187-D190 WeakPolarHBondContact O-CB 3.5Å; E187-D190 PolarHBondContact O-N 3.41Å; L188-D190 VanDerWaalsContact C-N 3.25Å; L188-D190 PolarHBondContact O-N 3.35Å; D190-R192 PolarHBondContact O-N 3.04Å; D190-R192 WeakPolarHBondContact OD1-CB 3.09Å; D190-R192 PolarHBondContact OD1-N 2.96Å; D190-R192 VanDerWaalsContact OD1-N 3.16Å; D190-R193 PolarHBondContact O-N 2.79Å; D190-R193 IonicContact OD2-CZ 2.76Å; D190-R193 IonicContact OD2-NE 3.93Å; D190-R193 PolarHBondContact OD2-NE 3.31Å; D190-R193 IonicContact OD2-NH2 3.49Å; D190-Y194 PolarHBondContact O-N 3.48Å
191	D	89.1	Confident	93.1	Very high	65 Å²	65	30.5 Å²	30.5	35%	0.348	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-16.7	-179.8	-162	50.1	0	0	0	113.3	S189 R193 D195 R452	S189-D191 PolarHBondContact O-N 2.9Å; D191-R193 VanDerWaalsContact C-N 3.34Å; D191-D195 WeakPolarHBondContact O-CA 3.49Å; D191-D195 WeakPolarHBondContact O-CB 3.27Å; D191-R452 IonicContact OD1-CZ 3.69Å; D191-R452 VanDerWaalsContact OD1-CZ 3.25Å; D191-R452 IonicContact OD1-NH1 3.78Å; D191-R452 PolarHBondContact OD1-NH1 3.46Å; D191-R452 IonicContact OD1-NH2 2.92Å; D191-R452 PolarHBondContact OD1-NH2 3.35Å; D191-R452 IonicContact OD2-NH1 2.69Å
192	R	91.1	Very high	93.1	Very high	227 Å²	227	30.8 Å²	30.8	86%	0.857	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-27	174.4	-59.7	175.7	59.3	178.5	-3.2	112.5	D190	D190-R192 PolarHBondContact O-N 3.04Å; D190-R192 WeakPolarHBondContact OD1-CB 3.09Å; D190-R192 PolarHBondContact OD1-N 2.96Å; D190-R192 VanDerWaalsContact OD1-N 3.16Å
193	R	91.8	Very high	93.1	Very high	106 Å²	106	30.7 Å²	30.7	40%	0.4	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-38	-179	-69.8	-169.4	-67.4	154.5	6.9	112	R172 D190 D191	R172-R193 PolarHBondContact NH1-O 3.4Å; D190-R193 PolarHBondContact O-N 2.79Å; D190-R193 IonicContact OD2-CZ 2.76Å; D190-R193 IonicContact OD2-NE 3.93Å; D190-R193 PolarHBondContact OD2-NE 3.31Å; D190-R193 IonicContact OD2-NH2 3.49Å; D191-R193 VanDerWaalsContact C-N 3.34Å
194	Y	93.6	Very high	93.1	Very high	15 Å²	15	30.8 Å²	30.8	6%	0.059	14%	0.141	C	C	.	.			trans	-121.5	53.3	-174.3	-51.7	-71.2	0	0	0	111.2	I165 A168 E187 L188 D190 F196 F197	I165-Y194 HydrophobicContact CG2-CE1 4.13Å; I165-Y194 WeakPolarHBondContact CG2-OH 3.25Å; A168-Y194 HydrophobicContact CB-CD1 3.99Å; E187-Y194 VanDerWaalsContact O-CD2 3.27Å; E187-Y194 WeakPolarHBondContact O-CD2 3.41Å; E187-Y194 VanDerWaalsContact O-CE2 3.25Å; E187-Y194 WeakPolarHBondContact O-CE2 3.42Å; L188-Y194 HydrophobicContact CD2-CD1 4.2Å; L188-Y194 HydrophobicContact CD2-CD2 4.27Å; L188-Y194 HydrophobicContact CD2-CE1 4.41Å; L188-Y194 HydrophobicContact CD2-CE2 4.48Å; L188-Y194 HydrophobicContact CD2-CG 4.12Å; D190-Y194 PolarHBondContact O-N 3.48Å; Y194-F196 PolarHBondContact O-N 3.25Å; Y194-F197 WeakPolarHBondContact O-CB 3.33Å; Y194-F197 PolarHBondContact O-N 3.01Å
195	D	92.7	Very high	93.1	Very high	54 Å²	54	32.5 Å²	32.5	29%	0.289	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-26	-175.9	56.3	-25.9	0	0	0	114.4	D191 L448 R452	D191-D195 WeakPolarHBondContact O-CA 3.49Å; D191-D195 WeakPolarHBondContact O-CB 3.27Å; D195-L448 WeakPolarHBondContact O-CD2 3.29Å; D195-R452 PolarHBondContact O-NH2 3.06Å; D195-R452 VanDerWaalsContact O-NH2 3.08Å
196	F	95.3	Very high	93.2	Very high	9 Å²	9	35.1 Å²	35.1	4%	0.039	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	7.4	177.1	-72.5	-92	0	0	0	114.5	R172 Q175 P177 Q178 Y194 K445 L448	R172-F196 HydrophobicContact CB-CB 4.49Å; R172-F196 HydrophobicContact CB-CD2 3.89Å; Q175-F196 HydrophobicContact CB-CE1 3.71Å; Q175-F196 HydrophobicContact CB-CE2 4.42Å; Q175-F196 HydrophobicContact CB-CZ 3.57Å; Q175-F196 HydrophobicContact CG-CE1 4.45Å; Q175-F196 HydrophobicContact CG-CE2 4.42Å; Q175-F196 HydrophobicContact CG-CZ 3.81Å; Q175-F196 WeakPolarHBondContact O-CE1 3.48Å; P177-F196 WeakPolarHBondContact CA-O 3.44Å; Q178-F196 PolarHBondContact N-O 2.88Å; Y194-F196 PolarHBondContact O-N 3.25Å; F196-K445 HydrophobicContact CE1-CB 4.48Å; F196-K445 HydrophobicContact CE1-CG 3.77Å; F196-K445 HydrophobicContact CE2-CG 4.45Å; F196-K445 HydrophobicContact CZ-CB 4.5Å; F196-K445 HydrophobicContact CZ-CD 4.29Å; F196-K445 HydrophobicContact CZ-CG 3.37Å; F196-L448 HydrophobicContact CD1-CD2 4.28Å
197	F	96.9	Very high	93.4	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.009	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	141.8	178.9	-173.5	-95.3	0	0	0	110.9	A168 Q178 L188 Y194 R199 R452	A168-F197 HydrophobicContact CB-CD2 4.45Å; Q178-F197 HydrophobicContact CB-CD2 4.48Å; Q178-F197 HydrophobicContact CG-CD2 4.27Å; L188-F197 HydrophobicContact CB-CD1 3.89Å; L188-F197 HydrophobicContact CB-CE1 3.66Å; L188-F197 HydrophobicContact CB-CZ 4.26Å; L188-F197 HydrophobicContact CD1-CE1 4.02Å; L188-F197 HydrophobicContact CD1-CE2 4.32Å; L188-F197 HydrophobicContact CD1-CZ 3.75Å; L188-F197 HydrophobicContact CD2-CD1 4.24Å; L188-F197 HydrophobicContact CD2-CD2 4.22Å; L188-F197 HydrophobicContact CD2-CE1 4.25Å; L188-F197 HydrophobicContact CD2-CE2 4.22Å; L188-F197 HydrophobicContact CD2-CG 4.23Å; L188-F197 HydrophobicContact CD2-CZ 4.24Å; L188-F197 HydrophobicContact CG-CE1 4.2Å; L188-F197 HydrophobicContact CG-CZ 4.31Å; Y194-F197 WeakPolarHBondContact O-CB 3.33Å; Y194-F197 PolarHBondContact O-N 3.01Å; F197-R199 HydrophobicContact CE1-CB 4.11Å; F197-R199 HydrophobicContact CE1-CG 4.09Å; F197-R199 HydrophobicContact CZ-CB 4.28Å; F197-R452 PolarHBondContact O-NH2 2.99Å
198	S	96.9	Very high	93.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	162.8	169.4	-63.6	0	0	0	0	108.9	Q178 I179 S180 G470	Q178-S198 PolarHBondContact O-N 2.75Å; I179-S198 CarbonylContact C-O 3.57Å; I179-S198 VanDerWaalsContact CA-O 3.26Å; I179-S198 WeakPolarHBondContact CA-O 3.33Å; S180-S198 PolarHBondContact N-O 2.94Å; S198-G470 CarbonylContact C-O 3.5Å; S198-G470 WeakPolarHBondContact CA-O 3.41Å; S198-G470 WeakPolarHBondContact CB-O 2.98Å
199	R	96	Very high	93.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	146.7	179.4	56.9	175.7	172.7	-156.4	-9.7	112.5	S180 S183 T184 A185 S189 F197 V201 F466 G470 D471 A472	S180-R199 VanDerWaalsContact O-CA 3.23Å; S180-R199 WeakPolarHBondContact O-CA 3.42Å; S180-R199 VanDerWaalsContact O-CB 3.31Å; S180-R199 WeakPolarHBondContact O-CB 3.39Å; S183-R199 WeakPolarHBondContact O-CD 3.47Å; S183-R199 PolarHBondContact O-NH1 3.47Å; T184-R199 PolarHBondContact O-NH1 3.14Å; T184-R199 VanDerWaalsContact O-NH1 3.12Å; A185-R199 PolarHBondContact O-NH1 2.97Å; S189-R199 PolarHBondContact OG-NH2 3.13Å; F197-R199 HydrophobicContact CE1-CB 4.11Å; F197-R199 HydrophobicContact CE1-CG 4.09Å; F197-R199 HydrophobicContact CZ-CB 4.28Å; R199-V201 VanDerWaalsContact C-N 3.31Å; R199-V201 HydrophobicContact CB-CG2 4.29Å; R199-V201 VanDerWaalsContact CD-O 3.23Å; R199-V201 WeakPolarHBondContact CD-O 3.43Å; R199-V201 VanDerWaalsContact CG-O 3.32Å; R199-V201 WeakPolarHBondContact CG-O 3.49Å; R199-F466 VanDerWaalsContact O-CE1 3.32Å; R199-F466 WeakPolarHBondContact O-CE1 3.31Å; R199-G470 PolarHBondContact N-O 3.03Å; R199-D471 IonicContact CZ-OD1 3.33Å; R199-D471 IonicContact NE-OD1 3.69Å; R199-D471 PolarHBondContact NE-OD1 2.98Å; R199-D471 IonicContact NH2-OD1 3.79Å; R199-D471 PolarHBondContact NH2-OD1 3.38Å; R199-D471 IonicContact NH2-OD2 2.82Å; R199-A472 PolarHBondContact O-N 2.84Å
200	V	94.8	Very high	93.9	Very high	11 Å²	11	34 Å²	34	7%	0.067	16%	0.155	C	C	.	.	S	Bend	trans	-90.8	2.5	178	-62.4	0	0	0	0	113	I179 S180 F409 A413 V464 F466 A472	I179-V200 HydrophobicContact CG2-CG1 4.09Å; S180-V200 PolarHBondContact O-N 3.12Å; V200-F409 HydrophobicContact CG2-CB 3.96Å; V200-F409 HydrophobicContact CG2-CD1 4.44Å; V200-F409 VanDerWaalsContact CG2-O 3.26Å; V200-F409 WeakPolarHBondContact CG2-O 2.99Å; V200-A413 HydrophobicContact CG1-CB 4.31Å; V200-A413 HydrophobicContact CG2-CB 4.07Å; V200-V464 HydrophobicContact CG1-CG1 4.11Å; V200-F466 HydrophobicContact CG1-CE1 4.01Å; V200-F466 HydrophobicContact CG1-CZ 3.82Å; V200-A472 VanDerWaalsContact C-CB 3.41Å; V200-A472 VanDerWaalsContact O-CB 3.3Å; V200-A472 WeakPolarHBondContact O-CB 3.48Å
201	V	93.1	Very high	94	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.024	14%	0.141	C	C	.	.	S	Bend	trans	-110.4	147.3	173.8	-66.4	0	0	0	0	110.6	Y181 T184 R199 F409	Y181-V201 WeakPolarHBondContact O-CG1 3.44Å; T184-V201 HydrophobicContact CG2-CB 4.3Å; T184-V201 HydrophobicContact CG2-CG2 3.82Å; R199-V201 VanDerWaalsContact C-N 3.31Å; R199-V201 HydrophobicContact CB-CG2 4.29Å; R199-V201 VanDerWaalsContact CD-O 3.23Å; R199-V201 WeakPolarHBondContact CD-O 3.43Å; R199-V201 VanDerWaalsContact CG-O 3.32Å; R199-V201 WeakPolarHBondContact CG-O 3.49Å; V201-F409 HydrophobicContact CG1-CB 4.04Å; V201-F409 HydrophobicContact CG1-CD1 3.86Å; V201-F409 HydrophobicContact CG1-CD2 3.73Å; V201-F409 HydrophobicContact CG1-CE1 4.25Å; V201-F409 HydrophobicContact CG1-CE2 4.14Å; V201-F409 HydrophobicContact CG1-CG 3.6Å; V201-F409 HydrophobicContact CG1-CZ 4.39Å
202	P	93.3	Very high	94.4	Very high	7 Å²	7	28.3 Å²	28.3	5%	0.045	13%	0.125	C	C	.	.			trans	-72.7	150.8	179.4	28.7	-34.9	0	0	0	112.8	F206 Y476	P202-F206 HydrophobicContact CB-CD2 4.18Å; P202-Y476 HydrophobicContact CG-CE1 4.06Å; P202-Y476 HydrophobicContact CG-CE2 4.46Å; P202-Y476 WeakPolarHBondContact CG-OH 3.18Å
203	P	93.6	Very high	94.6	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.013	9%	0.091	C	C	.	.			trans	-62.2	152.7	171.2	4.2	-12.3	0	0	0	114	T184 S205 F206 D471 Y476	T184-P203 CarbonylContact O-C 3.28Å; T184-P203 WeakPolarHBondContact O-CA 3.06Å; P203-S205 WeakPolarHBondContact CB-OG 3.48Å; P203-S205 PolarHBondContact O-N 2.81Å; P203-F206 HydrophobicContact CG-CD2 3.66Å; P203-F206 HydrophobicContact CG-CE2 3.74Å; P203-F206 PolarHBondContact O-N 2.99Å; P203-D471 HydrophobicContact CG-CB 4.31Å; P203-Y476 PolarHBondContact O-OH 2.89Å
204	D	91.9	Very high	94.8	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-61.6	-14.1	171.7	-55.9	-34.3	0	0	0	112.7	T184 A185 P186 F206 Q207 A208 Y232 F286	T184-D204 VanDerWaalsContact C-OD2 3.23Å; T184-D204 WeakPolarHBondContact CB-OD1 3.46Å; T184-D204 PolarHBondContact O-N 3.3Å; T184-D204 VanDerWaalsContact OG1-CG 3.31Å; T184-D204 PolarHBondContact OG1-OD1 3.03Å; T184-D204 PolarHBondContact OG1-OD2 3.19Å; A185-D204 WeakPolarHBondContact CA-OD2 3.14Å; A185-D204 PolarHBondContact N-OD2 3.22Å; P186-D204 HydrophobicContact CG-CB 4.04Å; D204-F206 VanDerWaalsContact C-N 3.3Å; D204-F206 PolarHBondContact O-N 3.48Å; D204-Q207 WeakPolarHBondContact O-CB 3.43Å; D204-Q207 PolarHBondContact O-N 3.49Å; D204-Q207 PolarHBondContact OD1-OE1 3.06Å; D204-A208 VanDerWaalsContact O-CB 3.31Å; D204-A208 WeakPolarHBondContact O-CB 3.42Å; D204-A208 PolarHBondContact O-N 3.33Å; D204-Y232 WeakPolarHBondContact OD2-CD2 3.33Å; D204-Y232 WeakPolarHBondContact OD2-CE2 3.19Å; D204-F286 HydrophobicContact CB-CE1 4.4Å
205	S	92.9	Very high	94.9	Very high	43 Å²	43	13.1 Å²	13.1	30%	0.301	7%	0.069	S	C	.	.	H	α-helix	trans	-63.3	-36.8	172.6	60.5	0	0	0	0	112	P203 Q209	P203-S205 WeakPolarHBondContact CB-OG 3.48Å; P203-S205 PolarHBondContact O-N 2.81Å; S205-Q209 PolarHBondContact O-N 2.98Å
206	F	94.2	Very high	95	Very high	56 Å²	56	14.4 Å²	14.4	25%	0.246	7%	0.074	C	C	.	.	H	α-helix	trans	-72.9	-34.9	174.1	-66.9	-63.2	0	0	0	111.6	P202 P203 D204 Q209 A210 Y476 W497	P202-F206 HydrophobicContact CB-CD2 4.18Å; P203-F206 HydrophobicContact CG-CD2 3.66Å; P203-F206 HydrophobicContact CG-CE2 3.74Å; P203-F206 PolarHBondContact O-N 2.99Å; D204-F206 VanDerWaalsContact C-N 3.3Å; D204-F206 PolarHBondContact O-N 3.48Å; F206-Q209 WeakPolarHBondContact O-CB 3.38Å; F206-Q209 PolarHBondContact O-N 3.03Å; F206-A210 PolarHBondContact O-N 3.08Å; F206-Y476 HydrophobicContact CB-CE2 3.86Å; F206-W497 HydrophobicContact CB-CH2 4.13Å; F206-W497 HydrophobicContact CB-CZ3 4.08Å; F206-W497 AromaticContact CD1-CH2 3.9Å; F206-W497 HydrophobicContact CD1-CH2 3.9Å; F206-W497 HydrophobicContact CD1-CZ3 4.36Å; F206-W497 HydrophobicContact CG-CH2 4.44Å
207	Q	94.1	Very high	94.9	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-65.2	-43.5	173.8	-174.5	-179.4	46.3	0	0	111.8	D204 Q209 A210 M211 F286 S313 D314 I336 Y476	D204-Q207 WeakPolarHBondContact O-CB 3.43Å; D204-Q207 PolarHBondContact O-N 3.49Å; D204-Q207 PolarHBondContact OD1-OE1 3.06Å; Q207-Q209 VanDerWaalsContact C-N 3.31Å; Q207-Q209 PolarHBondContact O-N 3.36Å; Q207-A210 PolarHBondContact O-N 3.14Å; Q207-M211 HydrophobicContact CG-CE 4.09Å; Q207-M211 WeakPolarHBondContact O-CG 3.42Å; Q207-M211 PolarHBondContact O-N 3.5Å; Q207-F286 HydrophobicContact CG-CE1 4.33Å; Q207-F286 VanDerWaalsContact OE1-CE1 3.27Å; Q207-S313 VanDerWaalsContact NE2-CB 3.35Å; Q207-D314 PolarHBondContact NE2-OD1 2.86Å; Q207-I336 HydrophobicContact CG-CD1 4.39Å; Q207-I336 HydrophobicContact CG-CG2 4.37Å; Q207-Y476 HydrophobicContact CB-CE1 4.31Å; Q207-Y476 PolarHBondContact N-OH 3.32Å
208	A	95.6	Very high	94.8	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.2	-40.2	174.3	0	0	0	0	0	111.4	D204 M211 V212 A239 F240 L243 F286	D204-A208 VanDerWaalsContact O-CB 3.31Å; D204-A208 WeakPolarHBondContact O-CB 3.42Å; D204-A208 PolarHBondContact O-N 3.33Å; A208-M211 PolarHBondContact O-N 3.31Å; A208-V212 WeakPolarHBondContact O-CG2 3.41Å; A208-V212 PolarHBondContact O-N 2.95Å; A208-A239 HydrophobicContact CB-CB 4.02Å; A208-F240 HydrophobicContact CB-CB 4.06Å; A208-L243 HydrophobicContact CB-CD1 4.02Å; A208-F286 HydrophobicContact CB-CZ 4.26Å
209	Q	95.5	Very high	94.6	Very high	56 Å²	56	22.3 Å²	22.3	26%	0.262	12%	0.122	S	C	.	.	H	α-helix	trans	-61.4	-48	172.7	-174.1	62.3	54.3	0	0	111.5	S205 F206 Q207 M211 V212 D213 L243 W497	S205-Q209 PolarHBondContact O-N 2.98Å; F206-Q209 WeakPolarHBondContact O-CB 3.38Å; F206-Q209 PolarHBondContact O-N 3.03Å; Q207-Q209 VanDerWaalsContact C-N 3.31Å; Q207-Q209 PolarHBondContact O-N 3.36Å; Q209-M211 VanDerWaalsContact C-N 3.28Å; Q209-M211 PolarHBondContact O-N 3.37Å; Q209-V212 WeakPolarHBondContact O-CB 3.27Å; Q209-V212 PolarHBondContact O-N 3.14Å; Q209-V212 VanDerWaalsContact O-N 3.11Å; Q209-D213 PolarHBondContact NE2-OD1 3.47Å; Q209-D213 VanDerWaalsContact O-CG 3.27Å; Q209-D213 PolarHBondContact O-N 3.23Å; Q209-L243 HydrophobicContact CB-CD1 3.99Å; Q209-W497 HydrophobicContact CB-CZ2 4.13Å; Q209-W497 HydrophobicContact CG-CZ2 3.82Å
210	A	95.8	Very high	94.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.3	-40.6	176.8	0	0	0	0	0	112	F206 Q207 D213 I214 I336 W497	F206-A210 PolarHBondContact O-N 3.08Å; Q207-A210 PolarHBondContact O-N 3.14Å; A210-D213 PolarHBondContact O-N 3.43Å; A210-I214 WeakPolarHBondContact O-CD1 3.43Å; A210-I214 WeakPolarHBondContact O-CG1 3.47Å; A210-I214 PolarHBondContact O-N 3.25Å; A210-I336 HydrophobicContact CB-CD1 4.04Å; A210-W497 HydrophobicContact CB-CB 4.22Å; A210-W497 HydrophobicContact CB-CD2 3.79Å; A210-W497 HydrophobicContact CB-CE3 4.49Å; A210-W497 HydrophobicContact CB-CG 3.66Å
211	M	96.3	Very high	94.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.7	-41.4	174.7	-69.7	-179	176.5	0	0	112.7	Q207 A208 Q209 I214 I215 F240 I284 F286 I311 G312 I336	Q207-M211 HydrophobicContact CG-CE 4.09Å; Q207-M211 WeakPolarHBondContact O-CG 3.42Å; Q207-M211 PolarHBondContact O-N 3.5Å; A208-M211 PolarHBondContact O-N 3.31Å; Q209-M211 VanDerWaalsContact C-N 3.28Å; Q209-M211 PolarHBondContact O-N 3.37Å; M211-I214 PolarHBondContact O-N 3.47Å; M211-I215 WeakPolarHBondContact O-CD1 3.34Å; M211-I215 WeakPolarHBondContact O-CG1 3.21Å; M211-I215 PolarHBondContact O-N 3.3Å; M211-F240 HydrophobicContact CB-CD2 4.04Å; M211-F240 HydrophobicContact CB-CE2 4.07Å; M211-I284 HydrophobicContact SD-CG2 3.52Å; M211-I284 VanDerWaalsContact SD-CG2 3.52Å; M211-F286 HydrophobicContact CE-CE1 4.41Å; M211-F286 HydrophobicContact CE-CE2 4.11Å; M211-F286 HydrophobicContact CE-CZ 3.92Å; M211-F286 HydrophobicContact SD-CD2 4.31Å; M211-F286 HydrophobicContact SD-CE1 4.42Å; M211-F286 HydrophobicContact SD-CE2 3.33Å; M211-F286 WeakPolarHBondContact SD-CE2 3.34Å; M211-F286 HydrophobicContact SD-CZ 3.41Å; M211-F286 WeakPolarHBondContact SD-CZ 3.47Å; M211-I311 HydrophobicContact CB-CG2 4.43Å; M211-I311 HydrophobicContact CE-CG2 4.22Å; M211-I311 HydrophobicContact CG-CG2 3.84Å; M211-I311 HydrophobicContact SD-CG2 4.15Å; M211-G312 WeakPolarHBondContact CE-O 3.4Å; M211-I336 HydrophobicContact CB-CD1 4.44Å; M211-I336 HydrophobicContact CE-CD1 4.01Å; M211-I336 HydrophobicContact CE-CG1 4.44Å; M211-I336 HydrophobicContact CG-CD1 3.37Å
212	V	96.4	Very high	94.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-46.8	174.7	168.9	0	0	0	0	110.6	A208 Q209 I214 I215 Q216 F240 L243 A247 I250	A208-V212 WeakPolarHBondContact O-CG2 3.41Å; A208-V212 PolarHBondContact O-N 2.95Å; Q209-V212 WeakPolarHBondContact O-CB 3.27Å; Q209-V212 PolarHBondContact O-N 3.14Å; Q209-V212 VanDerWaalsContact O-N 3.11Å; V212-I214 VanDerWaalsContact C-N 3.31Å; V212-I214 PolarHBondContact O-N 2.9Å; V212-I215 PolarHBondContact O-N 3.38Å; V212-Q216 WeakPolarHBondContact O-CG 3.23Å; V212-Q216 PolarHBondContact O-N 2.86Å; V212-F240 HydrophobicContact CG2-CD2 3.69Å; V212-F240 HydrophobicContact CG2-CE2 3.58Å; V212-F240 HydrophobicContact CG2-CZ 4.43Å; V212-L243 HydrophobicContact CG2-CB 3.98Å; V212-A247 HydrophobicContact CG1-CB 4Å; V212-I250 HydrophobicContact CG1-CD1 3.98Å
213	D	95.9	Very high	94.7	Very high	28 Å²	28	24.6 Å²	24.6	15%	0.15	13%	0.133	C	C	.	.	H	α-helix	trans	-62.3	-39.5	179.8	-61.1	-15.5	0	0	0	111.3	Q209 A210 Q216 A217 W497 L501	Q209-D213 PolarHBondContact NE2-OD1 3.47Å; Q209-D213 VanDerWaalsContact O-CG 3.27Å; Q209-D213 PolarHBondContact O-N 3.23Å; A210-D213 PolarHBondContact O-N 3.43Å; D213-Q216 PolarHBondContact O-N 3.46Å; D213-A217 WeakPolarHBondContact O-CB 3.38Å; D213-A217 PolarHBondContact O-N 3.25Å; D213-W497 PolarHBondContact OD2-NE1 2.82Å; D213-L501 HydrophobicContact CB-CB 4.01Å; D213-L501 HydrophobicContact CB-CD2 3.98Å; D213-L501 WeakPolarHBondContact O-CD2 3.41Å
214	I	95.8	Very high	94.9	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-61.6	-46.8	175.8	-70.5	161.9	0	0	0	110.5	A210 M211 V212 Q216 A217 L218 I311 I336 L478 L501	A210-I214 WeakPolarHBondContact O-CD1 3.43Å; A210-I214 WeakPolarHBondContact O-CG1 3.47Å; A210-I214 PolarHBondContact O-N 3.25Å; M211-I214 PolarHBondContact O-N 3.47Å; V212-I214 VanDerWaalsContact C-N 3.31Å; V212-I214 PolarHBondContact O-N 2.9Å; I214-Q216 VanDerWaalsContact C-N 3.31Å; I214-Q216 PolarHBondContact O-N 3.19Å; I214-A217 PolarHBondContact O-N 3.5Å; I214-L218 HydrophobicContact CG2-CD1 3.83Å; I214-L218 HydrophobicContact CG2-CG 4.42Å; I214-L218 VanDerWaalsContact O-CG 3.29Å; I214-L218 WeakPolarHBondContact O-CG 3.47Å; I214-L218 PolarHBondContact O-N 3.1Å; I214-I311 HydrophobicContact CG2-CD1 4.22Å; I214-I336 HydrophobicContact CD1-CD1 3.85Å; I214-I336 HydrophobicContact CD1-CG1 4.26Å; I214-L478 HydrophobicContact CD1-CD1 3.94Å; I214-L478 HydrophobicContact CD1-CD2 3.82Å; I214-L478 HydrophobicContact CG1-CD1 4.14Å; I214-L501 HydrophobicContact CG1-CD1 3.94Å; I214-L501 HydrophobicContact CG1-CD2 4.16Å
215	I	95.9	Very high	95.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.9	-40.9	179.8	-69	164.9	0	0	0	111	M211 V212 L218 N219 W220 V223 F240 I250 I284 I311	M211-I215 WeakPolarHBondContact O-CD1 3.34Å; M211-I215 WeakPolarHBondContact O-CG1 3.21Å; M211-I215 PolarHBondContact O-N 3.3Å; V212-I215 PolarHBondContact O-N 3.38Å; I215-L218 PolarHBondContact O-N 3.47Å; I215-N219 PolarHBondContact O-N 3.05Å; I215-W220 HydrophobicContact CG2-CB 3.83Å; I215-W220 VanDerWaalsContact CG2-O 3.32Å; I215-W220 WeakPolarHBondContact CG2-O 3.4Å; I215-W220 PolarHBondContact O-N 3.23Å; I215-W220 VanDerWaalsContact O-N 3.09Å; I215-V223 HydrophobicContact CD1-CG1 4.32Å; I215-V223 HydrophobicContact CG2-CG1 4.11Å; I215-F240 HydrophobicContact CD1-CE2 3.43Å; I215-F240 VanDerWaalsContact CD1-CE2 3.43Å; I215-F240 HydrophobicContact CD1-CZ 3.3Å; I215-I250 HydrophobicContact CB-CD1 4.17Å; I215-I250 HydrophobicContact CG2-CD1 3.67Å; I215-I250 HydrophobicContact CG2-CG1 3.9Å; I215-I250 HydrophobicContact CG2-CG2 4.2Å; I215-I284 HydrophobicContact CD1-CD1 3.54Å; I215-I284 HydrophobicContact CD1-CG1 4.14Å; I215-I284 HydrophobicContact CG1-CD1 4.21Å; I215-I311 HydrophobicContact CD1-CD1 4.43Å; I215-I311 HydrophobicContact CG1-CD1 3.78Å
216	Q	94.3	Very high	95.4	Very high	81 Å²	81	22.4 Å²	22.4	38%	0.379	12%	0.118	S	C	.	.	H	α-helix	trans	-64.6	-43.4	175.5	-69.8	-172	-33	0	0	111.8	V212 D213 I214 L218 N219 I250	V212-Q216 WeakPolarHBondContact O-CG 3.23Å; V212-Q216 PolarHBondContact O-N 2.86Å; D213-Q216 PolarHBondContact O-N 3.46Å; I214-Q216 VanDerWaalsContact C-N 3.31Å; I214-Q216 PolarHBondContact O-N 3.19Å; Q216-L218 PolarHBondContact O-N 3.41Å; Q216-N219 PolarHBondContact O-N 3.12Å; Q216-N219 VanDerWaalsContact O-N 3.09Å; Q216-I250 HydrophobicContact CG-CD1 3.96Å
217	A	94.2	Very high	95.5	Very high	39 Å²	39	19.8 Å²	19.8	32%	0.322	11%	0.107	S	C	.	.	H	α-helix	trans	-63	-30.9	176.8	0	0	0	0	0	112.8	D213 I214 N219 L501 L503	D213-A217 WeakPolarHBondContact O-CB 3.38Å; D213-A217 PolarHBondContact O-N 3.25Å; I214-A217 PolarHBondContact O-N 3.5Å; A217-N219 VanDerWaalsContact C-N 3.32Å; A217-L501 HydrophobicContact CB-CD2 3.78Å; A217-L503 HydrophobicContact CB-CD2 4.28Å
218	L	93.7	Very high	95.4	Very high	7 Å²	7	20.2 Å²	20.2	4%	0.037	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	1.2	176.2	-64.7	175	0	0	0	113.9	I214 I215 Q216 W220 L505 L508 W510 V517	I214-L218 HydrophobicContact CG2-CD1 3.83Å; I214-L218 HydrophobicContact CG2-CG 4.42Å; I214-L218 VanDerWaalsContact O-CG 3.29Å; I214-L218 WeakPolarHBondContact O-CG 3.47Å; I214-L218 PolarHBondContact O-N 3.1Å; I215-L218 PolarHBondContact O-N 3.47Å; Q216-L218 PolarHBondContact O-N 3.41Å; L218-W220 HydrophobicContact CB-CD2 3.98Å; L218-W220 HydrophobicContact CB-CE3 4.41Å; L218-W220 HydrophobicContact CB-CG 4.14Å; L218-W220 HydrophobicContact CD1-CD2 4.22Å; L218-W220 HydrophobicContact CD1-CE3 3.95Å; L218-W220 HydrophobicContact CD1-CH2 3.73Å; L218-W220 HydrophobicContact CD1-CZ2 3.96Å; L218-W220 HydrophobicContact CD1-CZ3 3.73Å; L218-W220 PolarHBondContact O-N 3.48Å; L218-L505 HydrophobicContact CD2-CD2 3.88Å; L218-L508 HydrophobicContact CD2-CD1 3.87Å; L218-W510 HydrophobicContact CD1-CH2 4.06Å; L218-W510 HydrophobicContact CD2-CH2 4.17Å; L218-W510 HydrophobicContact CD2-CZ2 3.9Å; L218-V517 HydrophobicContact CB-CG1 4.14Å; L218-V517 HydrophobicContact CD2-CG1 3.94Å; L218-V517 HydrophobicContact CD2-CG2 4.01Å
219	N	93.2	Very high	95.1	Very high	131 Å²	131	24.8 Å²	24.8	70%	0.701	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	28.4	-175.3	-66.7	-47.1	0	0	0	114.4	I215 Q216 A217	I215-N219 PolarHBondContact O-N 3.05Å; Q216-N219 PolarHBondContact O-N 3.12Å; Q216-N219 VanDerWaalsContact O-N 3.09Å; A217-N219 VanDerWaalsContact C-N 3.32Å
220	W	94.8	Very high	94.6	Very high	5 Å²	5	23.7 Å²	23.7	2%	0.019	14%	0.135	C	C	.	.			trans	-83.7	132.1	175.9	-70	-8.2	0	0	0	110.5	I215 L218 A282 L309 I311 W510 V517 P518	I215-W220 HydrophobicContact CG2-CB 3.83Å; I215-W220 VanDerWaalsContact CG2-O 3.32Å; I215-W220 WeakPolarHBondContact CG2-O 3.4Å; I215-W220 PolarHBondContact O-N 3.23Å; I215-W220 VanDerWaalsContact O-N 3.09Å; L218-W220 HydrophobicContact CB-CD2 3.98Å; L218-W220 HydrophobicContact CB-CE3 4.41Å; L218-W220 HydrophobicContact CB-CG 4.14Å; L218-W220 HydrophobicContact CD1-CD2 4.22Å; L218-W220 HydrophobicContact CD1-CE3 3.95Å; L218-W220 HydrophobicContact CD1-CH2 3.73Å; L218-W220 HydrophobicContact CD1-CZ2 3.96Å; L218-W220 HydrophobicContact CD1-CZ3 3.73Å; L218-W220 PolarHBondContact O-N 3.48Å; W220-A282 HydrophobicContact CD2-CB 3.85Å; W220-A282 HydrophobicContact CE3-CB 3.25Å; W220-A282 HydrophobicContact CH2-CB 4.2Å; W220-A282 HydrophobicContact CZ3-CB 3.43Å; W220-A282 VanDerWaalsContact CZ3-CB 3.43Å; W220-L309 HydrophobicContact CH2-CB 3.82Å; W220-L309 HydrophobicContact CH2-CD1 3.82Å; W220-L309 HydrophobicContact CH2-CG 4.45Å; W220-L309 HydrophobicContact CZ2-CB 4.35Å; W220-L309 HydrophobicContact CZ2-CD1 3.46Å; W220-L309 VanDerWaalsContact CZ2-CD1 3.46Å; W220-I311 HydrophobicContact CE3-CD1 4.18Å; W220-I311 HydrophobicContact CZ3-CD1 3.68Å; W220-I311 HydrophobicContact CZ3-CG1 4.21Å; W220-W510 AromaticContact CH2-CH2 3.85Å; W220-W510 HydrophobicContact CH2-CH2 3.85Å; W220-W510 AromaticContact CH2-CZ3 3.93Å; W220-W510 HydrophobicContact CH2-CZ3 3.93Å; W220-W510 AromaticContact CZ2-CH2 3.82Å; W220-W510 HydrophobicContact CZ2-CH2 3.82Å; W220-W510 HydrophobicContact CZ2-CZ3 4.05Å; W220-V517 HydrophobicContact CZ2-CG1 4.14Å; W220-P518 PolarHBondContact NE1-O 3.23Å
221	T	93.6	Very high	94	Very high	43 Å²	43	25.2 Å²	25.2	26%	0.264	15%	0.146	S	C	.	.			trans	-120.4	-9.7	-176.1	58.5	0	0	0	0	113.1	G249 C251 S520 V521	T221-G249 WeakPolarHBondContact CB-O 3.36Å; T221-G249 WeakPolarHBondContact CG2-O 3.38Å; T221-C251 PolarHBondContact O-N 3.13Å; T221-S520 PolarHBondContact N-O 3.02Å; T221-V521 WeakPolarHBondContact OG1-CG1 3.34Å
222	Y	95.1	Very high	93.5	Very high	22 Å²	22	27.1 Å²	27.1	9%	0.086	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	112	-177.8	-164.5	-124.2	0	0	0	110.3	C251 A253 N279 A280 S520 C522 M538	Y222-C251 WeakPolarHBondContact CA-O 3.37Å; Y222-C251 HydrophobicContact CD2-CB 4.02Å; Y222-A253 HydrophobicContact CD1-CB 4.2Å; Y222-A253 HydrophobicContact CD2-CB 4.14Å; Y222-A253 HydrophobicContact CE1-CB 3.56Å; Y222-A253 HydrophobicContact CE2-CB 3.5Å; Y222-A253 HydrophobicContact CG-CB 4.46Å; Y222-A253 VanDerWaalsContact OH-CB 3.27Å; Y222-A253 WeakPolarHBondContact OH-CB 3.33Å; Y222-N279 HydrophobicContact CD1-CB 4.42Å; Y222-A280 HydrophobicContact CD1-CB 3.62Å; Y222-A280 HydrophobicContact CE1-CB 3.74Å; Y222-A280 HydrophobicContact CG-CB 4.45Å; Y222-S520 PolarHBondContact N-O 3.29Å; Y222-S520 PolarHBondContact O-OG 2.96Å; Y222-C522 VanDerWaalsContact CB-N 3.27Å; Y222-C522 HydrophobicContact CD1-CB 3.9Å; Y222-C522 HydrophobicContact CD2-CB 3.68Å; Y222-C522 HydrophobicContact CE1-CB 4.26Å; Y222-C522 HydrophobicContact CE2-CB 4.05Å; Y222-C522 HydrophobicContact CG-CB 3.6Å; Y222-M538 HydrophobicContact CE2-CE 4.48Å; Y222-M538 HydrophobicContact CE2-SD 3.68Å
223	V	96.7	Very high	93.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	156.3	-171.6	-53.5	0	0	0	0	110.8	I215 F240 I250 C251 I252 A253 A282 I284	I215-V223 HydrophobicContact CD1-CG1 4.32Å; I215-V223 HydrophobicContact CG2-CG1 4.11Å; V223-F240 HydrophobicContact CG2-CE1 4.15Å; V223-F240 HydrophobicContact CG2-CZ 4.22Å; V223-I250 HydrophobicContact CG1-CG2 4.46Å; V223-I250 HydrophobicContact CG2-CG2 3.94Å; V223-C251 PolarHBondContact N-O 3.18Å; V223-I252 HydrophobicContact CG2-CG1 4.27Å; V223-I252 CarbonylContact O-C 3.58Å; V223-I252 VanDerWaalsContact O-CA 3.3Å; V223-I252 WeakPolarHBondContact O-CA 3.45Å; V223-A253 PolarHBondContact O-N 3.34Å; V223-A282 WeakPolarHBondContact CA-O 3.29Å; V223-A282 HydrophobicContact CB-CB 4.39Å; V223-A282 HydrophobicContact CG1-CB 3.92Å; V223-I284 HydrophobicContact CG2-CG1 4.46Å
224	S	97.5	Very high	93	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	153.8	170.4	-65.6	0	0	0	0	110.4	Q254 A282 I283 I284	S224-Q254 WeakPolarHBondContact CA-O 3.49Å; S224-A282 PolarHBondContact N-O 2.96Å; S224-I283 CarbonylContact O-C 3.53Å; S224-I283 WeakPolarHBondContact O-CA 3.5Å; S224-I284 PolarHBondContact O-N 2.03Å
225	T	97.6	Very high	92.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.4	179.5	64.8	0	0	0	0	111	V237 F240 I252 Q254 S255 L256 I284	T225-V237 HydrophobicContact CG2-CG1 4.29Å; T225-V237 WeakPolarHBondContact OG1-CG1 3.47Å; T225-F240 HydrophobicContact CG2-CD1 3.88Å; T225-F240 HydrophobicContact CG2-CE1 3.9Å; T225-I252 HydrophobicContact CG2-CG2 4.28Å; T225-Q254 PolarHBondContact N-O 3.14Å; T225-S255 WeakPolarHBondContact O-CA 3.38Å; T225-S255 VanDerWaalsContact OG1-CA 3.3Å; T225-S255 WeakPolarHBondContact OG1-CA 3.4Å; T225-S255 VanDerWaalsContact OG1-CB 3.24Å; T225-S255 WeakPolarHBondContact OG1-CB 3.44Å; T225-S255 PolarHBondContact OG1-OG 2.97Å; T225-L256 PolarHBondContact O-N 2.65Å; T225-I284 CarbonylContact C-O 3.48Å; T225-I284 WeakPolarHBondContact CA-O 3.38Å; T225-I284 HydrophobicContact CG2-CB 4.11Å; T225-I284 HydrophobicContact CG2-CG1 4.34Å
226	V	97.6	Very high	92.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126.6	174.7	-178.4	0	0	0	0	108.6	L256 I258 I270 L274 I283 I284 I285 F286	V226-L256 WeakPolarHBondContact CA-O 3.49Å; V226-L256 HydrophobicContact CG2-CB 4.47Å; V226-I258 HydrophobicContact CG1-CD1 3.76Å; V226-I258 HydrophobicContact CG1-CG1 3.99Å; V226-I270 HydrophobicContact CG1-CG2 4.44Å; V226-I270 HydrophobicContact CG2-CG2 4.33Å; V226-L274 HydrophobicContact CG2-CD1 4.23Å; V226-L274 HydrophobicContact CG2-CD2 4.48Å; V226-I283 HydrophobicContact CG2-CG2 3.81Å; V226-I284 PolarHBondContact N-O 2.91Å; V226-I285 HydrophobicContact CB-CG1 4.33Å; V226-I285 HydrophobicContact CG1-CD1 4.5Å; V226-I285 WeakPolarHBondContact O-CA 3.39Å; V226-F286 PolarHBondContact O-N 3.03Å
227	A	96.3	Very high	92.7	Very high	2 Å²	2	28.3 Å²	28.3	2%	0.017	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	140.6	179.9	0	0	0	0	0	112.2	G233 V237 L256 K257 I258 F286	A227-G233 WeakPolarHBondContact CB-O 3.37Å; A227-V237 HydrophobicContact CB-CB 4.35Å; A227-V237 HydrophobicContact CB-CG2 3.76Å; A227-L256 PolarHBondContact N-O 3.48Å; A227-K257 CarbonylContact O-C 3.51Å; A227-K257 WeakPolarHBondContact O-CA 3.47Å; A227-I258 PolarHBondContact O-N 2.86Å; A227-F286 VanDerWaalsContact CA-O 3.29Å; A227-F286 WeakPolarHBondContact CA-O 3.41Å
228	S	92.5	Very high	92.7	Very high	10 Å²	10	31.7 Å²	31.7	7%	0.07	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	139.6	161.4	-61.2	0	0	0	0	110.7	G230 G233 F286 A287 S288 D291	S228-G230 PolarHBondContact O-N 3.4Å; S228-G233 WeakPolarHBondContact O-CA 3.28Å; S228-F286 PolarHBondContact N-O 3.36Å; S228-A287 WeakPolarHBondContact OG-CA 3.24Å; S228-A287 WeakPolarHBondContact OG-CB 3.46Å; S228-S288 PolarHBondContact OG-N 2.72Å; S228-D291 VanDerWaalsContact CB-OD2 3.32Å; S228-D291 WeakPolarHBondContact CB-OD2 3.35Å; S228-D291 WeakPolarHBondContact OG-CB 3.43Å; S228-D291 VanDerWaalsContact OG-CG 3.3Å; S228-D291 PolarHBondContact OG-OD2 2.81Å
229	E	88.8	Confident	92.8	Very high	95 Å²	95	32.3 Å²	32.3	44%	0.444	17%	0.172	S	C	.	.	S	Bend	trans	-61.9	127.1	173.7	-175.2	174.5	-161.1	0	0	110.8	I258 P259 H260	E229-I258 WeakPolarHBondContact CB-O 3.37Å; E229-I258 PolarHBondContact N-O 3.2Å; E229-P259 WeakPolarHBondContact OE2-CA 3.37Å; E229-H260 PolarHBondContact OE2-N 3.31Å
230	G	84.4	Confident	92.9	Very high	33 Å²	33	26 Å²	26	34%	0.34	14%	0.139	S	C	.	.	S	Bend	trans	134.4	171.4	-177.9	0	0	0	0	0	112.8	S228 Y232 E234	S228-G230 PolarHBondContact O-N 3.4Å; G230-Y232 PolarHBondContact O-N 2.87Å; G230-Y232 VanDerWaalsContact O-N 3.15Å; G230-E234 WeakPolarHBondContact O-CB 3.31Å; G230-E234 PolarHBondContact O-N 3.31Å; G230-E234 VanDerWaalsContact O-N 3.11Å
231	S	83.7	Confident	92.9	Very high	32 Å²	32	26.9 Å²	26.9	22%	0.224	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.4	-173.9	-62.9	0	0	0	0	115.2	I165 E187 K235	I165-S231 WeakPolarHBondContact CD1-OG 3.26Å; E187-S231 WeakPolarHBondContact OE1-CB 3.44Å; E187-S231 PolarHBondContact OE1-OG 3.08Å; S231-K235 WeakPolarHBondContact O-CB 3.35Å; S231-K235 WeakPolarHBondContact O-CG 3.43Å
232	Y	86.1	Confident	92.9	Very high	41 Å²	41	29.1 Å²	29.1	16%	0.161	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-63	176.1	170.8	-104.9	0	0	0	110.8	T184 D204 G230 G236 S313 D314	T184-Y232 WeakPolarHBondContact OG1-CE2 3.47Å; D204-Y232 WeakPolarHBondContact OD2-CD2 3.33Å; D204-Y232 WeakPolarHBondContact OD2-CE2 3.19Å; G230-Y232 PolarHBondContact O-N 2.87Å; G230-Y232 VanDerWaalsContact O-N 3.15Å; Y232-G236 PolarHBondContact O-N 3.01Å; Y232-S313 VanDerWaalsContact OH-CB 3.28Å; Y232-S313 WeakPolarHBondContact OH-CB 3.32Å; Y232-S313 PolarHBondContact OH-OG 3.38Å; Y232-D314 PolarHBondContact OH-OD1 2.92Å
233	G	89.3	Confident	92.9	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-63.9	-48.7	-174.4	0	0	0	0	0	113.4	A227 S228 G236 V237 F286	A227-G233 WeakPolarHBondContact CB-O 3.37Å; S228-G233 WeakPolarHBondContact O-CA 3.28Å; G233-G236 PolarHBondContact O-N 3.29Å; G233-V237 PolarHBondContact O-N 3.33Å; G233-V237 VanDerWaalsContact O-N 3.09Å; G233-F286 WeakPolarHBondContact CA-O 3.3Å
234	E	91.9	Very high	92.8	Very high	60 Å²	60	29.6 Å²	29.6	28%	0.28	16%	0.156	S	C	.	.	H	α-helix	trans	-67.4	-42.9	-176.6	-62.4	-159.2	169.1	0	0	112.7	G230 V237 E238 K257	G230-E234 WeakPolarHBondContact O-CB 3.31Å; G230-E234 PolarHBondContact O-N 3.31Å; G230-E234 VanDerWaalsContact O-N 3.11Å; E234-V237 PolarHBondContact O-N 3.46Å; E234-E238 VanDerWaalsContact O-CB 3.31Å; E234-E238 WeakPolarHBondContact O-CB 3.47Å; E234-E238 PolarHBondContact O-N 3.3Å; E234-K257 WeakPolarHBondContact OE1-CD 3.41Å; E234-K257 WeakPolarHBondContact OE1-CE 3.44Å; E234-K257 IonicContact OE1-NZ 3.36Å; E234-K257 PolarHBondContact OE1-NZ 3.1Å; E234-K257 IonicContact OE2-NZ 3.04Å; E234-K257 PolarHBondContact OE2-NZ 2.67Å
235	K	91.2	Very high	92.5	Very high	66 Å²	66	38.2 Å²	38.2	29%	0.287	19%	0.189	S	C	.	.	H	α-helix	trans	-72.6	-31.6	179.7	-60.7	-53.6	-166.1	-173.7	0	112.3	P186 E187 S231 E238 A239	P186-K235 HydrophobicContact CG-CB 4.31Å; E187-K235 VanDerWaalsContact OE2-CE 3.23Å; E187-K235 WeakPolarHBondContact OE2-CE 3.36Å; S231-K235 WeakPolarHBondContact O-CB 3.35Å; S231-K235 WeakPolarHBondContact O-CG 3.43Å; K235-E238 WeakPolarHBondContact CD-OE2 3.3Å; K235-E238 IonicContact NZ-OE2 2.78Å; K235-E238 PolarHBondContact NZ-OE2 2.89Å; K235-E238 PolarHBondContact O-N 3.33Å; K235-A239 WeakPolarHBondContact O-CB 3.47Å; K235-A239 PolarHBondContact O-N 3.32Å
236	G	92.8	Very high	92.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.6	-49.8	170.8	0	0	0	0	0	111.9	Y232 G233 A239 F240	Y232-G236 PolarHBondContact O-N 3.01Å; G233-G236 PolarHBondContact O-N 3.29Å; G236-A239 PolarHBondContact O-N 2.92Å; G236-F240 WeakPolarHBondContact O-CB 3.08Å; G236-F240 PolarHBondContact O-N 3.11Å
237	V	95.4	Very high	91.9	Very high	7 Å²	7	46.7 Å²	46.7	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-66.9	-36.6	176.3	169.4	0	0	0	0	112.6	T225 A227 G233 E234 F240 T241 F286	T225-V237 HydrophobicContact CG2-CG1 4.29Å; T225-V237 WeakPolarHBondContact OG1-CG1 3.47Å; A227-V237 HydrophobicContact CB-CB 4.35Å; A227-V237 HydrophobicContact CB-CG2 3.76Å; G233-V237 PolarHBondContact O-N 3.33Å; G233-V237 VanDerWaalsContact O-N 3.09Å; E234-V237 PolarHBondContact O-N 3.46Å; V237-F240 PolarHBondContact O-N 3.37Å; V237-T241 VanDerWaalsContact O-CB 3.31Å; V237-T241 WeakPolarHBondContact O-CB 3.2Å; V237-T241 PolarHBondContact O-N 3.36Å; V237-T241 PolarHBondContact O-OG1 3.43Å; V237-F286 HydrophobicContact CG2-CB 4.13Å; V237-F286 HydrophobicContact CG2-CD2 3.85Å; V237-F286 HydrophobicContact CG2-CG 4.36Å
238	E	94.7	Very high	91.4	Very high	111 Å²	111	48.2 Å²	48.2	52%	0.519	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-46.2	174.7	-174.6	175.2	-161.5	0	0	111	E234 K235 T241 Q242	E234-E238 VanDerWaalsContact O-CB 3.31Å; E234-E238 WeakPolarHBondContact O-CB 3.47Å; E234-E238 PolarHBondContact O-N 3.3Å; K235-E238 WeakPolarHBondContact CD-OE2 3.3Å; K235-E238 IonicContact NZ-OE2 2.78Å; K235-E238 PolarHBondContact NZ-OE2 2.89Å; K235-E238 PolarHBondContact O-N 3.33Å; E238-T241 PolarHBondContact O-N 3.45Å; E238-Q242 PolarHBondContact O-N 2.97Å
239	A	94.9	Very high	91	Very high	19 Å²	19	50.3 Å²	50.3	16%	0.157	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-46.9	175.1	0	0	0	0	0	111.3	A208 K235 G236 T241 Q242 L243	A208-A239 HydrophobicContact CB-CB 4.02Å; K235-A239 WeakPolarHBondContact O-CB 3.47Å; K235-A239 PolarHBondContact O-N 3.32Å; G236-A239 PolarHBondContact O-N 2.92Å; A239-T241 VanDerWaalsContact C-N 3.32Å; A239-T241 PolarHBondContact O-N 3.46Å; A239-Q242 PolarHBondContact O-N 3.2Å; A239-L243 WeakPolarHBondContact O-CB 3.28Å; A239-L243 VanDerWaalsContact O-CG 3.29Å; A239-L243 WeakPolarHBondContact O-CG 3.28Å; A239-L243 PolarHBondContact O-N 3.16Å
240	F	96.1	Very high	91.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-42.9	175.8	175.5	-94.5	0	0	0	112.3	A208 M211 V212 I215 V223 T225 G236 V237 L243 S244 I252 I284 F286	A208-F240 HydrophobicContact CB-CB 4.06Å; M211-F240 HydrophobicContact CB-CD2 4.04Å; M211-F240 HydrophobicContact CB-CE2 4.07Å; V212-F240 HydrophobicContact CG2-CD2 3.69Å; V212-F240 HydrophobicContact CG2-CE2 3.58Å; V212-F240 HydrophobicContact CG2-CZ 4.43Å; I215-F240 HydrophobicContact CD1-CE2 3.43Å; I215-F240 VanDerWaalsContact CD1-CE2 3.43Å; I215-F240 HydrophobicContact CD1-CZ 3.3Å; V223-F240 HydrophobicContact CG2-CE1 4.15Å; V223-F240 HydrophobicContact CG2-CZ 4.22Å; T225-F240 HydrophobicContact CG2-CD1 3.88Å; T225-F240 HydrophobicContact CG2-CE1 3.9Å; G236-F240 WeakPolarHBondContact O-CB 3.08Å; G236-F240 PolarHBondContact O-N 3.11Å; V237-F240 PolarHBondContact O-N 3.37Å; F240-L243 PolarHBondContact O-N 3.01Å; F240-S244 WeakPolarHBondContact CE1-OG 3.46Å; F240-S244 WeakPolarHBondContact CZ-OG 3.48Å; F240-S244 VanDerWaalsContact O-CB 3.26Å; F240-S244 WeakPolarHBondContact O-CB 3.42Å; F240-S244 PolarHBondContact O-N 3Å; F240-S244 PolarHBondContact O-OG 3.09Å; F240-I252 HydrophobicContact CD1-CD1 4.33Å; F240-I252 HydrophobicContact CE1-CD1 4.24Å; F240-I252 HydrophobicContact CE1-CG1 4.35Å; F240-I284 HydrophobicContact CD2-CG2 4.47Å; F240-I284 HydrophobicContact CE1-CG1 4.02Å; F240-I284 HydrophobicContact CE2-CG1 4.28Å; F240-I284 HydrophobicContact CZ-CD1 4.43Å; F240-I284 HydrophobicContact CZ-CG1 3.81Å; F240-F286 HydrophobicContact CB-CE2 4.34Å
241	T	94.9	Very high	91.6	Very high	23 Å²	23	45.3 Å²	45.3	14%	0.141	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-43	178.4	-63	0	0	0	0	111.7	V237 E238 A239 R245 I252	V237-T241 VanDerWaalsContact O-CB 3.31Å; V237-T241 WeakPolarHBondContact O-CB 3.2Å; V237-T241 PolarHBondContact O-N 3.36Å; V237-T241 PolarHBondContact O-OG1 3.43Å; E238-T241 PolarHBondContact O-N 3.45Å; A239-T241 VanDerWaalsContact C-N 3.32Å; A239-T241 PolarHBondContact O-N 3.46Å; T241-R245 WeakPolarHBondContact O-CG 3.5Å; T241-R245 PolarHBondContact O-N 3.34Å; T241-I252 HydrophobicContact CG2-CD1 3.8Å; T241-I252 VanDerWaalsContact OG1-CD1 3.28Å; T241-I252 WeakPolarHBondContact OG1-CD1 3.38Å
242	Q	94.4	Very high	92.1	Very high	90 Å²	90	45.8 Å²	45.8	42%	0.421	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-49.3	179	-176.8	60.6	21.7	0	0	111	E238 A239 S244 R245 E246	E238-Q242 PolarHBondContact O-N 2.97Å; A239-Q242 PolarHBondContact O-N 3.2Å; Q242-S244 VanDerWaalsContact C-N 3.34Å; Q242-S244 PolarHBondContact O-N 3.38Å; Q242-R245 WeakPolarHBondContact O-CB 3.36Å; Q242-R245 PolarHBondContact O-N 3.3Å; Q242-R245 VanDerWaalsContact O-N 3.13Å; Q242-E246 WeakPolarHBondContact CG-OE1 3.19Å; Q242-E246 PolarHBondContact NE2-OE1 2.88Å; Q242-E246 WeakPolarHBondContact O-CG 2.99Å; Q242-E246 PolarHBondContact O-N 2.86Å
243	L	95.1	Very high	92.4	Very high	30 Å²	30	44.7 Å²	44.7	16%	0.157	24%	0.243	C	C	.	.	H	α-helix	trans	-63.4	-38	179.3	-66.4	173	0	0	0	112.2	A208 Q209 V212 A239 F240 R245 E246 A247	A208-L243 HydrophobicContact CB-CD1 4.02Å; Q209-L243 HydrophobicContact CB-CD1 3.99Å; V212-L243 HydrophobicContact CG2-CB 3.98Å; A239-L243 WeakPolarHBondContact O-CB 3.28Å; A239-L243 VanDerWaalsContact O-CG 3.29Å; A239-L243 WeakPolarHBondContact O-CG 3.28Å; A239-L243 PolarHBondContact O-N 3.16Å; F240-L243 PolarHBondContact O-N 3.01Å; L243-R245 VanDerWaalsContact C-N 3.29Å; L243-R245 PolarHBondContact O-N 3.33Å; L243-E246 PolarHBondContact O-N 2.92Å; L243-A247 VanDerWaalsContact O-CB 3.31Å; L243-A247 WeakPolarHBondContact O-CB 3.43Å; L243-A247 PolarHBondContact O-N 3.04Å
244	S	94.4	Very high	92.6	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-36.9	174.4	-65	0	0	0	0	112.6	F240 Q242 G248	F240-S244 WeakPolarHBondContact CE1-OG 3.46Å; F240-S244 WeakPolarHBondContact CZ-OG 3.48Å; F240-S244 VanDerWaalsContact O-CB 3.26Å; F240-S244 WeakPolarHBondContact O-CB 3.42Å; F240-S244 PolarHBondContact O-N 3Å; F240-S244 PolarHBondContact O-OG 3.09Å; Q242-S244 VanDerWaalsContact C-N 3.34Å; Q242-S244 PolarHBondContact O-N 3.38Å; S244-G248 PolarHBondContact O-N 2.96Å; S244-G248 VanDerWaalsContact O-N 3.13Å
245	R	91.4	Very high	92.8	Very high	182 Å²	182	46.6 Å²	46.6	69%	0.687	26%	0.259	S	S	*	.	H	α-helix	trans	-71.6	-38.9	176.5	-71.8	171.9	-177.2	172.3	3.1	112.1	T241 Q242 L243	T241-R245 WeakPolarHBondContact O-CG 3.5Å; T241-R245 PolarHBondContact O-N 3.34Å; Q242-R245 WeakPolarHBondContact O-CB 3.36Å; Q242-R245 PolarHBondContact O-N 3.3Å; Q242-R245 VanDerWaalsContact O-N 3.13Å; L243-R245 VanDerWaalsContact C-N 3.29Å; L243-R245 PolarHBondContact O-N 3.33Å
246	E	92.9	Very high	93.1	Very high	129 Å²	129	44.2 Å²	44.2	60%	0.603	25%	0.249	S	C	*	.	H	α-helix	trans	-69.4	-43.7	179	-71.8	173.9	-170.6	0	0	111.9	Q242 L243 G248	Q242-E246 WeakPolarHBondContact CG-OE1 3.19Å; Q242-E246 PolarHBondContact NE2-OE1 2.88Å; Q242-E246 WeakPolarHBondContact O-CG 2.99Å; Q242-E246 PolarHBondContact O-N 2.86Å; L243-E246 PolarHBondContact O-N 2.92Å; E246-G248 VanDerWaalsContact C-N 3.3Å; E246-G248 PolarHBondContact O-N 3.4Å
247	A	88.9	Confident	93.2	Very high	48 Å²	48	49.8 Å²	49.8	40%	0.397	27%	0.274	S	S	.	.	H	α-helix	trans	-67.7	-32.5	177.2	0	0	0	0	0	112.1	V212 L243	V212-A247 HydrophobicContact CG1-CB 4Å; L243-A247 VanDerWaalsContact O-CB 3.31Å; L243-A247 WeakPolarHBondContact O-CB 3.43Å; L243-A247 PolarHBondContact O-N 3.04Å
248	G	84.8	Confident	93.2	Very high	35 Å²	35	49.5 Å²	49.5	36%	0.361	27%	0.272	S	S	.	.			trans	73.8	158.9	-177.7	0	0	0	0	0	113	S244 E246 I250	S244-G248 PolarHBondContact O-N 2.96Å; S244-G248 VanDerWaalsContact O-N 3.13Å; E246-G248 VanDerWaalsContact C-N 3.3Å; E246-G248 PolarHBondContact O-N 3.4Å; G248-I250 VanDerWaalsContact C-N 3.33Å; G248-I250 PolarHBondContact O-N 3.02Å
249	G	83.9	Confident	93	Very high	53 Å²	53	46.5 Å²	46.5	55%	0.546	26%	0.262	S	S	.	.	S	Bend	trans	85.2	-7.8	176.7	0	0	0	0	0	116	T221	T221-G249 WeakPolarHBondContact CB-O 3.36Å; T221-G249 WeakPolarHBondContact CG2-O 3.38Å
250	I	93.3	Very high	92.2	Very high	15 Å²	15	50.3 Å²	50.3	8%	0.077	28%	0.276	C	S	.	.			trans	-112.3	126.8	175.8	-54.8	166.2	0	0	0	109.5	V212 I215 Q216 V223 G248	V212-I250 HydrophobicContact CG1-CD1 3.98Å; I215-I250 HydrophobicContact CB-CD1 4.17Å; I215-I250 HydrophobicContact CG2-CD1 3.67Å; I215-I250 HydrophobicContact CG2-CG1 3.9Å; I215-I250 HydrophobicContact CG2-CG2 4.2Å; Q216-I250 HydrophobicContact CG-CD1 3.96Å; V223-I250 HydrophobicContact CG1-CG2 4.46Å; V223-I250 HydrophobicContact CG2-CG2 3.94Å; G248-I250 VanDerWaalsContact C-N 3.33Å; G248-I250 PolarHBondContact O-N 3.02Å
251	C	93.3	Very high	91.5	Very high	9 Å²	9	55.1 Å²	55.1	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	136.2	174.3	-71.4	0	0	0	0	110.6	T221 Y222 V223 M538 C540	T221-C251 PolarHBondContact O-N 3.13Å; Y222-C251 WeakPolarHBondContact CA-O 3.37Å; Y222-C251 HydrophobicContact CD2-CB 4.02Å; V223-C251 PolarHBondContact N-O 3.18Å; C251-M538 HydrophobicContact CB-CG 4.2Å; C251-C540 HydrophobicContact CB-CB 3.67Å; C251-C540 WeakPolarHBondContact CB-SG 3.35Å; C251-C540 PolarHBondContact N-SG 3.42Å; C251-C540 VanDerWaalsContact N-SG 3.38Å; C251-C540 WeakPolarHBondContact SG-CB 3.44Å; C251-C540 PolarHBondContact SG-N 2.81Å; C251-C540 CovalentContact SG-SG 2.04Å; C251-C540 PolarHBondContact SG-SG 2.82Å
252	I	94.4	Very high	91.1	Very high	41 Å²	41	55.8 Å²	55.8	21%	0.21	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.2	174.8	-63.3	163.7	0	0	0	108.3	V223 T225 F240 T241 Q254	V223-I252 HydrophobicContact CG2-CG1 4.27Å; V223-I252 CarbonylContact O-C 3.58Å; V223-I252 VanDerWaalsContact O-CA 3.3Å; V223-I252 WeakPolarHBondContact O-CA 3.45Å; T225-I252 HydrophobicContact CG2-CG2 4.28Å; F240-I252 HydrophobicContact CD1-CD1 4.33Å; F240-I252 HydrophobicContact CE1-CD1 4.24Å; F240-I252 HydrophobicContact CE1-CG1 4.35Å; T241-I252 HydrophobicContact CG2-CD1 3.8Å; T241-I252 VanDerWaalsContact OG1-CD1 3.28Å; T241-I252 WeakPolarHBondContact OG1-CD1 3.38Å; I252-Q254 WeakPolarHBondContact CG2-O 3.29Å
253	A	93.1	Very high	90.9	Very high	18 Å²	18	58.5 Å²	58.5	15%	0.149	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	-54.5	179.1	0	0	0	0	0	110.8	Y222 V223 T277 A280	Y222-A253 HydrophobicContact CD1-CB 4.2Å; Y222-A253 HydrophobicContact CD2-CB 4.14Å; Y222-A253 HydrophobicContact CE1-CB 3.56Å; Y222-A253 HydrophobicContact CE2-CB 3.5Å; Y222-A253 HydrophobicContact CG-CB 4.46Å; Y222-A253 VanDerWaalsContact OH-CB 3.27Å; Y222-A253 WeakPolarHBondContact OH-CB 3.33Å; V223-A253 PolarHBondContact O-N 3.34Å; A253-T277 HydrophobicContact CB-CG2 4.2Å; A253-A280 HydrophobicContact CB-CB 3.7Å
254	Q	93.6	Very high	90.7	Very high	39 Å²	39	63.9 Å²	63.9	18%	0.182	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	149.9	177.8	-62.8	-173.1	-4.6	0	0	109.7	S224 T225 I252 L256 Q273 T277	S224-Q254 WeakPolarHBondContact CA-O 3.49Å; T225-Q254 PolarHBondContact N-O 3.14Å; I252-Q254 WeakPolarHBondContact CG2-O 3.29Å; Q254-L256 HydrophobicContact CB-CD2 4.29Å; Q254-L256 HydrophobicContact CB-CG 4.45Å; Q254-Q273 PolarHBondContact NE2-O 3.44Å; Q254-Q273 PolarHBondContact OE1-O 2.93Å; Q254-Q273 VanDerWaalsContact OE1-O 3.08Å; Q254-T277 HydrophobicContact CG-CG2 4.01Å
255	S	95.4	Very high	90.6	Very high	62 Å²	62	69.9 Å²	69.9	43%	0.434	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	106	171.1	175.1	0	0	0	0	108.6	T225	T225-S255 WeakPolarHBondContact O-CA 3.38Å; T225-S255 VanDerWaalsContact OG1-CA 3.3Å; T225-S255 WeakPolarHBondContact OG1-CA 3.4Å; T225-S255 VanDerWaalsContact OG1-CB 3.24Å; T225-S255 WeakPolarHBondContact OG1-CB 3.44Å; T225-S255 PolarHBondContact OG1-OG 2.97Å
256	L	96.6	Very high	90.8	Very high	17 Å²	17	63 Å²	63	9%	0.089	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	147.7	-174.8	-55	-177.7	0	0	0	110.8	T225 V226 A227 Q254 I270 Q273 L274	T225-L256 PolarHBondContact O-N 2.65Å; V226-L256 WeakPolarHBondContact CA-O 3.49Å; V226-L256 HydrophobicContact CG2-CB 4.47Å; A227-L256 PolarHBondContact N-O 3.48Å; Q254-L256 HydrophobicContact CB-CD2 4.29Å; Q254-L256 HydrophobicContact CB-CG 4.45Å; L256-I270 HydrophobicContact CD1-CB 4.46Å; L256-I270 HydrophobicContact CD1-CG2 3.87Å; L256-Q273 HydrophobicContact CD1-CB 3.82Å; L256-Q273 HydrophobicContact CD2-CB 4.2Å; L256-L274 HydrophobicContact CD1-CD2 3.6Å; L256-L274 HydrophobicContact CD1-CG 3.69Å; L256-L274 HydrophobicContact CG-CD2 4.43Å
257	K	95.5	Very high	91	Very high	117 Å²	117	58 Å²	58	51%	0.509	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.5	-177.9	-65.1	-175.9	171.8	-161.4	0	110.5	A227 E234	A227-K257 CarbonylContact O-C 3.51Å; A227-K257 WeakPolarHBondContact O-CA 3.47Å; E234-K257 WeakPolarHBondContact OE1-CD 3.41Å; E234-K257 WeakPolarHBondContact OE1-CE 3.44Å; E234-K257 IonicContact OE1-NZ 3.36Å; E234-K257 PolarHBondContact OE1-NZ 3.1Å; E234-K257 IonicContact OE2-NZ 3.04Å; E234-K257 PolarHBondContact OE2-NZ 2.67Å
258	I	94.8	Very high	91.3	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	122.4	173.4	-55.7	165.7	0	0	0	107.4	V226 A227 E229 P262 Y267 I270 A287 D291 V295	V226-I258 HydrophobicContact CG1-CD1 3.76Å; V226-I258 HydrophobicContact CG1-CG1 3.99Å; A227-I258 PolarHBondContact O-N 2.86Å; E229-I258 WeakPolarHBondContact CB-O 3.37Å; E229-I258 PolarHBondContact N-O 3.2Å; I258-P262 HydrophobicContact CG2-CB 3.76Å; I258-P262 HydrophobicContact CG2-CG 4.03Å; I258-Y267 HydrophobicContact CD1-CE1 4.34Å; I258-Y267 HydrophobicContact CG2-CE1 3.86Å; I258-I270 HydrophobicContact CB-CD1 4.27Å; I258-I270 HydrophobicContact CD1-CD1 4.47Å; I258-I270 HydrophobicContact CG1-CD1 3.41Å; I258-I270 VanDerWaalsContact CG1-CD1 3.41Å; I258-A287 HydrophobicContact CD1-CB 4.25Å; I258-D291 HydrophobicContact CD1-CB 3.8Å; I258-V295 HydrophobicContact CD1-CG2 3.75Å
259	P	90.5	Very high	91.9	Very high	47 Å²	47	61 Å²	61	31%	0.305	32%	0.32	S	S	.	.			trans	-65.2	154.2	-179.5	26.1	-32.4	0	0	0	111.8	E229 N261 P262 D266	E229-P259 WeakPolarHBondContact OE2-CA 3.37Å; P259-N261 VanDerWaalsContact C-N 3.26Å; P259-N261 PolarHBondContact O-N 3.49Å; P259-N261 VanDerWaalsContact O-N 3.12Å; P259-P262 HydrophobicContact CG-CB 4.3Å; P259-P262 VanDerWaalsContact O-CD 3.27Å; P259-P262 WeakPolarHBondContact O-CD 3.46Å; P259-D266 HydrophobicContact CG-CB 4.26Å
260	H	77.8	Confident	92.5	Very high	99 Å²	99	58.8 Å²	58.8	46%	0.458	30%	0.296	S	S	.	.	S	Bend	trans	-58.7	-27.8	-172.2	-168.4	65.5	0	0	0	115.9	R62 E229	R62-H260 PolarHBondContact NH1-CD2 2.77Å; R62-H260 VanDerWaalsContact NH1-CD2 3.26Å; R62-H260 PolarHBondContact NH1-NE2 3.47Å; R62-H260 PolarHBondContact NH2-NE2 3.23Å; E229-H260 PolarHBondContact OE2-N 3.31Å
261	N	81.4	Confident	92.7	Very high	102 Å²	102	58.2 Å²	58.2	55%	0.545	29%	0.293	S	S	.	.	S	Bend	trans	-125.9	77.9	173.2	-75.1	-10.2	0	0	0	109	R62 P259	R62-N261 PolarHBondContact NH1-OD1 3.29Å; P259-N261 VanDerWaalsContact C-N 3.26Å; P259-N261 PolarHBondContact O-N 3.49Å; P259-N261 VanDerWaalsContact O-N 3.12Å
262	P	86.9	Confident	92.8	Very high	37 Å²	37	63.9 Å²	63.9	24%	0.24	32%	0.319	C	S	.	.			trans	-76.3	141.2	-168.9	30.1	-33.2	0	0	0	112.1	I258 P259 Y267	I258-P262 HydrophobicContact CG2-CB 3.76Å; I258-P262 HydrophobicContact CG2-CG 4.03Å; P259-P262 HydrophobicContact CG-CB 4.3Å; P259-P262 VanDerWaalsContact O-CD 3.27Å; P259-P262 WeakPolarHBondContact O-CD 3.46Å; P262-Y267 HydrophobicContact CB-CE1 4.34Å; P262-Y267 HydrophobicContact CB-CE2 3.91Å; P262-Y267 HydrophobicContact CG-CE1 4.43Å; P262-Y267 HydrophobicContact CG-CE2 4.04Å; P262-Y267 WeakPolarHBondContact CG-OH 3.37Å
263	K	90.6	Very high	92.9	Very high	147 Å²	147	65.9 Å²	65.9	64%	0.639	33%	0.327	S	S	*	.			trans	-93.6	162.8	167.9	-62.4	179.3	-178.3	178.5	0	110.1	E265 D266 Y267	K263-E265 PolarHBondContact O-N 3.3Å; K263-D266 WeakPolarHBondContact CB-OD2 3.08Å; K263-D266 PolarHBondContact N-OD2 3.41Å; K263-D266 WeakPolarHBondContact O-CB 3.5Å; K263-D266 PolarHBondContact O-N 3.18Å; K263-Y267 WeakPolarHBondContact O-CD2 3.15Å
264	M	90.4	Very high	93	Very high	143 Å²	143	65 Å²	65	70%	0.704	32%	0.32	S	S	*	.	H	α-helix	trans	-53.7	-40.4	176.1	-69	-173.2	176.4	0	0	112.6	D266 Y267 D268	M264-D266 PolarHBondContact O-N 3.49Å; M264-Y267 PolarHBondContact O-N 3.2Å; M264-D268 PolarHBondContact O-N 3.35Å
265	E	93.4	Very high	93.1	Very high	127 Å²	127	65.9 Å²	65.9	59%	0.593	33%	0.325	S	S	*	.	H	α-helix	trans	-61.6	-28.4	177.4	-62.6	177.1	-169.1	0	0	113.6	K263 D268 K269	K263-E265 PolarHBondContact O-N 3.3Å; E265-D268 PolarHBondContact O-N 2.85Å; E265-K269 VanDerWaalsContact O-CG 3.28Å; E265-K269 WeakPolarHBondContact O-CG 3.48Å; E265-K269 PolarHBondContact O-N 3.46Å
266	D	95.3	Very high	93.1	Very high	36 Å²	36	69.6 Å²	69.6	19%	0.193	34%	0.336	C	S	.	.	H	α-helix	trans	-74.3	-36.7	-178.3	-59.4	-41.9	0	0	0	110.8	P259 K263 M264 K269 I270	P259-D266 HydrophobicContact CG-CB 4.26Å; K263-D266 WeakPolarHBondContact CB-OD2 3.08Å; K263-D266 PolarHBondContact N-OD2 3.41Å; K263-D266 WeakPolarHBondContact O-CB 3.5Å; K263-D266 PolarHBondContact O-N 3.18Å; M264-D266 PolarHBondContact O-N 3.49Å; D266-K269 PolarHBondContact O-N 3.43Å; D266-K269 IonicContact OD1-NZ 2.69Å; D266-K269 PolarHBondContact OD1-NZ 3.07Å; D266-I270 WeakPolarHBondContact O-CG1 3.46Å; D266-I270 PolarHBondContact O-N 2.84Å; D266-I270 VanDerWaalsContact O-N 3.15Å
267	Y	96.5	Very high	92.8	Very high	24 Å²	24	69.8 Å²	69.8	9%	0.094	34%	0.338	C	S	.	.	H	α-helix	trans	-65.3	-40.3	171.2	-61.1	-68.2	0	0	0	112.1	I258 P262 K263 M264 K269 I270 I271 D291 V295	I258-Y267 HydrophobicContact CD1-CE1 4.34Å; I258-Y267 HydrophobicContact CG2-CE1 3.86Å; P262-Y267 HydrophobicContact CB-CE1 4.34Å; P262-Y267 HydrophobicContact CB-CE2 3.91Å; P262-Y267 HydrophobicContact CG-CE1 4.43Å; P262-Y267 HydrophobicContact CG-CE2 4.04Å; P262-Y267 WeakPolarHBondContact CG-OH 3.37Å; K263-Y267 WeakPolarHBondContact O-CD2 3.15Å; M264-Y267 PolarHBondContact O-N 3.2Å; Y267-K269 VanDerWaalsContact C-N 3.34Å; Y267-K269 PolarHBondContact O-N 3.44Å; Y267-I270 WeakPolarHBondContact O-CB 3.36Å; Y267-I270 PolarHBondContact O-N 2.97Å; Y267-I271 PolarHBondContact O-N 3.46Å; Y267-I271 VanDerWaalsContact O-N 3.15Å; Y267-D291 PolarHBondContact OH-OD1 2.83Å; Y267-V295 HydrophobicContact CD1-CG2 3.81Å; Y267-V295 HydrophobicContact CE1-CG2 4.21Å
268	D	96.1	Very high	92.5	Very high	52 Å²	52	69.7 Å²	69.7	28%	0.278	34%	0.339	S	S	.	.	H	α-helix	trans	-64.2	-39.7	178.1	-65.6	-27.6	0	0	0	111.4	M264 E265 I270 I271 Q272 R301	M264-D268 PolarHBondContact O-N 3.35Å; E265-D268 PolarHBondContact O-N 2.85Å; D268-I270 VanDerWaalsContact C-N 3.34Å; D268-I270 PolarHBondContact O-N 3.45Å; D268-I271 PolarHBondContact O-N 2.92Å; D268-Q272 WeakPolarHBondContact O-CG 3.31Å; D268-Q272 PolarHBondContact O-N 2.78Å; D268-R301 IonicContact OD1-CZ 3.05Å; D268-R301 IonicContact OD1-NE 2.81Å; D268-R301 PolarHBondContact OD1-NE 3.36Å; D268-R301 IonicContact OD1-NH2 2.86Å; D268-R301 PolarHBondContact OD1-NH2 3.43Å; D268-R301 IonicContact OD2-NE 3.64Å; D268-R301 IonicContact OD2-NH2 3.51Å
269	K	96.4	Very high	92.4	Very high	96 Å²	96	72.7 Å²	72.7	42%	0.417	36%	0.355	S	S	.	.	H	α-helix	trans	-61.1	-40.7	173.5	-72.4	167.9	-159.7	155.3	0	112.2	E265 D266 Y267 Q272 Q273	E265-K269 VanDerWaalsContact O-CG 3.28Å; E265-K269 WeakPolarHBondContact O-CG 3.48Å; E265-K269 PolarHBondContact O-N 3.46Å; D266-K269 PolarHBondContact O-N 3.43Å; D266-K269 IonicContact OD1-NZ 2.69Å; D266-K269 PolarHBondContact OD1-NZ 3.07Å; Y267-K269 VanDerWaalsContact C-N 3.34Å; Y267-K269 PolarHBondContact O-N 3.44Å; K269-Q272 PolarHBondContact O-N 3.2Å; K269-Q273 WeakPolarHBondContact O-CG 3.23Å; K269-Q273 PolarHBondContact O-N 2.91Å
270	I	96.9	Very high	92.6	Very high	6 Å²	6	70.5 Å²	70.5	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-47.2	177.6	-72.7	170.2	0	0	0	110.2	V226 L256 I258 D266 Y267 D268 Q272 Q273 L274	V226-I270 HydrophobicContact CG1-CG2 4.44Å; V226-I270 HydrophobicContact CG2-CG2 4.33Å; L256-I270 HydrophobicContact CD1-CB 4.46Å; L256-I270 HydrophobicContact CD1-CG2 3.87Å; I258-I270 HydrophobicContact CB-CD1 4.27Å; I258-I270 HydrophobicContact CD1-CD1 4.47Å; I258-I270 HydrophobicContact CG1-CD1 3.41Å; I258-I270 VanDerWaalsContact CG1-CD1 3.41Å; D266-I270 WeakPolarHBondContact O-CG1 3.46Å; D266-I270 PolarHBondContact O-N 2.84Å; D266-I270 VanDerWaalsContact O-N 3.15Å; Y267-I270 WeakPolarHBondContact O-CB 3.36Å; Y267-I270 PolarHBondContact O-N 2.97Å; D268-I270 VanDerWaalsContact C-N 3.34Å; D268-I270 PolarHBondContact O-N 3.45Å; I270-Q272 VanDerWaalsContact C-N 3.35Å; I270-Q272 PolarHBondContact O-N 2.68Å; I270-Q273 PolarHBondContact O-N 2.86Å; I270-L274 HydrophobicContact CG2-CD1 4.31Å; I270-L274 WeakPolarHBondContact O-CG 3.32Å; I270-L274 PolarHBondContact O-N 2.72Å
271	I	97	Very high	93.4	Very high	2 Å²	2	68.9 Å²	68.9	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-63.5	-41.7	177.8	-60.8	-53.8	0	0	0	111.4	Y267 D268 Q273 L274 L275 V295 A298 T299 A302 F308	Y267-I271 PolarHBondContact O-N 3.46Å; Y267-I271 VanDerWaalsContact O-N 3.15Å; D268-I271 PolarHBondContact O-N 2.92Å; I271-Q273 VanDerWaalsContact C-N 3.32Å; I271-Q273 PolarHBondContact O-N 3.47Å; I271-L274 HydrophobicContact CD1-CD1 4.23Å; I271-L274 PolarHBondContact O-N 3.04Å; I271-L275 HydrophobicContact CG2-CD1 4.16Å; I271-L275 VanDerWaalsContact O-CG 3.31Å; I271-L275 WeakPolarHBondContact O-CG 3.22Å; I271-L275 PolarHBondContact O-N 3.14Å; I271-V295 HydrophobicContact CD1-CG1 4.02Å; I271-A298 HydrophobicContact CG1-CB 3.71Å; I271-T299 WeakPolarHBondContact CD1-OG1 3.46Å; I271-A302 HydrophobicContact CG2-CB 3.75Å; I271-F308 HydrophobicContact CG2-CE2 4.26Å
272	Q	95.9	Very high	94.1	Very high	129 Å²	129	64 Å²	64	60%	0.603	31%	0.305	S	S	*	.	H	α-helix	trans	-58.8	-42.9	175.2	-73.5	176.1	-3.1	0	0	112.2	D268 K269 I270 L275 E276	D268-Q272 WeakPolarHBondContact O-CG 3.31Å; D268-Q272 PolarHBondContact O-N 2.78Å; K269-Q272 PolarHBondContact O-N 3.2Å; I270-Q272 VanDerWaalsContact C-N 3.35Å; I270-Q272 PolarHBondContact O-N 2.68Å; Q272-L275 PolarHBondContact O-N 3.13Å; Q272-E276 PolarHBondContact O-N 3.07Å
273	Q	96.3	Very high	94.6	Very high	82 Å²	82	62.3 Å²	62.3	38%	0.383	29%	0.293	S	S	.	.	H	α-helix	trans	-65.7	-42.7	177.2	-74	176.6	-25.2	0	0	112.1	Q254 L256 K269 I270 I271 L275 E276	Q254-Q273 PolarHBondContact NE2-O 3.44Å; Q254-Q273 PolarHBondContact OE1-O 2.93Å; Q254-Q273 VanDerWaalsContact OE1-O 3.08Å; L256-Q273 HydrophobicContact CD1-CB 3.82Å; L256-Q273 HydrophobicContact CD2-CB 4.2Å; K269-Q273 WeakPolarHBondContact O-CG 3.23Å; K269-Q273 PolarHBondContact O-N 2.91Å; I270-Q273 PolarHBondContact O-N 2.86Å; I271-Q273 VanDerWaalsContact C-N 3.32Å; I271-Q273 PolarHBondContact O-N 3.47Å; Q273-L275 PolarHBondContact O-N 3.18Å; Q273-E276 VanDerWaalsContact O-CB 3.28Å; Q273-E276 WeakPolarHBondContact O-CB 3.49Å; Q273-E276 PolarHBondContact O-N 3.47Å
274	L	96.2	Very high	95	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-38.4	175.1	-69.8	178.5	0	0	0	112	V226 L256 I270 I271 E276 T277 I283 F308	V226-L274 HydrophobicContact CG2-CD1 4.23Å; V226-L274 HydrophobicContact CG2-CD2 4.48Å; L256-L274 HydrophobicContact CD1-CD2 3.6Å; L256-L274 HydrophobicContact CD1-CG 3.69Å; L256-L274 HydrophobicContact CG-CD2 4.43Å; I270-L274 HydrophobicContact CG2-CD1 4.31Å; I270-L274 WeakPolarHBondContact O-CG 3.32Å; I270-L274 PolarHBondContact O-N 2.72Å; I271-L274 HydrophobicContact CD1-CD1 4.23Å; I271-L274 PolarHBondContact O-N 3.04Å; L274-E276 VanDerWaalsContact C-N 3.29Å; L274-E276 PolarHBondContact O-N 2.92Å; L274-T277 CarbonylContact O-C 3.54Å; L274-T277 PolarHBondContact O-N 3.33Å; L274-T277 VanDerWaalsContact O-N 3.12Å; L274-T277 PolarHBondContact O-OG1 3.26Å; L274-T277 VanDerWaalsContact O-OG1 3.04Å; L274-I283 HydrophobicContact CD1-CD1 4.13Å; L274-I283 HydrophobicContact CD1-CG1 4.47Å; L274-I283 HydrophobicContact CD1-CG2 4.42Å; L274-I283 HydrophobicContact CD2-CD1 3.92Å; L274-F308 HydrophobicContact CB-CE1 3.88Å; L274-F308 HydrophobicContact CB-CZ 3.73Å; L274-F308 HydrophobicContact CD1-CZ 4.49Å
275	L	95.5	Very high	95.3	Very high	57 Å²	57	48.6 Å²	48.6	30%	0.298	23%	0.23	S	C	.	.	H	α-helix	trans	-68.5	-21.9	177.6	-69.9	170.5	0	0	0	113.8	I271 Q272 Q273 T277 H278 Q304 F308	I271-L275 HydrophobicContact CG2-CD1 4.16Å; I271-L275 VanDerWaalsContact O-CG 3.31Å; I271-L275 WeakPolarHBondContact O-CG 3.22Å; I271-L275 PolarHBondContact O-N 3.14Å; Q272-L275 PolarHBondContact O-N 3.13Å; Q273-L275 PolarHBondContact O-N 3.18Å; L275-T277 PolarHBondContact O-N 3.3Å; L275-H278 PolarHBondContact O-N 2.74Å; L275-Q304 HydrophobicContact CD1-CG 4.05Å; L275-Q304 HydrophobicContact CD2-CG 3.97Å; L275-F308 HydrophobicContact CD2-CE2 4.34Å; L275-F308 HydrophobicContact CD2-CZ 3.75Å; L275-F308 HydrophobicContact CG-CZ 4.03Å
276	E	94.8	Very high	95.4	Very high	141 Å²	141	42.5 Å²	42.5	66%	0.659	20%	0.201	S	C	*	.	H	α-helix	trans	-61	-29	171.3	-61.4	179.2	170.9	0	0	111.1	Q272 Q273 L274	Q272-E276 PolarHBondContact O-N 3.07Å; Q273-E276 VanDerWaalsContact O-CB 3.28Å; Q273-E276 WeakPolarHBondContact O-CB 3.49Å; Q273-E276 PolarHBondContact O-N 3.47Å; L274-E276 VanDerWaalsContact C-N 3.29Å; L274-E276 PolarHBondContact O-N 2.92Å
277	T	91.4	Very high	95.2	Very high	20 Å²	20	40.8 Å²	40.8	12%	0.123	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	56.8	176	51.2	0	0	0	0	112.5	A253 Q254 L274 L275 N279 A280	A253-T277 HydrophobicContact CB-CG2 4.2Å; Q254-T277 HydrophobicContact CG-CG2 4.01Å; L274-T277 CarbonylContact O-C 3.54Å; L274-T277 PolarHBondContact O-N 3.33Å; L274-T277 VanDerWaalsContact O-N 3.12Å; L274-T277 PolarHBondContact O-OG1 3.26Å; L274-T277 VanDerWaalsContact O-OG1 3.04Å; L275-T277 PolarHBondContact O-N 3.3Å; T277-N279 PolarHBondContact O-N 3.04Å; T277-A280 WeakPolarHBondContact O-CB 3.41Å; T277-A280 PolarHBondContact O-N 2.7Å
278	H	89.1	Confident	94.8	Very high	116 Å²	116	41.6 Å²	41.6	54%	0.537	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.4	-28.1	-177.2	71.8	-73.2	0	0	0	117.2	L275	L275-H278 PolarHBondContact O-N 2.74Å
279	N	91.3	Very high	94.3	Very high	64 Å²	64	41.1 Å²	41.1	34%	0.342	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-17.4	178.7	-77.2	-17.1	0	0	0	113.8	Y222 T277 R281 V521 C522	Y222-N279 HydrophobicContact CD1-CB 4.42Å; T277-N279 PolarHBondContact O-N 3.04Å; N279-R281 PolarHBondContact O-N 3.23Å; N279-V521 WeakPolarHBondContact CB-O 3.46Å; N279-C522 PolarHBondContact ND2-O 3.03Å
280	A	94.7	Very high	93.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.208	C	C	.	.			trans	-87	76.2	174.2	0	0	0	0	0	109.4	Y222 A253 T277	Y222-A280 HydrophobicContact CD1-CB 3.62Å; Y222-A280 HydrophobicContact CE1-CB 3.74Å; Y222-A280 HydrophobicContact CG-CB 4.45Å; A253-A280 HydrophobicContact CB-CB 3.7Å; T277-A280 WeakPolarHBondContact O-CB 3.41Å; T277-A280 PolarHBondContact O-N 2.7Å
281	R	95.1	Very high	93.5	Very high	66 Å²	66	43.7 Å²	43.7	25%	0.249	21%	0.211	C	C	.	.			trans	-74.3	-32.1	-179.7	-65.3	-173.6	67.5	-175.1	-0.6	112.5	N279 G306 H307 F308 L309 S520	N279-R281 PolarHBondContact O-N 3.23Å; R281-G306 PolarHBondContact NH2-O 3.2Å; R281-G306 VanDerWaalsContact NH2-O 3.08Å; R281-H307 PolarHBondContact NE-O 2.86Å; R281-H307 PolarHBondContact NH2-O 3.47Å; R281-F308 CarbonylContact O-C 3.45Å; R281-F308 WeakPolarHBondContact O-CA 3.43Å; R281-L309 HydrophobicContact CB-CD1 4.18Å; R281-L309 HydrophobicContact CB-CG 4.37Å; R281-L309 PolarHBondContact O-N 3.12Å; R281-S520 PolarHBondContact N-OG 3.05Å
282	A	96.7	Very high	93.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.2	179.9	0	0	0	0	0	111.9	W220 V223 S224 L309 S520	W220-A282 HydrophobicContact CD2-CB 3.85Å; W220-A282 HydrophobicContact CE3-CB 3.25Å; W220-A282 HydrophobicContact CH2-CB 4.2Å; W220-A282 HydrophobicContact CZ3-CB 3.43Å; W220-A282 VanDerWaalsContact CZ3-CB 3.43Å; V223-A282 WeakPolarHBondContact CA-O 3.29Å; V223-A282 HydrophobicContact CB-CB 4.39Å; V223-A282 HydrophobicContact CG1-CB 3.92Å; S224-A282 PolarHBondContact N-O 2.96Å; A282-L309 CarbonylContact C-O 3.57Å; A282-L309 WeakPolarHBondContact CA-O 3.27Å; A282-S520 PolarHBondContact N-OG 3.46Å
283	I	97.8	Very high	93.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.4	-177.5	-47.8	-59.1	0	0	0	110.1	S224 V226 L274 F308 L309 W310 I311	S224-I283 CarbonylContact O-C 3.53Å; S224-I283 WeakPolarHBondContact O-CA 3.5Å; V226-I283 HydrophobicContact CG2-CG2 3.81Å; L274-I283 HydrophobicContact CD1-CD1 4.13Å; L274-I283 HydrophobicContact CD1-CG1 4.47Å; L274-I283 HydrophobicContact CD1-CG2 4.42Å; L274-I283 HydrophobicContact CD2-CD1 3.92Å; I283-F308 HydrophobicContact CD1-CD1 3.83Å; I283-F308 HydrophobicContact CD1-CE1 4.26Å; I283-F308 HydrophobicContact CG1-CB 3.98Å; I283-F308 HydrophobicContact CG1-CD1 3.76Å; I283-F308 HydrophobicContact CG1-CG 4.08Å; I283-L309 PolarHBondContact N-O 3.45Å; I283-W310 HydrophobicContact CB-CE3 3.8Å; I283-W310 HydrophobicContact CB-CZ3 3.87Å; I283-W310 HydrophobicContact CG1-CE3 4.39Å; I283-W310 HydrophobicContact CG1-CZ3 4.2Å; I283-W310 HydrophobicContact CG2-CE3 3.93Å; I283-W310 HydrophobicContact CG2-CZ3 3.63Å; I283-I311 PolarHBondContact O-N 3.28Å
284	I	97.8	Very high	93.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	120.7	175.9	-45.2	-52.1	0	0	0	108.8	M211 I215 V223 S224 T225 V226 F240 F286 I311	M211-I284 HydrophobicContact SD-CG2 3.52Å; M211-I284 VanDerWaalsContact SD-CG2 3.52Å; I215-I284 HydrophobicContact CD1-CD1 3.54Å; I215-I284 HydrophobicContact CD1-CG1 4.14Å; I215-I284 HydrophobicContact CG1-CD1 4.21Å; V223-I284 HydrophobicContact CG2-CG1 4.46Å; S224-I284 PolarHBondContact O-N 2.03Å; T225-I284 CarbonylContact C-O 3.48Å; T225-I284 WeakPolarHBondContact CA-O 3.38Å; T225-I284 HydrophobicContact CG2-CB 4.11Å; T225-I284 HydrophobicContact CG2-CG1 4.34Å; V226-I284 PolarHBondContact N-O 2.91Å; F240-I284 HydrophobicContact CD2-CG2 4.47Å; F240-I284 HydrophobicContact CE1-CG1 4.02Å; F240-I284 HydrophobicContact CE2-CG1 4.28Å; F240-I284 HydrophobicContact CZ-CD1 4.43Å; F240-I284 HydrophobicContact CZ-CG1 3.81Å; I284-F286 HydrophobicContact CG2-CD2 4.11Å; I284-F286 HydrophobicContact CG2-CE2 3.87Å; I284-I311 HydrophobicContact CD1-CB 3.66Å; I284-I311 HydrophobicContact CD1-CD1 3.59Å; I284-I311 HydrophobicContact CD1-CG1 4.03Å; I284-I311 HydrophobicContact CD1-CG2 4.17Å
285	I	96.7	Very high	93.2	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	113.1	-175.6	-167.4	163.5	0	0	0	112.9	V226 A287 I292 V295 I311 S313 W316	V226-I285 HydrophobicContact CB-CG1 4.33Å; V226-I285 HydrophobicContact CG1-CD1 4.5Å; V226-I285 WeakPolarHBondContact O-CA 3.39Å; I285-A287 HydrophobicContact CD1-CB 4.03Å; I285-A287 HydrophobicContact CG1-CB 3.63Å; I285-I292 HydrophobicContact CD1-CG1 3.89Å; I285-I292 HydrophobicContact CG1-CG1 4.26Å; I285-V295 HydrophobicContact CD1-CG1 4.49Å; I285-I311 PolarHBondContact N-O 3.37Å; I285-S313 PolarHBondContact O-N 2.91Å; I285-S313 PolarHBondContact O-OG 3.27Å; I285-W316 HydrophobicContact CG2-CE3 4.21Å; I285-W316 HydrophobicContact CG2-CZ3 4.39Å
286	F	95.3	Very high	93.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	78	168.3	-76.6	-93	0	0	0	109	D204 Q207 A208 M211 V226 A227 S228 G233 V237 F240 I284	D204-F286 HydrophobicContact CB-CE1 4.4Å; Q207-F286 HydrophobicContact CG-CE1 4.33Å; Q207-F286 VanDerWaalsContact OE1-CE1 3.27Å; A208-F286 HydrophobicContact CB-CZ 4.26Å; M211-F286 HydrophobicContact CE-CE1 4.41Å; M211-F286 HydrophobicContact CE-CE2 4.11Å; M211-F286 HydrophobicContact CE-CZ 3.92Å; M211-F286 HydrophobicContact SD-CD2 4.31Å; M211-F286 HydrophobicContact SD-CE1 4.42Å; M211-F286 HydrophobicContact SD-CE2 3.33Å; M211-F286 WeakPolarHBondContact SD-CE2 3.34Å; M211-F286 HydrophobicContact SD-CZ 3.41Å; M211-F286 WeakPolarHBondContact SD-CZ 3.47Å; V226-F286 PolarHBondContact O-N 3.03Å; A227-F286 VanDerWaalsContact CA-O 3.29Å; A227-F286 WeakPolarHBondContact CA-O 3.41Å; S228-F286 PolarHBondContact N-O 3.36Å; G233-F286 WeakPolarHBondContact CA-O 3.3Å; V237-F286 HydrophobicContact CG2-CB 4.13Å; V237-F286 HydrophobicContact CG2-CD2 3.85Å; V237-F286 HydrophobicContact CG2-CG 4.36Å; F240-F286 HydrophobicContact CB-CE2 4.34Å; I284-F286 HydrophobicContact CG2-CD2 4.11Å; I284-F286 HydrophobicContact CG2-CE2 3.87Å
287	A	92.4	Very high	93.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.			trans	-133	163.4	-174.4	0	0	0	0	0	112	S228 I258 I285 D291 I292 S315	S228-A287 WeakPolarHBondContact OG-CA 3.24Å; S228-A287 WeakPolarHBondContact OG-CB 3.46Å; I258-A287 HydrophobicContact CD1-CB 4.25Å; I285-A287 HydrophobicContact CD1-CB 4.03Å; I285-A287 HydrophobicContact CG1-CB 3.63Å; A287-D291 HydrophobicContact CB-CB 3.97Å; A287-I292 HydrophobicContact CB-CG1 3.98Å; A287-S315 WeakPolarHBondContact O-CB 3.49Å; A287-S315 PolarHBondContact O-OG 3.47Å
288	S	87.3	Confident	93.5	Very high	41 Å²	41	31.2 Å²	31.2	29%	0.287	15%	0.152	S	C	.	.			trans	-68	162.2	172.7	79.1	0	0	0	0	111.1	S228 E290 D291 I292	S228-S288 PolarHBondContact OG-N 2.72Å; S288-E290 VanDerWaalsContact C-N 3.26Å; S288-E290 PolarHBondContact O-N 3.44Å; S288-D291 PolarHBondContact O-N 3.46Å; S288-D291 WeakPolarHBondContact OG-CB 3.32Å; S288-D291 PolarHBondContact OG-N 3.42Å; S288-D291 PolarHBondContact OG-OD2 3.48Å; S288-I292 WeakPolarHBondContact O-CD1 3.23Å; S288-I292 VanDerWaalsContact O-CG1 3.26Å; S288-I292 WeakPolarHBondContact O-CG1 3.44Å; S288-I292 PolarHBondContact O-N 3.28Å
289	E	85.4	Confident	93.8	Very high	42 Å²	42	25.7 Å²	25.7	20%	0.196	13%	0.126	C	C	.	.	H	α-helix	trans	-58.4	-39.5	178.7	-172.7	175.2	145.6	0	0	112.2	R293 K319 S321 P322	E289-R293 PolarHBondContact O-N 3.49Å; E289-K319 IonicContact OE2-NZ 2.82Å; E289-K319 PolarHBondContact OE2-NZ 2.99Å; E289-S321 WeakPolarHBondContact OE1-CB 3.27Å; E289-S321 PolarHBondContact OE1-OG 2.92Å; E289-P322 HydrophobicContact CG-CB 4.02Å; E289-P322 HydrophobicContact CG-CG 3.97Å
290	E	84.9	Confident	94	Very high	138 Å²	138	26.3 Å²	26.3	65%	0.645	13%	0.126	S	C	*	.	H	α-helix	trans	-66.2	-43.1	177.5	-65.2	170.3	-156.9	0	0	111.4	S288 R293 G294	S288-E290 VanDerWaalsContact C-N 3.26Å; S288-E290 PolarHBondContact O-N 3.44Å; E290-R293 PolarHBondContact O-N 2.82Å; E290-G294 PolarHBondContact O-N 3.28Å
291	D	91.8	Very high	94	Very high	18 Å²	18	31.3 Å²	31.3	10%	0.096	15%	0.145	C	C	.	.	H	α-helix	trans	-69	-39.9	179.9	-68.9	-39.4	0	0	0	112.5	S228 I258 Y267 A287 S288 R293 G294 V295	S228-D291 VanDerWaalsContact CB-OD2 3.32Å; S228-D291 WeakPolarHBondContact CB-OD2 3.35Å; S228-D291 WeakPolarHBondContact OG-CB 3.43Å; S228-D291 VanDerWaalsContact OG-CG 3.3Å; S228-D291 PolarHBondContact OG-OD2 2.81Å; I258-D291 HydrophobicContact CD1-CB 3.8Å; Y267-D291 PolarHBondContact OH-OD1 2.83Å; A287-D291 HydrophobicContact CB-CB 3.97Å; S288-D291 PolarHBondContact O-N 3.46Å; S288-D291 WeakPolarHBondContact OG-CB 3.32Å; S288-D291 PolarHBondContact OG-N 3.42Å; S288-D291 PolarHBondContact OG-OD2 3.48Å; D291-R293 VanDerWaalsContact C-N 3.33Å; D291-R293 PolarHBondContact O-N 2.81Å; D291-G294 PolarHBondContact O-N 2.95Å; D291-G294 VanDerWaalsContact O-N 3.17Å; D291-V295 WeakPolarHBondContact O-CG2 3.49Å; D291-V295 PolarHBondContact O-N 3.26Å
292	I	94.6	Very high	94	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.3	-49.8	174.2	-69.7	160.5	0	0	0	109.4	I285 A287 S288 G294 V295 L296 S315 W316 P322	I285-I292 HydrophobicContact CD1-CG1 3.89Å; I285-I292 HydrophobicContact CG1-CG1 4.26Å; A287-I292 HydrophobicContact CB-CG1 3.98Å; S288-I292 WeakPolarHBondContact O-CD1 3.23Å; S288-I292 VanDerWaalsContact O-CG1 3.26Å; S288-I292 WeakPolarHBondContact O-CG1 3.44Å; S288-I292 PolarHBondContact O-N 3.28Å; I292-G294 VanDerWaalsContact C-N 3.29Å; I292-G294 PolarHBondContact O-N 3.26Å; I292-V295 PolarHBondContact O-N 2.75Å; I292-L296 HydrophobicContact CG2-CD1 3.92Å; I292-L296 HydrophobicContact CG2-CG 4.3Å; I292-L296 WeakPolarHBondContact O-CG 3.33Å; I292-L296 PolarHBondContact O-N 2.94Å; I292-S315 WeakPolarHBondContact CD1-OG 3.34Å; I292-W316 HydrophobicContact CD1-CB 3.92Å; I292-W316 HydrophobicContact CG2-CD2 4.01Å; I292-W316 HydrophobicContact CG2-CE3 3.76Å; I292-W316 HydrophobicContact CG2-CZ3 4.1Å; I292-P322 HydrophobicContact CB-CB 4.45Å; I292-P322 HydrophobicContact CG2-CB 4.05Å
293	R	93.3	Very high	93.9	Very high	91 Å²	91	36.6 Å²	36.6	34%	0.343	18%	0.184	S	C	.	.	H	α-helix	trans	-59.3	-41.2	177	-173.6	179.2	178.6	119.5	1.4	111.6	E289 E290 D291 L296 N297 S321 L326	E289-R293 PolarHBondContact O-N 3.49Å; E290-R293 PolarHBondContact O-N 2.82Å; D291-R293 VanDerWaalsContact C-N 3.33Å; D291-R293 PolarHBondContact O-N 2.81Å; R293-L296 PolarHBondContact O-N 3.16Å; R293-N297 VanDerWaalsContact O-CB 3.23Å; R293-N297 WeakPolarHBondContact O-CB 3.43Å; R293-N297 PolarHBondContact O-N 2.95Å; R293-S321 PolarHBondContact NH1-O 3.28Å; R293-L326 HydrophobicContact CG-CD1 4.04Å
294	G	94.1	Very high	93.7	Very high	13 Å²	13	39.3 Å²	39.3	13%	0.134	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-46.8	175.5	0	0	0	0	0	113.2	E290 D291 I292 A298	E290-G294 PolarHBondContact O-N 3.28Å; D291-G294 PolarHBondContact O-N 2.95Å; D291-G294 VanDerWaalsContact O-N 3.17Å; I292-G294 VanDerWaalsContact C-N 3.29Å; I292-G294 PolarHBondContact O-N 3.26Å; G294-A298 WeakPolarHBondContact O-CB 3.29Å; G294-A298 PolarHBondContact O-N 3.46Å
295	V	96.6	Very high	93.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-44.5	178	173.4	0	0	0	0	111.9	I258 Y267 I271 I285 D291 I292 N297 A298 T299 W310	I258-V295 HydrophobicContact CD1-CG2 3.75Å; Y267-V295 HydrophobicContact CD1-CG2 3.81Å; Y267-V295 HydrophobicContact CE1-CG2 4.21Å; I271-V295 HydrophobicContact CD1-CG1 4.02Å; I285-V295 HydrophobicContact CD1-CG1 4.49Å; D291-V295 WeakPolarHBondContact O-CG2 3.49Å; D291-V295 PolarHBondContact O-N 3.26Å; I292-V295 PolarHBondContact O-N 2.75Å; V295-N297 VanDerWaalsContact C-N 3.35Å; V295-N297 PolarHBondContact O-N 3Å; V295-A298 PolarHBondContact O-N 3.27Å; V295-T299 PolarHBondContact O-N 3.11Å; V295-T299 PolarHBondContact O-OG1 3.08Å; V295-W310 HydrophobicContact CG1-CH2 3.65Å; V295-W310 HydrophobicContact CG1-CZ3 3.87Å
296	L	96.2	Very high	93.1	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-40.6	177.7	-66.9	178.6	0	0	0	111.5	I292 R293 T299 K300 W310 W316 I323 L326 V329	I292-L296 HydrophobicContact CG2-CD1 3.92Å; I292-L296 HydrophobicContact CG2-CG 4.3Å; I292-L296 WeakPolarHBondContact O-CG 3.33Å; I292-L296 PolarHBondContact O-N 2.94Å; R293-L296 PolarHBondContact O-N 3.16Å; L296-T299 WeakPolarHBondContact O-CB 3.42Å; L296-T299 PolarHBondContact O-N 3.2Å; L296-K300 PolarHBondContact O-N 3.36Å; L296-W310 HydrophobicContact CD2-CD2 4.17Å; L296-W310 HydrophobicContact CD2-CZ2 4.01Å; L296-W316 HydrophobicContact CD1-CH2 3.84Å; L296-W316 HydrophobicContact CD1-CZ2 3.96Å; L296-W316 HydrophobicContact CD1-CZ3 4.46Å; L296-W316 HydrophobicContact CD2-CH2 4.01Å; L296-W316 HydrophobicContact CD2-CZ3 4.49Å; L296-W316 HydrophobicContact CG-CH2 4.46Å; L296-I323 HydrophobicContact CD1-CG2 3.93Å; L296-L326 HydrophobicContact CB-CD1 3.91Å; L296-V329 HydrophobicContact CB-CG1 4.41Å; L296-V329 HydrophobicContact CD2-CB 4.49Å; L296-V329 HydrophobicContact CD2-CG1 3.85Å
297	N	95.6	Very high	93	Very high	64 Å²	64	45.2 Å²	45.2	34%	0.342	23%	0.233	S	C	.	.	H	α-helix	trans	-65.2	-41.7	175.7	-169.4	6	0	0	0	111.6	R293 V295 T299 K300 R301 L326	R293-N297 VanDerWaalsContact O-CB 3.23Å; R293-N297 WeakPolarHBondContact O-CB 3.43Å; R293-N297 PolarHBondContact O-N 2.95Å; V295-N297 VanDerWaalsContact C-N 3.35Å; V295-N297 PolarHBondContact O-N 3Å; N297-T299 VanDerWaalsContact C-N 3.3Å; N297-T299 PolarHBondContact O-N 3.13Å; N297-K300 PolarHBondContact O-N 3.37Å; N297-R301 PolarHBondContact ND2-NH1 3.41Å; N297-R301 WeakPolarHBondContact O-CG 3.07Å; N297-R301 PolarHBondContact O-N 3.47Å; N297-R301 PolarHBondContact OD1-NH1 3.22Å; N297-L326 HydrophobicContact CB-CD1 4.03Å; N297-L326 HydrophobicContact CB-CD2 4.35Å
298	A	96.3	Very high	93.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-38.2	173	0	0	0	0	0	112.4	I271 G294 V295 K300 R301 A302	I271-A298 HydrophobicContact CG1-CB 3.71Å; G294-A298 WeakPolarHBondContact O-CB 3.29Å; G294-A298 PolarHBondContact O-N 3.46Å; V295-A298 PolarHBondContact O-N 3.27Å; A298-K300 PolarHBondContact O-N 3Å; A298-R301 PolarHBondContact O-N 3.34Å; A298-A302 WeakPolarHBondContact O-CB 3.46Å; A298-A302 PolarHBondContact O-N 2.99Å
299	T	96.2	Very high	93.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.5	-43.4	174.9	-56.1	0	0	0	0	111.4	I271 V295 L296 N297 A302 N303 Q304 F308 W310 V329	I271-T299 WeakPolarHBondContact CD1-OG1 3.46Å; V295-T299 PolarHBondContact O-N 3.11Å; V295-T299 PolarHBondContact O-OG1 3.08Å; L296-T299 WeakPolarHBondContact O-CB 3.42Å; L296-T299 PolarHBondContact O-N 3.2Å; N297-T299 VanDerWaalsContact C-N 3.3Å; N297-T299 PolarHBondContact O-N 3.13Å; T299-A302 PolarHBondContact O-N 3.27Å; T299-N303 PolarHBondContact O-N 3.4Å; T299-Q304 HydrophobicContact CG2-CB 4.01Å; T299-Q304 PolarHBondContact O-N 2.85Å; T299-Q304 VanDerWaalsContact O-N 3.14Å; T299-F308 HydrophobicContact CG2-CD2 3.98Å; T299-F308 HydrophobicContact CG2-CE2 4.48Å; T299-W310 HydrophobicContact CG2-CZ2 4.2Å; T299-V329 HydrophobicContact CG2-CG1 3.76Å
300	K	95.1	Very high	94	Very high	77 Å²	77	41.8 Å²	41.8	34%	0.335	21%	0.212	S	C	.	.	H	α-helix	trans	-62.8	-45.1	175.1	-164.1	164.8	-174.7	154	0	111.8	L296 N297 A298 A302 N303 Q325 L326 D328 V329	L296-K300 PolarHBondContact O-N 3.36Å; N297-K300 PolarHBondContact O-N 3.37Å; A298-K300 PolarHBondContact O-N 3Å; K300-A302 VanDerWaalsContact C-N 3.3Å; K300-A302 PolarHBondContact O-N 3.35Å; K300-N303 PolarHBondContact O-N 3.12Å; K300-Q325 PolarHBondContact NZ-O 2.97Å; K300-L326 HydrophobicContact CB-CD2 4.32Å; K300-L326 HydrophobicContact CD-CD2 3.57Å; K300-D328 VanDerWaalsContact CE-OD2 3.25Å; K300-D328 WeakPolarHBondContact CE-OD2 3.3Å; K300-D328 VanDerWaalsContact NZ-CG 3.3Å; K300-D328 IonicContact NZ-OD1 3.99Å; K300-D328 PolarHBondContact NZ-OD1 2.72Å; K300-D328 IonicContact NZ-OD2 2.82Å; K300-D328 PolarHBondContact NZ-OD2 3.47Å; K300-V329 HydrophobicContact CB-CG2 3.9Å; K300-V329 HydrophobicContact CD-CG2 4.17Å; K300-V329 HydrophobicContact CG-CG2 4.25Å
301	R	94.9	Very high	94.6	Very high	104 Å²	104	35.2 Å²	35.2	39%	0.392	18%	0.181	S	C	.	.	H	α-helix	trans	-61.9	-35.4	175.8	-71	-167.1	-57.9	-88.1	6.8	113.1	D268 N297 A298 N303	D268-R301 IonicContact OD1-CZ 3.05Å; D268-R301 IonicContact OD1-NE 2.81Å; D268-R301 PolarHBondContact OD1-NE 3.36Å; D268-R301 IonicContact OD1-NH2 2.86Å; D268-R301 PolarHBondContact OD1-NH2 3.43Å; D268-R301 IonicContact OD2-NE 3.64Å; D268-R301 IonicContact OD2-NH2 3.51Å; N297-R301 PolarHBondContact ND2-NH1 3.41Å; N297-R301 WeakPolarHBondContact O-CG 3.07Å; N297-R301 PolarHBondContact O-N 3.47Å; N297-R301 PolarHBondContact OD1-NH1 3.22Å; A298-R301 PolarHBondContact O-N 3.34Å; R301-N303 PolarHBondContact O-N 3Å
302	A	95.1	Very high	94.7	Very high	40 Å²	40	34.3 Å²	34.3	33%	0.331	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	0.2	176.5	0	0	0	0	0	113.7	I271 A298 T299 K300 Q304	I271-A302 HydrophobicContact CG2-CB 3.75Å; A298-A302 WeakPolarHBondContact O-CB 3.46Å; A298-A302 PolarHBondContact O-N 2.99Å; T299-A302 PolarHBondContact O-N 3.27Å; K300-A302 VanDerWaalsContact C-N 3.3Å; K300-A302 PolarHBondContact O-N 3.35Å; A302-Q304 VanDerWaalsContact C-N 3.29Å; A302-Q304 HydrophobicContact CB-CG 4.08Å; A302-Q304 PolarHBondContact O-N 3.05Å; A302-Q304 PolarHBondContact O-NE2 2.66Å
303	N	94.6	Very high	94.7	Very high	138 Å²	138	34.3 Å²	34.3	74%	0.738	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	41.4	-177.3	-161.6	40.1	0	0	0	112.9	T299 K300 R301	T299-N303 PolarHBondContact O-N 3.4Å; K300-N303 PolarHBondContact O-N 3.12Å; R301-N303 PolarHBondContact O-N 3Å
304	Q	93.9	Very high	94.6	Very high	56 Å²	56	30.4 Å²	30.4	26%	0.262	16%	0.162	S	C	.	.			trans	-111.6	33.7	-179.5	-61.9	-56.4	-49.8	0	0	112.5	L275 T299 A302 G306 H307 F308	L275-Q304 HydrophobicContact CD1-CG 4.05Å; L275-Q304 HydrophobicContact CD2-CG 3.97Å; T299-Q304 HydrophobicContact CG2-CB 4.01Å; T299-Q304 PolarHBondContact O-N 2.85Å; T299-Q304 VanDerWaalsContact O-N 3.14Å; A302-Q304 VanDerWaalsContact C-N 3.29Å; A302-Q304 HydrophobicContact CB-CG 4.08Å; A302-Q304 PolarHBondContact O-N 3.05Å; A302-Q304 PolarHBondContact O-NE2 2.66Å; Q304-G306 PolarHBondContact O-N 2.91Å; Q304-H307 HydrophobicContact CB-CB 4.29Å; Q304-H307 PolarHBondContact O-N 3.36Å; Q304-F308 HydrophobicContact CB-CD2 4.5Å; Q304-F308 HydrophobicContact CB-CE2 4.19Å
305	V	92	Very high	94.3	Very high	62 Å²	62	30.5 Å²	30.5	38%	0.376	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	132.4	176.8	-174.2	0	0	0	0	109.4	H307 D328 V329	V305-H307 PolarHBondContact O-N 3.28Å; V305-D328 HydrophobicContact CG1-CB 4.28Å; V305-D328 VanDerWaalsContact CG1-O 3.25Å; V305-D328 WeakPolarHBondContact CG1-O 3.33Å; V305-V329 HydrophobicContact CG2-CG2 4.25Å
306	G	89.3	Confident	94	Very high	19 Å²	19	30.5 Å²	30.5	20%	0.196	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	-8	-178.5	0	0	0	0	0	116	R281 Q304	R281-G306 PolarHBondContact NH2-O 3.2Å; R281-G306 VanDerWaalsContact NH2-O 3.08Å; Q304-G306 PolarHBondContact O-N 2.91Å
307	H	92.6	Very high	93.7	Very high	45 Å²	45	30.5 Å²	30.5	21%	0.208	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-53.6	178.4	179.8	62.5	0	0	0	112.1	R281 Q304 V305	R281-H307 PolarHBondContact NE-O 2.86Å; R281-H307 PolarHBondContact NH2-O 3.47Å; Q304-H307 HydrophobicContact CB-CB 4.29Å; Q304-H307 PolarHBondContact O-N 3.36Å; V305-H307 PolarHBondContact O-N 3.28Å
308	F	95.2	Very high	93.3	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.018	16%	0.157	C	C	.	.	S	Bend	trans	-84.4	142.1	-179.6	-61.5	-60.8	0	0	0	111.9	I271 L274 L275 R281 I283 T299 Q304 W310	I271-F308 HydrophobicContact CG2-CE2 4.26Å; L274-F308 HydrophobicContact CB-CE1 3.88Å; L274-F308 HydrophobicContact CB-CZ 3.73Å; L274-F308 HydrophobicContact CD1-CZ 4.49Å; L275-F308 HydrophobicContact CD2-CE2 4.34Å; L275-F308 HydrophobicContact CD2-CZ 3.75Å; L275-F308 HydrophobicContact CG-CZ 4.03Å; R281-F308 CarbonylContact O-C 3.45Å; R281-F308 WeakPolarHBondContact O-CA 3.43Å; I283-F308 HydrophobicContact CD1-CD1 3.83Å; I283-F308 HydrophobicContact CD1-CE1 4.26Å; I283-F308 HydrophobicContact CG1-CB 3.98Å; I283-F308 HydrophobicContact CG1-CD1 3.76Å; I283-F308 HydrophobicContact CG1-CG 4.08Å; T299-F308 HydrophobicContact CG2-CD2 3.98Å; T299-F308 HydrophobicContact CG2-CE2 4.48Å; Q304-F308 HydrophobicContact CB-CD2 4.5Å; Q304-F308 HydrophobicContact CB-CE2 4.19Å; F308-W310 HydrophobicContact CB-CH2 4.31Å; F308-W310 HydrophobicContact CB-CZ2 3.76Å; F308-W310 HydrophobicContact CD2-CH2 4.39Å; F308-W310 HydrophobicContact CD2-CZ2 4.1Å; F308-W310 HydrophobicContact CG-CZ2 4.27Å
309	L	95.2	Very high	92.7	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	111.6	177.7	-53.5	170.2	0	0	0	107.8	W220 R281 A282 I283 W510 P511 P518	W220-L309 HydrophobicContact CH2-CB 3.82Å; W220-L309 HydrophobicContact CH2-CD1 3.82Å; W220-L309 HydrophobicContact CH2-CG 4.45Å; W220-L309 HydrophobicContact CZ2-CB 4.35Å; W220-L309 HydrophobicContact CZ2-CD1 3.46Å; W220-L309 VanDerWaalsContact CZ2-CD1 3.46Å; R281-L309 HydrophobicContact CB-CD1 4.18Å; R281-L309 HydrophobicContact CB-CG 4.37Å; R281-L309 PolarHBondContact O-N 3.12Å; A282-L309 CarbonylContact C-O 3.57Å; A282-L309 WeakPolarHBondContact CA-O 3.27Å; I283-L309 PolarHBondContact N-O 3.45Å; L309-W510 HydrophobicContact CD2-CE3 4.02Å; L309-W510 HydrophobicContact CD2-CZ3 4.42Å; L309-P511 HydrophobicContact CD2-CG 4.31Å; L309-P518 HydrophobicContact CD1-CB 3.88Å; L309-P518 HydrophobicContact CD1-CG 4.07Å; L309-P518 HydrophobicContact CD2-CG 4.3Å
310	W	96.3	Very high	92.1	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.015	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	131.3	-170.8	-54.5	100	0	0	0	111.7	I283 V295 L296 T299 F308 W316 V329 A333 V334	I283-W310 HydrophobicContact CB-CE3 3.8Å; I283-W310 HydrophobicContact CB-CZ3 3.87Å; I283-W310 HydrophobicContact CG1-CE3 4.39Å; I283-W310 HydrophobicContact CG1-CZ3 4.2Å; I283-W310 HydrophobicContact CG2-CE3 3.93Å; I283-W310 HydrophobicContact CG2-CZ3 3.63Å; V295-W310 HydrophobicContact CG1-CH2 3.65Å; V295-W310 HydrophobicContact CG1-CZ3 3.87Å; L296-W310 HydrophobicContact CD2-CD2 4.17Å; L296-W310 HydrophobicContact CD2-CZ2 4.01Å; T299-W310 HydrophobicContact CG2-CZ2 4.2Å; F308-W310 HydrophobicContact CB-CH2 4.31Å; F308-W310 HydrophobicContact CB-CZ2 3.76Å; F308-W310 HydrophobicContact CD2-CH2 4.39Å; F308-W310 HydrophobicContact CD2-CZ2 4.1Å; F308-W310 HydrophobicContact CG-CZ2 4.27Å; W310-W316 HydrophobicContact CB-CH2 4.04Å; W310-W316 HydrophobicContact CB-CZ3 3.83Å; W310-W316 HydrophobicContact CG-CH2 4.2Å; W310-W316 HydrophobicContact CG-CZ3 4.21Å; W310-V329 PolarHBondContact NE1-O 3.15Å; W310-A333 HydrophobicContact CB-CB 3.83Å; W310-A333 CarbonylContact O-C 3.54Å; W310-A333 WeakPolarHBondContact O-CA 3.19Å; W310-V334 PolarHBondContact O-N 2.97Å
311	I	97.2	Very high	91.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	107.1	163.7	-63	177.8	0	0	0	108.1	M211 I214 I215 W220 I283 I284 I285 V334	M211-I311 HydrophobicContact CB-CG2 4.43Å; M211-I311 HydrophobicContact CE-CG2 4.22Å; M211-I311 HydrophobicContact CG-CG2 3.84Å; M211-I311 HydrophobicContact SD-CG2 4.15Å; I214-I311 HydrophobicContact CG2-CD1 4.22Å; I215-I311 HydrophobicContact CD1-CD1 4.43Å; I215-I311 HydrophobicContact CG1-CD1 3.78Å; W220-I311 HydrophobicContact CE3-CD1 4.18Å; W220-I311 HydrophobicContact CZ3-CD1 3.68Å; W220-I311 HydrophobicContact CZ3-CG1 4.21Å; I283-I311 PolarHBondContact O-N 3.28Å; I284-I311 HydrophobicContact CD1-CB 3.66Å; I284-I311 HydrophobicContact CD1-CD1 3.59Å; I284-I311 HydrophobicContact CD1-CG1 4.03Å; I284-I311 HydrophobicContact CD1-CG2 4.17Å; I285-I311 PolarHBondContact N-O 3.37Å; I311-V334 CarbonylContact C-O 3.49Å; I311-V334 VanDerWaalsContact CA-O 3.23Å; I311-V334 WeakPolarHBondContact CA-O 3.3Å
312	G	95.7	Very high	91	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	142.6	-175.4	0	0	0	0	0	114.3	M211 V334 T335 I336	M211-G312 WeakPolarHBondContact CE-O 3.4Å; G312-V334 PolarHBondContact N-O 3.1Å; G312-T335 WeakPolarHBondContact O-CA 3.37Å; G312-I336 PolarHBondContact O-N 3.41Å; G312-I336 VanDerWaalsContact O-N 3.08Å
313	S	94.3	Very high	90.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.158	C	C	.	.			trans	-72.2	-178.1	166.1	51.9	0	0	0	0	112.2	Q207 Y232 I285 S315 W316 G317 I336	Q207-S313 VanDerWaalsContact NE2-CB 3.35Å; Y232-S313 VanDerWaalsContact OH-CB 3.28Å; Y232-S313 WeakPolarHBondContact OH-CB 3.32Å; Y232-S313 PolarHBondContact OH-OG 3.38Å; I285-S313 PolarHBondContact O-N 2.91Å; I285-S313 PolarHBondContact O-OG 3.27Å; S313-S315 PolarHBondContact O-N 3.34Å; S313-S315 PolarHBondContact OG-OG 3.29Å; S313-W316 WeakPolarHBondContact O-CB 3.4Å; S313-W316 PolarHBondContact O-N 2.97Å; S313-W316 VanDerWaalsContact O-N 3.08Å; S313-G317 PolarHBondContact O-N 3.02Å; S313-G317 VanDerWaalsContact O-N 3.12Å; S313-I336 CarbonylContact C-O 3.59Å
314	D	90.6	Very high	90.5	Very high	8 Å²	8	24.8 Å²	24.8	4%	0.043	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.7	-174.4	67.8	-52.4	0	0	0	113.5	Q207 Y232 W316 I336 L337 P338 K406	Q207-D314 PolarHBondContact NE2-OD1 2.86Å; Y232-D314 PolarHBondContact OH-OD1 2.92Å; D314-W316 PolarHBondContact O-N 2.9Å; D314-I336 WeakPolarHBondContact CA-O 3.45Å; D314-I336 PolarHBondContact N-O 3.43Å; D314-L337 HydrophobicContact CB-CD1 4.42Å; D314-P338 HydrophobicContact CB-CG 4.33Å; D314-K406 IonicContact OD2-NZ 3.71Å
315	S	87.2	Confident	90.3	Very high	16 Å²	16	28.3 Å²	28.3	11%	0.112	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-35.3	166	58.7	0	0	0	0	111.8	A287 I292 S313 K319	A287-S315 WeakPolarHBondContact O-CB 3.49Å; A287-S315 PolarHBondContact O-OG 3.47Å; I292-S315 WeakPolarHBondContact CD1-OG 3.34Å; S313-S315 PolarHBondContact O-N 3.34Å; S313-S315 PolarHBondContact OG-OG 3.29Å; S315-K319 PolarHBondContact O-NZ 3.1Å
316	W	90.9	Very high	90.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-63.4	169.4	-162.9	-23.4	0	0	0	110.3	I285 I292 L296 W310 S313 D314 S318 K319 P322 I323 A330 A333 T335 Y491	I285-W316 HydrophobicContact CG2-CE3 4.21Å; I285-W316 HydrophobicContact CG2-CZ3 4.39Å; I292-W316 HydrophobicContact CD1-CB 3.92Å; I292-W316 HydrophobicContact CG2-CD2 4.01Å; I292-W316 HydrophobicContact CG2-CE3 3.76Å; I292-W316 HydrophobicContact CG2-CZ3 4.1Å; L296-W316 HydrophobicContact CD1-CH2 3.84Å; L296-W316 HydrophobicContact CD1-CZ2 3.96Å; L296-W316 HydrophobicContact CD1-CZ3 4.46Å; L296-W316 HydrophobicContact CD2-CH2 4.01Å; L296-W316 HydrophobicContact CD2-CZ3 4.49Å; L296-W316 HydrophobicContact CG-CH2 4.46Å; W310-W316 HydrophobicContact CB-CH2 4.04Å; W310-W316 HydrophobicContact CB-CZ3 3.83Å; W310-W316 HydrophobicContact CG-CH2 4.2Å; W310-W316 HydrophobicContact CG-CZ3 4.21Å; S313-W316 WeakPolarHBondContact O-CB 3.4Å; S313-W316 PolarHBondContact O-N 2.97Å; S313-W316 VanDerWaalsContact O-N 3.08Å; D314-W316 PolarHBondContact O-N 2.9Å; W316-S318 PolarHBondContact O-N 2.76Å; W316-K319 WeakPolarHBondContact O-CB 3.35Å; W316-K319 PolarHBondContact O-N 2.89Å; W316-K319 VanDerWaalsContact O-N 3.16Å; W316-P322 HydrophobicContact CG-CG 4.5Å; W316-I323 HydrophobicContact CZ2-CG2 3.39Å; W316-I323 VanDerWaalsContact NE1-CG2 3.32Å; W316-A330 HydrophobicContact CH2-CB 4.43Å; W316-A330 HydrophobicContact CZ2-CB 3.88Å; W316-A333 HydrophobicContact CH2-CB 3.78Å; W316-A333 HydrophobicContact CZ2-CB 4.02Å; W316-A333 HydrophobicContact CZ3-CB 4.45Å; W316-T335 HydrophobicContact CB-CG2 4.11Å; W316-T335 HydrophobicContact CD2-CG2 3.77Å; W316-T335 HydrophobicContact CE3-CG2 4.24Å; W316-T335 HydrophobicContact CG-CG2 3.71Å; W316-Y491 AromaticContact NE1-CZ 3.93Å; W316-Y491 PolarHBondContact NE1-OH 3.41Å
317	G	88.8	Confident	90.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	-132.3	-179.9	0	0	0	0	0	113	S313 T335	S313-G317 PolarHBondContact O-N 3.02Å; S313-G317 VanDerWaalsContact O-N 3.12Å; G317-T335 VanDerWaalsContact O-CB 3.29Å; G317-T335 WeakPolarHBondContact O-CB 3.43Å; G317-T335 PolarHBondContact O-OG1 3.35Å
318	S	87.7	Confident	90.2	Very high	36 Å²	36	29 Å²	29	25%	0.252	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	21.7	176.4	68.8	0	0	0	0	113.4	W316 Y491	W316-S318 PolarHBondContact O-N 2.76Å; S318-Y491 WeakPolarHBondContact O-CD2 3.34Å
319	K	84.1	Confident	90.1	Very high	43 Å²	43	29 Å²	29	19%	0.187	16%	0.157	C	C	.	.			trans	-83.3	139.5	-174.9	-63.5	174	175.6	176.2	0	112	E289 S315 W316 P322 Y491	E289-K319 IonicContact OE2-NZ 2.82Å; E289-K319 PolarHBondContact OE2-NZ 2.99Å; S315-K319 PolarHBondContact O-NZ 3.1Å; W316-K319 WeakPolarHBondContact O-CB 3.35Å; W316-K319 PolarHBondContact O-N 2.89Å; W316-K319 VanDerWaalsContact O-N 3.16Å; K319-P322 HydrophobicContact CB-CG 4.29Å; K319-Y491 PolarHBondContact O-OH 2.91Å
320	S	82.8	Confident	90	Very high	71 Å²	71	28.8 Å²	28.8	50%	0.497	16%	0.156	S	C	.	.	S	Bend	trans	-80.3	-27.6	175	57	0	0	0	0	113.9	I323 H324	S320-I323 CarbonylContact O-C 3.59Å; S320-I323 VanDerWaalsContact O-CG1 3.27Å; S320-I323 WeakPolarHBondContact O-CG1 3.34Å; S320-I323 PolarHBondContact O-N 2.74Å; S320-I323 VanDerWaalsContact O-N 3.12Å; S320-H324 PolarHBondContact O-N 2.96Å
321	S	82.3	Confident	89.8	Confident	55 Å²	55	30.1 Å²	30.1	39%	0.385	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-52.6	-49.2	-177.6	168.9	0	0	0	0	115.5	E289 R293 I323	E289-S321 WeakPolarHBondContact OE1-CB 3.27Å; E289-S321 PolarHBondContact OE1-OG 2.92Å; R293-S321 PolarHBondContact NH1-O 3.28Å; S321-I323 PolarHBondContact O-N 3.4Å
322	P	85.8	Confident	89.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-66.6	-21.3	179.5	15.4	-22.9	0	0	0	114.3	E289 I292 W316 K319	E289-P322 HydrophobicContact CG-CB 4.02Å; E289-P322 HydrophobicContact CG-CG 3.97Å; I292-P322 HydrophobicContact CB-CB 4.45Å; I292-P322 HydrophobicContact CG2-CB 4.05Å; W316-P322 HydrophobicContact CG-CG 4.5Å; K319-P322 HydrophobicContact CB-CG 4.29Å
323	I	90.4	Very high	89.5	Confident	5 Å²	5	30.2 Å²	30.2	3%	0.026	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-110.2	-0.6	-176.1	61.7	159	0	0	0	114.2	L296 W316 S320 S321 Q325 L326 E327 A330 F481 Y491	L296-I323 HydrophobicContact CD1-CG2 3.93Å; W316-I323 HydrophobicContact CZ2-CG2 3.39Å; W316-I323 VanDerWaalsContact NE1-CG2 3.32Å; S320-I323 CarbonylContact O-C 3.59Å; S320-I323 VanDerWaalsContact O-CG1 3.27Å; S320-I323 WeakPolarHBondContact O-CG1 3.34Å; S320-I323 PolarHBondContact O-N 2.74Å; S320-I323 VanDerWaalsContact O-N 3.12Å; S321-I323 PolarHBondContact O-N 3.4Å; I323-Q325 PolarHBondContact O-N 3.28Å; I323-L326 CarbonylContact O-C 3.58Å; I323-L326 VanDerWaalsContact O-C 3.29Å; I323-L326 WeakPolarHBondContact O-CA 3.44Å; I323-L326 PolarHBondContact O-N 2.96Å; I323-E327 PolarHBondContact O-N 3.47Å; I323-A330 HydrophobicContact CB-CB 4.16Å; I323-A330 HydrophobicContact CG2-CB 3.66Å; I323-F481 HydrophobicContact CD1-CD2 3.74Å; I323-F481 HydrophobicContact CD1-CE1 4.26Å; I323-F481 HydrophobicContact CD1-CE2 3.25Å; I323-F481 HydrophobicContact CD1-CG 4.41Å; I323-F481 HydrophobicContact CD1-CZ 3.53Å; I323-Y491 HydrophobicContact CD1-CE2 3.91Å; I323-Y491 VanDerWaalsContact CD1-OH 3.32Å; I323-Y491 WeakPolarHBondContact CD1-OH 3.37Å
324	H	87.6	Confident	89.6	Confident	94 Å²	94	30.4 Å²	30.4	44%	0.435	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	120.5	-177.7	177.2	-79.5	0	0	0	111.3	S320 E327	S320-H324 PolarHBondContact O-N 2.96Å; H324-E327 WeakPolarHBondContact CA-OE1 3.36Å
325	Q	89.4	Confident	89.9	Confident	129 Å²	129	30 Å²	30	60%	0.603	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	8.8	-171	-59.9	166.4	-10	0	0	115.8	K300 I323 E327	K300-Q325 PolarHBondContact NZ-O 2.97Å; I323-Q325 PolarHBondContact O-N 3.28Å; Q325-E327 WeakPolarHBondContact CA-OE2 3.43Å; Q325-E327 VanDerWaalsContact N-CD 3.32Å; Q325-E327 PolarHBondContact N-OE1 2.88Å; Q325-E327 PolarHBondContact N-OE2 2.94Å; Q325-E327 VanDerWaalsContact N-OE2 3.13Å
326	L	92.3	Very high	90.2	Very high	10 Å²	10	29.2 Å²	29.2	5%	0.052	16%	0.159	C	C	.	.			trans	-127.9	20.2	179.8	-59.2	173.1	0	0	0	111.2	R293 L296 N297 K300 I323 D328 V329 A330	R293-L326 HydrophobicContact CG-CD1 4.04Å; L296-L326 HydrophobicContact CB-CD1 3.91Å; N297-L326 HydrophobicContact CB-CD1 4.03Å; N297-L326 HydrophobicContact CB-CD2 4.35Å; K300-L326 HydrophobicContact CB-CD2 4.32Å; K300-L326 HydrophobicContact CD-CD2 3.57Å; I323-L326 CarbonylContact O-C 3.58Å; I323-L326 VanDerWaalsContact O-C 3.29Å; I323-L326 WeakPolarHBondContact O-CA 3.44Å; I323-L326 PolarHBondContact O-N 2.96Å; L326-D328 PolarHBondContact O-N 2.71Å; L326-V329 WeakPolarHBondContact O-CB 3.47Å; L326-V329 PolarHBondContact O-N 3.07Å; L326-A330 PolarHBondContact O-N 3.48Å
327	E	90.9	Very high	90.2	Very high	64 Å²	64	29.7 Å²	29.7	30%	0.299	16%	0.162	S	C	.	.	H	α-helix	trans	-59.7	-36.8	-176.5	-61.4	81.2	-176.9	0	0	111.1	I323 H324 Q325 V329 A330 V331 F481 P489	I323-E327 PolarHBondContact O-N 3.47Å; H324-E327 WeakPolarHBondContact CA-OE1 3.36Å; Q325-E327 WeakPolarHBondContact CA-OE2 3.43Å; Q325-E327 VanDerWaalsContact N-CD 3.32Å; Q325-E327 PolarHBondContact N-OE1 2.88Å; Q325-E327 PolarHBondContact N-OE2 2.94Å; Q325-E327 VanDerWaalsContact N-OE2 3.13Å; E327-V329 VanDerWaalsContact C-N 3.26Å; E327-V329 PolarHBondContact O-N 3.47Å; E327-A330 PolarHBondContact O-N 3.11Å; E327-A330 VanDerWaalsContact O-N 3.13Å; E327-V331 VanDerWaalsContact O-CG2 3.29Å; E327-V331 WeakPolarHBondContact O-CG2 3.29Å; E327-V331 PolarHBondContact O-N 2.97Å; E327-F481 HydrophobicContact CB-CE1 3.94Å; E327-F481 HydrophobicContact CB-CZ 3.85Å; E327-F481 HydrophobicContact CG-CZ 4.01Å; E327-F481 WeakPolarHBondContact O-CE1 3.3Å; E327-P489 HydrophobicContact CG-CG 4.4Å
328	D	90.2	Very high	90.3	Very high	66 Å²	66	30.1 Å²	30.1	35%	0.353	17%	0.165	S	C	.	.	H	α-helix	trans	-58.7	-34.3	175.4	58.1	-32.3	0	0	0	113.2	K300 V305 L326	K300-D328 VanDerWaalsContact CE-OD2 3.25Å; K300-D328 WeakPolarHBondContact CE-OD2 3.3Å; K300-D328 VanDerWaalsContact NZ-CG 3.3Å; K300-D328 IonicContact NZ-OD1 3.99Å; K300-D328 PolarHBondContact NZ-OD1 2.72Å; K300-D328 IonicContact NZ-OD2 2.82Å; K300-D328 PolarHBondContact NZ-OD2 3.47Å; V305-D328 HydrophobicContact CG1-CB 4.28Å; V305-D328 VanDerWaalsContact CG1-O 3.25Å; V305-D328 WeakPolarHBondContact CG1-O 3.33Å; L326-D328 PolarHBondContact O-N 2.71Å
329	V	93.1	Very high	90.4	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.024	17%	0.171	C	C	.	.	H	α-helix	trans	-79.6	-29	177.9	-167.7	0	0	0	0	111.9	L296 T299 K300 V305 W310 L326 E327	L296-V329 HydrophobicContact CB-CG1 4.41Å; L296-V329 HydrophobicContact CD2-CB 4.49Å; L296-V329 HydrophobicContact CD2-CG1 3.85Å; T299-V329 HydrophobicContact CG2-CG1 3.76Å; K300-V329 HydrophobicContact CB-CG2 3.9Å; K300-V329 HydrophobicContact CD-CG2 4.17Å; K300-V329 HydrophobicContact CG-CG2 4.25Å; V305-V329 HydrophobicContact CG2-CG2 4.25Å; W310-V329 PolarHBondContact NE1-O 3.15Å; L326-V329 WeakPolarHBondContact O-CB 3.47Å; L326-V329 PolarHBondContact O-N 3.07Å; E327-V329 VanDerWaalsContact C-N 3.26Å; E327-V329 PolarHBondContact O-N 3.47Å
330	A	92.9	Very high	90.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-83.1	-9.4	-176	0	0	0	0	0	113.6	W316 I323 L326 E327 G332 A333 F481	W316-A330 HydrophobicContact CH2-CB 4.43Å; W316-A330 HydrophobicContact CZ2-CB 3.88Å; I323-A330 HydrophobicContact CB-CB 4.16Å; I323-A330 HydrophobicContact CG2-CB 3.66Å; L326-A330 PolarHBondContact O-N 3.48Å; E327-A330 PolarHBondContact O-N 3.11Å; E327-A330 VanDerWaalsContact O-N 3.13Å; A330-G332 PolarHBondContact O-N 3.38Å; A330-A333 WeakPolarHBondContact O-CB 3.3Å; A330-A333 PolarHBondContact O-N 3.05Å; A330-F481 HydrophobicContact CB-CD1 3.75Å; A330-F481 HydrophobicContact CB-CE1 4.06Å; A330-F481 HydrophobicContact CB-CG 4.33Å
331	V	92	Very high	90.8	Very high	31 Å²	31	32.7 Å²	32.7	19%	0.188	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	128	-178.5	-176.1	0	0	0	0	111.3	E327 A333 V483	E327-V331 VanDerWaalsContact O-CG2 3.29Å; E327-V331 WeakPolarHBondContact O-CG2 3.29Å; E327-V331 PolarHBondContact O-N 2.97Å; V331-A333 VanDerWaalsContact C-N 3.26Å; V331-A333 PolarHBondContact O-N 2.8Å; V331-V483 HydrophobicContact CG1-CG2 4.25Å; V331-V483 HydrophobicContact CG2-CG2 3.58Å
332	G	91.8	Very high	91.1	Very high	2 Å²	2	33.9 Å²	33.9	2%	0.021	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-1.2	-178.8	0	0	0	0	0	114.7	A330 V334 Q480 F481 Q509	A330-G332 PolarHBondContact O-N 3.38Å; G332-V334 PolarHBondContact O-N 3.19Å; G332-Q480 PolarHBondContact O-NE2 3.47Å; G332-Q480 VanDerWaalsContact O-NE2 3.16Å; G332-F481 PolarHBondContact N-O 2.75Å; G332-Q509 WeakPolarHBondContact CA-O 3.46Å
333	A	95.1	Very high	91.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.			trans	-62.7	129.2	175.7	0	0	0	0	0	110.9	W310 W316 A330 V331 Q480 F481	W310-A333 HydrophobicContact CB-CB 3.83Å; W310-A333 CarbonylContact O-C 3.54Å; W310-A333 WeakPolarHBondContact O-CA 3.19Å; W316-A333 HydrophobicContact CH2-CB 3.78Å; W316-A333 HydrophobicContact CZ2-CB 4.02Å; W316-A333 HydrophobicContact CZ3-CB 4.45Å; A330-A333 WeakPolarHBondContact O-CB 3.3Å; A330-A333 PolarHBondContact O-N 3.05Å; V331-A333 VanDerWaalsContact C-N 3.26Å; V331-A333 PolarHBondContact O-N 2.8Å; A333-Q480 VanDerWaalsContact O-CA 3.27Å; A333-Q480 WeakPolarHBondContact O-CA 3.22Å; A333-Q480 WeakPolarHBondContact O-CG 3.48Å; A333-F481 PolarHBondContact O-N 3.38Å
334	V	95.9	Very high	91.6	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.024	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.7	174.7	179.5	0	0	0	0	108.4	W310 I311 G312 G332 F479 Q480	W310-V334 PolarHBondContact O-N 2.97Å; I311-V334 CarbonylContact C-O 3.49Å; I311-V334 VanDerWaalsContact CA-O 3.23Å; I311-V334 WeakPolarHBondContact CA-O 3.3Å; G312-V334 PolarHBondContact N-O 3.1Å; G332-V334 PolarHBondContact O-N 3.19Å; V334-F479 CarbonylContact C-O 3.48Å; V334-F479 VanDerWaalsContact CA-O 3.29Å; V334-F479 WeakPolarHBondContact CA-O 3.28Å; V334-Q480 HydrophobicContact CG2-CG 4.13Å
335	T	95.6	Very high	91.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.7	-178.7	62.3	0	0	0	0	110.9	G312 W316 G317 F479	G312-T335 WeakPolarHBondContact O-CA 3.37Å; W316-T335 HydrophobicContact CB-CG2 4.11Å; W316-T335 HydrophobicContact CD2-CG2 3.77Å; W316-T335 HydrophobicContact CE3-CG2 4.24Å; W316-T335 HydrophobicContact CG-CG2 3.71Å; G317-T335 VanDerWaalsContact O-CB 3.29Å; G317-T335 WeakPolarHBondContact O-CB 3.43Å; G317-T335 PolarHBondContact O-OG1 3.35Å; T335-F479 PolarHBondContact N-O 2.85Å; T335-F479 PolarHBondContact O-N 3.23Å
336	I	94.4	Very high	92.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.9	-177.6	-51.7	-172.4	0	0	0	108.6	Q207 A210 M211 I214 G312 S313 D314 Y476 L478	Q207-I336 HydrophobicContact CG-CD1 4.39Å; Q207-I336 HydrophobicContact CG-CG2 4.37Å; A210-I336 HydrophobicContact CB-CD1 4.04Å; M211-I336 HydrophobicContact CB-CD1 4.44Å; M211-I336 HydrophobicContact CE-CD1 4.01Å; M211-I336 HydrophobicContact CE-CG1 4.44Å; M211-I336 HydrophobicContact CG-CD1 3.37Å; I214-I336 HydrophobicContact CD1-CD1 3.85Å; I214-I336 HydrophobicContact CD1-CG1 4.26Å; G312-I336 PolarHBondContact O-N 3.41Å; G312-I336 VanDerWaalsContact O-N 3.08Å; S313-I336 CarbonylContact C-O 3.59Å; D314-I336 WeakPolarHBondContact CA-O 3.45Å; D314-I336 PolarHBondContact N-O 3.43Å; I336-Y476 HydrophobicContact CG2-CD1 3.52Å; I336-Y476 HydrophobicContact CG2-CD2 4.47Å; I336-Y476 HydrophobicContact CG2-CE1 4.32Å; I336-Y476 HydrophobicContact CG2-CG 3.61Å; I336-L478 HydrophobicContact CB-CD2 4.28Å; I336-L478 HydrophobicContact CD1-CD2 4.28Å; I336-L478 HydrophobicContact CG1-CD2 3.81Å; I336-L478 HydrophobicContact CG2-CD2 4.03Å
337	L	92	Very high	92.3	Very high	10 Å²	10	33.1 Å²	33.1	5%	0.052	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	133.2	178	-166.6	63.3	0	0	0	110.1	D314 K339 Y476 D477 F479	D314-L337 HydrophobicContact CB-CD1 4.42Å; L337-K339 PolarHBondContact O-N 3.36Å; L337-Y476 CarbonylContact O-C 3.57Å; L337-Y476 VanDerWaalsContact O-CA 3.24Å; L337-Y476 WeakPolarHBondContact O-CA 3.46Å; L337-D477 PolarHBondContact N-O 3.24Å; L337-D477 PolarHBondContact O-N 3.11Å; L337-F479 HydrophobicContact CB-CD2 4.19Å; L337-F479 HydrophobicContact CB-CE2 3.91Å; L337-F479 HydrophobicContact CD2-CE2 3.94Å; L337-F479 HydrophobicContact CD2-CZ 4.47Å
338	P	90.6	Very high	92.4	Very high	9 Å²	9	37 Å²	37	6%	0.058	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55	135.1	172	-25.5	33.4	0	0	0	110.2	D314 R340 F409 R475 Y476	D314-P338 HydrophobicContact CB-CG 4.33Å; P338-R340 PolarHBondContact O-N 3.2Å; P338-F409 HydrophobicContact CB-CE2 4.25Å; P338-F409 HydrophobicContact CB-CZ 3.97Å; P338-R475 WeakPolarHBondContact CA-O 3.43Å; P338-Y476 HydrophobicContact CB-CD1 4.37Å; P338-Y476 HydrophobicContact CB-CE1 4.4Å; P338-Y476 HydrophobicContact CG-CD1 4.13Å; P338-Y476 HydrophobicContact CG-CE1 3.91Å
339	K	88.6	Confident	92.7	Very high	87 Å²	87	35.9 Å²	35.9	38%	0.378	19%	0.19	S	C	.	.			trans	-59	121.8	-179.6	-176.4	161.5	-171.4	162.2	0	109.6	L337 R475	L337-K339 PolarHBondContact O-N 3.36Å; K339-R475 HydrophobicContact CB-CB 4.1Å; K339-R475 PolarHBondContact N-O 3.16Å
340	R	87.9	Confident	92.8	Very high	57 Å²	57	35.8 Å²	35.8	22%	0.215	19%	0.189	C	C	.	.			trans	-146.9	158.1	-173.7	69.6	-161.1	-164.4	163.2	-3.5	110.7	P338 G405 F409	P338-R340 PolarHBondContact O-N 3.2Å; R340-G405 VanDerWaalsContact CD-O 3.31Å; R340-G405 WeakPolarHBondContact CD-O 3.45Å; R340-G405 PolarHBondContact NH1-O 2.83Å; R340-F409 HydrophobicContact CB-CE2 4.3Å; R340-F409 HydrophobicContact CB-CZ 4.2Å
341	S	87.7	Confident	92.9	Very high	60 Å²	60	37.9 Å²	37.9	42%	0.42	20%	0.202	S	C	.	.			trans	-136.9	152	175.3	-57.8	0	0	0	0	110.2	Q408	S341-Q408 PolarHBondContact O-OE1 3.27Å
342	S	89.8	Confident	92.9	Very high	80 Å²	80	38.5 Å²	38.5	56%	0.559	22%	0.215	S	C	*	.			trans	-71.8	143.5	176.6	51	0	0	0	0	110.9
343	I	93.6	Very high	93	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.051	22%	0.215	C	C	.	.			trans	-100.5	103.3	176.5	-56.9	-58.9	0	0	0	108.9	G345 F346 D347 Q403 Q408 I411 A460	I343-G345 VanDerWaalsContact C-N 3.31Å; I343-G345 PolarHBondContact O-N 3.45Å; I343-F346 HydrophobicContact CB-CB 4.13Å; I343-F346 HydrophobicContact CG2-CB 4.07Å; I343-F346 WeakPolarHBondContact O-CB 3.38Å; I343-F346 PolarHBondContact O-N 3.03Å; I343-D347 PolarHBondContact O-N 3.35Å; I343-Q403 PolarHBondContact O-NE2 3.01Å; I343-Q408 HydrophobicContact CD1-CG 4.26Å; I343-Q408 HydrophobicContact CG1-CB 4.42Å; I343-Q408 HydrophobicContact CG1-CG 4.49Å; I343-I411 HydrophobicContact CB-CD1 4.46Å; I343-I411 HydrophobicContact CG1-CD1 4.2Å; I343-I411 HydrophobicContact CG2-CD1 4.32Å; I343-A460 HydrophobicContact CD1-CB 3.74Å
344	E	92.1	Very high	92.9	Very high	148 Å²	148	39.8 Å²	39.8	69%	0.692	22%	0.222	S	C	*	.	H	α-helix	trans	-56.6	-42.4	-177	-64.6	-179.2	172.4	0	0	112.3	F346 D347 E348	E344-F346 PolarHBondContact O-N 3.27Å; E344-D347 WeakPolarHBondContact O-CB 3.26Å; E344-D347 PolarHBondContact O-N 3.41Å; E344-E348 PolarHBondContact O-N 3.35Å
345	G	93.4	Very high	92.5	Very high	25 Å²	25	41.5 Å²	41.5	26%	0.258	23%	0.231	S	C	.	.	H	α-helix	trans	-62.9	-27.9	178	0	0	0	0	0	114	I343 Y349	I343-G345 VanDerWaalsContact C-N 3.31Å; I343-G345 PolarHBondContact O-N 3.45Å; G345-Y349 WeakPolarHBondContact O-CB 3.28Å; G345-Y349 PolarHBondContact O-N 3.49Å; G345-Y349 VanDerWaalsContact O-N 3.11Å
346	F	95.6	Very high	92.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-75.8	-35.8	173.2	-179.6	-99.7	0	0	0	111.6	Q79 E82 A83 Y86 I343 E344 Y349 F350 Q403 V407 I411	Q79-F346 HydrophobicContact CB-CE1 4.46Å; Q79-F346 HydrophobicContact CB-CZ 4.42Å; Q79-F346 VanDerWaalsContact O-CZ 3.32Å; Q79-F346 WeakPolarHBondContact O-CZ 3.2Å; E82-F346 HydrophobicContact CB-CE2 4.3Å; E82-F346 HydrophobicContact CB-CZ 4.34Å; A83-F346 VanDerWaalsContact CA-CE2 3.42Å; A83-F346 HydrophobicContact CB-CD2 4.32Å; A83-F346 HydrophobicContact CB-CE2 3.85Å; A83-F346 HydrophobicContact CB-CZ 4.12Å; Y86-F346 HydrophobicContact CD1-CB 4.38Å; Y86-F346 HydrophobicContact CD1-CD2 4.02Å; Y86-F346 HydrophobicContact CE1-CB 4.32Å; Y86-F346 AromaticContact CG-CD2 3.93Å; Y86-F346 HydrophobicContact CG-CD2 3.93Å; I343-F346 HydrophobicContact CB-CB 4.13Å; I343-F346 HydrophobicContact CG2-CB 4.07Å; I343-F346 WeakPolarHBondContact O-CB 3.38Å; I343-F346 PolarHBondContact O-N 3.03Å; E344-F346 PolarHBondContact O-N 3.27Å; F346-Y349 AromaticContact CD2-CD1 3.93Å; F346-Y349 HydrophobicContact CD2-CD1 3.93Å; F346-Y349 AromaticContact CE2-CD1 3.88Å; F346-Y349 HydrophobicContact CE2-CD1 3.88Å; F346-Y349 HydrophobicContact CE2-CE1 4.17Å; F346-Y349 PolarHBondContact O-N 3.46Å; F346-F350 HydrophobicContact CD1-CB 4.48Å; F346-F350 HydrophobicContact CE1-CB 4.09Å; F346-F350 HydrophobicContact CE1-CD2 4.33Å; F346-F350 HydrophobicContact CE1-CG 4.34Å; F346-F350 HydrophobicContact CE2-CD2 4.49Å; F346-F350 HydrophobicContact CZ-CB 4.11Å; F346-F350 AromaticContact CZ-CD2 3.81Å; F346-F350 HydrophobicContact CZ-CD2 3.81Å; F346-F350 HydrophobicContact CZ-CG 4.22Å; F346-F350 WeakPolarHBondContact O-CB 3.48Å; F346-F350 PolarHBondContact O-N 3.48Å; F346-Q403 HydrophobicContact CD1-CG 4.19Å; F346-V407 HydrophobicContact CB-CG1 4.31Å; F346-V407 HydrophobicContact CD1-CG1 3.57Å; F346-V407 HydrophobicContact CD1-CG2 4.29Å; F346-V407 HydrophobicContact CD2-CG1 4.33Å; F346-V407 HydrophobicContact CE1-CG1 3.88Å; F346-V407 HydrophobicContact CE1-CG2 3.81Å; F346-V407 HydrophobicContact CG-CG1 3.79Å; F346-V407 HydrophobicContact CZ-CG1 4.41Å; F346-V407 HydrophobicContact CZ-CG2 4.32Å; F346-I411 HydrophobicContact CB-CD1 4.48Å
347	D	94.6	Very high	91.9	Very high	38 Å²	38	54.9 Å²	54.9	20%	0.203	30%	0.297	C	S	.	.	H	α-helix	trans	-61.3	-46.3	176.1	-63.7	-33.4	0	0	0	110.6	I343 E344 F350 T351 Y401 Q403	I343-D347 PolarHBondContact O-N 3.35Å; E344-D347 WeakPolarHBondContact O-CB 3.26Å; E344-D347 PolarHBondContact O-N 3.41Å; D347-F350 PolarHBondContact O-N 3.5Å; D347-T351 WeakPolarHBondContact O-CB 3.34Å; D347-T351 VanDerWaalsContact O-CG2 3.29Å; D347-T351 WeakPolarHBondContact O-CG2 3.1Å; D347-T351 PolarHBondContact O-N 3.14Å; D347-T351 PolarHBondContact O-OG1 3.29Å; D347-Y401 HydrophobicContact CB-CE1 4.05Å; D347-Y401 WeakPolarHBondContact OD1-CE1 3.04Å; D347-Y401 PolarHBondContact OD1-OH 2.9Å; D347-Q403 VanDerWaalsContact CG-NE2 3.32Å; D347-Q403 WeakPolarHBondContact OD1-CB 3.37Å; D347-Q403 VanDerWaalsContact OD1-CD 3.3Å; D347-Q403 PolarHBondContact OD1-NE2 3.08Å
348	E	94.4	Very high	91.8	Very high	145 Å²	145	54.7 Å²	54.7	68%	0.678	30%	0.297	S	S	*	.	H	α-helix	trans	-61.5	-45.1	175	-67.1	-178.7	177.3	0	0	111.8	E344 T351 G352	E344-E348 PolarHBondContact O-N 3.35Å; E348-T351 PolarHBondContact O-OG1 3.21Å; E348-G352 PolarHBondContact O-N 3.2Å; E348-G352 VanDerWaalsContact O-N 3.12Å
349	Y	95.4	Very high	91.5	Very high	43 Å²	43	64.3 Å²	64.3	17%	0.169	33%	0.331	C	S	.	.	H	α-helix	trans	-60	-52.2	177	165.6	-97.4	0	0	0	111.8	E82 Y86 G345 F346 G352 L353 R360	E82-Y349 HydrophobicContact CB-CE1 4.23Å; E82-Y349 PolarHBondContact OE2-OH 3.06Å; Y86-Y349 AromaticContact CD2-CD1 3.91Å; Y86-Y349 HydrophobicContact CD2-CD1 3.91Å; Y86-Y349 AromaticContact CD2-CD2 3.87Å; Y86-Y349 HydrophobicContact CD2-CD2 3.87Å; Y86-Y349 AromaticContact CD2-CG 3.5Å; Y86-Y349 HydrophobicContact CD2-CG 3.5Å; Y86-Y349 HydrophobicContact CE2-CG 4.27Å; Y86-Y349 HydrophobicContact CG-CD1 4.18Å; Y86-Y349 HydrophobicContact CG-CG 4.24Å; G345-Y349 WeakPolarHBondContact O-CB 3.28Å; G345-Y349 PolarHBondContact O-N 3.49Å; G345-Y349 VanDerWaalsContact O-N 3.11Å; F346-Y349 AromaticContact CD2-CD1 3.93Å; F346-Y349 HydrophobicContact CD2-CD1 3.93Å; F346-Y349 AromaticContact CE2-CD1 3.88Å; F346-Y349 HydrophobicContact CE2-CD1 3.88Å; F346-Y349 HydrophobicContact CE2-CE1 4.17Å; F346-Y349 PolarHBondContact O-N 3.46Å; Y349-G352 PolarHBondContact O-N 3.03Å; Y349-L353 HydrophobicContact CE1-CD1 4Å; Y349-L353 HydrophobicContact CE1-CD2 4.34Å; Y349-L353 HydrophobicContact CE1-CG 4.44Å; Y349-L353 HydrophobicContact CE2-CD2 3.96Å; Y349-L353 WeakPolarHBondContact O-CG 3.42Å; Y349-L353 PolarHBondContact O-N 2.75Å; Y349-R360 PolarHBondContact OH-NH2 3.28Å
350	F	95.3	Very high	91.6	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.009	33%	0.327	C	S	.	.	H	α-helix	trans	-70.6	-41.2	-172.4	-168.2	-92.8	0	0	0	112	I78 Q79 E82 F346 D347 G352 L353 F367 I395 Y401	I78-F350 HydrophobicContact CG2-CE2 4.23Å; I78-F350 HydrophobicContact CG2-CZ 4.35Å; Q79-F350 HydrophobicContact CB-CE2 4.45Å; Q79-F350 HydrophobicContact CG-CE1 4.13Å; Q79-F350 HydrophobicContact CG-CE2 3.97Å; Q79-F350 HydrophobicContact CG-CZ 3.74Å; E82-F350 HydrophobicContact CB-CD2 4Å; E82-F350 HydrophobicContact CB-CE2 4.04Å; E82-F350 HydrophobicContact CG-CD2 4.29Å; E82-F350 HydrophobicContact CG-CE2 3.99Å; F346-F350 HydrophobicContact CD1-CB 4.48Å; F346-F350 HydrophobicContact CE1-CB 4.09Å; F346-F350 HydrophobicContact CE1-CD2 4.33Å; F346-F350 HydrophobicContact CE1-CG 4.34Å; F346-F350 HydrophobicContact CE2-CD2 4.49Å; F346-F350 HydrophobicContact CZ-CB 4.11Å; F346-F350 AromaticContact CZ-CD2 3.81Å; F346-F350 HydrophobicContact CZ-CD2 3.81Å; F346-F350 HydrophobicContact CZ-CG 4.22Å; F346-F350 WeakPolarHBondContact O-CB 3.48Å; F346-F350 PolarHBondContact O-N 3.48Å; D347-F350 PolarHBondContact O-N 3.5Å; F350-G352 PolarHBondContact O-N 3.37Å; F350-L353 HydrophobicContact CD2-CD1 3.93Å; F350-L353 HydrophobicContact CE2-CD1 4.34Å; F350-L353 HydrophobicContact CG-CD1 4.48Å; F350-L353 WeakPolarHBondContact O-CB 3.49Å; F350-L353 PolarHBondContact O-N 2.88Å; F350-F367 HydrophobicContact CE1-CZ 4.07Å; F350-F367 HydrophobicContact CZ-CE1 4.16Å; F350-F367 HydrophobicContact CZ-CE2 4.39Å; F350-F367 AromaticContact CZ-CZ 3.77Å; F350-F367 HydrophobicContact CZ-CZ 3.77Å; F350-I395 HydrophobicContact CD1-CD1 4.43Å; F350-I395 HydrophobicContact CD1-CG2 4.11Å; F350-I395 HydrophobicContact CE1-CD1 4.16Å; F350-I395 HydrophobicContact CE1-CG2 4.06Å; F350-Y401 HydrophobicContact CB-CE2 4.39Å; F350-Y401 AromaticContact CD1-CD2 3.8Å; F350-Y401 HydrophobicContact CD1-CD2 3.8Å; F350-Y401 AromaticContact CD1-CE2 3.28Å; F350-Y401 HydrophobicContact CD1-CE2 3.28Å; F350-Y401 HydrophobicContact CE1-CD2 4.07Å; F350-Y401 AromaticContact CE1-CE2 3.81Å; F350-Y401 HydrophobicContact CE1-CE2 3.81Å; F350-Y401 HydrophobicContact CG-CE2 4.07Å
351	T	94.4	Very high	91.7	Very high	45 Å²	45	61.3 Å²	61.3	28%	0.276	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-25.8	176.3	57.1	0	0	0	0	112.7	D347 E348 L353 I395 Y401	D347-T351 WeakPolarHBondContact O-CB 3.34Å; D347-T351 VanDerWaalsContact O-CG2 3.29Å; D347-T351 WeakPolarHBondContact O-CG2 3.1Å; D347-T351 PolarHBondContact O-N 3.14Å; D347-T351 PolarHBondContact O-OG1 3.29Å; E348-T351 PolarHBondContact O-OG1 3.21Å; T351-L353 VanDerWaalsContact C-N 3.32Å; T351-I395 HydrophobicContact CG2-CG2 4.45Å; T351-Y401 HydrophobicContact CG2-CD1 3.72Å; T351-Y401 HydrophobicContact CG2-CE1 3.99Å; T351-Y401 HydrophobicContact CG2-CG 4.06Å
352	G	93.6	Very high	91.9	Very high	44 Å²	44	62 Å²	62	45%	0.454	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-7.4	173.1	0	0	0	0	0	115.4	E348 Y349 F350	E348-G352 PolarHBondContact O-N 3.2Å; E348-G352 VanDerWaalsContact O-N 3.12Å; Y349-G352 PolarHBondContact O-N 3.03Å; F350-G352 PolarHBondContact O-N 3.37Å
353	L	93.4	Very high	92	Very high	5 Å²	5	58.7 Å²	58.7	3%	0.026	30%	0.295	C	S	.	.			trans	-72.1	136.6	-179.2	-64	177.9	0	0	0	112	E82 Y349 F350 T351 N358 F364	E82-L353 HydrophobicContact CG-CD1 4.17Å; Y349-L353 HydrophobicContact CE1-CD1 4Å; Y349-L353 HydrophobicContact CE1-CD2 4.34Å; Y349-L353 HydrophobicContact CE1-CG 4.44Å; Y349-L353 HydrophobicContact CE2-CD2 3.96Å; Y349-L353 WeakPolarHBondContact O-CG 3.42Å; Y349-L353 PolarHBondContact O-N 2.75Å; F350-L353 HydrophobicContact CD2-CD1 3.93Å; F350-L353 HydrophobicContact CE2-CD1 4.34Å; F350-L353 HydrophobicContact CG-CD1 4.48Å; F350-L353 WeakPolarHBondContact O-CB 3.49Å; F350-L353 PolarHBondContact O-N 2.88Å; T351-L353 VanDerWaalsContact C-N 3.32Å; L353-N358 HydrophobicContact CD2-CB 4.3Å; L353-F364 HydrophobicContact CB-CE1 4.41Å; L353-F364 HydrophobicContact CB-CE2 4.1Å; L353-F364 HydrophobicContact CB-CZ 3.59Å; L353-F364 HydrophobicContact CD1-CE2 4.01Å; L353-F364 HydrophobicContact CD1-CZ 4.36Å
354	T	91.6	Very high	91.9	Very high	23 Å²	23	58.3 Å²	58.3	14%	0.141	29%	0.293	C	S	.	.			trans	-134.2	161.6	175	67	0	0	0	0	110.1	E356 N357 N358	T354-E356 PolarHBondContact O-N 3.42Å; T354-E356 VanDerWaalsContact O-N 3.15Å; T354-N357 PolarHBondContact O-N 3Å; T354-N357 PolarHBondContact OG1-N 3.43Å; T354-N358 PolarHBondContact O-N 3.22Å
355	L	88.6	Confident	91.8	Very high	41 Å²	41	53.4 Å²	53.4	22%	0.215	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.9	175.2	-69.8	172.2	0	0	0	113.3	F364 A365 W368 L376	L355-F364 HydrophobicContact CD2-CD1 4.11Å; L355-F364 HydrophobicContact CD2-CE1 4.44Å; L355-A365 HydrophobicContact CD2-CB 4.45Å; L355-W368 HydrophobicContact CD1-CB 4.47Å; L355-W368 HydrophobicContact CD1-CD2 4.08Å; L355-W368 HydrophobicContact CD1-CG 3.82Å; L355-W368 HydrophobicContact CD2-CB 3.81Å; L355-W368 HydrophobicContact CD2-CD2 4.17Å; L355-W368 HydrophobicContact CD2-CE3 4.48Å; L355-W368 HydrophobicContact CD2-CG 3.9Å; L355-W368 HydrophobicContact CG-CB 4.33Å; L355-W368 HydrophobicContact CG-CD2 3.79Å; L355-W368 HydrophobicContact CG-CE3 4.21Å; L355-W368 HydrophobicContact CG-CG 3.85Å; L355-L376 HydrophobicContact CD1-CD1 4.15Å; L355-L376 HydrophobicContact CD1-CD2 3.55Å; L355-L376 HydrophobicContact CD1-CG 4.48Å; L355-L376 HydrophobicContact CD2-CD1 4.32Å
356	E	86.8	Confident	91.6	Very high	161 Å²	161	55.9 Å²	55.9	75%	0.752	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-41.3	178	-64.5	-174.6	170.7	0	0	112.1	T354	T354-E356 PolarHBondContact O-N 3.42Å; T354-E356 VanDerWaalsContact O-N 3.15Å
357	N	90.1	Very high	91.4	Very high	119 Å²	119	56 Å²	56	64%	0.636	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-37.1	-176.4	-169.2	19	0	0	0	112.2	T354 R359	T354-N357 PolarHBondContact O-N 3Å; T354-N357 PolarHBondContact OG1-N 3.43Å; N357-R359 PolarHBondContact O-N 3.39Å
358	N	89.9	Confident	91.2	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.037	27%	0.274	C	S	.	.			trans	-100.4	72.8	-176.5	-165.7	6.1	0	0	0	112.8	E82 L353 T354 R360 N361 F364	E82-N358 PolarHBondContact OE1-ND2 3.19Å; L353-N358 HydrophobicContact CD2-CB 4.3Å; T354-N358 PolarHBondContact O-N 3.22Å; N358-R360 WeakPolarHBondContact OD1-CG 3.2Å; N358-N361 PolarHBondContact OD1-N 2.91Å; N358-F364 HydrophobicContact CB-CD1 3.81Å; N358-F364 HydrophobicContact CB-CE1 3.97Å; N358-F364 HydrophobicContact CB-CG 4.15Å; N358-F364 HydrophobicContact CB-CZ 4.44Å; N358-F364 VanDerWaalsContact ND2-CD2 3.27Å; N358-F364 WeakPolarHBondContact ND2-CD2 3.31Å; N358-F364 WeakPolarHBondContact ND2-CG 3.49Å
359	R	85.6	Confident	91	Very high	210 Å²	210	49 Å²	49	79%	0.792	25%	0.25	S	C	*	.			trans	-88.8	-10.1	172.4	-62.7	-170.2	-178.1	-169.7	-0.3	113.9	N357	N357-R359 PolarHBondContact O-N 3.39Å
360	R	89.5	Confident	90.6	Very high	75 Å²	75	51.8 Å²	51.8	28%	0.283	26%	0.264	S	S	.	.	S	Bend	trans	-74.5	-32	-179.4	62.5	173.5	176.7	-164.4	-4.6	112.4	I45 D89 Y349 N358	I45-R360 WeakPolarHBondContact CG2-O 3.47Å; D89-R360 VanDerWaalsContact CG-NH1 3.27Å; D89-R360 IonicContact OD1-CZ 3.62Å; D89-R360 IonicContact OD1-NH1 3.96Å; D89-R360 PolarHBondContact OD1-NH1 3.13Å; D89-R360 IonicContact OD2-CZ 2.92Å; D89-R360 VanDerWaalsContact OD2-CZ 3.23Å; D89-R360 IonicContact OD2-NH1 2.67Å; D89-R360 PolarHBondContact OD2-NH1 3.08Å; D89-R360 IonicContact OD2-NH2 3.73Å; D89-R360 PolarHBondContact OD2-NH2 3.47Å; Y349-R360 PolarHBondContact OH-NH2 3.28Å; N358-R360 WeakPolarHBondContact OD1-CG 3.2Å
361	N	91	Very high	90.3	Very high	6 Å²	6	53.1 Å²	53.1	3%	0.032	27%	0.271	C	S	.	.			trans	-90.5	110.4	179.8	179.9	-3.9	0	0	0	110.7	I45 E82 N358 W363 F364	I45-N361 HydrophobicContact CD1-CB 4.05Å; E82-N361 VanDerWaalsContact OE1-CB 3.32Å; E82-N361 WeakPolarHBondContact OE1-CB 3.4Å; E82-N361 PolarHBondContact OE1-ND2 3.39Å; N358-N361 PolarHBondContact OD1-N 2.91Å; N361-W363 PolarHBondContact O-N 2.79Å; N361-W363 PolarHBondContact OD1-N 3.36Å; N361-F364 HydrophobicContact CB-CB 3.93Å; N361-F364 WeakPolarHBondContact O-CB 3.38Å; N361-F364 PolarHBondContact O-N 3.1Å; N361-F364 PolarHBondContact OD1-N 3.45Å
362	V	90.8	Very high	90.1	Very high	76 Å²	76	51.5 Å²	51.5	46%	0.461	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22.4	-177.8	-58.8	0	0	0	0	113.4	I45	I45-V362 HydrophobicContact CG1-CG2 4.07Å
363	W	92.4	Very high	89.8	Confident	10 Å²	10	56 Å²	56	4%	0.038	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-0.3	179.3	-57.1	-72.4	0	0	0	112.9	H43 I45 V59 H60 I78 L81 D109 N361 A365 E366 F367	H43-W363 HydrophobicContact CB-CZ2 4.09Å; H43-W363 WeakPolarHBondContact O-CZ2 3.19Å; I45-W363 HydrophobicContact CD1-CE3 3.74Å; I45-W363 HydrophobicContact CD1-CZ3 3.56Å; I45-W363 HydrophobicContact CG1-CE3 4.1Å; I45-W363 HydrophobicContact CG1-CH2 4.5Å; I45-W363 HydrophobicContact CG1-CZ3 3.7Å; V59-W363 HydrophobicContact CG1-CB 3.95Å; V59-W363 HydrophobicContact CG1-CD2 3.99Å; V59-W363 HydrophobicContact CG1-CE3 4.37Å; V59-W363 HydrophobicContact CG1-CG 3.81Å; V59-W363 HydrophobicContact CG2-CD2 4.32Å; V59-W363 HydrophobicContact CG2-CE3 4.01Å; V59-W363 HydrophobicContact CG2-CZ3 4.16Å; H60-W363 AromaticContact CE1-CD1 3.71Å; H60-W363 AromaticContact CE1-NE1 3.92Å; I78-W363 HydrophobicContact CD1-CB 3.93Å; L81-W363 HydrophobicContact CD1-CE3 3.72Å; L81-W363 HydrophobicContact CD1-CZ3 3.69Å; D109-W363 HydrophobicContact CB-CH2 4.27Å; D109-W363 HydrophobicContact CB-CZ2 3.93Å; N361-W363 PolarHBondContact O-N 2.79Å; N361-W363 PolarHBondContact OD1-N 3.36Å; W363-A365 VanDerWaalsContact C-N 3.32Å; W363-A365 PolarHBondContact O-N 3.01Å; W363-E366 PolarHBondContact O-N 2.71Å; W363-F367 PolarHBondContact O-N 3.39Å
364	F	91.6	Very high	89.6	Confident	1 Å²	1	56 Å²	56	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-69.9	-30.8	-177.2	-165.8	-107.1	0	0	0	112.8	L353 L355 N358 N361 F367 W368 I395	L353-F364 HydrophobicContact CB-CE1 4.41Å; L353-F364 HydrophobicContact CB-CE2 4.1Å; L353-F364 HydrophobicContact CB-CZ 3.59Å; L353-F364 HydrophobicContact CD1-CE2 4.01Å; L353-F364 HydrophobicContact CD1-CZ 4.36Å; L355-F364 HydrophobicContact CD2-CD1 4.11Å; L355-F364 HydrophobicContact CD2-CE1 4.44Å; N358-F364 HydrophobicContact CB-CD1 3.81Å; N358-F364 HydrophobicContact CB-CE1 3.97Å; N358-F364 HydrophobicContact CB-CG 4.15Å; N358-F364 HydrophobicContact CB-CZ 4.44Å; N358-F364 VanDerWaalsContact ND2-CD2 3.27Å; N358-F364 WeakPolarHBondContact ND2-CD2 3.31Å; N358-F364 WeakPolarHBondContact ND2-CG 3.49Å; N361-F364 HydrophobicContact CB-CB 3.93Å; N361-F364 WeakPolarHBondContact O-CB 3.38Å; N361-F364 PolarHBondContact O-N 3.1Å; N361-F364 PolarHBondContact OD1-N 3.45Å; F364-F367 AromaticContact CD2-CD1 3.89Å; F364-F367 HydrophobicContact CD2-CD1 3.89Å; F364-F367 AromaticContact CE2-CD1 3.7Å; F364-F367 HydrophobicContact CE2-CD1 3.7Å; F364-F367 AromaticContact CE2-CE1 3.94Å; F364-F367 HydrophobicContact CE2-CE1 3.94Å; F364-F367 HydrophobicContact CZ-CD1 4.33Å; F364-F367 HydrophobicContact CZ-CE1 4.44Å; F364-F367 PolarHBondContact O-N 3.4Å; F364-W368 AromaticContact CE1-CE3 3.8Å; F364-W368 HydrophobicContact CE1-CE3 3.8Å; F364-W368 HydrophobicContact CE1-CZ3 4.08Å; F364-W368 AromaticContact CZ-CE3 3.96Å; F364-W368 HydrophobicContact CZ-CE3 3.96Å; F364-W368 HydrophobicContact CZ-CZ3 4.06Å; F364-W368 WeakPolarHBondContact O-CB 3.32Å; F364-W368 PolarHBondContact O-N 3.17Å; F364-I395 HydrophobicContact CZ-CD1 4.39Å
365	A	89.1	Confident	89.2	Confident	45 Å²	45	61.7 Å²	61.7	37%	0.372	29%	0.293	S	S	.	.	H	α-helix	trans	-64.8	-44.3	174	0	0	0	0	0	111.8	L355 W363 W368 E369 L376	L355-A365 HydrophobicContact CD2-CB 4.45Å; W363-A365 VanDerWaalsContact C-N 3.32Å; W363-A365 PolarHBondContact O-N 3.01Å; A365-W368 WeakPolarHBondContact O-CB 3.4Å; A365-W368 PolarHBondContact O-N 3.38Å; A365-E369 PolarHBondContact O-N 3.45Å; A365-E369 VanDerWaalsContact O-N 3.14Å; A365-L376 HydrophobicContact CB-CD1 3.93Å
366	E	89.6	Confident	88.9	Confident	77 Å²	77	61.6 Å²	61.6	36%	0.36	29%	0.293	S	S	.	.	H	α-helix	trans	-64.4	-43.5	175.7	-174	-179.9	-175.3	0	0	111.4	H60 L72 W363 W368 E369 E370	H60-E366 IonicContact CD2-OE1 2.73Å; H60-E366 IonicContact CE1-OE2 3.89Å; H60-E366 IonicContact NE2-OE1 3.15Å; H60-E366 PolarHBondContact NE2-OE1 3.45Å; H60-E366 VanDerWaalsContact NE2-OE1 3.16Å; H60-E366 IonicContact NE2-OE2 3.16Å; H60-E366 PolarHBondContact NE2-OE2 2.66Å; L72-E366 HydrophobicContact CD1-CB 4.01Å; L72-E366 HydrophobicContact CD1-CG 3.78Å; W363-E366 PolarHBondContact O-N 2.71Å; E366-W368 VanDerWaalsContact C-N 3.27Å; E366-W368 PolarHBondContact O-N 2.95Å; E366-E369 PolarHBondContact O-N 3.41Å; E366-E370 WeakPolarHBondContact O-CB 3.14Å; E366-E370 PolarHBondContact O-N 2.95Å
367	F	91.4	Very high	87.9	Confident	3 Å²	3	61.2 Å²	61.2	1%	0.013	30%	0.295	C	S	.	.	H	α-helix	trans	-56.1	-42.1	171.6	167.2	-101.3	0	0	0	112.3	L72 K74 I78 F350 W363 F364 E370 N371 I395	L72-F367 HydrophobicContact CD1-CB 4.32Å; L72-F367 HydrophobicContact CD2-CB 4.14Å; L72-F367 HydrophobicContact CD2-CD2 4.11Å; K74-F367 HydrophobicContact CB-CD2 4.37Å; K74-F367 HydrophobicContact CB-CE2 4.05Å; K74-F367 HydrophobicContact CG-CD2 4.24Å; K74-F367 HydrophobicContact CG-CE2 4.19Å; I78-F367 HydrophobicContact CB-CD2 4.12Å; I78-F367 HydrophobicContact CB-CG 4.47Å; I78-F367 HydrophobicContact CD1-CB 4.44Å; I78-F367 HydrophobicContact CG1-CB 4.09Å; I78-F367 HydrophobicContact CG1-CD2 4.08Å; I78-F367 HydrophobicContact CG1-CG 4.29Å; I78-F367 HydrophobicContact CG2-CB 4.4Å; I78-F367 HydrophobicContact CG2-CD1 4.4Å; I78-F367 HydrophobicContact CG2-CD2 4.02Å; I78-F367 HydrophobicContact CG2-CE2 4.44Å; I78-F367 HydrophobicContact CG2-CG 3.99Å; F350-F367 HydrophobicContact CE1-CZ 4.07Å; F350-F367 HydrophobicContact CZ-CE1 4.16Å; F350-F367 HydrophobicContact CZ-CE2 4.39Å; F350-F367 AromaticContact CZ-CZ 3.77Å; F350-F367 HydrophobicContact CZ-CZ 3.77Å; W363-F367 PolarHBondContact O-N 3.39Å; F364-F367 AromaticContact CD2-CD1 3.89Å; F364-F367 HydrophobicContact CD2-CD1 3.89Å; F364-F367 AromaticContact CE2-CD1 3.7Å; F364-F367 HydrophobicContact CE2-CD1 3.7Å; F364-F367 AromaticContact CE2-CE1 3.94Å; F364-F367 HydrophobicContact CE2-CE1 3.94Å; F364-F367 HydrophobicContact CZ-CD1 4.33Å; F364-F367 HydrophobicContact CZ-CE1 4.44Å; F364-F367 PolarHBondContact O-N 3.4Å; F367-E370 PolarHBondContact O-N 3.38Å; F367-N371 HydrophobicContact CD2-CB 4.41Å; F367-N371 HydrophobicContact CE1-CB 4.33Å; F367-N371 HydrophobicContact CE2-CB 4.03Å; F367-N371 HydrophobicContact CZ-CB 3.98Å; F367-N371 WeakPolarHBondContact O-CB 3.48Å; F367-N371 PolarHBondContact O-N 2.97Å; F367-I395 HydrophobicContact CE1-CD1 3.95Å; F367-I395 HydrophobicContact CZ-CD1 4.46Å
368	W	90.9	Very high	86.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-44.9	-179.7	-161.8	-88.9	0	0	0	112.1	L355 F364 A365 E366 N371 F372 E393 I395	L355-W368 HydrophobicContact CD1-CB 4.47Å; L355-W368 HydrophobicContact CD1-CD2 4.08Å; L355-W368 HydrophobicContact CD1-CG 3.82Å; L355-W368 HydrophobicContact CD2-CB 3.81Å; L355-W368 HydrophobicContact CD2-CD2 4.17Å; L355-W368 HydrophobicContact CD2-CE3 4.48Å; L355-W368 HydrophobicContact CD2-CG 3.9Å; L355-W368 HydrophobicContact CG-CB 4.33Å; L355-W368 HydrophobicContact CG-CD2 3.79Å; L355-W368 HydrophobicContact CG-CE3 4.21Å; L355-W368 HydrophobicContact CG-CG 3.85Å; F364-W368 AromaticContact CE1-CE3 3.8Å; F364-W368 HydrophobicContact CE1-CE3 3.8Å; F364-W368 HydrophobicContact CE1-CZ3 4.08Å; F364-W368 AromaticContact CZ-CE3 3.96Å; F364-W368 HydrophobicContact CZ-CE3 3.96Å; F364-W368 HydrophobicContact CZ-CZ3 4.06Å; F364-W368 WeakPolarHBondContact O-CB 3.32Å; F364-W368 PolarHBondContact O-N 3.17Å; A365-W368 WeakPolarHBondContact O-CB 3.4Å; A365-W368 PolarHBondContact O-N 3.38Å; E366-W368 VanDerWaalsContact C-N 3.27Å; E366-W368 PolarHBondContact O-N 2.95Å; W368-N371 PolarHBondContact O-N 3.11Å; W368-F372 AromaticContact CD1-CD2 3.86Å; W368-F372 AromaticContact CD2-CD2 3.79Å; W368-F372 HydrophobicContact CD2-CD2 3.79Å; W368-F372 AromaticContact CD2-CE2 3.57Å; W368-F372 HydrophobicContact CD2-CE2 3.57Å; W368-F372 AromaticContact CE2-CD2 3.63Å; W368-F372 AromaticContact CE2-CE2 3.44Å; W368-F372 VanDerWaalsContact CE2-CE2 3.44Å; W368-F372 HydrophobicContact CE3-CD2 4.37Å; W368-F372 AromaticContact CE3-CE2 3.74Å; W368-F372 HydrophobicContact CE3-CE2 3.74Å; W368-F372 AromaticContact CG-CD2 3.98Å; W368-F372 HydrophobicContact CG-CD2 3.98Å; W368-F372 HydrophobicContact CG-CE2 4.24Å; W368-F372 AromaticContact CH2-CE2 3.71Å; W368-F372 HydrophobicContact CH2-CE2 3.71Å; W368-F372 HydrophobicContact CH2-CZ 4.22Å; W368-F372 HydrophobicContact CZ2-CD2 4.14Å; W368-F372 AromaticContact CZ2-CE2 3.55Å; W368-F372 HydrophobicContact CZ2-CE2 3.55Å; W368-F372 HydrophobicContact CZ2-CZ 4.26Å; W368-F372 AromaticContact CZ3-CE2 3.8Å; W368-F372 HydrophobicContact CZ3-CE2 3.8Å; W368-F372 HydrophobicContact CZ3-CZ 4.49Å; W368-F372 AromaticContact NE1-CD2 3.66Å; W368-F372 AromaticContact NE1-CE2 3.98Å; W368-F372 WeakPolarHBondContact O-CD2 3.29Å; W368-F372 PolarHBondContact O-N 2.89Å; W368-F372 VanDerWaalsContact O-N 3.16Å; W368-E393 WeakPolarHBondContact CH2-O 3.34Å; W368-E393 HydrophobicContact CZ2-CB 3.74Å; W368-E393 VanDerWaalsContact CZ2-O 3.22Å; W368-E393 WeakPolarHBondContact CZ2-O 3.46Å; W368-E393 PolarHBondContact NE1-OE2 2.99Å; W368-I395 HydrophobicContact CZ3-CD1 4.15Å; W368-I395 HydrophobicContact CZ3-CG1 4.22Å
369	E	88.8	Confident	84.5	Confident	37 Å²	37	64.6 Å²	64.6	17%	0.173	33%	0.333	C	S	.	.	H	α-helix	trans	-58.6	-49.3	175.8	-69.8	-169.3	139.2	0	0	111.1	A365 E366 D373 C374 R375 L376	A365-E369 PolarHBondContact O-N 3.45Å; A365-E369 VanDerWaalsContact O-N 3.14Å; E366-E369 PolarHBondContact O-N 3.41Å; E369-D373 WeakPolarHBondContact O-CA 3.13Å; E369-D373 PolarHBondContact O-N 3.09Å; E369-C374 CarbonylContact C-O 3.54Å; E369-C374 WeakPolarHBondContact CA-O 3.42Å; E369-C374 WeakPolarHBondContact CB-O 3.44Å; E369-C374 WeakPolarHBondContact CG-O 3.47Å; E369-C374 PolarHBondContact O-N 3.39Å; E369-R375 WeakPolarHBondContact OE1-CA 3.38Å; E369-L376 HydrophobicContact CG-CB 4.3Å; E369-L376 HydrophobicContact CG-CD1 3.91Å; E369-L376 HydrophobicContact CG-CG 3.94Å; E369-L376 PolarHBondContact OE1-N 3.17Å
370	E	87.1	Confident	82.6	Confident	101 Å²	101	58.4 Å²	58.4	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-71	-35.4	-176.6	-167.4	64.4	-161.2	0	0	112.1	K74 E366 F367	K74-E370 WeakPolarHBondContact CE-O 3.27Å; K74-E370 PolarHBondContact NZ-O 3.19Å; E366-E370 WeakPolarHBondContact O-CB 3.14Å; E366-E370 PolarHBondContact O-N 2.95Å; F367-E370 PolarHBondContact O-N 3.38Å
371	N	89.5	Confident	80.7	Confident	29 Å²	29	65 Å²	65	16%	0.155	35%	0.353	C	S	.	.	H	α-helix	trans	-73.3	-38.5	-177.4	-175.1	68.3	0	0	0	113.1	F367 W368 S399	F367-N371 HydrophobicContact CD2-CB 4.41Å; F367-N371 HydrophobicContact CE1-CB 4.33Å; F367-N371 HydrophobicContact CE2-CB 4.03Å; F367-N371 HydrophobicContact CZ-CB 3.98Å; F367-N371 WeakPolarHBondContact O-CB 3.48Å; F367-N371 PolarHBondContact O-N 2.97Å; W368-N371 PolarHBondContact O-N 3.11Å; N371-S399 WeakPolarHBondContact ND2-CB 3.4Å; N371-S399 PolarHBondContact ND2-OG 3.32Å
372	F	90.3	Very high	78.6	Confident	12 Å²	12	75.7 Å²	75.7	5%	0.053	39%	0.393	C	S	.	.	H	α-helix	trans	-101.1	4	-179.4	-64.3	-68.1	0	0	0	114	W368 C374 E393 I395 D398	W368-F372 AromaticContact CD1-CD2 3.86Å; W368-F372 AromaticContact CD2-CD2 3.79Å; W368-F372 HydrophobicContact CD2-CD2 3.79Å; W368-F372 AromaticContact CD2-CE2 3.57Å; W368-F372 HydrophobicContact CD2-CE2 3.57Å; W368-F372 AromaticContact CE2-CD2 3.63Å; W368-F372 AromaticContact CE2-CE2 3.44Å; W368-F372 VanDerWaalsContact CE2-CE2 3.44Å; W368-F372 HydrophobicContact CE3-CD2 4.37Å; W368-F372 AromaticContact CE3-CE2 3.74Å; W368-F372 HydrophobicContact CE3-CE2 3.74Å; W368-F372 AromaticContact CG-CD2 3.98Å; W368-F372 HydrophobicContact CG-CD2 3.98Å; W368-F372 HydrophobicContact CG-CE2 4.24Å; W368-F372 AromaticContact CH2-CE2 3.71Å; W368-F372 HydrophobicContact CH2-CE2 3.71Å; W368-F372 HydrophobicContact CH2-CZ 4.22Å; W368-F372 HydrophobicContact CZ2-CD2 4.14Å; W368-F372 AromaticContact CZ2-CE2 3.55Å; W368-F372 HydrophobicContact CZ2-CE2 3.55Å; W368-F372 HydrophobicContact CZ2-CZ 4.26Å; W368-F372 AromaticContact CZ3-CE2 3.8Å; W368-F372 HydrophobicContact CZ3-CE2 3.8Å; W368-F372 HydrophobicContact CZ3-CZ 4.49Å; W368-F372 AromaticContact NE1-CD2 3.66Å; W368-F372 AromaticContact NE1-CE2 3.98Å; W368-F372 WeakPolarHBondContact O-CD2 3.29Å; W368-F372 PolarHBondContact O-N 2.89Å; W368-F372 VanDerWaalsContact O-N 3.16Å; F372-C374 VanDerWaalsContact C-N 3.34Å; F372-C374 PolarHBondContact O-N 3.06Å; F372-E393 HydrophobicContact CB-CG 4.4Å; F372-E393 HydrophobicContact CD1-CB 3.77Å; F372-E393 HydrophobicContact CD1-CG 4.11Å; F372-E393 HydrophobicContact CD2-CB 3.88Å; F372-E393 HydrophobicContact CD2-CG 4.35Å; F372-E393 HydrophobicContact CE1-CB 3.69Å; F372-E393 HydrophobicContact CE2-CB 3.8Å; F372-E393 HydrophobicContact CG-CB 3.87Å; F372-E393 HydrophobicContact CG-CG 4.03Å; F372-E393 HydrophobicContact CZ-CB 3.7Å; F372-I395 HydrophobicContact CE2-CG1 4.33Å; F372-I395 HydrophobicContact CZ-CG1 3.93Å; F372-D398 HydrophobicContact CD1-CB 4.1Å; F372-D398 HydrophobicContact CE1-CB 3.75Å
373	D	87.8	Confident	76.7	Confident	137 Å²	137	81.3 Å²	81.3	73%	0.733	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	53.9	-177.2	-165.9	21.1	0	0	0	111.5	E369	E369-D373 WeakPolarHBondContact O-CA 3.13Å; E369-D373 PolarHBondContact O-N 3.09Å
374	C	88.2	Confident	74.8	Confident	5 Å²	5	88 Å²	88	3%	0.034	45%	0.451	C	S	.	.			trans	-141.4	164.9	-175.9	69	0	0	0	0	112.1	E369 F372 R387 C389	E369-C374 CarbonylContact C-O 3.54Å; E369-C374 WeakPolarHBondContact CA-O 3.42Å; E369-C374 WeakPolarHBondContact CB-O 3.44Å; E369-C374 WeakPolarHBondContact CG-O 3.47Å; E369-C374 PolarHBondContact O-N 3.39Å; F372-C374 VanDerWaalsContact C-N 3.34Å; F372-C374 PolarHBondContact O-N 3.06Å; C374-R387 CarbonylContact C-O 3.46Å; C374-R387 WeakPolarHBondContact CA-O 3.3Å; C374-R387 HydrophobicContact CB-CB 4.45Å; C374-R387 HydrophobicContact CB-CG 4.31Å; C374-R387 VanDerWaalsContact CB-O 3.31Å; C374-R387 WeakPolarHBondContact CB-O 3.41Å; C374-C389 HydrophobicContact CB-CB 4.01Å; C374-C389 WeakPolarHBondContact CB-SG 3.38Å; C374-C389 WeakPolarHBondContact SG-CA 3.1Å; C374-C389 WeakPolarHBondContact SG-CB 3.33Å; C374-C389 CovalentContact SG-SG 2.03Å; C374-C389 PolarHBondContact SG-SG 3.19Å
375	R	84.2	Confident	73.1	Confident	144 Å²	144	93.7 Å²	93.7	54%	0.543	49%	0.491	S	S	.	.	B	Isolated β-bridge	trans	-113.7	136.5	177.2	-67.7	-73.6	-173.3	154.4	-4.1	112.5	E369 S386 R387 C389	E369-R375 WeakPolarHBondContact OE1-CA 3.38Å; R375-S386 VanDerWaalsContact CG-OG 3.25Å; R375-S386 WeakPolarHBondContact CG-OG 3.35Å; R375-R387 PolarHBondContact N-O 3.29Å; R375-C389 VanDerWaalsContact C-SG 3.54Å; R375-C389 PolarHBondContact N-SG 3.19Å; R375-C389 VanDerWaalsContact N-SG 3.43Å; R375-C389 PolarHBondContact O-N 3.36Å
376	L	81.4	Confident	71.9	Confident	38 Å²	38	94.7 Å²	94.7	20%	0.199	50%	0.495	C	S	.	.			trans	-85.3	139.6	171.8	-70.8	164.6	0	0	0	110.3	L355 A365 E369 S378 C389	L355-L376 HydrophobicContact CD1-CD1 4.15Å; L355-L376 HydrophobicContact CD1-CD2 3.55Å; L355-L376 HydrophobicContact CD1-CG 4.48Å; L355-L376 HydrophobicContact CD2-CD1 4.32Å; A365-L376 HydrophobicContact CB-CD1 3.93Å; E369-L376 HydrophobicContact CG-CB 4.3Å; E369-L376 HydrophobicContact CG-CD1 3.91Å; E369-L376 HydrophobicContact CG-CG 3.94Å; E369-L376 PolarHBondContact OE1-N 3.17Å; L376-S378 PolarHBondContact O-N 3.03Å; L376-C389 HydrophobicContact CD2-CB 3.77Å; L376-C389 HydrophobicContact CG-CB 4.2Å
377	L	66	Low	71.6	Confident	153 Å²	153	98.1 Å²	98.1	80%	0.801	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-3.8	-170.8	-75.5	159.8	0	0	0	115.2	K388	L377-K388 HydrophobicContact CD2-CD 4.47Å
378	S	56.6	Low	71.3	Confident	120 Å²	120	104.1 Å²	104.1	84%	0.839	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	3.3	-171.2	78.3	0	0	0	0	116.3	L376	L376-S378 PolarHBondContact O-N 3.03Å
379	A	52	Low	70.9	Confident	77 Å²	77	104.8 Å²	104.8	64%	0.636	54%	0.535	S	S	*	.	S	Bend	trans	-129.2	-5.4	-168.5	0	0	0	0	0	118.9
380	S	45.9	Very low	70.7	Confident	81 Å²	81	107.7 Å²	107.7	57%	0.566	56%	0.555	S	S	*	*			trans	-159.1	127.6	176.4	-175.9	0	0	0	0	115.6	R382	S380-R382 PolarHBondContact O-N 3.25Å; S380-R382 PolarHBondContact OG-N 2.8Å
381	K	50.3	Low	70.4	Confident	214 Å²	214	104.2 Å²	104.2	93%	0.93	55%	0.547	S	S	*	.			trans	-83.7	73.6	157.8	-72.7	-179.7	176.8	176.9	0	109.2
382	R	47.1	Very low	70.1	Confident	230 Å²	230	110.2 Å²	110.2	87%	0.868	57%	0.574	S	S	*	*			trans	-142.6	142.9	162.8	-79.8	-167.3	173.8	175.1	-1.2	110.4	S380	S380-R382 PolarHBondContact O-N 3.25Å; S380-R382 PolarHBondContact OG-N 2.8Å
383	E	50.6	Low	70.1	Confident	194 Å²	194	109.9 Å²	109.9	91%	0.907	57%	0.572	S	S	*	*			trans	-56.7	121.6	-166.5	-75.2	167.4	135.1	0	0	116.4	S385	E383-S385 PolarHBondContact O-N 3.38Å
384	D	52.9	Low	70.2	Confident	150 Å²	150	108 Å²	108	80%	0.802	56%	0.555	S	S	*	*	S	Bend		56.6	43.9	109.7	-97.9	5.3	0	0	0	123
385	S	55.8	Low	70.4	Confident	121 Å²	121	108.1 Å²	108.1	85%	0.846	56%	0.555	S	S	*	*			trans	-139.9	-5.3	158.2	70	0	0	0	0	117.3	E383	E383-S385 PolarHBondContact O-N 3.38Å
386	S	64.5	Low	70.6	Confident	65 Å²	65	103.3 Å²	103.3	46%	0.455	55%	0.55	S	S	.	*	S	Bend	trans	-97.4	142.4	-179.3	44.4	0	0	0	0	112.5	R375	R375-S386 VanDerWaalsContact CG-OG 3.25Å; R375-S386 WeakPolarHBondContact CG-OG 3.35Å
387	R	83.3	Confident	70.9	Confident	149 Å²	149	108 Å²	108	56%	0.562	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-55.2	135.9	174.7	175.6	-177.2	170.1	179.4	-3.8	109.6	C374 R375	C374-R387 CarbonylContact C-O 3.46Å; C374-R387 WeakPolarHBondContact CA-O 3.3Å; C374-R387 HydrophobicContact CB-CB 4.45Å; C374-R387 HydrophobicContact CB-CG 4.31Å; C374-R387 VanDerWaalsContact CB-O 3.31Å; C374-R387 WeakPolarHBondContact CB-O 3.41Å; R375-R387 PolarHBondContact N-O 3.29Å
388	K	83.4	Confident	71.9	Confident	129 Å²	129	105.1 Å²	105.1	56%	0.561	56%	0.56	S	S	*	*	B	Isolated β-bridge	trans	-81.9	136.2	175.5	-65.4	179.2	-178.5	175.1	0	110	L377	L377-K388 HydrophobicContact CD2-CD 4.47Å
389	C	84.1	Confident	73.3	Confident	15 Å²	15	100.1 Å²	100.1	10%	0.101	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-72	133	171.9	-53.7	0	0	0	0	109.7	C374 R375 L376	C374-C389 HydrophobicContact CB-CB 4.01Å; C374-C389 WeakPolarHBondContact CB-SG 3.38Å; C374-C389 WeakPolarHBondContact SG-CA 3.1Å; C374-C389 WeakPolarHBondContact SG-CB 3.33Å; C374-C389 CovalentContact SG-SG 2.03Å; C374-C389 PolarHBondContact SG-SG 3.19Å; R375-C389 VanDerWaalsContact C-SG 3.54Å; R375-C389 PolarHBondContact N-SG 3.19Å; R375-C389 VanDerWaalsContact N-SG 3.43Å; R375-C389 PolarHBondContact O-N 3.36Å; L376-C389 HydrophobicContact CD2-CB 3.77Å; L376-C389 HydrophobicContact CG-CB 4.2Å
390	T	83.1	Confident	75	Confident	97 Å²	97	104.5 Å²	104.5	60%	0.595	53%	0.529	S	S	*	.			trans	-88.8	-20.4	178.3	61.4	0	0	0	0	112.7	Q392 E393	T390-Q392 PolarHBondContact O-N 3.01Å; T390-Q392 PolarHBondContact OG1-N 2.75Å; T390-E393 WeakPolarHBondContact CB-OE1 3.47Å; T390-E393 PolarHBondContact N-OE1 2.78Å; T390-E393 PolarHBondContact N-OE2 3.08Å; T390-E393 PolarHBondContact OG1-OE1 2.91Å; T390-E393 PolarHBondContact OG1-OE2 2.04Å
391	G	80.9	Confident	77	Confident	29 Å²	29	102.9 Å²	102.9	30%	0.299	51%	0.511	S	S	.	.	S	Bend	trans	78	-2.6	-171.6	0	0	0	0	0	113.3	E393	G391-E393 WeakPolarHBondContact CA-OE2 3.48Å; G391-E393 PolarHBondContact N-OE2 2.96Å
392	Q	84.6	Confident	78.7	Confident	155 Å²	155	97.6 Å²	97.6	72%	0.724	49%	0.49	S	S	*	.			trans	-96.4	-5	176.7	-64	-171.6	-12	0	0	112.9	T390 R394	T390-Q392 PolarHBondContact O-N 3.01Å; T390-Q392 PolarHBondContact OG1-N 2.75Å; Q392-R394 PolarHBondContact O-NH1 2.83Å
393	E	89.4	Confident	80.7	Confident	4 Å²	4	88 Å²	88	2%	0.019	46%	0.455	C	S	.	.			trans	-58.4	151.6	176.4	-57.7	79.8	-168.3	0	0	111	W368 F372 T390 G391 D398	W368-E393 WeakPolarHBondContact CH2-O 3.34Å; W368-E393 HydrophobicContact CZ2-CB 3.74Å; W368-E393 VanDerWaalsContact CZ2-O 3.22Å; W368-E393 WeakPolarHBondContact CZ2-O 3.46Å; W368-E393 PolarHBondContact NE1-OE2 2.99Å; F372-E393 HydrophobicContact CB-CG 4.4Å; F372-E393 HydrophobicContact CD1-CB 3.77Å; F372-E393 HydrophobicContact CD1-CG 4.11Å; F372-E393 HydrophobicContact CD2-CB 3.88Å; F372-E393 HydrophobicContact CD2-CG 4.35Å; F372-E393 HydrophobicContact CE1-CB 3.69Å; F372-E393 HydrophobicContact CE2-CB 3.8Å; F372-E393 HydrophobicContact CG-CB 3.87Å; F372-E393 HydrophobicContact CG-CG 4.03Å; F372-E393 HydrophobicContact CZ-CB 3.7Å; T390-E393 WeakPolarHBondContact CB-OE1 3.47Å; T390-E393 PolarHBondContact N-OE1 2.78Å; T390-E393 PolarHBondContact N-OE2 3.08Å; T390-E393 PolarHBondContact OG1-OE1 2.91Å; T390-E393 PolarHBondContact OG1-OE2 2.04Å; G391-E393 WeakPolarHBondContact CA-OE2 3.48Å; G391-E393 PolarHBondContact N-OE2 2.96Å; E393-D398 WeakPolarHBondContact CA-OD2 3.44Å; E393-D398 HydrophobicContact CB-CB 4.48Å
394	R	90.9	Very high	82.6	Confident	99 Å²	99	79.2 Å²	79.2	37%	0.374	41%	0.414	S	S	.	.			trans	-129.7	129.7	-179.7	-67.2	-65.4	-179.8	-91.5	1.9	111.7	Q392 I397 D398	Q392-R394 PolarHBondContact O-NH1 2.83Å; R394-I397 HydrophobicContact CB-CB 4.11Å; R394-I397 HydrophobicContact CB-CD1 4Å; R394-I397 HydrophobicContact CB-CG1 4.32Å; R394-I397 PolarHBondContact O-N 3.32Å; R394-D398 PolarHBondContact N-OD2 3.29Å; R394-D398 PolarHBondContact O-N 3.09Å
395	I	91.4	Very high	84.1	Confident	6 Å²	6	72.6 Å²	72.6	3%	0.031	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-68.1	131.9	177.7	-58.1	166	0	0	0	108.4	F350 T351 F364 F367 W368 F372 I397 Y401	F350-I395 HydrophobicContact CD1-CD1 4.43Å; F350-I395 HydrophobicContact CD1-CG2 4.11Å; F350-I395 HydrophobicContact CE1-CD1 4.16Å; F350-I395 HydrophobicContact CE1-CG2 4.06Å; T351-I395 HydrophobicContact CG2-CG2 4.45Å; F364-I395 HydrophobicContact CZ-CD1 4.39Å; F367-I395 HydrophobicContact CE1-CD1 3.95Å; F367-I395 HydrophobicContact CZ-CD1 4.46Å; W368-I395 HydrophobicContact CZ3-CD1 4.15Å; W368-I395 HydrophobicContact CZ3-CG1 4.22Å; F372-I395 HydrophobicContact CE2-CG1 4.33Å; F372-I395 HydrophobicContact CZ-CG1 3.93Å; I395-I397 VanDerWaalsContact C-N 3.29Å; I395-I397 PolarHBondContact O-N 3.2Å; I395-Y401 HydrophobicContact CG2-CD2 4.05Å; I395-Y401 HydrophobicContact CG2-CG 4.3Å
396	G	87.6	Confident	85.8	Confident	43 Å²	43	68.4 Å²	68.4	44%	0.443	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	-19.5	-176.2	0	0	0	0	0	114.4	S399	G396-S399 CarbonylContact C-O 3.38Å; G396-S399 WeakPolarHBondContact CA-O 3.22Å; G396-S399 PolarHBondContact N-O 2.88Å
397	I	88.3	Confident	87.2	Confident	137 Å²	137	65.3 Å²	65.3	70%	0.703	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-59.1	176	-57.5	175.2	0	0	0	110	R394 I395	R394-I397 HydrophobicContact CB-CB 4.11Å; R394-I397 HydrophobicContact CB-CD1 4Å; R394-I397 HydrophobicContact CB-CG1 4.32Å; R394-I397 PolarHBondContact O-N 3.32Å; I395-I397 VanDerWaalsContact C-N 3.29Å; I395-I397 PolarHBondContact O-N 3.2Å
398	D	86.8	Confident	87.7	Confident	93 Å²	93	58.3 Å²	58.3	50%	0.497	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-11.6	-178.7	-59.3	-57.6	0	0	0	112.4	F372 E393 R394	F372-D398 HydrophobicContact CD1-CB 4.1Å; F372-D398 HydrophobicContact CE1-CB 3.75Å; E393-D398 WeakPolarHBondContact CA-OD2 3.44Å; E393-D398 HydrophobicContact CB-CB 4.48Å; R394-D398 PolarHBondContact N-OD2 3.29Å; R394-D398 PolarHBondContact O-N 3.09Å
399	S	87.5	Confident	88.2	Confident	14 Å²	14	52.9 Å²	52.9	10%	0.098	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-136.1	144.7	173	70.8	0	0	0	0	110.4	N371 G396 Y401	N371-S399 WeakPolarHBondContact ND2-CB 3.4Å; N371-S399 PolarHBondContact ND2-OG 3.32Å; G396-S399 CarbonylContact C-O 3.38Å; G396-S399 WeakPolarHBondContact CA-O 3.22Å; G396-S399 PolarHBondContact N-O 2.88Å; S399-Y401 PolarHBondContact O-N 3.32Å
400	K	85.9	Confident	88.8	Confident	169 Å²	169	52.2 Å²	52.2	74%	0.735	27%	0.271	S	S	*	.			trans	-62.5	130.6	172.7	-170.6	-175.4	176.7	-160.3	0	109.6	E402	K400-E402 IonicContact NZ-OE2 2.84Å
401	Y	88.4	Confident	89.4	Confident	47 Å²	47	47.6 Å²	47.6	18%	0.184	24%	0.243	C	C	.	.			trans	-118.1	130.3	173.4	175.3	-109.2	0	0	0	109.7	D347 F350 T351 I395 S399	D347-Y401 HydrophobicContact CB-CE1 4.05Å; D347-Y401 WeakPolarHBondContact OD1-CE1 3.04Å; D347-Y401 PolarHBondContact OD1-OH 2.9Å; F350-Y401 HydrophobicContact CB-CE2 4.39Å; F350-Y401 AromaticContact CD1-CD2 3.8Å; F350-Y401 HydrophobicContact CD1-CD2 3.8Å; F350-Y401 AromaticContact CD1-CE2 3.28Å; F350-Y401 HydrophobicContact CD1-CE2 3.28Å; F350-Y401 HydrophobicContact CE1-CD2 4.07Å; F350-Y401 AromaticContact CE1-CE2 3.81Å; F350-Y401 HydrophobicContact CE1-CE2 3.81Å; F350-Y401 HydrophobicContact CG-CE2 4.07Å; T351-Y401 HydrophobicContact CG2-CD1 3.72Å; T351-Y401 HydrophobicContact CG2-CE1 3.99Å; T351-Y401 HydrophobicContact CG2-CG 4.06Å; I395-Y401 HydrophobicContact CG2-CD2 4.05Å; I395-Y401 HydrophobicContact CG2-CG 4.3Å; S399-Y401 PolarHBondContact O-N 3.32Å
402	E	86.9	Confident	90.1	Very high	104 Å²	104	46.4 Å²	46.4	49%	0.486	23%	0.23	S	C	.	.			trans	-139.2	130.1	171	-170.7	175.6	158.6	0	0	106.9	Q79 K400 E404	Q79-E402 PolarHBondContact NE2-O 3.45Å; Q79-E402 PolarHBondContact OE1-O 3.18Å; K400-E402 IonicContact NZ-OE2 2.84Å; E402-E404 PolarHBondContact O-N 3.15Å
403	Q	89.4	Confident	90.7	Very high	28 Å²	28	39 Å²	39	13%	0.131	20%	0.196	C	C	.	.			trans	-71.5	124.1	-178.1	-169	-179.3	85.8	0	0	110.1	I343 F346 D347 G405 V407	I343-Q403 PolarHBondContact O-NE2 3.01Å; F346-Q403 HydrophobicContact CD1-CG 4.19Å; D347-Q403 VanDerWaalsContact CG-NE2 3.32Å; D347-Q403 WeakPolarHBondContact OD1-CB 3.37Å; D347-Q403 VanDerWaalsContact OD1-CD 3.3Å; D347-Q403 PolarHBondContact OD1-NE2 3.08Å; Q403-G405 PolarHBondContact O-N 3.16Å; Q403-V407 HydrophobicContact CG-CB 4.29Å; Q403-V407 HydrophobicContact CG-CG1 4.44Å; Q403-V407 HydrophobicContact CG-CG2 4.25Å
404	E	88.6	Confident	91.1	Very high	10 Å²	10	38.9 Å²	38.9	5%	0.047	20%	0.195	C	C	.	.			trans	-68.9	119.9	175.5	-162.7	-77.2	145.1	0	0	109.3	E75 R80 E402 K406 V407	E75-E404 HydrophobicContact CB-CB 4.28Å; E75-E404 HydrophobicContact CB-CG 4.22Å; R80-E404 IonicContact CZ-OE1 3.66Å; R80-E404 IonicContact CZ-OE2 2.71Å; R80-E404 IonicContact NE-OE1 3.83Å; R80-E404 IonicContact NE-OE2 3.95Å; R80-E404 PolarHBondContact NE-OE2 3.12Å; R80-E404 IonicContact NH2-OE1 3.23Å; R80-E404 PolarHBondContact NH2-OE1 2.99Å; R80-E404 IonicContact NH2-OE2 3.21Å; R80-E404 PolarHBondContact NH2-OE2 2.8Å; E402-E404 PolarHBondContact O-N 3.15Å; E404-K406 VanDerWaalsContact CD-N 3.31Å; E404-K406 PolarHBondContact O-N 2.82Å; E404-K406 PolarHBondContact OE1-N 3Å; E404-K406 WeakPolarHBondContact OE2-CA 3.04Å; E404-K406 WeakPolarHBondContact OE2-CB 3.37Å; E404-K406 PolarHBondContact OE2-N 3.23Å; E404-V407 HydrophobicContact CB-CG2 4.4Å; E404-V407 VanDerWaalsContact O-CB 3.22Å; E404-V407 WeakPolarHBondContact O-CB 3.01Å; E404-V407 WeakPolarHBondContact O-CG2 3.49Å; E404-V407 PolarHBondContact O-N 3.18Å
405	G	86	Confident	91.4	Very high	11 Å²	11	35.8 Å²	35.8	11%	0.113	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	4.4	-167.8	0	0	0	0	0	116.6	R340 Q403 V407	R340-G405 VanDerWaalsContact CD-O 3.31Å; R340-G405 WeakPolarHBondContact CD-O 3.45Å; R340-G405 PolarHBondContact NH1-O 2.83Å; Q403-G405 PolarHBondContact O-N 3.16Å; G405-V407 VanDerWaalsContact C-N 3.34Å
406	K	89.9	Confident	91.7	Very high	32 Å²	32	35.5 Å²	35.5	14%	0.139	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-1.8	164.3	-54.1	-168.2	-176.6	-170	0	112.8	A182 D314 E404 Q408 F409 V410	A182-K406 HydrophobicContact CB-CD 3.61Å; D314-K406 IonicContact OD2-NZ 3.71Å; E404-K406 VanDerWaalsContact CD-N 3.31Å; E404-K406 PolarHBondContact O-N 2.82Å; E404-K406 PolarHBondContact OE1-N 3Å; E404-K406 WeakPolarHBondContact OE2-CA 3.04Å; E404-K406 WeakPolarHBondContact OE2-CB 3.37Å; E404-K406 PolarHBondContact OE2-N 3.23Å; K406-Q408 VanDerWaalsContact C-N 3.28Å; K406-Q408 PolarHBondContact O-N 3.26Å; K406-F409 HydrophobicContact CB-CD2 4.22Å; K406-F409 HydrophobicContact CG-CD2 4.33Å; K406-F409 PolarHBondContact O-N 2.76Å; K406-F409 VanDerWaalsContact O-N 3.1Å; K406-V410 PolarHBondContact O-N 2.86Å
407	V	93.9	Very high	92.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-51.5	-46.7	171.8	162.3	0	0	0	0	111.3	Q79 A83 F346 Q403 E404 G405 F409 V410 I411	Q79-V407 HydrophobicContact CB-CG2 4.32Å; A83-V407 HydrophobicContact CB-CB 4.41Å; A83-V407 HydrophobicContact CB-CG1 3.92Å; A83-V407 HydrophobicContact CB-CG2 4.3Å; F346-V407 HydrophobicContact CB-CG1 4.31Å; F346-V407 HydrophobicContact CD1-CG1 3.57Å; F346-V407 HydrophobicContact CD1-CG2 4.29Å; F346-V407 HydrophobicContact CD2-CG1 4.33Å; F346-V407 HydrophobicContact CE1-CG1 3.88Å; F346-V407 HydrophobicContact CE1-CG2 3.81Å; F346-V407 HydrophobicContact CG-CG1 3.79Å; F346-V407 HydrophobicContact CZ-CG1 4.41Å; F346-V407 HydrophobicContact CZ-CG2 4.32Å; Q403-V407 HydrophobicContact CG-CB 4.29Å; Q403-V407 HydrophobicContact CG-CG1 4.44Å; Q403-V407 HydrophobicContact CG-CG2 4.25Å; E404-V407 HydrophobicContact CB-CG2 4.4Å; E404-V407 VanDerWaalsContact O-CB 3.22Å; E404-V407 WeakPolarHBondContact O-CB 3.01Å; E404-V407 WeakPolarHBondContact O-CG2 3.49Å; E404-V407 PolarHBondContact O-N 3.18Å; G405-V407 VanDerWaalsContact C-N 3.34Å; V407-F409 VanDerWaalsContact C-N 3.33Å; V407-F409 PolarHBondContact O-N 2.92Å; V407-V410 PolarHBondContact O-N 2.77Å; V407-V410 VanDerWaalsContact O-N 3.14Å; V407-I411 HydrophobicContact CG1-CD1 3.86Å; V407-I411 WeakPolarHBondContact O-CG1 3.27Å; V407-I411 PolarHBondContact O-N 3.22Å
408	Q	93.9	Very high	92.5	Very high	3 Å²	3	26.9 Å²	26.9	1%	0.014	13%	0.127	C	C	.	.	H	α-helix	trans	-54.4	-48.8	176.6	-172.6	-160.8	-43.5	0	0	111.6	S341 I343 K406 V410 I411 D412 A460 T462	S341-Q408 PolarHBondContact O-OE1 3.27Å; I343-Q408 HydrophobicContact CD1-CG 4.26Å; I343-Q408 HydrophobicContact CG1-CB 4.42Å; I343-Q408 HydrophobicContact CG1-CG 4.49Å; K406-Q408 VanDerWaalsContact C-N 3.28Å; K406-Q408 PolarHBondContact O-N 3.26Å; Q408-V410 VanDerWaalsContact C-N 3.31Å; Q408-V410 PolarHBondContact O-N 3.1Å; Q408-I411 PolarHBondContact O-N 3.23Å; Q408-D412 PolarHBondContact NE2-OD2 3.28Å; Q408-D412 VanDerWaalsContact NE2-OD2 3.08Å; Q408-D412 WeakPolarHBondContact O-CB 3.38Å; Q408-D412 VanDerWaalsContact O-CG 3.31Å; Q408-D412 PolarHBondContact O-N 3.04Å; Q408-A460 HydrophobicContact CG-CB 3.85Å; Q408-T462 PolarHBondContact NE2-OG1 3.5Å
409	F	94.8	Very high	93	Very high	15 Å²	15	24.6 Å²	24.6	7%	0.066	11%	0.113	C	C	.	.	H	α-helix	trans	-66.2	-30.9	-178.9	-60.1	-55.2	0	0	0	112.9	Y181 V200 V201 P338 R340 K406 V407 A413	Y181-F409 WeakPolarHBondContact O-CB 3.43Å; V200-F409 HydrophobicContact CG2-CB 3.96Å; V200-F409 HydrophobicContact CG2-CD1 4.44Å; V200-F409 VanDerWaalsContact CG2-O 3.26Å; V200-F409 WeakPolarHBondContact CG2-O 2.99Å; V201-F409 HydrophobicContact CG1-CB 4.04Å; V201-F409 HydrophobicContact CG1-CD1 3.86Å; V201-F409 HydrophobicContact CG1-CD2 3.73Å; V201-F409 HydrophobicContact CG1-CE1 4.25Å; V201-F409 HydrophobicContact CG1-CE2 4.14Å; V201-F409 HydrophobicContact CG1-CG 3.6Å; V201-F409 HydrophobicContact CG1-CZ 4.39Å; P338-F409 HydrophobicContact CB-CE2 4.25Å; P338-F409 HydrophobicContact CB-CZ 3.97Å; R340-F409 HydrophobicContact CB-CE2 4.3Å; R340-F409 HydrophobicContact CB-CZ 4.2Å; K406-F409 HydrophobicContact CB-CD2 4.22Å; K406-F409 HydrophobicContact CG-CD2 4.33Å; K406-F409 PolarHBondContact O-N 2.76Å; K406-F409 VanDerWaalsContact O-N 3.1Å; V407-F409 VanDerWaalsContact C-N 3.33Å; V407-F409 PolarHBondContact O-N 2.92Å; F409-A413 VanDerWaalsContact O-CB 3.32Å; F409-A413 WeakPolarHBondContact O-CB 3.27Å; F409-A413 PolarHBondContact O-N 3.24Å
410	V	96.7	Very high	93.4	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.4	-48.1	172.6	177.9	0	0	0	0	110.1	F57 R80 A83 M84 Y181 K406 V407 Q408 A413 V414	F57-V410 HydrophobicContact CE1-CG1 3.96Å; F57-V410 HydrophobicContact CE1-CG2 4.25Å; F57-V410 HydrophobicContact CZ-CG1 4.13Å; R80-V410 HydrophobicContact CB-CG2 4.09Å; R80-V410 HydrophobicContact CG-CG2 4.36Å; A83-V410 HydrophobicContact CB-CB 4.15Å; A83-V410 HydrophobicContact CB-CG1 4.09Å; M84-V410 HydrophobicContact CB-CG1 4Å; Y181-V410 HydrophobicContact CD1-CG2 3.99Å; Y181-V410 HydrophobicContact CD2-CG2 3.58Å; Y181-V410 HydrophobicContact CE1-CG2 4.37Å; Y181-V410 HydrophobicContact CE2-CG2 4.04Å; Y181-V410 HydrophobicContact CG-CB 4.49Å; Y181-V410 HydrophobicContact CG-CG2 3.57Å; K406-V410 PolarHBondContact O-N 2.86Å; V407-V410 PolarHBondContact O-N 2.77Å; V407-V410 VanDerWaalsContact O-N 3.14Å; Q408-V410 VanDerWaalsContact C-N 3.31Å; Q408-V410 PolarHBondContact O-N 3.1Å; V410-A413 PolarHBondContact O-N 3.35Å; V410-V414 WeakPolarHBondContact O-CG2 3.46Å; V410-V414 PolarHBondContact O-N 3.06Å; V410-V414 VanDerWaalsContact O-N 3.12Å
411	I	96.3	Very high	93.8	Very high	1 Å²	1	16 Å²	16	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-59.5	-50.2	178.4	-65.1	169.3	0	0	0	109.5	A83 Y86 A87 I343 F346 V407 Q408 A413 V414 Y415	A83-I411 HydrophobicContact CB-CG1 4.21Å; Y86-I411 HydrophobicContact CD1-CD1 3.98Å; Y86-I411 HydrophobicContact CD1-CG1 4.45Å; Y86-I411 HydrophobicContact CE1-CD1 4.16Å; A87-I411 HydrophobicContact CB-CG1 4.36Å; A87-I411 HydrophobicContact CB-CG2 4.24Å; I343-I411 HydrophobicContact CB-CD1 4.46Å; I343-I411 HydrophobicContact CG1-CD1 4.2Å; I343-I411 HydrophobicContact CG2-CD1 4.32Å; F346-I411 HydrophobicContact CB-CD1 4.48Å; V407-I411 HydrophobicContact CG1-CD1 3.86Å; V407-I411 WeakPolarHBondContact O-CG1 3.27Å; V407-I411 PolarHBondContact O-N 3.22Å; Q408-I411 PolarHBondContact O-N 3.23Å; I411-A413 VanDerWaalsContact C-N 3.28Å; I411-A413 PolarHBondContact O-N 3.24Å; I411-V414 PolarHBondContact O-N 3.23Å; I411-V414 VanDerWaalsContact O-N 3.09Å; I411-Y415 HydrophobicContact CG2-CD2 3.56Å; I411-Y415 HydrophobicContact CG2-CE2 3.63Å; I411-Y415 WeakPolarHBondContact O-CD2 3.11Å; I411-Y415 PolarHBondContact O-N 3.39Å
412	D	95.9	Very high	94.1	Very high	4 Å²	4	15.7 Å²	15.7	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-58.8	-37.1	178.7	-71.6	-20.5	0	0	0	112.1	Q408 A416 G458 V464	Q408-D412 PolarHBondContact NE2-OD2 3.28Å; Q408-D412 VanDerWaalsContact NE2-OD2 3.08Å; Q408-D412 WeakPolarHBondContact O-CB 3.38Å; Q408-D412 VanDerWaalsContact O-CG 3.31Å; Q408-D412 PolarHBondContact O-N 3.04Å; D412-A416 VanDerWaalsContact O-CB 3.26Å; D412-A416 WeakPolarHBondContact O-CB 3.44Å; D412-A416 PolarHBondContact O-N 2.69Å; D412-G458 WeakPolarHBondContact OD1-CA 3.27Å; D412-V464 HydrophobicContact CB-CG2 3.93Å
413	A	97	Very high	94.5	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-66.4	-39.6	175.9	0	0	0	0	0	112.8	I156 I179 V200 F409 V410 I411 M417	I156-A413 HydrophobicContact CD1-CB 4.31Å; I156-A413 HydrophobicContact CG2-CB 4.07Å; I179-A413 HydrophobicContact CG2-CB 3.82Å; V200-A413 HydrophobicContact CG1-CB 4.31Å; V200-A413 HydrophobicContact CG2-CB 4.07Å; F409-A413 VanDerWaalsContact O-CB 3.32Å; F409-A413 WeakPolarHBondContact O-CB 3.27Å; F409-A413 PolarHBondContact O-N 3.24Å; V410-A413 PolarHBondContact O-N 3.35Å; I411-A413 VanDerWaalsContact C-N 3.28Å; I411-A413 PolarHBondContact O-N 3.24Å; A413-M417 PolarHBondContact O-N 3.45Å
414	V	97.3	Very high	94.7	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-69.2	-44.5	176.4	-179.7	0	0	0	0	110.5	L53 M84 A87 L88 I91 I156 V410 I411 A416 M417 A418	L53-V414 HydrophobicContact CD1-CG1 4.48Å; M84-V414 HydrophobicContact CB-CG2 4.26Å; M84-V414 HydrophobicContact CG-CG2 3.87Å; A87-V414 HydrophobicContact CB-CB 3.93Å; A87-V414 HydrophobicContact CB-CG1 3.91Å; A87-V414 HydrophobicContact CB-CG2 4.32Å; L88-V414 HydrophobicContact CD2-CG1 4.12Å; L88-V414 HydrophobicContact CG-CG1 4.31Å; I91-V414 HydrophobicContact CD1-CG1 3.72Å; I156-V414 HydrophobicContact CG1-CG2 4.23Å; I156-V414 HydrophobicContact CG2-CG2 4.42Å; V410-V414 WeakPolarHBondContact O-CG2 3.46Å; V410-V414 PolarHBondContact O-N 3.06Å; V410-V414 VanDerWaalsContact O-N 3.12Å; I411-V414 PolarHBondContact O-N 3.23Å; I411-V414 VanDerWaalsContact O-N 3.09Å; V414-A416 VanDerWaalsContact C-N 3.32Å; V414-A416 PolarHBondContact O-N 3.37Å; V414-M417 WeakPolarHBondContact O-CB 3.34Å; V414-M417 PolarHBondContact O-N 3.01Å; V414-A418 PolarHBondContact O-N 3.39Å
415	Y	96.9	Very high	94.9	Very high	34 Å²	34	12 Å²	12	13%	0.133	6%	0.059	C	C	.	.	H	α-helix	trans	-62.7	-37.7	175	-88.7	-86.6	0	0	0	112.2	A87 Q90 I91 L97 I411 M417 A418 H419 F456	A87-Y415 HydrophobicContact CB-CD2 4.5Å; A87-Y415 HydrophobicContact CB-CE2 4.3Å; Q90-Y415 WeakPolarHBondContact CB-OH 3.31Å; I91-Y415 HydrophobicContact CD1-CD1 4.29Å; I91-Y415 HydrophobicContact CD1-CD2 4.28Å; I91-Y415 HydrophobicContact CD1-CE1 4.33Å; I91-Y415 HydrophobicContact CD1-CE2 4.33Å; I91-Y415 HydrophobicContact CD1-CG 4.27Å; I91-Y415 HydrophobicContact CG1-CD1 4.12Å; I91-Y415 HydrophobicContact CG1-CE1 3.74Å; I91-Y415 HydrophobicContact CG1-CE2 4.26Å; L97-Y415 HydrophobicContact CD2-CD1 3.99Å; L97-Y415 HydrophobicContact CD2-CE1 4.1Å; I411-Y415 HydrophobicContact CG2-CD2 3.56Å; I411-Y415 HydrophobicContact CG2-CE2 3.63Å; I411-Y415 WeakPolarHBondContact O-CD2 3.11Å; I411-Y415 PolarHBondContact O-N 3.39Å; Y415-M417 VanDerWaalsContact C-N 3.31Å; Y415-M417 PolarHBondContact O-N 3.24Å; Y415-A418 PolarHBondContact O-N 2.69Å; Y415-H419 WeakPolarHBondContact O-CB 3.35Å; Y415-H419 PolarHBondContact O-CD2 2.8Å; Y415-H419 PolarHBondContact O-N 3.01Å; Y415-F456 HydrophobicContact CG-CE2 4.48Å
416	A	97.1	Very high	95.2	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.4	-42.1	174.9	0	0	0	0	0	111.8	I179 D412 V414 A420 F456 F466	I179-A416 HydrophobicContact CD1-CB 4.21Å; D412-A416 VanDerWaalsContact O-CB 3.26Å; D412-A416 WeakPolarHBondContact O-CB 3.44Å; D412-A416 PolarHBondContact O-N 2.69Å; V414-A416 VanDerWaalsContact C-N 3.32Å; V414-A416 PolarHBondContact O-N 3.37Å; A416-A420 VanDerWaalsContact O-CB 3.3Å; A416-A420 WeakPolarHBondContact O-CB 3.41Å; A416-A420 PolarHBondContact O-N 3.12Å; A416-F456 HydrophobicContact CB-CE1 3.86Å; A416-F456 HydrophobicContact CB-CZ 4.1Å; A416-F466 HydrophobicContact CB-CE2 4.12Å; A416-F466 HydrophobicContact CB-CZ 4.05Å
417	M	96.8	Very high	95.3	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.6	-43.8	173.9	-170.6	65.2	70.8	0	0	111.6	L53 I156 I179 A413 V414 Y415 A420 L421 L447 I451	L53-M417 HydrophobicContact CD1-CB 4.42Å; L53-M417 HydrophobicContact CD1-CG 4.04Å; L53-M417 HydrophobicContact CD2-CG 3.69Å; I156-M417 HydrophobicContact CD1-CB 4.38Å; I156-M417 HydrophobicContact CD1-CE 4.35Å; I179-M417 HydrophobicContact CD1-CB 4.38Å; I179-M417 HydrophobicContact CD1-CE 3.81Å; I179-M417 HydrophobicContact CG1-CE 4.05Å; A413-M417 PolarHBondContact O-N 3.45Å; V414-M417 WeakPolarHBondContact O-CB 3.34Å; V414-M417 PolarHBondContact O-N 3.01Å; Y415-M417 VanDerWaalsContact C-N 3.31Å; Y415-M417 PolarHBondContact O-N 3.24Å; M417-A420 PolarHBondContact O-N 2.99Å; M417-L421 HydrophobicContact CG-CD1 4.21Å; M417-L421 WeakPolarHBondContact O-CB 3.19Å; M417-L421 VanDerWaalsContact O-CG 3.31Å; M417-L421 WeakPolarHBondContact O-CG 3.24Å; M417-L421 PolarHBondContact O-N 3.45Å; M417-L447 HydrophobicContact SD-CD2 4.21Å; M417-I451 HydrophobicContact CE-CD1 3.8Å; M417-I451 HydrophobicContact SD-CD1 3.8Å; M417-I451 HydrophobicContact SD-CG1 4.29Å
418	A	96.6	Very high	95.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.5	-44.8	179.4	0	0	0	0	0	112.7	I91 L97 L98 L103 V414 Y415 A420 L421 H422	I91-A418 HydrophobicContact CD1-CB 3.79Å; I91-A418 HydrophobicContact CG1-CB 4.36Å; I91-A418 HydrophobicContact CG2-CB 4.07Å; L97-A418 HydrophobicContact CD2-CB 3.97Å; L97-A418 HydrophobicContact CG-CB 4.44Å; L98-A418 HydrophobicContact CD1-CB 4.06Å; L103-A418 HydrophobicContact CD1-CB 4.06Å; V414-A418 PolarHBondContact O-N 3.39Å; Y415-A418 PolarHBondContact O-N 2.69Å; A418-A420 VanDerWaalsContact C-N 3.33Å; A418-A420 PolarHBondContact O-N 2.03Å; A418-L421 PolarHBondContact O-N 2.71Å; A418-H422 WeakPolarHBondContact O-CB 3.03Å; A418-H422 PolarHBondContact O-N 2.98Å
419	H	96.6	Very high	95	Very high	45 Å²	45	22.7 Å²	22.7	21%	0.208	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-37.6	174.1	-79.8	-68.5	0	0	0	112.3	Y415 H422 N423 F456	Y415-H419 WeakPolarHBondContact O-CB 3.35Å; Y415-H419 PolarHBondContact O-CD2 2.8Å; Y415-H419 PolarHBondContact O-N 3.01Å; H419-H422 PolarHBondContact O-N 2.8Å; H419-N423 WeakPolarHBondContact O-CB 2.97Å; H419-N423 PolarHBondContact O-N 2.97Å; H419-N423 PolarHBondContact O-ND2 2.85Å; H419-N423 VanDerWaalsContact O-ND2 3.15Å; H419-F456 HydrophobicContact CB-CD1 4.33Å; H419-F456 AromaticContact CD2-CD1 3.53Å; H419-F456 AromaticContact CD2-CD2 3.65Å; H419-F456 AromaticContact CD2-CE1 3.97Å; H419-F456 AromaticContact CD2-CG 3.37Å; H419-F456 WeakPolarHBondContact CD2-CG 3.28Å; H419-F456 AromaticContact NE2-CD2 3.67Å; H419-F456 AromaticContact NE2-CG 3.58Å
420	A	96.3	Very high	94.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.2	-47.6	174.3	0	0	0	0	0	111.5	A416 M417 A418 H422 N423 M424 L447 I451	A416-A420 VanDerWaalsContact O-CB 3.3Å; A416-A420 WeakPolarHBondContact O-CB 3.41Å; A416-A420 PolarHBondContact O-N 3.12Å; M417-A420 PolarHBondContact O-N 2.99Å; A418-A420 VanDerWaalsContact C-N 3.33Å; A418-A420 PolarHBondContact O-N 2.03Å; A420-H422 VanDerWaalsContact C-N 3.31Å; A420-H422 PolarHBondContact O-N 2.92Å; A420-N423 PolarHBondContact O-N 3.48Å; A420-M424 VanDerWaalsContact O-CB 3.31Å; A420-M424 WeakPolarHBondContact O-CB 3.24Å; A420-M424 PolarHBondContact O-N 3.49Å; A420-L447 HydrophobicContact CB-CD1 4.32Å; A420-I451 HydrophobicContact CB-CB 4.31Å; A420-I451 HydrophobicContact CB-CG1 3.6Å
421	L	94.8	Very high	93.8	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-38.2	175.7	-70.6	171.2	0	0	0	111.9	L51 L98 L103 M417 A418 M424 H425 M439 L447	L51-L421 HydrophobicContact CD1-CD1 4.08Å; L51-L421 HydrophobicContact CD1-CD2 4.18Å; L98-L421 HydrophobicContact CD1-CB 4.3Å; L98-L421 HydrophobicContact CD2-CB 4.02Å; L103-L421 HydrophobicContact CD2-CD1 3.88Å; M417-L421 HydrophobicContact CG-CD1 4.21Å; M417-L421 WeakPolarHBondContact O-CB 3.19Å; M417-L421 VanDerWaalsContact O-CG 3.31Å; M417-L421 WeakPolarHBondContact O-CG 3.24Å; M417-L421 PolarHBondContact O-N 3.45Å; A418-L421 PolarHBondContact O-N 2.71Å; L421-M424 HydrophobicContact CD2-CE 3.62Å; L421-M424 PolarHBondContact O-N 3.46Å; L421-H425 WeakPolarHBondContact O-CB 3.04Å; L421-H425 PolarHBondContact O-N 2.91Å; L421-M439 HydrophobicContact CD2-CE 4.29Å; L421-L447 HydrophobicContact CD2-CD1 3.73Å; L421-L447 HydrophobicContact CD2-CD2 4.3Å; L421-L447 HydrophobicContact CG-CD1 4.26Å
422	H	94.8	Very high	93.3	Very high	40 Å²	40	38 Å²	38	19%	0.185	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-46.3	178.1	-179.6	80.3	0	0	0	112.1	Q96 L97 L98 A418 H419 A420 M424 H425 R426	Q96-H422 PolarHBondContact O-CE1 3.4Å; Q96-H422 VanDerWaalsContact O-CE1 3.26Å; L97-H422 HydrophobicContact CD1-CB 3.68Å; L98-H422 HydrophobicContact CD2-CB 3.94Å; L98-H422 HydrophobicContact CG-CB 4.12Å; L98-H422 PolarHBondContact N-ND1 2.03Å; A418-H422 WeakPolarHBondContact O-CB 3.03Å; A418-H422 PolarHBondContact O-N 2.98Å; H419-H422 PolarHBondContact O-N 2.8Å; A420-H422 VanDerWaalsContact C-N 3.31Å; A420-H422 PolarHBondContact O-N 2.92Å; H422-M424 VanDerWaalsContact C-N 3.32Å; H422-M424 PolarHBondContact O-N 2.82Å; H422-H425 PolarHBondContact O-N 2.82Å; H422-R426 PolarHBondContact O-N 3.28Å
423	N	94.9	Very high	92.7	Very high	36 Å²	36	42.3 Å²	42.3	19%	0.193	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-40.6	175.5	-73.5	-37.6	0	0	0	111.2	H419 A420 R426 D427 Y450	H419-N423 WeakPolarHBondContact O-CB 2.97Å; H419-N423 PolarHBondContact O-N 2.97Å; H419-N423 PolarHBondContact O-ND2 2.85Å; H419-N423 VanDerWaalsContact O-ND2 3.15Å; A420-N423 PolarHBondContact O-N 3.48Å; N423-R426 PolarHBondContact O-N 3.31Å; N423-R426 PolarHBondContact OD1-NH2 3.05Å; N423-R426 VanDerWaalsContact OD1-NH2 3.08Å; N423-D427 PolarHBondContact O-N 2.85Å; N423-D427 VanDerWaalsContact O-N 3.09Å; N423-Y450 HydrophobicContact CB-CD1 3.94Å; N423-Y450 HydrophobicContact CB-CE1 4.37Å
424	M	93.9	Very high	92.2	Very high	7 Å²	7	42.7 Å²	42.7	3%	0.034	22%	0.221	C	C	.	.	H	α-helix	trans	-62.3	-42.9	174.2	-175.1	171	77.2	0	0	112	A420 L421 H422 D427 L428 M439 T442 L447 Y450	A420-M424 VanDerWaalsContact O-CB 3.31Å; A420-M424 WeakPolarHBondContact O-CB 3.24Å; A420-M424 PolarHBondContact O-N 3.49Å; L421-M424 HydrophobicContact CD2-CE 3.62Å; L421-M424 PolarHBondContact O-N 3.46Å; H422-M424 VanDerWaalsContact C-N 3.32Å; H422-M424 PolarHBondContact O-N 2.82Å; M424-D427 PolarHBondContact O-N 3.4Å; M424-L428 HydrophobicContact CG-CD1 3.69Å; M424-L428 HydrophobicContact CG-CG 4.34Å; M424-L428 WeakPolarHBondContact O-CB 3.29Å; M424-L428 WeakPolarHBondContact O-CG 3.48Å; M424-L428 PolarHBondContact O-N 2.88Å; M424-M439 HydrophobicContact CE-CE 3.81Å; M424-M439 HydrophobicContact CE-CG 3.95Å; M424-M439 HydrophobicContact CE-SD 4.39Å; M424-M439 HydrophobicContact CG-CG 4.49Å; M424-T442 HydrophobicContact SD-CG2 3.89Å; M424-L447 HydrophobicContact CE-CD1 4.09Å; M424-L447 HydrophobicContact SD-CB 4.33Å; M424-L447 HydrophobicContact SD-CD1 4.1Å; M424-Y450 HydrophobicContact CB-CD1 4.29Å; M424-Y450 HydrophobicContact CB-CD2 3.7Å; M424-Y450 HydrophobicContact CB-CE1 4.42Å; M424-Y450 HydrophobicContact CB-CE2 3.86Å; M424-Y450 HydrophobicContact CB-CG 3.94Å; M424-Y450 HydrophobicContact CG-CD2 3.84Å; M424-Y450 HydrophobicContact CG-CE2 3.74Å; M424-Y450 HydrophobicContact SD-CD2 4.1Å; M424-Y450 HydrophobicContact SD-CE2 4.39Å
425	H	92.9	Very high	91.7	Very high	23 Å²	23	44.4 Å²	44.4	11%	0.106	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-44	175.5	-179.9	-85.2	0	0	0	111.6	I101 L421 H422 D427 C429 H432 G434 M439	I101-H425 VanDerWaalsContact CD1-CD2 3.49Å; I101-H425 WeakPolarHBondContact CD1-CD2 3.47Å; L421-H425 WeakPolarHBondContact O-CB 3.04Å; L421-H425 PolarHBondContact O-N 2.91Å; H422-H425 PolarHBondContact O-N 2.82Å; H425-D427 VanDerWaalsContact C-N 3.27Å; H425-D427 PolarHBondContact O-N 2.94Å; H425-C429 CarbonylContact O-C 3.48Å; H425-C429 VanDerWaalsContact O-CA 3.23Å; H425-C429 WeakPolarHBondContact O-CA 3.45Å; H425-C429 VanDerWaalsContact O-CB 3.28Å; H425-C429 WeakPolarHBondContact O-CB 3.34Å; H425-C429 PolarHBondContact O-N 3.05Å; H425-H432 PolarHBondContact CE1-O 3.13Å; H425-H432 PolarHBondContact NE2-O 2.04Å; H425-G434 PolarHBondContact NE2-O 3.25Å; H425-G434 VanDerWaalsContact NE2-O 3.16Å; H425-M439 HydrophobicContact CB-SD 3.72Å
426	R	92.1	Very high	91.4	Very high	139 Å²	139	43.1 Å²	43.1	53%	0.525	23%	0.227	S	C	.	.	H	α-helix	trans	-61.3	-37.8	178.8	-171.4	178.8	65.6	-146.5	-7.4	112.1	H422 N423	H422-R426 PolarHBondContact O-N 3.28Å; N423-R426 PolarHBondContact O-N 3.31Å; N423-R426 PolarHBondContact OD1-NH2 3.05Å; N423-R426 VanDerWaalsContact OD1-NH2 3.08Å
427	D	92.6	Very high	90.8	Very high	91 Å²	91	47.4 Å²	47.4	49%	0.487	26%	0.255	S	S	.	.	H	α-helix	trans	-79.8	-38.8	-177.9	-70.4	1.5	0	0	0	112.8	N423 M424 H425 Y450	N423-D427 PolarHBondContact O-N 2.85Å; N423-D427 VanDerWaalsContact O-N 3.09Å; M424-D427 PolarHBondContact O-N 3.4Å; H425-D427 VanDerWaalsContact C-N 3.27Å; H425-D427 PolarHBondContact O-N 2.94Å; D427-Y450 WeakPolarHBondContact CB-OH 3.4Å; D427-Y450 WeakPolarHBondContact OD2-CE1 3.47Å; D427-Y450 PolarHBondContact OD2-OH 2.92Å
428	L	90.8	Very high	90.2	Very high	35 Å²	35	52.8 Å²	52.8	18%	0.183	28%	0.28	C	S	.	.	H	α-helix	trans	-93.2	-32.2	-176	-63	-177.8	0	0	0	113.6	M424 P430 Q438 M439 M446	M424-L428 HydrophobicContact CG-CD1 3.69Å; M424-L428 HydrophobicContact CG-CG 4.34Å; M424-L428 WeakPolarHBondContact O-CB 3.29Å; M424-L428 WeakPolarHBondContact O-CG 3.48Å; M424-L428 PolarHBondContact O-N 2.88Å; L428-P430 WeakPolarHBondContact O-CD 3.29Å; L428-Q438 PolarHBondContact O-OE1 3.26Å; L428-M439 HydrophobicContact CD1-CG 4.47Å; L428-M446 HydrophobicContact CD1-CE 4.13Å; L428-M446 HydrophobicContact CD2-CE 3.75Å; L428-M446 HydrophobicContact CG-CE 4.29Å
429	C	90.8	Very high	89.8	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.034	28%	0.284	C	S	.	.			trans	-124.1	48.8	-170.8	-46.1	0	0	0	0	112.4	H425 N431 H432 C436	H425-C429 CarbonylContact O-C 3.48Å; H425-C429 VanDerWaalsContact O-CA 3.23Å; H425-C429 WeakPolarHBondContact O-CA 3.45Å; H425-C429 VanDerWaalsContact O-CB 3.28Å; H425-C429 WeakPolarHBondContact O-CB 3.34Å; H425-C429 PolarHBondContact O-N 3.05Å; C429-N431 PolarHBondContact O-N 3.13Å; C429-H432 HydrophobicContact CB-CB 4.11Å; C429-H432 PolarHBondContact O-N 3.23Å; C429-C436 HydrophobicContact CB-CB 3.78Å; C429-C436 WeakPolarHBondContact CB-SG 3.37Å; C429-C436 WeakPolarHBondContact SG-CB 3.45Å; C429-C436 CovalentContact SG-SG 2.04Å; C429-C436 PolarHBondContact SG-SG 3.38Å
430	P	83.1	Confident	89	Confident	91 Å²	91	57.9 Å²	57.9	59%	0.591	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.1	-168	23.8	-34.6	0	0	0	115.7	L428	L428-P430 WeakPolarHBondContact O-CD 3.29Å
431	N	82.9	Confident	87.8	Confident	163 Å²	163	62.4 Å²	62.4	87%	0.872	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.8	19.3	179.8	-65.7	-49.7	0	0	0	113.4	C429	C429-N431 PolarHBondContact O-N 3.13Å
432	H	85.1	Confident	86.8	Confident	84 Å²	84	63.7 Å²	63.7	39%	0.389	34%	0.344	S	S	.	.			trans	-108.5	125	-179.6	-167.6	-78.7	0	0	0	109.5	H425 C429 G434 C436	H425-H432 PolarHBondContact CE1-O 3.13Å; H425-H432 PolarHBondContact NE2-O 2.04Å; C429-H432 HydrophobicContact CB-CB 4.11Å; C429-H432 PolarHBondContact O-N 3.23Å; H432-G434 PolarHBondContact ND1-O 3.38Å; H432-C436 HydrophobicContact CB-CB 3.95Å
433	P	83.6	Confident	86.1	Confident	93 Å²	93	65 Å²	65	60%	0.604	35%	0.353	S	S	*	.	S	Bend	trans	-75.2	132.1	170.6	30.4	-31.5	0	0	0	109.6
434	G	86.4	Confident	85.7	Confident	9 Å²	9	64 Å²	64	9%	0.093	35%	0.351	C	S	.	.	S	Bend	trans	74.9	-174.7	-179.7	0	0	0	0	0	113.7	N100 H425 H432 C436	N100-G434 WeakPolarHBondContact O-CA 3.46Å; H425-G434 PolarHBondContact NE2-O 3.25Å; H425-G434 VanDerWaalsContact NE2-O 3.16Å; H432-G434 PolarHBondContact ND1-O 3.38Å; G434-C436 PolarHBondContact O-N 3.25Å
435	V	87.9	Confident	85.6	Confident	35 Å²	35	68.8 Å²	68.8	21%	0.212	37%	0.371	C	S	.	.			trans	-65.4	120.8	-175.9	-175.9	0	0	0	0	110.9	H50 L51 I101 M439	H50-V435 HydrophobicContact CB-CG2 3.89Å; L51-V435 HydrophobicContact CD1-CG2 4.2Å; L51-V435 HydrophobicContact CD2-CG1 4.15Å; L51-V435 HydrophobicContact CD2-CG2 3.93Å; L51-V435 HydrophobicContact CG-CG2 3.88Å; I101-V435 HydrophobicContact CD1-CG2 4.14Å; I101-V435 HydrophobicContact CG1-CG2 4.11Å; I101-V435 HydrophobicContact CG2-CG2 3.98Å; V435-M439 HydrophobicContact CG1-CB 3.96Å; V435-M439 HydrophobicContact CG1-CE 4.48Å
436	C	88.9	Confident	85.6	Confident	7 Å²	7	71 Å²	71	5%	0.047	38%	0.383	C	S	.	.			trans	-90.6	159.2	177.6	83.8	0	0	0	0	112.5	C429 H432 G434 Q438 M439 E440	C429-C436 HydrophobicContact CB-CB 3.78Å; C429-C436 WeakPolarHBondContact CB-SG 3.37Å; C429-C436 WeakPolarHBondContact SG-CB 3.45Å; C429-C436 CovalentContact SG-SG 2.04Å; C429-C436 PolarHBondContact SG-SG 3.38Å; H432-C436 HydrophobicContact CB-CB 3.95Å; G434-C436 PolarHBondContact O-N 3.25Å; C436-Q438 PolarHBondContact O-N 3.03Å; C436-Q438 VanDerWaalsContact O-N 3.12Å; C436-M439 WeakPolarHBondContact O-CB 3.5Å; C436-M439 PolarHBondContact O-N 2.78Å; C436-E440 PolarHBondContact O-N 3.28Å; C436-E440 VanDerWaalsContact O-N 3.13Å
437	P	85.6	Confident	85.7	Confident	91 Å²	91	64.7 Å²	64.7	59%	0.591	36%	0.359	S	S	*	.	H	α-helix	trans	-58.2	-30	-177.5	-26.7	34.9	0	0	0	114.2	E440 S441	P437-E440 PolarHBondContact O-N 2.88Å; P437-S441 WeakPolarHBondContact O-CB 3.41Å; P437-S441 PolarHBondContact O-N 2.98Å; P437-S441 PolarHBondContact O-OG 2.8Å; P437-S441 VanDerWaalsContact O-OG 3.08Å
438	Q	84.3	Confident	85.8	Confident	112 Å²	112	61.2 Å²	61.2	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-64.4	-43.6	175.3	-69.1	-173.9	-28	0	0	111.2	L428 C436 S441 T442	L428-Q438 PolarHBondContact O-OE1 3.26Å; C436-Q438 PolarHBondContact O-N 3.03Å; C436-Q438 VanDerWaalsContact O-N 3.12Å; Q438-S441 PolarHBondContact O-N 2.94Å; Q438-S441 PolarHBondContact O-OG 2.97Å; Q438-T442 PolarHBondContact O-N 2.86Å; Q438-T442 VanDerWaalsContact O-N 3.12Å; Q438-T442 PolarHBondContact O-OG1 3.4Å
439	M	86.8	Confident	85.9	Confident	14 Å²	14	66.9 Å²	66.9	7%	0.069	36%	0.364	C	S	.	.	H	α-helix	trans	-61.9	-41.6	172.3	-93.1	-173.7	67.5	0	0	112.2	L51 L421 M424 H425 L428 V435 C436 S441 T442	L51-M439 HydrophobicContact CD1-CE 3.64Å; L421-M439 HydrophobicContact CD2-CE 4.29Å; M424-M439 HydrophobicContact CE-CE 3.81Å; M424-M439 HydrophobicContact CE-CG 3.95Å; M424-M439 HydrophobicContact CE-SD 4.39Å; M424-M439 HydrophobicContact CG-CG 4.49Å; H425-M439 HydrophobicContact CB-SD 3.72Å; L428-M439 HydrophobicContact CD1-CG 4.47Å; V435-M439 HydrophobicContact CG1-CB 3.96Å; V435-M439 HydrophobicContact CG1-CE 4.48Å; C436-M439 WeakPolarHBondContact O-CB 3.5Å; C436-M439 PolarHBondContact O-N 2.78Å; M439-S441 VanDerWaalsContact C-N 3.3Å; M439-S441 PolarHBondContact O-N 3.32Å; M439-T442 WeakPolarHBondContact CA-OG1 3.32Å; M439-T442 WeakPolarHBondContact O-CB 3.49Å; M439-T442 PolarHBondContact O-N 2.75Å; M439-T442 PolarHBondContact O-OG1 3.39Å
440	E	79.7	Confident	86.2	Confident	138 Å²	138	68.6 Å²	68.6	65%	0.645	37%	0.37	S	S	*	.	H	α-helix	trans	-65.7	-34.5	-178.3	-163.8	171.3	-165.7	0	0	112.6	K151 C436 P437	K151-E440 PolarHBondContact NZ-O 3.16Å; C436-E440 PolarHBondContact O-N 3.28Å; C436-E440 VanDerWaalsContact O-N 3.13Å; P437-E440 PolarHBondContact O-N 2.88Å
441	S	70.9	Confident	86.8	Confident	96 Å²	96	64.3 Å²	64.3	67%	0.671	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-4	175.7	70.5	0	0	0	0	115.1	P437 Q438 M439	P437-S441 WeakPolarHBondContact O-CB 3.41Å; P437-S441 PolarHBondContact O-N 2.98Å; P437-S441 PolarHBondContact O-OG 2.8Å; P437-S441 VanDerWaalsContact O-OG 3.08Å; Q438-S441 PolarHBondContact O-N 2.94Å; Q438-S441 PolarHBondContact O-OG 2.97Å; M439-S441 VanDerWaalsContact C-N 3.3Å; M439-S441 PolarHBondContact O-N 3.32Å
442	T	74.6	Confident	87.4	Confident	29 Å²	29	58.6 Å²	58.6	18%	0.178	31%	0.308	C	S	.	.			trans	-68.7	133.2	-173.7	-66.4	0	0	0	0	111.9	M424 Q438 M439 M446	M424-T442 HydrophobicContact SD-CG2 3.89Å; Q438-T442 PolarHBondContact O-N 2.86Å; Q438-T442 VanDerWaalsContact O-N 3.12Å; Q438-T442 PolarHBondContact O-OG1 3.4Å; M439-T442 WeakPolarHBondContact CA-OG1 3.32Å; M439-T442 WeakPolarHBondContact O-CB 3.49Å; M439-T442 PolarHBondContact O-N 2.75Å; M439-T442 PolarHBondContact O-OG1 3.39Å; T442-M446 HydrophobicContact CG2-CB 3.66Å; T442-M446 HydrophobicContact CG2-CG 3.96Å; T442-M446 HydrophobicContact CG2-SD 4.1Å
443	D	80.2	Confident	87.8	Confident	67 Å²	67	61.5 Å²	61.5	36%	0.358	33%	0.327	S	S	.	.			trans	-71.7	138.8	171.6	-179.6	-2.4	0	0	0	109.8	Q175 K445 M446	Q175-D443 WeakPolarHBondContact CB-OD1 3.48Å; Q175-D443 VanDerWaalsContact NE2-CG 3.3Å; Q175-D443 PolarHBondContact NE2-OD1 2.88Å; Q175-D443 PolarHBondContact NE2-OD2 3.39Å; Q175-D443 PolarHBondContact OE1-OD1 2.95Å; D443-K445 PolarHBondContact O-N 3.34Å; D443-K445 PolarHBondContact OD1-N 3.33Å; D443-M446 WeakPolarHBondContact O-CB 3.47Å; D443-M446 PolarHBondContact O-N 2.98Å
444	G	87.2	Confident	88.3	Confident	15 Å²	15	57.1 Å²	57.1	16%	0.155	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-14.5	179.5	0	0	0	0	0	114.2	Q175 M446 L447 L448	Q175-G444 WeakPolarHBondContact O-CA 3.42Å; G444-M446 VanDerWaalsContact C-N 3.26Å; G444-M446 PolarHBondContact O-N 3.21Å; G444-L447 PolarHBondContact O-N 3Å; G444-L448 WeakPolarHBondContact O-CB 3.47Å; G444-L448 PolarHBondContact O-N 3.09Å
445	K	91.3	Very high	88.7	Confident	107 Å²	107	60.7 Å²	60.7	47%	0.465	32%	0.322	S	S	.	.	H	α-helix	trans	-60.2	-35.8	165.7	-75.5	-175.6	175.7	171.8	0	113	Q175 F196 D443 K449	Q175-K445 VanDerWaalsContact NE2-CE 3.31Å; F196-K445 HydrophobicContact CE1-CB 4.48Å; F196-K445 HydrophobicContact CE1-CG 3.77Å; F196-K445 HydrophobicContact CE2-CG 4.45Å; F196-K445 HydrophobicContact CZ-CB 4.5Å; F196-K445 HydrophobicContact CZ-CD 4.29Å; F196-K445 HydrophobicContact CZ-CG 3.37Å; D443-K445 PolarHBondContact O-N 3.34Å; D443-K445 PolarHBondContact OD1-N 3.33Å; K445-K449 PolarHBondContact O-N 3.25Å
446	M	92.7	Very high	89	Confident	70 Å²	70	60 Å²	60	35%	0.345	32%	0.316	S	S	.	.	H	α-helix	trans	-74.1	-44.5	178.7	-175.9	160.1	-172.7	0	0	110.2	L428 T442 D443 G444 L448 K449 Y450	L428-M446 HydrophobicContact CD1-CE 4.13Å; L428-M446 HydrophobicContact CD2-CE 3.75Å; L428-M446 HydrophobicContact CG-CE 4.29Å; T442-M446 HydrophobicContact CG2-CB 3.66Å; T442-M446 HydrophobicContact CG2-CG 3.96Å; T442-M446 HydrophobicContact CG2-SD 4.1Å; D443-M446 WeakPolarHBondContact O-CB 3.47Å; D443-M446 PolarHBondContact O-N 2.98Å; G444-M446 VanDerWaalsContact C-N 3.26Å; G444-M446 PolarHBondContact O-N 3.21Å; M446-L448 VanDerWaalsContact C-N 3.28Å; M446-L448 PolarHBondContact O-N 3.09Å; M446-K449 WeakPolarHBondContact O-CB 3.45Å; M446-K449 PolarHBondContact O-N 3.41Å; M446-K449 VanDerWaalsContact O-N 3.1Å; M446-Y450 HydrophobicContact CE-CE2 3.98Å; M446-Y450 HydrophobicContact CG-CD2 4.37Å; M446-Y450 HydrophobicContact CG-CE2 3.97Å; M446-Y450 VanDerWaalsContact O-CD2 3.28Å; M446-Y450 WeakPolarHBondContact O-CD2 3.26Å; M446-Y450 PolarHBondContact O-N 3.21Å
447	L	93.8	Very high	89.1	Confident	7 Å²	7	65.3 Å²	65.3	4%	0.037	34%	0.344	C	S	.	.	H	α-helix	trans	-57.4	-41.8	173.8	179.7	56.1	0	0	0	111.8	V153 P177 M417 A420 L421 M424 G444 K449 Y450 I451	V153-L447 WeakPolarHBondContact O-CD2 3.39Å; P177-L447 HydrophobicContact CG-CB 4.46Å; P177-L447 HydrophobicContact CG-CD2 3.81Å; P177-L447 HydrophobicContact CG-CG 4.07Å; M417-L447 HydrophobicContact SD-CD2 4.21Å; A420-L447 HydrophobicContact CB-CD1 4.32Å; L421-L447 HydrophobicContact CD2-CD1 3.73Å; L421-L447 HydrophobicContact CD2-CD2 4.3Å; L421-L447 HydrophobicContact CG-CD1 4.26Å; M424-L447 HydrophobicContact CE-CD1 4.09Å; M424-L447 HydrophobicContact SD-CB 4.33Å; M424-L447 HydrophobicContact SD-CD1 4.1Å; G444-L447 PolarHBondContact O-N 3Å; L447-K449 VanDerWaalsContact C-N 3.28Å; L447-K449 PolarHBondContact O-N 3.06Å; L447-Y450 WeakPolarHBondContact O-CB 3.48Å; L447-Y450 PolarHBondContact O-N 3.23Å; L447-I451 HydrophobicContact CD1-CG1 4.45Å; L447-I451 HydrophobicContact CG-CD1 4.02Å; L447-I451 HydrophobicContact CG-CG1 4.44Å; L447-I451 WeakPolarHBondContact O-CG1 3.47Å; L447-I451 PolarHBondContact O-N 3.33Å
448	L	94.6	Very high	89.1	Confident	18 Å²	18	61.4 Å²	61.4	9%	0.094	32%	0.32	C	S	.	.	H	α-helix	trans	-56.7	-38.9	175.9	-179.7	71	0	0	0	113	P177 D195 F196 G444 M446 Y450 I451 R452	P177-L448 HydrophobicContact CB-CD1 4.28Å; D195-L448 WeakPolarHBondContact O-CD2 3.29Å; F196-L448 HydrophobicContact CD1-CD2 4.28Å; G444-L448 WeakPolarHBondContact O-CB 3.47Å; G444-L448 PolarHBondContact O-N 3.09Å; M446-L448 VanDerWaalsContact C-N 3.28Å; M446-L448 PolarHBondContact O-N 3.09Å; L448-Y450 VanDerWaalsContact C-N 3.31Å; L448-Y450 PolarHBondContact O-N 3.23Å; L448-I451 PolarHBondContact O-N 2.94Å; L448-R452 HydrophobicContact CD1-CG 4.46Å; L448-R452 PolarHBondContact O-N 3.11Å
449	K	94.3	Very high	88.9	Confident	154 Å²	154	59.1 Å²	59.1	67%	0.67	32%	0.317	S	S	*	.	H	α-helix	trans	-63.4	-40.1	176.5	-68.7	176.1	-178.4	178.1	0	111.5	K445 M446 L447 N453	K445-K449 PolarHBondContact O-N 3.25Å; M446-K449 WeakPolarHBondContact O-CB 3.45Å; M446-K449 PolarHBondContact O-N 3.41Å; M446-K449 VanDerWaalsContact O-N 3.1Å; L447-K449 VanDerWaalsContact C-N 3.28Å; L447-K449 PolarHBondContact O-N 3.06Å; K449-N453 WeakPolarHBondContact O-CB 3.39Å; K449-N453 PolarHBondContact O-N 3.35Å; K449-N453 VanDerWaalsContact O-N 3.14Å
450	Y	95.8	Very high	88.5	Confident	40 Å²	40	59.8 Å²	59.8	16%	0.157	32%	0.324	C	S	.	.	H	α-helix	trans	-67.3	-37.8	175	-74	-74.2	0	0	0	112.1	N423 M424 D427 M446 L447 L448 N453 A454	N423-Y450 HydrophobicContact CB-CD1 3.94Å; N423-Y450 HydrophobicContact CB-CE1 4.37Å; M424-Y450 HydrophobicContact CB-CD1 4.29Å; M424-Y450 HydrophobicContact CB-CD2 3.7Å; M424-Y450 HydrophobicContact CB-CE1 4.42Å; M424-Y450 HydrophobicContact CB-CE2 3.86Å; M424-Y450 HydrophobicContact CB-CG 3.94Å; M424-Y450 HydrophobicContact CG-CD2 3.84Å; M424-Y450 HydrophobicContact CG-CE2 3.74Å; M424-Y450 HydrophobicContact SD-CD2 4.1Å; M424-Y450 HydrophobicContact SD-CE2 4.39Å; D427-Y450 WeakPolarHBondContact CB-OH 3.4Å; D427-Y450 WeakPolarHBondContact OD2-CE1 3.47Å; D427-Y450 PolarHBondContact OD2-OH 2.92Å; M446-Y450 HydrophobicContact CE-CE2 3.98Å; M446-Y450 HydrophobicContact CG-CD2 4.37Å; M446-Y450 HydrophobicContact CG-CE2 3.97Å; M446-Y450 VanDerWaalsContact O-CD2 3.28Å; M446-Y450 WeakPolarHBondContact O-CD2 3.26Å; M446-Y450 PolarHBondContact O-N 3.21Å; L447-Y450 WeakPolarHBondContact O-CB 3.48Å; L447-Y450 PolarHBondContact O-N 3.23Å; L448-Y450 VanDerWaalsContact C-N 3.31Å; L448-Y450 PolarHBondContact O-N 3.23Å; Y450-N453 PolarHBondContact O-N 3.05Å; Y450-A454 PolarHBondContact O-N 3.01Å; Y450-A454 VanDerWaalsContact O-N 3.09Å
451	I	95.8	Very high	88.6	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-51.8	174.3	-67.9	167.3	0	0	0	110.4	P177 I179 M417 A420 L447 L448 N453 A454 F466	P177-I451 HydrophobicContact CB-CD1 3.68Å; P177-I451 HydrophobicContact CG-CD1 3.84Å; I179-I451 HydrophobicContact CD1-CD1 4.22Å; I179-I451 HydrophobicContact CD1-CG1 4.31Å; I179-I451 HydrophobicContact CD1-CG2 3.61Å; I179-I451 HydrophobicContact CG1-CG2 4.06Å; M417-I451 HydrophobicContact CE-CD1 3.8Å; M417-I451 HydrophobicContact SD-CD1 3.8Å; M417-I451 HydrophobicContact SD-CG1 4.29Å; A420-I451 HydrophobicContact CB-CB 4.31Å; A420-I451 HydrophobicContact CB-CG1 3.6Å; L447-I451 HydrophobicContact CD1-CG1 4.45Å; L447-I451 HydrophobicContact CG-CD1 4.02Å; L447-I451 HydrophobicContact CG-CG1 4.44Å; L447-I451 WeakPolarHBondContact O-CG1 3.47Å; L447-I451 PolarHBondContact O-N 3.33Å; L448-I451 PolarHBondContact O-N 2.94Å; I451-N453 PolarHBondContact O-N 3.05Å; I451-A454 VanDerWaalsContact O-CB 3.28Å; I451-A454 WeakPolarHBondContact O-CB 2.94Å; I451-A454 PolarHBondContact O-N 3.15Å; I451-F466 HydrophobicContact CG2-CE2 4.35Å; I451-F466 HydrophobicContact CG2-CZ 4.5Å; I451-F466 WeakPolarHBondContact O-CD2 3.44Å; I451-F466 WeakPolarHBondContact O-CE2 3.44Å
452	R	94.9	Very high	89.2	Confident	43 Å²	43	53.2 Å²	53.2	16%	0.162	30%	0.302	C	S	.	.	H	α-helix	trans	-67.7	-21.3	-177.8	-70	-174.2	176.3	175.4	2.3	113.9	D191 D195 F197 L448	D191-R452 IonicContact OD1-CZ 3.69Å; D191-R452 VanDerWaalsContact OD1-CZ 3.25Å; D191-R452 IonicContact OD1-NH1 3.78Å; D191-R452 PolarHBondContact OD1-NH1 3.46Å; D191-R452 IonicContact OD1-NH2 2.92Å; D191-R452 PolarHBondContact OD1-NH2 3.35Å; D191-R452 IonicContact OD2-NH1 2.69Å; D195-R452 PolarHBondContact O-NH2 3.06Å; D195-R452 VanDerWaalsContact O-NH2 3.08Å; F197-R452 PolarHBondContact O-NH2 2.99Å; L448-R452 HydrophobicContact CD1-CG 4.46Å; L448-R452 PolarHBondContact O-N 3.11Å
453	N	95.4	Very high	89.9	Confident	145 Å²	145	54.1 Å²	54.1	78%	0.775	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-0.9	173.4	-95.6	13.5	0	0	0	114	K449 Y450 I451 S455	K449-N453 WeakPolarHBondContact O-CB 3.39Å; K449-N453 PolarHBondContact O-N 3.35Å; K449-N453 VanDerWaalsContact O-N 3.14Å; Y450-N453 PolarHBondContact O-N 3.05Å; I451-N453 PolarHBondContact O-N 3.05Å; N453-S455 PolarHBondContact O-N 3.49Å
454	A	93.4	Very high	90.5	Very high	2 Å²	2	51.5 Å²	51.5	2%	0.017	30%	0.296	C	S	.	.			trans	-65.7	132.6	178.9	0	0	0	0	0	110.4	Y450 I451	Y450-A454 PolarHBondContact O-N 3.01Å; Y450-A454 VanDerWaalsContact O-N 3.09Å; I451-A454 VanDerWaalsContact O-CB 3.28Å; I451-A454 WeakPolarHBondContact O-CB 2.94Å; I451-A454 PolarHBondContact O-N 3.15Å
455	S	94.7	Very high	90.9	Very high	84 Å²	84	53.1 Å²	53.1	59%	0.587	30%	0.303	S	S	*	.			trans	-143.8	121.2	174.3	-178.5	0	0	0	0	109	N453 V464	N453-S455 PolarHBondContact O-N 3.49Å; S455-V464 WeakPolarHBondContact CA-O 3.31Å
456	F	94	Very high	91	Very high	19 Å²	19	49.1 Å²	49.1	8%	0.083	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	166.7	179.8	63.6	-79.5	0	0	0	109.7	Y415 A416 H419 S463 V464	Y415-F456 HydrophobicContact CG-CE2 4.48Å; A416-F456 HydrophobicContact CB-CE1 3.86Å; A416-F456 HydrophobicContact CB-CZ 4.1Å; H419-F456 HydrophobicContact CB-CD1 4.33Å; H419-F456 AromaticContact CD2-CD1 3.53Å; H419-F456 AromaticContact CD2-CD2 3.65Å; H419-F456 AromaticContact CD2-CE1 3.97Å; H419-F456 AromaticContact CD2-CG 3.37Å; H419-F456 WeakPolarHBondContact CD2-CG 3.28Å; H419-F456 AromaticContact NE2-CD2 3.67Å; H419-F456 AromaticContact NE2-CG 3.58Å; F456-S463 WeakPolarHBondContact O-CA 3.34Å; F456-V464 HydrophobicContact CD1-CB 4.27Å; F456-V464 HydrophobicContact CE1-CB 3.74Å; F456-V464 HydrophobicContact CE1-CG1 3.79Å; F456-V464 HydrophobicContact CE1-CG2 4.42Å; F456-V464 HydrophobicContact CE2-CB 4.12Å; F456-V464 HydrophobicContact CE2-CG2 3.94Å; F456-V464 HydrophobicContact CZ-CB 3.66Å; F456-V464 HydrophobicContact CZ-CG1 3.8Å; F456-V464 HydrophobicContact CZ-CG2 3.83Å; F456-V464 PolarHBondContact N-O 2.9Å; F456-V464 PolarHBondContact O-N 2.96Å
457	N	91.9	Very high	91	Very high	119 Å²	119	48.7 Å²	48.7	64%	0.636	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	120.8	169.7	-72.8	-16.2	0	0	0	108.3
458	G	84.8	Confident	90.8	Very high	9 Å²	9	57.5 Å²	57.5	9%	0.093	32%	0.323	C	S	.	.			trans	-68.4	170.8	176.2	0	0	0	0	0	112	D412 A460 G461 T462	D412-G458 WeakPolarHBondContact OD1-CA 3.27Å; G458-A460 PolarHBondContact O-N 3.11Å; G458-A460 VanDerWaalsContact O-N 3.07Å; G458-G461 PolarHBondContact O-N 2.89Å; G458-T462 PolarHBondContact N-O 2.89Å
459	S	79.3	Confident	90.6	Very high	65 Å²	65	60.1 Å²	60.1	46%	0.455	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.3	-177.8	-51.6	0	0	0	0	113.6	G461	S459-G461 VanDerWaalsContact C-N 3.35Å
460	A	79.5	Confident	90.5	Very high	27 Å²	27	52.8 Å²	52.8	22%	0.223	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	3.7	174.4	0	0	0	0	0	114.5	I343 Q408 G458 T462	I343-A460 HydrophobicContact CD1-CB 3.74Å; Q408-A460 HydrophobicContact CG-CB 3.85Å; G458-A460 PolarHBondContact O-N 3.11Å; G458-A460 VanDerWaalsContact O-N 3.07Å; A460-T462 PolarHBondContact O-N 2.84Å
461	G	81.2	Confident	90.4	Very high	61 Å²	61	51 Å²	51	63%	0.629	30%	0.298	S	S	*	.	S	Bend	trans	76.8	3.3	-176.1	0	0	0	0	0	114.7	G458 S459	G458-G461 PolarHBondContact O-N 2.89Å; S459-G461 VanDerWaalsContact C-N 3.35Å
462	T	83.9	Confident	90.3	Very high	36 Å²	36	51.5 Å²	51.5	22%	0.221	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-87.2	132.5	174.2	50.7	0	0	0	0	111.2	Q408 G458 A460 V464	Q408-T462 PolarHBondContact NE2-OG1 3.5Å; G458-T462 PolarHBondContact N-O 2.89Å; A460-T462 PolarHBondContact O-N 2.84Å; T462-V464 PolarHBondContact O-N 3.41Å
463	S	89.6	Confident	90.1	Very high	48 Å²	48	52.2 Å²	52.2	34%	0.336	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.6	174.6	-175.2	0	0	0	0	111.1	F456	F456-S463 WeakPolarHBondContact O-CA 3.34Å
464	V	93	Very high	89.8	Confident	12 Å²	12	45.5 Å²	45.5	7%	0.073	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	117.4	176.4	-178.3	0	0	0	0	108.3	V200 D412 S455 F456 T462	V200-V464 HydrophobicContact CG1-CG1 4.11Å; D412-V464 HydrophobicContact CB-CG2 3.93Å; S455-V464 WeakPolarHBondContact CA-O 3.31Å; F456-V464 HydrophobicContact CD1-CB 4.27Å; F456-V464 HydrophobicContact CE1-CB 3.74Å; F456-V464 HydrophobicContact CE1-CG1 3.79Å; F456-V464 HydrophobicContact CE1-CG2 4.42Å; F456-V464 HydrophobicContact CE2-CB 4.12Å; F456-V464 HydrophobicContact CE2-CG2 3.94Å; F456-V464 HydrophobicContact CZ-CB 3.66Å; F456-V464 HydrophobicContact CZ-CG1 3.8Å; F456-V464 HydrophobicContact CZ-CG2 3.83Å; F456-V464 PolarHBondContact N-O 2.9Å; F456-V464 PolarHBondContact O-N 2.96Å; T462-V464 PolarHBondContact O-N 3.41Å
465	V	94.4	Very high	89.7	Confident	49 Å²	49	51 Å²	51	30%	0.297	30%	0.298	S	S	.	.			trans	-144.3	151.7	-179.2	-67.1	0	0	0	0	110.3	P473	V465-P473 HydrophobicContact CG2-CG 4.11Å
466	F	94.6	Very high	89.7	Confident	23 Å²	23	47.3 Å²	47.3	10%	0.101	27%	0.271	C	S	.	.			trans	-112.2	142.9	176.5	-58.8	-82	0	0	0	111.1	R199 V200 A416 I451 G470 D471	R199-F466 VanDerWaalsContact O-CE1 3.32Å; R199-F466 WeakPolarHBondContact O-CE1 3.31Å; V200-F466 HydrophobicContact CG1-CE1 4.01Å; V200-F466 HydrophobicContact CG1-CZ 3.82Å; A416-F466 HydrophobicContact CB-CE2 4.12Å; A416-F466 HydrophobicContact CB-CZ 4.05Å; I451-F466 HydrophobicContact CG2-CE2 4.35Å; I451-F466 HydrophobicContact CG2-CZ 4.5Å; I451-F466 WeakPolarHBondContact O-CD2 3.44Å; I451-F466 WeakPolarHBondContact O-CE2 3.44Å; F466-G470 WeakPolarHBondContact CD1-O 3.33Å; F466-D471 WeakPolarHBondContact CA-O 3.45Å
467	N	92	Very high	89.7	Confident	61 Å²	61	47.5 Å²	47.5	33%	0.326	27%	0.272	S	S	.	.			trans	-80.5	-177.2	168.8	75.5	9.9	0	0	0	110.9	N469 G470 D471	N467-N469 PolarHBondContact O-N 3.01Å; N467-N469 VanDerWaalsContact O-N 3.15Å; N467-N469 WeakPolarHBondContact OD1-CA 3.46Å; N467-N469 WeakPolarHBondContact OD1-CB 3.34Å; N467-N469 PolarHBondContact OD1-N 3.12Å; N467-G470 PolarHBondContact O-N 2.82Å; N467-G470 PolarHBondContact OD1-N 2Å; N467-G470 VanDerWaalsContact OD1-N 3.11Å; N467-D471 PolarHBondContact N-O 2.78Å; N467-D471 PolarHBondContact OD1-N 3.19Å; N467-D471 PolarHBondContact OD1-O 2.86Å
468	K	90.1	Very high	89.9	Confident	192 Å²	192	41.8 Å²	41.8	84%	0.835	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.4	179.8	-65.7	-177.8	-179.7	177.6	0	114.1
469	N	90.8	Very high	90.4	Very high	72 Å²	72	42.7 Å²	42.7	39%	0.385	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-1.9	-179.1	-57.4	-14.7	0	0	0	112.4	N467	N467-N469 PolarHBondContact O-N 3.01Å; N467-N469 VanDerWaalsContact O-N 3.15Å; N467-N469 WeakPolarHBondContact OD1-CA 3.46Å; N467-N469 WeakPolarHBondContact OD1-CB 3.34Å; N467-N469 PolarHBondContact OD1-N 3.12Å
470	G	91.8	Very high	91.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.222	C	C	.	.	S	Bend	trans	82.2	19.4	-175.3	0	0	0	0	0	114.5	S198 R199 F466 N467	S198-G470 CarbonylContact C-O 3.5Å; S198-G470 WeakPolarHBondContact CA-O 3.41Å; S198-G470 WeakPolarHBondContact CB-O 2.98Å; R199-G470 PolarHBondContact N-O 3.03Å; F466-G470 WeakPolarHBondContact CD1-O 3.33Å; N467-G470 PolarHBondContact O-N 2.82Å; N467-G470 PolarHBondContact OD1-N 2Å; N467-G470 VanDerWaalsContact OD1-N 3.11Å
471	D	94.3	Very high	91.7	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.021	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-100.3	149.3	177.2	-56	-59.6	0	0	0	112.7	S189 R199 P203 F466 N467	S189-D471 WeakPolarHBondContact CB-OD2 3.27Å; S189-D471 VanDerWaalsContact OG-CG 3.23Å; S189-D471 PolarHBondContact OG-OD1 3.25Å; S189-D471 VanDerWaalsContact OG-OD1 3.1Å; S189-D471 PolarHBondContact OG-OD2 3.3Å; R199-D471 IonicContact CZ-OD1 3.33Å; R199-D471 IonicContact NE-OD1 3.69Å; R199-D471 PolarHBondContact NE-OD1 2.98Å; R199-D471 IonicContact NH2-OD1 3.79Å; R199-D471 PolarHBondContact NH2-OD1 3.38Å; R199-D471 IonicContact NH2-OD2 2.82Å; P203-D471 HydrophobicContact CG-CB 4.31Å; F466-D471 WeakPolarHBondContact CA-O 3.45Å; N467-D471 PolarHBondContact N-O 2.78Å; N467-D471 PolarHBondContact OD1-N 3.19Å; N467-D471 PolarHBondContact OD1-O 2.86Å
472	A	92.7	Very high	92.2	Very high	10 Å²	10	35.8 Å²	35.8	8%	0.083	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-75.4	151.4	167.2	0	0	0	0	0	112.1	R199 V200	R199-A472 PolarHBondContact O-N 2.84Å; V200-A472 VanDerWaalsContact C-CB 3.41Å; V200-A472 VanDerWaalsContact O-CB 3.3Å; V200-A472 WeakPolarHBondContact O-CB 3.48Å
473	P	91.3	Very high	92.1	Very high	58 Å²	58	37.5 Å²	37.5	38%	0.377	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-67	146.8	176.5	27.7	-34.6	0	0	0	112.6	V465 R475	V465-P473 HydrophobicContact CG2-CG 4.11Å; P473-R475 PolarHBondContact O-N 3.01Å
474	G	88.9	Confident	91.1	Very high	4 Å²	4	37.3 Å²	37.3	4%	0.041	19%	0.19	C	C	.	.			trans	-74.9	114.4	-179.8	0	0	0	0	0	113.2
475	R	91.9	Very high	89.8	Confident	119 Å²	119	45.5 Å²	45.5	45%	0.449	23%	0.234	S	C	.	.			trans	-138	123	171.6	-62.6	179	-176.4	173.5	2.1	108.9	P338 K339 P473 W497 A498	P338-R475 WeakPolarHBondContact CA-O 3.43Å; K339-R475 HydrophobicContact CB-CB 4.1Å; K339-R475 PolarHBondContact N-O 3.16Å; P473-R475 PolarHBondContact O-N 3.01Å; R475-W497 WeakPolarHBondContact CA-O 3.43Å; R475-A498 HydrophobicContact CG-CB 4.48Å
476	Y	94	Very high	88	Confident	6 Å²	6	47.1 Å²	47.1	2%	0.024	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144.5	-176.4	-56.8	-87.4	0	0	0	111.6	P202 P203 F206 Q207 I336 L337 P338 Q496 W497	P202-Y476 HydrophobicContact CG-CE1 4.06Å; P202-Y476 HydrophobicContact CG-CE2 4.46Å; P202-Y476 WeakPolarHBondContact CG-OH 3.18Å; P203-Y476 PolarHBondContact O-OH 2.89Å; F206-Y476 HydrophobicContact CB-CE2 3.86Å; Q207-Y476 HydrophobicContact CB-CE1 4.31Å; Q207-Y476 PolarHBondContact N-OH 3.32Å; I336-Y476 HydrophobicContact CG2-CD1 3.52Å; I336-Y476 HydrophobicContact CG2-CD2 4.47Å; I336-Y476 HydrophobicContact CG2-CE1 4.32Å; I336-Y476 HydrophobicContact CG2-CG 3.61Å; L337-Y476 CarbonylContact O-C 3.57Å; L337-Y476 VanDerWaalsContact O-CA 3.24Å; L337-Y476 WeakPolarHBondContact O-CA 3.46Å; P338-Y476 HydrophobicContact CB-CD1 4.37Å; P338-Y476 HydrophobicContact CB-CE1 4.4Å; P338-Y476 HydrophobicContact CG-CD1 4.13Å; P338-Y476 HydrophobicContact CG-CE1 3.91Å; Y476-Q496 WeakPolarHBondContact O-CA 3.38Å; Y476-W497 HydrophobicContact CD2-CD2 4.45Å; Y476-W497 AromaticContact CD2-CE3 3.65Å; Y476-W497 HydrophobicContact CD2-CE3 3.65Å; Y476-W497 HydrophobicContact CD2-CZ3 4.18Å; Y476-W497 HydrophobicContact CE2-CE3 4.09Å; Y476-W497 HydrophobicContact CE2-CZ3 4.15Å; Y476-W497 PolarHBondContact N-O 2.94Å; Y476-W497 PolarHBondContact O-N 2.81Å
477	D	94	Very high	86.3	Confident	22 Å²	22	51.3 Å²	51.3	12%	0.118	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	139.5	163.2	-66.2	-49.5	0	0	0	108.4	L337 F479 Q496	L337-D477 PolarHBondContact N-O 3.24Å; L337-D477 PolarHBondContact O-N 3.11Å; D477-F479 HydrophobicContact CB-CD2 4.49Å; D477-F479 HydrophobicContact CB-CE2 3.68Å; D477-F479 HydrophobicContact CB-CZ 4.15Å; D477-Q496 WeakPolarHBondContact OD1-CG 3.21Å; D477-Q496 PolarHBondContact OD1-NE2 3Å
478	L	95.8	Very high	85.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.9	-179.1	-54.6	-179.9	0	0	0	108.9	I214 I336 V493 V494 G495 L501 L503	I214-L478 HydrophobicContact CD1-CD1 3.94Å; I214-L478 HydrophobicContact CD1-CD2 3.82Å; I214-L478 HydrophobicContact CG1-CD1 4.14Å; I336-L478 HydrophobicContact CB-CD2 4.28Å; I336-L478 HydrophobicContact CD1-CD2 4.28Å; I336-L478 HydrophobicContact CG1-CD2 3.81Å; I336-L478 HydrophobicContact CG2-CD2 4.03Å; L478-V493 CarbonylContact O-C 3.55Å; L478-V493 WeakPolarHBondContact O-CA 3.38Å; L478-V494 HydrophobicContact CB-CG2 4.12Å; L478-V494 WeakPolarHBondContact O-CG2 3.43Å; L478-V494 PolarHBondContact O-N 2.63Å; L478-G495 PolarHBondContact N-O 3.22Å; L478-G495 PolarHBondContact O-N 3.02Å; L478-L501 HydrophobicContact CD1-CD1 3.4Å; L478-L501 VanDerWaalsContact CD1-CD1 3.4Å; L478-L503 HydrophobicContact CD1-CD1 4.05Å
479	F	94.8	Very high	84.7	Confident	27 Å²	27	47.7 Å²	47.7	12%	0.118	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.9	179.4	-64.6	-95	0	0	0	110.2	V334 T335 L337 D477 Y491 K492 V493	V334-F479 CarbonylContact C-O 3.48Å; V334-F479 VanDerWaalsContact CA-O 3.29Å; V334-F479 WeakPolarHBondContact CA-O 3.28Å; T335-F479 PolarHBondContact N-O 2.85Å; T335-F479 PolarHBondContact O-N 3.23Å; L337-F479 HydrophobicContact CB-CD2 4.19Å; L337-F479 HydrophobicContact CB-CE2 3.91Å; L337-F479 HydrophobicContact CD2-CE2 3.94Å; L337-F479 HydrophobicContact CD2-CZ 4.47Å; D477-F479 HydrophobicContact CB-CD2 4.49Å; D477-F479 HydrophobicContact CB-CE2 3.68Å; D477-F479 HydrophobicContact CB-CZ 4.15Å; F479-Y491 HydrophobicContact CB-CD1 4.19Å; F479-K492 CarbonylContact C-O 3.52Å; F479-K492 VanDerWaalsContact CA-O 3.26Å; F479-K492 WeakPolarHBondContact CA-O 3.47Å; F479-V493 HydrophobicContact CD1-CG2 3.89Å; F479-V493 HydrophobicContact CE1-CB 4.48Å; F479-V493 HydrophobicContact CE1-CG2 3.37Å; F479-V493 HydrophobicContact CZ-CG2 3.93Å
480	Q	94.6	Very high	84.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	135.9	164.1	-165.3	-178.4	37.6	0	0	109.5	G332 A333 V334 Q482 K492 V494 L508 Q509	G332-Q480 PolarHBondContact O-NE2 3.47Å; G332-Q480 VanDerWaalsContact O-NE2 3.16Å; A333-Q480 VanDerWaalsContact O-CA 3.27Å; A333-Q480 WeakPolarHBondContact O-CA 3.22Å; A333-Q480 WeakPolarHBondContact O-CG 3.48Å; V334-Q480 HydrophobicContact CG2-CG 4.13Å; Q480-Q482 HydrophobicContact CB-CG 4.32Å; Q480-Q482 HydrophobicContact CG-CG 4.25Å; Q480-Q482 PolarHBondContact O-N 2.92Å; Q480-K492 PolarHBondContact N-O 2.95Å; Q480-K492 PolarHBondContact O-N 3.25Å; Q480-V494 HydrophobicContact CB-CG1 3.65Å; Q480-V494 HydrophobicContact CB-CG2 4.15Å; Q480-L508 HydrophobicContact CB-CD2 4.46Å; Q480-L508 VanDerWaalsContact OE1-CA 3.27Å; Q480-Q509 PolarHBondContact NE2-O 2.89Å; Q480-Q509 PolarHBondContact OE1-O 3.39Å
481	F	93	Very high	84.5	Confident	5 Å²	5	51.4 Å²	51.4	2%	0.022	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	114.1	173.1	-170.1	-105.1	0	0	0	109.8	I323 E327 A330 G332 A333 P489 Y491	I323-F481 HydrophobicContact CD1-CD2 3.74Å; I323-F481 HydrophobicContact CD1-CE1 4.26Å; I323-F481 HydrophobicContact CD1-CE2 3.25Å; I323-F481 HydrophobicContact CD1-CG 4.41Å; I323-F481 HydrophobicContact CD1-CZ 3.53Å; E327-F481 HydrophobicContact CB-CE1 3.94Å; E327-F481 HydrophobicContact CB-CZ 3.85Å; E327-F481 HydrophobicContact CG-CZ 4.01Å; E327-F481 WeakPolarHBondContact O-CE1 3.3Å; A330-F481 HydrophobicContact CB-CD1 3.75Å; A330-F481 HydrophobicContact CB-CE1 4.06Å; A330-F481 HydrophobicContact CB-CG 4.33Å; G332-F481 PolarHBondContact N-O 2.75Å; A333-F481 PolarHBondContact O-N 3.38Å; F481-P489 HydrophobicContact CE1-CB 4.12Å; F481-P489 HydrophobicContact CE2-CB 4.18Å; F481-P489 HydrophobicContact CZ-CB 3.56Å; F481-P489 HydrophobicContact CZ-CG 4.11Å; F481-Y491 HydrophobicContact CB-CD1 4.11Å; F481-Y491 HydrophobicContact CB-CE1 3.8Å; F481-Y491 HydrophobicContact CD2-CD1 4.05Å; F481-Y491 HydrophobicContact CD2-CD2 4.12Å; F481-Y491 AromaticContact CD2-CE1 3.82Å; F481-Y491 HydrophobicContact CD2-CE1 3.82Å; F481-Y491 AromaticContact CD2-CE2 3.88Å; F481-Y491 HydrophobicContact CD2-CE2 3.88Å; F481-Y491 HydrophobicContact CD2-CG 4.19Å; F481-Y491 AromaticContact CD2-CZ 3.71Å; F481-Y491 HydrophobicContact CE2-CE2 4.28Å; F481-Y491 HydrophobicContact CG-CE1 4.23Å
482	Q	90.4	Very high	84.4	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.019	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	146.2	-174.8	-62.1	-176.4	-1.5	0	0	110.5	Q480 E490 K492 E507 Q509	Q480-Q482 HydrophobicContact CB-CG 4.32Å; Q480-Q482 HydrophobicContact CG-CG 4.25Å; Q480-Q482 PolarHBondContact O-N 2.92Å; Q482-E490 PolarHBondContact N-O 3.08Å; Q482-E490 PolarHBondContact O-N 3.29Å; Q482-E490 VanDerWaalsContact O-N 3.1Å; Q482-K492 VanDerWaalsContact OE1-CD 3.29Å; Q482-E507 PolarHBondContact NE2-O 3.37Å; Q482-Q509 HydrophobicContact CG-CB 4.24Å
483	V	82.1	Confident	84.4	Confident	72 Å²	72	56.8 Å²	56.8	44%	0.436	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	103.2	173.1	-173.5	0	0	0	0	107.4	V331 P489	V331-V483 HydrophobicContact CG1-CG2 4.25Å; V331-V483 HydrophobicContact CG2-CG2 3.58Å; V483-P489 HydrophobicContact CG2-CB 4.16Å
484	T	69.1	Low	84.6	Confident	44 Å²	44	54 Å²	54	27%	0.27	29%	0.293	S	S	.	.			trans	-74.3	161.6	174.6	41.5	0	0	0	0	111.9	S486 D488	T484-S486 CarbonylContact C-O 3.58Å; T484-S486 CarbonylContact O-C 3.54Å; T484-S486 PolarHBondContact O-N 3.15Å; T484-S486 PolarHBondContact OG1-O 3.43Å; T484-S486 PolarHBondContact OG1-OG 3.06Å; T484-S486 VanDerWaalsContact OG1-OG 3.14Å; T484-D488 PolarHBondContact OG1-O 3.09Å
485	N	64.8	Low	84.8	Confident	184 Å²	184	54 Å²	54	98%	0.984	29%	0.293	S	S	*	.	S	Bend	trans	-61.9	-20.8	174.1	-74.1	-29.5	0	0	0	113.3
486	S	57	Low	85	Confident	82 Å²	82	52.1 Å²	52.1	57%	0.573	29%	0.289	S	S	*	.	S	Bend	trans	-77.2	124.5	161.4	40.1	0	0	0	0	108.4	T484 D488	T484-S486 CarbonylContact C-O 3.58Å; T484-S486 CarbonylContact O-C 3.54Å; T484-S486 PolarHBondContact O-N 3.15Å; T484-S486 PolarHBondContact OG1-O 3.43Å; T484-S486 PolarHBondContact OG1-OG 3.06Å; T484-S486 VanDerWaalsContact OG1-OG 3.14Å; S486-D488 PolarHBondContact O-N 3.23Å
487	S	59.6	Low	85.1	Confident	111 Å²	111	52 Å²	52	78%	0.776	29%	0.289	S	S	*	.	S	Bend	trans	-51.2	0	-167.5	45.1	0	0	0	0	118.9
488	D	69.9	Low	85	Confident	122 Å²	122	53.5 Å²	53.5	65%	0.652	30%	0.304	S	S	*	.			trans	-105.1	114.7	-178.6	-66.2	-24.2	0	0	0	110.4	T484 S486	T484-D488 PolarHBondContact OG1-O 3.09Å; S486-D488 PolarHBondContact O-N 3.23Å
489	P	78.4	Confident	84.6	Confident	55 Å²	55	59.6 Å²	59.6	36%	0.357	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	136.8	174.7	31.8	-34.7	0	0	0	110.5	E327 F481 V483	E327-P489 HydrophobicContact CG-CG 4.4Å; F481-P489 HydrophobicContact CE1-CB 4.12Å; F481-P489 HydrophobicContact CE2-CB 4.18Å; F481-P489 HydrophobicContact CZ-CB 3.56Å; F481-P489 HydrophobicContact CZ-CG 4.11Å; V483-P489 HydrophobicContact CG2-CB 4.16Å
490	E	87.8	Confident	84.4	Confident	110 Å²	110	62.7 Å²	62.7	51%	0.514	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	158.4	-175.7	68.2	173.6	-171.2	0	0	113.6	Q482	Q482-E490 PolarHBondContact N-O 3.08Å; Q482-E490 PolarHBondContact O-N 3.29Å; Q482-E490 VanDerWaalsContact O-N 3.1Å
491	Y	90.6	Very high	84.5	Confident	40 Å²	40	64.8 Å²	64.8	16%	0.157	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	110.8	169.8	-77.1	-75.5	0	0	0	109.9	W316 S318 K319 I323 F479 F481	W316-Y491 AromaticContact NE1-CZ 3.93Å; W316-Y491 PolarHBondContact NE1-OH 3.41Å; S318-Y491 WeakPolarHBondContact O-CD2 3.34Å; K319-Y491 PolarHBondContact O-OH 2.91Å; I323-Y491 HydrophobicContact CD1-CE2 3.91Å; I323-Y491 VanDerWaalsContact CD1-OH 3.32Å; I323-Y491 WeakPolarHBondContact CD1-OH 3.37Å; F479-Y491 HydrophobicContact CB-CD1 4.19Å; F481-Y491 HydrophobicContact CB-CD1 4.11Å; F481-Y491 HydrophobicContact CB-CE1 3.8Å; F481-Y491 HydrophobicContact CD2-CD1 4.05Å; F481-Y491 HydrophobicContact CD2-CD2 4.12Å; F481-Y491 AromaticContact CD2-CE1 3.82Å; F481-Y491 HydrophobicContact CD2-CE1 3.82Å; F481-Y491 AromaticContact CD2-CE2 3.88Å; F481-Y491 HydrophobicContact CD2-CE2 3.88Å; F481-Y491 HydrophobicContact CD2-CG 4.19Å; F481-Y491 AromaticContact CD2-CZ 3.71Å; F481-Y491 HydrophobicContact CE2-CE2 4.28Å; F481-Y491 HydrophobicContact CG-CE1 4.23Å
492	K	91.9	Very high	84.6	Confident	73 Å²	73	70.6 Å²	70.6	32%	0.317	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	135.8	177.2	-169.3	179.4	178.7	-175	0	110.8	F479 Q480 Q482 V494	F479-K492 CarbonylContact C-O 3.52Å; F479-K492 VanDerWaalsContact CA-O 3.26Å; F479-K492 WeakPolarHBondContact CA-O 3.47Å; Q480-K492 PolarHBondContact N-O 2.95Å; Q480-K492 PolarHBondContact O-N 3.25Å; Q482-K492 VanDerWaalsContact OE1-CD 3.29Å; K492-V494 PolarHBondContact O-N 3.03Å
493	V	93.1	Very high	84.7	Confident	54 Å²	54	72 Å²	72	33%	0.327	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	121.2	172.3	-177.8	0	0	0	0	109	L478 F479 R504	L478-V493 CarbonylContact O-C 3.55Å; L478-V493 WeakPolarHBondContact O-CA 3.38Å; F479-V493 HydrophobicContact CD1-CG2 3.89Å; F479-V493 HydrophobicContact CE1-CB 4.48Å; F479-V493 HydrophobicContact CE1-CG2 3.37Å; F479-V493 HydrophobicContact CZ-CG2 3.93Å; V493-R504 PolarHBondContact O-NH2 2.93Å
494	V	94.3	Very high	85.2	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-7.9	-177.8	-64.9	0	0	0	0	113.1	L478 Q480 K492 L503 R504 L508	L478-V494 HydrophobicContact CB-CG2 4.12Å; L478-V494 WeakPolarHBondContact O-CG2 3.43Å; L478-V494 PolarHBondContact O-N 2.63Å; Q480-V494 HydrophobicContact CB-CG1 3.65Å; Q480-V494 HydrophobicContact CB-CG2 4.15Å; K492-V494 PolarHBondContact O-N 3.03Å; V494-L503 HydrophobicContact CG2-CD1 4.1Å; V494-R504 WeakPolarHBondContact O-CB 3.2Å; V494-R504 PolarHBondContact O-N 3.14Å; V494-L508 HydrophobicContact CB-CD2 3.85Å; V494-L508 HydrophobicContact CG1-CD2 3.86Å; V494-L508 HydrophobicContact CG2-CD2 4.02Å
495	G	94.8	Very high	86.1	Confident	4 Å²	4	75.9 Å²	75.9	4%	0.041	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.9	-178.6	179.7	0	0	0	0	0	114.2	L478 Q502	L478-G495 PolarHBondContact N-O 3.22Å; L478-G495 PolarHBondContact O-N 3.02Å; G495-Q502 CarbonylContact C-O 3.56Å; G495-Q502 WeakPolarHBondContact CA-O 3.32Å
496	Q	95.3	Very high	87.2	Confident	79 Å²	79	76.1 Å²	76.1	37%	0.369	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	151.9	175.3	-63.5	-171.2	-28.7	0	0	109.9	Y476 D477 Q502	Y476-Q496 WeakPolarHBondContact O-CA 3.38Å; D477-Q496 WeakPolarHBondContact OD1-CG 3.21Å; D477-Q496 PolarHBondContact OD1-NE2 3Å; Q496-Q502 PolarHBondContact N-O 3.26Å; Q496-Q502 PolarHBondContact O-N 3.36Å
497	W	95.7	Very high	88.6	Confident	5 Å²	5	75.2 Å²	75.2	2%	0.019	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.9	173.7	-171.4	97.1	0	0	0	109.8	F206 Q209 A210 D213 R475 Y476	F206-W497 HydrophobicContact CB-CH2 4.13Å; F206-W497 HydrophobicContact CB-CZ3 4.08Å; F206-W497 AromaticContact CD1-CH2 3.9Å; F206-W497 HydrophobicContact CD1-CH2 3.9Å; F206-W497 HydrophobicContact CD1-CZ3 4.36Å; F206-W497 HydrophobicContact CG-CH2 4.44Å; Q209-W497 HydrophobicContact CB-CZ2 4.13Å; Q209-W497 HydrophobicContact CG-CZ2 3.82Å; A210-W497 HydrophobicContact CB-CB 4.22Å; A210-W497 HydrophobicContact CB-CD2 3.79Å; A210-W497 HydrophobicContact CB-CE3 4.49Å; A210-W497 HydrophobicContact CB-CG 3.66Å; D213-W497 PolarHBondContact OD2-NE1 2.82Å; R475-W497 WeakPolarHBondContact CA-O 3.43Å; Y476-W497 HydrophobicContact CD2-CD2 4.45Å; Y476-W497 AromaticContact CD2-CE3 3.65Å; Y476-W497 HydrophobicContact CD2-CE3 3.65Å; Y476-W497 HydrophobicContact CD2-CZ3 4.18Å; Y476-W497 HydrophobicContact CE2-CE3 4.09Å; Y476-W497 HydrophobicContact CE2-CZ3 4.15Å; Y476-W497 PolarHBondContact N-O 2.94Å; Y476-W497 PolarHBondContact O-N 2.81Å
498	A	92.1	Very high	90.1	Very high	52 Å²	52	70.1 Å²	70.1	43%	0.43	36%	0.357	S	S	.	.	S	Bend	trans	-148.7	89.3	173.9	0	0	0	0	0	107.8	R475 T500	R475-A498 HydrophobicContact CG-CB 4.48Å; A498-T500 PolarHBondContact N-O 3.4Å; A498-T500 VanDerWaalsContact N-O 3.16Å; A498-T500 PolarHBondContact O-N 3.09Å
499	D	86.5	Confident	91	Very high	128 Å²	128	67.3 Å²	67.3	68%	0.684	34%	0.34	S	S	*	.	S	Bend	trans	59.4	-23.7	-167.4	-58.6	-39.2	0	0	0	115.4
500	T	92	Very high	91.6	Very high	93 Å²	93	64.9 Å²	64.9	57%	0.571	32%	0.324	S	S	*	.	S	Bend	trans	-132.4	146.1	176.6	55	0	0	0	0	109.8	A498	A498-T500 PolarHBondContact N-O 3.4Å; A498-T500 VanDerWaalsContact N-O 3.16Å; A498-T500 PolarHBondContact O-N 3.09Å
501	L	95.1	Very high	91.4	Very high	44 Å²	44	60.2 Å²	60.2	23%	0.23	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.1	178.6	179	65.6	0	0	0	111.5	D213 I214 A217 L478 L503	D213-L501 HydrophobicContact CB-CB 4.01Å; D213-L501 HydrophobicContact CB-CD2 3.98Å; D213-L501 WeakPolarHBondContact O-CD2 3.41Å; I214-L501 HydrophobicContact CG1-CD1 3.94Å; I214-L501 HydrophobicContact CG1-CD2 4.16Å; A217-L501 HydrophobicContact CB-CD2 3.78Å; L478-L501 HydrophobicContact CD1-CD1 3.4Å; L478-L501 VanDerWaalsContact CD1-CD1 3.4Å; L501-L503 HydrophobicContact CD1-CB 4.21Å; L501-L503 HydrophobicContact CD2-CB 4.24Å; L501-L503 HydrophobicContact CG-CB 4.09Å
502	Q	95.3	Very high	90.8	Very high	127 Å²	127	66 Å²	66	59%	0.593	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	97.4	167.2	-63.7	-176.9	-5.1	0	0	108.8	G495 Q496	G495-Q502 CarbonylContact C-O 3.56Å; G495-Q502 WeakPolarHBondContact CA-O 3.32Å; Q496-Q502 PolarHBondContact N-O 3.26Å; Q496-Q502 PolarHBondContact O-N 3.36Å
503	L	93.3	Very high	90	Very high	33 Å²	33	65.2 Å²	65.2	17%	0.173	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	128.9	-177.8	-171.1	67.1	0	0	0	110.7	A217 L478 V494 L501 L505 L508	A217-L503 HydrophobicContact CB-CD2 4.28Å; L478-L503 HydrophobicContact CD1-CD1 4.05Å; V494-L503 HydrophobicContact CG2-CD1 4.1Å; L501-L503 HydrophobicContact CD1-CB 4.21Å; L501-L503 HydrophobicContact CD2-CB 4.24Å; L501-L503 HydrophobicContact CG-CB 4.09Å; L503-L505 HydrophobicContact CD2-CD2 3.88Å; L503-L505 HydrophobicContact CG-CD2 4.41Å; L503-L505 PolarHBondContact O-N 3.43Å; L503-L508 HydrophobicContact CD2-CD1 4.39Å
504	R	92.5	Very high	89.3	Confident	116 Å²	116	67.9 Å²	67.9	44%	0.438	36%	0.358	S	S	.	.			trans	-90.4	84.9	176.7	-63.6	-174	-69.1	-122.2	-3	110	V493 V494 E506 E507	V493-R504 PolarHBondContact O-NH2 2.93Å; V494-R504 WeakPolarHBondContact O-CB 3.2Å; V494-R504 PolarHBondContact O-N 3.14Å; R504-E506 PolarHBondContact O-N 3.25Å; R504-E507 HydrophobicContact CB-CB 4.23Å; R504-E507 HydrophobicContact CB-CG 4.14Å; R504-E507 VanDerWaalsContact CD-OE1 3.31Å; R504-E507 WeakPolarHBondContact CD-OE1 3.28Å; R504-E507 IonicContact CZ-OE2 3.06Å; R504-E507 VanDerWaalsContact NE-CD 3.25Å; R504-E507 IonicContact NE-OE1 2.79Å; R504-E507 PolarHBondContact NE-OE1 2.85Å; R504-E507 IonicContact NE-OE2 2.8Å; R504-E507 PolarHBondContact NE-OE2 2.66Å; R504-E507 IonicContact NH2-OE2 3.53Å; R504-E507 PolarHBondContact O-N 3.06Å; R504-E507 VanDerWaalsContact O-N 3.11Å
505	L	88.1	Confident	88.7	Confident	81 Å²	81	74.7 Å²	74.7	42%	0.424	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-57.5	-34.4	-177.2	-68.5	171	0	0	0	113.3	L218 L503 E507 L508	L218-L505 HydrophobicContact CD2-CD2 3.88Å; L503-L505 HydrophobicContact CD2-CD2 3.88Å; L503-L505 HydrophobicContact CG-CD2 4.41Å; L503-L505 PolarHBondContact O-N 3.43Å; L505-E507 PolarHBondContact O-N 3.47Å; L505-L508 HydrophobicContact CD2-CD1 3.86Å; L505-L508 WeakPolarHBondContact O-CB 3.45Å; L505-L508 PolarHBondContact O-N 2.92Å
506	E	87.6	Confident	88.4	Confident	189 Å²	189	82.3 Å²	82.3	88%	0.883	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-68.1	-21.1	-179.7	-60.8	175.9	-170.8	0	0	113.5	R504	R504-E506 PolarHBondContact O-N 3.25Å
507	E	87.4	Confident	88.1	Confident	64 Å²	64	80.7 Å²	80.7	30%	0.299	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-91.4	-6.3	178.7	-66.8	-178.7	-172.2	0	0	112.8	Q482 R504 L505	Q482-E507 PolarHBondContact NE2-O 3.37Å; R504-E507 HydrophobicContact CB-CB 4.23Å; R504-E507 HydrophobicContact CB-CG 4.14Å; R504-E507 VanDerWaalsContact CD-OE1 3.31Å; R504-E507 WeakPolarHBondContact CD-OE1 3.28Å; R504-E507 IonicContact CZ-OE2 3.06Å; R504-E507 VanDerWaalsContact NE-CD 3.25Å; R504-E507 IonicContact NE-OE1 2.79Å; R504-E507 PolarHBondContact NE-OE1 2.85Å; R504-E507 IonicContact NE-OE2 2.8Å; R504-E507 PolarHBondContact NE-OE2 2.66Å; R504-E507 IonicContact NH2-OE2 3.53Å; R504-E507 PolarHBondContact O-N 3.06Å; R504-E507 VanDerWaalsContact O-N 3.11Å; L505-E507 PolarHBondContact O-N 3.47Å
508	L	90.2	Very high	87.9	Confident	3 Å²	3	81 Å²	81	2%	0.016	42%	0.423	C	S	.	.			trans	-74.4	140.8	180	-63.2	177.6	0	0	0	111.2	L218 Q480 V494 L503 L505 W510	L218-L508 HydrophobicContact CD2-CD1 3.87Å; Q480-L508 HydrophobicContact CB-CD2 4.46Å; Q480-L508 VanDerWaalsContact OE1-CA 3.27Å; V494-L508 HydrophobicContact CB-CD2 3.85Å; V494-L508 HydrophobicContact CG1-CD2 3.86Å; V494-L508 HydrophobicContact CG2-CD2 4.02Å; L503-L508 HydrophobicContact CD2-CD1 4.39Å; L505-L508 HydrophobicContact CD2-CD1 3.86Å; L505-L508 WeakPolarHBondContact O-CB 3.45Å; L505-L508 PolarHBondContact O-N 2.92Å; L508-W510 HydrophobicContact CB-CZ2 4.41Å; L508-W510 HydrophobicContact CD1-CZ2 3.98Å
509	Q	89.4	Confident	87.9	Confident	64 Å²	64	84 Å²	84	30%	0.299	43%	0.432	S	S	.	.			trans	-130.3	134.3	174.9	-64.6	-175.7	-7.2	0	0	109.7	G332 Q480 Q482	G332-Q509 WeakPolarHBondContact CA-O 3.46Å; Q480-Q509 PolarHBondContact NE2-O 2.89Å; Q480-Q509 PolarHBondContact OE1-O 3.39Å; Q482-Q509 HydrophobicContact CG-CB 4.24Å
510	W	89.8	Confident	88.3	Confident	4 Å²	4	78 Å²	78	2%	0.015	40%	0.399	C	S	.	.			trans	-106.5	169.3	-178.7	-56.4	104.7	0	0	0	110.6	L218 W220 L309 L508 G513 E514 V517 P518	L218-W510 HydrophobicContact CD1-CH2 4.06Å; L218-W510 HydrophobicContact CD2-CH2 4.17Å; L218-W510 HydrophobicContact CD2-CZ2 3.9Å; W220-W510 AromaticContact CH2-CH2 3.85Å; W220-W510 HydrophobicContact CH2-CH2 3.85Å; W220-W510 AromaticContact CH2-CZ3 3.93Å; W220-W510 HydrophobicContact CH2-CZ3 3.93Å; W220-W510 AromaticContact CZ2-CH2 3.82Å; W220-W510 HydrophobicContact CZ2-CH2 3.82Å; W220-W510 HydrophobicContact CZ2-CZ3 4.05Å; L309-W510 HydrophobicContact CD2-CE3 4.02Å; L309-W510 HydrophobicContact CD2-CZ3 4.42Å; L508-W510 HydrophobicContact CB-CZ2 4.41Å; L508-W510 HydrophobicContact CD1-CZ2 3.98Å; W510-G513 PolarHBondContact O-N 2.73Å; W510-G513 VanDerWaalsContact O-N 3.11Å; W510-E514 PolarHBondContact N-O 3.1Å; W510-V517 HydrophobicContact CZ2-CB 4.31Å; W510-V517 HydrophobicContact CZ2-CG1 3.9Å; W510-V517 HydrophobicContact CZ2-CG2 4Å; W510-P518 HydrophobicContact CB-CG 3.93Å; W510-P518 VanDerWaalsContact CD2-CD 3.41Å; W510-P518 HydrophobicContact CD2-CG 4.09Å; W510-P518 HydrophobicContact CE3-CG 4.44Å; W510-P518 VanDerWaalsContact CG-CD 3.4Å; W510-P518 HydrophobicContact CG-CG 3.86Å
511	P	84.1	Confident	88.4	Confident	11 Å²	11	75 Å²	75	7%	0.071	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-48.5	146.6	172.1	-27.7	36.3	0	0	0	111.6	L309 G513	L309-P511 HydrophobicContact CD2-CG 4.31Å; P511-G513 PolarHBondContact O-N 2.76Å
512	D	78	Confident	88.2	Confident	161 Å²	161	73.9 Å²	73.9	86%	0.861	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	67.7	7.7	-174.4	-52.8	-45	0	0	0	116.2	E514	D512-E514 VanDerWaalsContact C-N 3.33Å
513	G	74.6	Confident	88	Confident	57 Å²	57	68.9 Å²	68.9	59%	0.588	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	79.8	14.2	176.2	0	0	0	0	0	113.9	W510 P511	W510-G513 PolarHBondContact O-N 2.73Å; W510-G513 VanDerWaalsContact O-N 3.11Å; P511-G513 PolarHBondContact O-N 2.76Å
514	E	79.9	Confident	87.8	Confident	110 Å²	110	73.3 Å²	73.3	51%	0.514	38%	0.379	S	S	.	.			trans	-68.4	137.3	175.2	-64	-170.8	162.9	0	0	111	W510 D512	W510-E514 PolarHBondContact N-O 3.1Å; D512-E514 VanDerWaalsContact C-N 3.33Å
515	Q	82.1	Confident	87.6	Confident	144 Å²	144	72.7 Å²	72.7	67%	0.673	39%	0.39	S	S	*	.			trans	-92	-21.9	171.7	-73.4	-177.7	-20.1	0	0	112.3
516	E	87.2	Confident	87.8	Confident	163 Å²	163	70.2 Å²	70.2	76%	0.762	38%	0.379	S	S	*	.	S	Bend	trans	-72.3	134.1	176.1	-70.7	-168	172.6	0	0	110.5	P518	E516-P518 VanDerWaalsContact O-CD 3.27Å; E516-P518 WeakPolarHBondContact O-CD 3.22Å
517	V	89.6	Confident	87.9	Confident	45 Å²	45	68.7 Å²	68.7	27%	0.273	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-65.8	119.1	179.1	-178.9	0	0	0	0	109.6	L218 W220 W510	L218-V517 HydrophobicContact CB-CG1 4.14Å; L218-V517 HydrophobicContact CD2-CG1 3.94Å; L218-V517 HydrophobicContact CD2-CG2 4.01Å; W220-V517 HydrophobicContact CZ2-CG1 4.14Å; W510-V517 HydrophobicContact CZ2-CB 4.31Å; W510-V517 HydrophobicContact CZ2-CG1 3.9Å; W510-V517 HydrophobicContact CZ2-CG2 4Å
518	P	91.8	Very high	88	Confident	12 Å²	12	70.6 Å²	70.6	8%	0.078	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-66.1	143.2	179.7	-16.8	28.2	0	0	0	110.6	W220 L309 W510 E516	W220-P518 PolarHBondContact NE1-O 3.23Å; L309-P518 HydrophobicContact CD1-CB 3.88Å; L309-P518 HydrophobicContact CD1-CG 4.07Å; L309-P518 HydrophobicContact CD2-CG 4.3Å; W510-P518 HydrophobicContact CB-CG 3.93Å; W510-P518 VanDerWaalsContact CD2-CD 3.41Å; W510-P518 HydrophobicContact CD2-CG 4.09Å; W510-P518 HydrophobicContact CE3-CG 4.44Å; W510-P518 VanDerWaalsContact CG-CD 3.4Å; W510-P518 HydrophobicContact CG-CG 3.86Å; E516-P518 VanDerWaalsContact O-CD 3.27Å; E516-P518 WeakPolarHBondContact O-CD 3.22Å
519	N	91.8	Very high	87.9	Confident	116 Å²	116	70.5 Å²	70.5	62%	0.62	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-75.3	133.5	-176.8	-67.6	-52.6	0	0	0	112.3
520	S	94.8	Very high	88.1	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.38	C	S	.	.			trans	-124.6	84.1	166.6	-160.6	0	0	0	0	109.2	T221 Y222 R281 A282	T221-S520 PolarHBondContact N-O 3.02Å; Y222-S520 PolarHBondContact N-O 3.29Å; Y222-S520 PolarHBondContact O-OG 2.96Å; R281-S520 PolarHBondContact N-OG 3.05Å; A282-S520 PolarHBondContact N-OG 3.46Å
521	V	93.6	Very high	88.2	Confident	31 Å²	31	71.8 Å²	71.8	19%	0.188	39%	0.389	C	S	.	.			trans	-134.9	142.5	-173.1	-58.3	0	0	0	0	110.5	T221 N279 L524	T221-V521 WeakPolarHBondContact OG1-CG1 3.34Å; N279-V521 WeakPolarHBondContact CB-O 3.46Å; V521-L524 HydrophobicContact CG2-CD2 4.23Å
522	C	91.9	Very high	88.6	Confident	20 Å²	20	73.3 Å²	73.3	14%	0.135	39%	0.394	C	S	.	.	S	Bend	trans	-69.7	-45.3	-175.3	-177.5	0	0	0	0	112.9	Y222 N279 C541	Y222-C522 VanDerWaalsContact CB-N 3.27Å; Y222-C522 HydrophobicContact CD1-CB 3.9Å; Y222-C522 HydrophobicContact CD2-CB 3.68Å; Y222-C522 HydrophobicContact CE1-CB 4.26Å; Y222-C522 HydrophobicContact CE2-CB 4.05Å; Y222-C522 HydrophobicContact CG-CB 3.6Å; N279-C522 PolarHBondContact ND2-O 3.03Å; C522-C541 HydrophobicContact CB-CB 4.01Å; C522-C541 WeakPolarHBondContact CB-SG 3.3Å; C522-C541 WeakPolarHBondContact SG-CB 3.39Å; C522-C541 CovalentContact SG-SG 2Å; C522-C541 PolarHBondContact SG-SG 3.46Å
523	S	90.1	Very high	89.2	Confident	22 Å²	22	70.5 Å²	70.5	15%	0.154	38%	0.375	C	S	.	.	S	Bend	trans	-134.5	131.8	-174	-54.4	0	0	0	0	109.5	W542	S523-W542 VanDerWaalsContact CB-O 3.24Å; S523-W542 WeakPolarHBondContact CB-O 3.44Å; S523-W542 VanDerWaalsContact O-CZ2 3.24Å; S523-W542 WeakPolarHBondContact O-CZ2 3.25Å; S523-W542 PolarHBondContact OG-N 3.26Å; S523-W542 PolarHBondContact OG-O 2.93Å
524	L	89.2	Confident	89.8	Confident	126 Å²	126	74.3 Å²	74.3	66%	0.66	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-69.1	158.1	175.5	-66	173.6	0	0	0	110.7	V521 C526 W542	V521-L524 HydrophobicContact CG2-CD2 4.23Å; L524-C526 PolarHBondContact O-N 2.82Å; L524-W542 PolarHBondContact O-NE1 3.37Å
525	P	89.1	Confident	90.2	Very high	104 Å²	104	72 Å²	72	68%	0.675	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-54.1	134.4	170.4	-24.9	34.6	0	0	0	111.6
526	C	91.1	Very high	90.3	Very high	28 Å²	28	75 Å²	75	19%	0.189	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-69.2	153.6	179.3	-60.5	0	0	0	0	112.1	L524 E530 K532 C544	L524-C526 PolarHBondContact O-N 2.82Å; C526-E530 HydrophobicContact CB-CB 4.09Å; C526-K532 HydrophobicContact CB-CG 4.44Å; C526-K532 VanDerWaalsContact SG-CG 3.59Å; C526-C544 WeakPolarHBondContact CA-SG 3.34Å; C526-C544 HydrophobicContact CB-CB 3.67Å; C526-C544 WeakPolarHBondContact CB-SG 3.31Å; C526-C544 WeakPolarHBondContact SG-CA 3.44Å; C526-C544 WeakPolarHBondContact SG-CB 3.42Å; C526-C544 CovalentContact SG-SG 2.03Å; C526-C544 PolarHBondContact SG-SG 2.78Å
527	K	90.4	Very high	89.9	Confident	157 Å²	157	71.4 Å²	71.4	68%	0.683	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-74.3	161.5	177.8	-62.7	178	-178.9	176	0	110.4	G529 E530	K527-G529 PolarHBondContact O-N 3.41Å; K527-E530 HydrophobicContact CB-CG 4.48Å; K527-E530 PolarHBondContact N-OE2 2.84Å; K527-E530 WeakPolarHBondContact O-CB 3.43Å; K527-E530 PolarHBondContact O-N 2.79Å; K527-E530 VanDerWaalsContact O-N 3.12Å
528	T	89.3	Confident	89.6	Confident	104 Å²	104	71.9 Å²	71.9	64%	0.638	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	132.1	174.7	51.6	0	0	0	0	111
529	G	88.5	Confident	89.1	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.01	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-1.6	-176.3	0	0	0	0	0	114.5	K527 C547 N571	K527-G529 PolarHBondContact O-N 3.41Å; G529-C547 WeakPolarHBondContact O-CB 3.3Å; G529-C547 PolarHBondContact O-N 2.93Å; G529-N571 WeakPolarHBondContact CA-O 3.48Å
530	E	93	Very high	88.9	Confident	43 Å²	43	70.6 Å²	70.6	20%	0.201	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150.4	173.8	-59.4	172.5	169.4	0	0	110.6	C526 K527 C544 E545 L546 Q553	C526-E530 HydrophobicContact CB-CB 4.09Å; K527-E530 HydrophobicContact CB-CG 4.48Å; K527-E530 PolarHBondContact N-OE2 2.84Å; K527-E530 WeakPolarHBondContact O-CB 3.43Å; K527-E530 PolarHBondContact O-N 2.79Å; K527-E530 VanDerWaalsContact O-N 3.12Å; E530-C544 HydrophobicContact CB-CB 4.29Å; E530-C544 VanDerWaalsContact OE2-CB 3.27Å; E530-C544 WeakPolarHBondContact OE2-CB 3.36Å; E530-E545 CarbonylContact C-O 3.59Å; E530-E545 WeakPolarHBondContact CA-O 3.45Å; E530-L546 HydrophobicContact CG-CB 4.49Å; E530-L546 HydrophobicContact CG-CD1 3.98Å; E530-Q553 VanDerWaalsContact O-CD 3.31Å; E530-Q553 PolarHBondContact O-NE2 3.19Å
531	R	91.9	Very high	88.7	Confident	53 Å²	53	70.9 Å²	70.9	20%	0.2	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	146.4	171.1	64.9	168.7	178.4	103	9.8	111.6	K533 E545 E556 C559	R531-K533 PolarHBondContact O-N 3.29Å; R531-E545 HydrophobicContact CG-CB 4.28Å; R531-E545 WeakPolarHBondContact CG-O 3.04Å; R531-E545 IonicContact CZ-OE1 2.72Å; R531-E545 IonicContact CZ-OE2 3.76Å; R531-E545 PolarHBondContact N-O 2.91Å; R531-E545 IonicContact NH2-OE1 3.75Å; R531-E545 PolarHBondContact NH2-OE1 3.1Å; R531-E545 IonicContact NH2-OE2 2.8Å; R531-E545 PolarHBondContact NH2-OE2 3.36Å; R531-E545 PolarHBondContact O-N 3.4Å; R531-E556 CarbonylContact C-O 3.51Å; R531-E556 WeakPolarHBondContact CA-O 3.49Å; R531-C559 WeakPolarHBondContact CD-SG 3.39Å; R531-C559 VanDerWaalsContact CG-SG 3.55Å
532	K	92.4	Very high	88.6	Confident	42 Å²	42	72 Å²	72	18%	0.183	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	115.9	170.5	-64.1	177.1	-177.1	170.9	0	109.6	C526 W542 E556 T557	C526-K532 HydrophobicContact CB-CG 4.44Å; C526-K532 VanDerWaalsContact SG-CG 3.59Å; K532-W542 HydrophobicContact CB-CB 4.12Å; K532-W542 HydrophobicContact CB-CG 4.07Å; K532-W542 HydrophobicContact CD-CD2 4.27Å; K532-W542 HydrophobicContact CD-CG 4.37Å; K532-W542 HydrophobicContact CG-CD2 4.45Å; K532-W542 HydrophobicContact CG-CG 4.04Å; K532-E556 WeakPolarHBondContact CB-O 3.37Å; K532-E556 HydrophobicContact CD-CB 4.31Å; K532-E556 WeakPolarHBondContact CE-OE2 3.24Å; K532-E556 PolarHBondContact N-O 3.29Å; K532-E556 VanDerWaalsContact NZ-CD 3.33Å; K532-E556 IonicContact NZ-OE1 3.27Å; K532-E556 PolarHBondContact NZ-OE1 2.73Å; K532-E556 IonicContact NZ-OE2 2.96Å; K532-E556 PolarHBondContact NZ-OE2 2.85Å; K532-T557 HydrophobicContact CB-CG2 4.44Å
533	K	90.3	Very high	88.6	Confident	103 Å²	103	76.2 Å²	76.2	45%	0.448	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	103.4	169.7	-177	173.2	180	-179	0	109.3	R531 W542 I543 E545	R531-K533 PolarHBondContact O-N 3.29Å; K533-W542 CarbonylContact O-C 3.54Å; K533-W542 VanDerWaalsContact O-CA 3.29Å; K533-W542 WeakPolarHBondContact O-CA 3.48Å; K533-I543 WeakPolarHBondContact CB-O 3.17Å; K533-I543 PolarHBondContact N-O 2.88Å; K533-I543 PolarHBondContact O-N 3.48Å; K533-E545 WeakPolarHBondContact CD-OE2 3.39Å; K533-E545 IonicContact NZ-OE2 3.45Å; K533-E545 PolarHBondContact NZ-OE2 3.45Å
534	K	88.8	Confident	88.8	Confident	136 Å²	136	77.4 Å²	77.4	59%	0.591	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	137.1	-179.8	-64.4	-172.2	177.9	-173.1	0	111.2	C541	K534-C541 WeakPolarHBondContact CA-O 3.24Å
535	V	87.6	Confident	88.9	Confident	63 Å²	63	74.8 Å²	74.8	38%	0.382	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	134.5	174.3	-178.7	0	0	0	0	108.8	G537 M538 C541 I543	V535-G537 PolarHBondContact O-N 2.91Å; V535-M538 PolarHBondContact O-N 3.08Å; V535-C541 HydrophobicContact CB-CB 4.22Å; V535-C541 HydrophobicContact CG2-CB 4.01Å; V535-C541 PolarHBondContact N-O 3.16Å; V535-I543 HydrophobicContact CG2-CD1 4.42Å; V535-I543 HydrophobicContact CG2-CG1 4.23Å
536	K	83	Confident	89	Confident	207 Å²	207	73.4 Å²	73.4	90%	0.9	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	128	179.3	-71.7	-173.7	178	-178.1	0	109.8
537	G	80.3	Confident	89	Confident	86 Å²	86	72.1 Å²	72.1	89%	0.887	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	-10.2	179	0	0	0	0	0	115.4	V535	V535-G537 PolarHBondContact O-N 2.91Å
538	M	82.6	Confident	88.8	Confident	55 Å²	55	69.6 Å²	69.6	27%	0.271	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	94.7	-179.3	-161	173.7	-77.1	0	0	111	Y222 C251 V535 C540 C541	Y222-M538 HydrophobicContact CE2-CE 4.48Å; Y222-M538 HydrophobicContact CE2-SD 3.68Å; C251-M538 HydrophobicContact CB-CG 4.2Å; V535-M538 PolarHBondContact O-N 3.08Å; M538-C540 VanDerWaalsContact C-N 3.3Å; M538-C540 PolarHBondContact O-N 2.71Å; M538-C541 HydrophobicContact CB-CB 4.38Å; M538-C541 HydrophobicContact CG-CB 4.22Å; M538-C541 VanDerWaalsContact CG-SG 3.57Å; M538-C541 PolarHBondContact O-N 3.38Å; M538-C541 HydrophobicContact SD-CB 4.25Å; M538-C541 PolarHBondContact SD-SG 3.29Å
539	P	82.1	Confident	88.8	Confident	89 Å²	89	65.5 Å²	65.5	58%	0.578	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	-23.7	-168.3	25.4	-33.8	0	0	0	114.7	C541	P539-C541 VanDerWaalsContact C-N 3.33Å
540	C	87.8	Confident	88.8	Confident	13 Å²	13	67.1 Å²	67.1	9%	0.088	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-8.9	180	-35.8	0	0	0	0	113.3	C251 M538 W542	C251-C540 HydrophobicContact CB-CB 3.67Å; C251-C540 WeakPolarHBondContact CB-SG 3.35Å; C251-C540 PolarHBondContact N-SG 3.42Å; C251-C540 VanDerWaalsContact N-SG 3.38Å; C251-C540 WeakPolarHBondContact SG-CB 3.44Å; C251-C540 PolarHBondContact SG-N 2.81Å; C251-C540 CovalentContact SG-SG 2.04Å; C251-C540 PolarHBondContact SG-SG 2.82Å; M538-C540 VanDerWaalsContact C-N 3.3Å; M538-C540 PolarHBondContact O-N 2.71Å; C540-W542 WeakPolarHBondContact O-CZ3 3.27Å
541	C	90.6	Very high	88.8	Confident	6 Å²	6	68.2 Å²	68.2	4%	0.041	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.2	-179.5	-60.5	0	0	0	0	110.5	C522 K534 V535 M538 P539	C522-C541 HydrophobicContact CB-CB 4.01Å; C522-C541 WeakPolarHBondContact CB-SG 3.3Å; C522-C541 WeakPolarHBondContact SG-CB 3.39Å; C522-C541 CovalentContact SG-SG 2Å; C522-C541 PolarHBondContact SG-SG 3.46Å; K534-C541 WeakPolarHBondContact CA-O 3.24Å; V535-C541 HydrophobicContact CB-CB 4.22Å; V535-C541 HydrophobicContact CG2-CB 4.01Å; V535-C541 PolarHBondContact N-O 3.16Å; M538-C541 HydrophobicContact CB-CB 4.38Å; M538-C541 HydrophobicContact CG-CB 4.22Å; M538-C541 VanDerWaalsContact CG-SG 3.57Å; M538-C541 PolarHBondContact O-N 3.38Å; M538-C541 HydrophobicContact SD-CB 4.25Å; M538-C541 PolarHBondContact SD-SG 3.29Å; P539-C541 VanDerWaalsContact C-N 3.33Å
542	W	91.4	Very high	88.8	Confident	55 Å²	55	67.9 Å²	67.9	21%	0.208	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	147.9	175.2	54.5	77.7	0	0	0	111	S523 L524 K532 K533 C540	S523-W542 VanDerWaalsContact CB-O 3.24Å; S523-W542 WeakPolarHBondContact CB-O 3.44Å; S523-W542 VanDerWaalsContact O-CZ2 3.24Å; S523-W542 WeakPolarHBondContact O-CZ2 3.25Å; S523-W542 PolarHBondContact OG-N 3.26Å; S523-W542 PolarHBondContact OG-O 2.93Å; L524-W542 PolarHBondContact O-NE1 3.37Å; K532-W542 HydrophobicContact CB-CB 4.12Å; K532-W542 HydrophobicContact CB-CG 4.07Å; K532-W542 HydrophobicContact CD-CD2 4.27Å; K532-W542 HydrophobicContact CD-CG 4.37Å; K532-W542 HydrophobicContact CG-CD2 4.45Å; K532-W542 HydrophobicContact CG-CG 4.04Å; K533-W542 CarbonylContact O-C 3.54Å; K533-W542 VanDerWaalsContact O-CA 3.29Å; K533-W542 WeakPolarHBondContact O-CA 3.48Å; C540-W542 WeakPolarHBondContact O-CZ3 3.27Å
543	I	91.8	Very high	88.9	Confident	108 Å²	108	67.8 Å²	67.8	55%	0.554	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	132.1	170.8	-58.2	171.4	0	0	0	107.2	K533 V535 E545	K533-I543 WeakPolarHBondContact CB-O 3.17Å; K533-I543 PolarHBondContact N-O 2.88Å; K533-I543 PolarHBondContact O-N 3.48Å; V535-I543 HydrophobicContact CG2-CD1 4.42Å; V535-I543 HydrophobicContact CG2-CG1 4.23Å; I543-E545 PolarHBondContact O-N 2.78Å
544	C	92.9	Very high	88.8	Confident	47 Å²	47	68 Å²	68	32%	0.318	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	118	174.6	-56.8	0	0	0	0	109.3	C526 E530	C526-C544 WeakPolarHBondContact CA-SG 3.34Å; C526-C544 HydrophobicContact CB-CB 3.67Å; C526-C544 WeakPolarHBondContact CB-SG 3.31Å; C526-C544 WeakPolarHBondContact SG-CA 3.44Å; C526-C544 WeakPolarHBondContact SG-CB 3.42Å; C526-C544 CovalentContact SG-SG 2.03Å; C526-C544 PolarHBondContact SG-SG 2.78Å; E530-C544 HydrophobicContact CB-CB 4.29Å; E530-C544 VanDerWaalsContact OE2-CB 3.27Å; E530-C544 WeakPolarHBondContact OE2-CB 3.36Å
545	E	92	Very high	88.8	Confident	71 Å²	71	65.3 Å²	65.3	33%	0.332	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122.9	-179.4	-162.9	-176.4	131.1	0	0	108.9	E530 R531 K533 I543 C547	E530-E545 CarbonylContact C-O 3.59Å; E530-E545 WeakPolarHBondContact CA-O 3.45Å; R531-E545 HydrophobicContact CG-CB 4.28Å; R531-E545 WeakPolarHBondContact CG-O 3.04Å; R531-E545 IonicContact CZ-OE1 2.72Å; R531-E545 IonicContact CZ-OE2 3.76Å; R531-E545 PolarHBondContact N-O 2.91Å; R531-E545 IonicContact NH2-OE1 3.75Å; R531-E545 PolarHBondContact NH2-OE1 3.1Å; R531-E545 IonicContact NH2-OE2 2.8Å; R531-E545 PolarHBondContact NH2-OE2 3.36Å; R531-E545 PolarHBondContact O-N 3.4Å; K533-E545 WeakPolarHBondContact CD-OE2 3.39Å; K533-E545 IonicContact NZ-OE2 3.45Å; K533-E545 PolarHBondContact NZ-OE2 3.45Å; I543-E545 PolarHBondContact O-N 2.78Å; E545-C547 PolarHBondContact O-N 3.46Å
546	L	91.2	Very high	88.8	Confident	75 Å²	75	67.9 Å²	67.9	39%	0.393	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	132.4	179.2	-171.5	70.1	0	0	0	110.5	E530 D548 R572	E530-L546 HydrophobicContact CG-CB 4.49Å; E530-L546 HydrophobicContact CG-CD1 3.98Å; L546-D548 PolarHBondContact O-N 3.09Å; L546-R572 VanDerWaalsContact CD2-NH1 3.31Å
547	C	90.9	Very high	89.2	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.338	C	S	.	.			trans	-69.1	98.4	170.3	-64.9	0	0	0	0	109	G529 E545 Q551 Q553 C559 R572	G529-C547 WeakPolarHBondContact O-CB 3.3Å; G529-C547 PolarHBondContact O-N 2.93Å; E545-C547 PolarHBondContact O-N 3.46Å; C547-Q551 HydrophobicContact CB-CB 4.22Å; C547-Q553 VanDerWaalsContact SG-CA 3.58Å; C547-C559 WeakPolarHBondContact CA-SG 3.23Å; C547-C559 HydrophobicContact CB-CB 3.77Å; C547-C559 WeakPolarHBondContact CB-SG 3.38Å; C547-C559 WeakPolarHBondContact SG-CB 3.48Å; C547-C559 CovalentContact SG-SG 2.03Å; C547-C559 PolarHBondContact SG-SG 2.82Å; C547-R572 VanDerWaalsContact O-CD 3.22Å; C547-R572 WeakPolarHBondContact O-CD 3.41Å; C547-R572 PolarHBondContact O-NH1 3.32Å
548	D	87.1	Confident	89.7	Confident	104 Å²	104	59.2 Å²	59.2	56%	0.556	31%	0.307	S	S	*	.			trans	-95.2	157.8	-169.2	-155.6	30.4	0	0	0	116	L546 Q551 R572	L546-D548 PolarHBondContact O-N 3.09Å; D548-Q551 WeakPolarHBondContact O-CB 3.23Å; D548-Q551 WeakPolarHBondContact O-CG 3.19Å; D548-Q551 PolarHBondContact O-N 2.87Å; D548-R572 IonicContact OD1-CZ 3.43Å; D548-R572 IonicContact OD1-NH1 2.71Å; D548-R572 PolarHBondContact OD1-NH1 2.86Å; D548-R572 IonicContact OD1-NH2 2.66Å
549	G	87.9	Confident	90.2	Very high	19 Å²	19	57.8 Å²	57.8	20%	0.196	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	-130.8	-177.2	0	0	0	0	0	112.5	Q551 P568 P739	G549-Q551 PolarHBondContact O-N 3.41Å; G549-P568 WeakPolarHBondContact O-CG 3.42Å; G549-P739 WeakPolarHBondContact O-CG 3.46Å
550	Y	90.3	Very high	90.7	Very high	35 Å²	35	59 Å²	59	14%	0.137	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	22.3	179.7	-69.6	-99.5	0	0	0	112.7	C562 R567 I578 K735 T736 P739 A742	Y550-C562 WeakPolarHBondContact O-CB 3.45Å; Y550-C562 PolarHBondContact O-N 3.27Å; Y550-R567 HydrophobicContact CD1-CB 4.39Å; Y550-R567 HydrophobicContact CE1-CB 4.28Å; Y550-I578 HydrophobicContact CE1-CD1 4.49Å; Y550-K735 HydrophobicContact CE2-CG 4.49Å; Y550-K735 VanDerWaalsContact OH-CG 3.32Å; Y550-K735 WeakPolarHBondContact OH-CG 3.28Å; Y550-T736 PolarHBondContact OH-O 3.14Å; Y550-P739 HydrophobicContact CD1-CB 4.23Å; Y550-P739 HydrophobicContact CE1-CB 4.06Å; Y550-P739 HydrophobicContact CE2-CB 4.37Å; Y550-P739 HydrophobicContact CG-CB 4.47Å; Y550-A742 HydrophobicContact CE1-CB 4.34Å; Y550-A742 WeakPolarHBondContact OH-CB 3.28Å
551	Q	92.1	Very high	91	Very high	65 Å²	65	64.4 Å²	64.4	30%	0.304	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	152.3	177.7	-60.7	-176.2	-4.8	0	0	111.7	C547 D548 G549 C559 R560 L561	C547-Q551 HydrophobicContact CB-CB 4.22Å; D548-Q551 WeakPolarHBondContact O-CB 3.23Å; D548-Q551 WeakPolarHBondContact O-CG 3.19Å; D548-Q551 PolarHBondContact O-N 2.87Å; G549-Q551 PolarHBondContact O-N 3.41Å; Q551-C559 HydrophobicContact CB-CB 4.22Å; Q551-R560 CarbonylContact C-O 3.52Å; Q551-R560 WeakPolarHBondContact CA-O 3.32Å; Q551-L561 HydrophobicContact CG-CD2 3.85Å; Q551-L561 HydrophobicContact CG-CG 3.98Å
552	Y	92.7	Very high	91.1	Very high	47 Å²	47	65 Å²	65	18%	0.184	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	155.5	171	75.8	-77.5	0	0	0	109.7	Y554 C559 R560 R572 T573 C575	Y552-Y554 HydrophobicContact CE2-CD2 4.15Å; Y552-Y554 PolarHBondContact O-N 3.05Å; Y552-Y554 WeakPolarHBondContact OH-CD2 3.49Å; Y552-C559 CarbonylContact O-C 3.56Å; Y552-C559 VanDerWaalsContact O-CA 3.3Å; Y552-C559 WeakPolarHBondContact O-CA 3.17Å; Y552-R560 HydrophobicContact CD1-CB 4.43Å; Y552-R560 WeakPolarHBondContact CD1-O 3.31Å; Y552-R560 HydrophobicContact CE1-CB 3.84Å; Y552-R560 PolarHBondContact N-O 3.07Å; Y552-R560 PolarHBondContact O-N 3.18Å; Y552-R572 CarbonylContact C-O 3.58Å; Y552-R572 VanDerWaalsContact CA-O 3.29Å; Y552-R572 WeakPolarHBondContact CA-O 3.41Å; Y552-R572 WeakPolarHBondContact CB-O 3.33Å; Y552-T573 WeakPolarHBondContact CD2-O 3.43Å; Y552-C575 WeakPolarHBondContact CD1-SG 3.45Å; Y552-C575 VanDerWaalsContact CE1-SG 3.6Å
553	Q	93.5	Very high	91.1	Very high	40 Å²	40	64.7 Å²	64.7	19%	0.187	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	110.2	174	-175.3	-175.6	12.2	0	0	108.8	E530 C547 D555 R572	E530-Q553 VanDerWaalsContact O-CD 3.31Å; E530-Q553 PolarHBondContact O-NE2 3.19Å; C547-Q553 VanDerWaalsContact SG-CA 3.58Å; Q553-D555 WeakPolarHBondContact CG-O 3.29Å; Q553-R572 PolarHBondContact N-O 3.03Å
554	Y	88.9	Confident	90.9	Very high	107 Å²	107	65 Å²	65	42%	0.42	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-48.3	175.9	177.8	-94.5	0	0	0	110.5	Y552 S558 R560	Y552-Y554 HydrophobicContact CE2-CD2 4.15Å; Y552-Y554 PolarHBondContact O-N 3.05Å; Y552-Y554 WeakPolarHBondContact OH-CD2 3.49Å; Y554-S558 PolarHBondContact N-O 2.98Å; Y554-S558 VanDerWaalsContact N-O 3.1Å; Y554-R560 VanDerWaalsContact CD1-CZ 3.41Å; Y554-R560 HydrophobicContact CG-CG 4.15Å; Y554-R560 VanDerWaalsContact CZ-CZ 3.45Å
555	D	89.1	Confident	90.6	Very high	79 Å²	79	68.5 Å²	68.5	42%	0.422	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	169.6	172.8	-64.1	-43.2	0	0	0	109.8	Q553 T557 S558	Q553-D555 WeakPolarHBondContact CG-O 3.29Å; D555-T557 PolarHBondContact O-N 2.9Å; D555-S558 PolarHBondContact N-O 2.74Å; D555-S558 PolarHBondContact O-N 2.92Å; D555-S558 VanDerWaalsContact O-O 3.13Å
556	E	87.5	Confident	90.5	Very high	117 Å²	117	67.2 Å²	67.2	55%	0.547	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.3	175.2	-66.8	-163.4	150.5	0	0	113.6	R531 K532	R531-E556 CarbonylContact C-O 3.51Å; R531-E556 WeakPolarHBondContact CA-O 3.49Å; K532-E556 WeakPolarHBondContact CB-O 3.37Å; K532-E556 HydrophobicContact CD-CB 4.31Å; K532-E556 WeakPolarHBondContact CE-OE2 3.24Å; K532-E556 PolarHBondContact N-O 3.29Å; K532-E556 VanDerWaalsContact NZ-CD 3.33Å; K532-E556 IonicContact NZ-OE1 3.27Å; K532-E556 PolarHBondContact NZ-OE1 2.73Å; K532-E556 IonicContact NZ-OE2 2.96Å; K532-E556 PolarHBondContact NZ-OE2 2.85Å
557	T	89.7	Confident	90.5	Very high	77 Å²	77	65.4 Å²	65.4	47%	0.472	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-8	-177.6	56.6	0	0	0	0	113.9	K532 D555	K532-T557 HydrophobicContact CB-CG2 4.44Å; D555-T557 PolarHBondContact O-N 2.9Å
558	S	91.3	Very high	90.6	Very high	34 Å²	34	65.4 Å²	65.4	24%	0.238	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.2	-170.3	79.8	0	0	0	0	114	Y554 D555	Y554-S558 PolarHBondContact N-O 2.98Å; Y554-S558 VanDerWaalsContact N-O 3.1Å; D555-S558 PolarHBondContact N-O 2.74Å; D555-S558 PolarHBondContact O-N 2.92Å; D555-S558 VanDerWaalsContact O-O 3.13Å
559	C	93.6	Very high	90.7	Very high	25 Å²	25	62.1 Å²	62.1	17%	0.169	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	143.9	169.7	-56.1	0	0	0	0	109.4	R531 C547 Q551 Y552	R531-C559 WeakPolarHBondContact CD-SG 3.39Å; R531-C559 VanDerWaalsContact CG-SG 3.55Å; C547-C559 WeakPolarHBondContact CA-SG 3.23Å; C547-C559 HydrophobicContact CB-CB 3.77Å; C547-C559 WeakPolarHBondContact CB-SG 3.38Å; C547-C559 WeakPolarHBondContact SG-CB 3.48Å; C547-C559 CovalentContact SG-SG 2.03Å; C547-C559 PolarHBondContact SG-SG 2.82Å; Q551-C559 HydrophobicContact CB-CB 4.22Å; Y552-C559 CarbonylContact O-C 3.56Å; Y552-C559 VanDerWaalsContact O-CA 3.3Å; Y552-C559 WeakPolarHBondContact O-CA 3.17Å
560	R	93.2	Very high	90.7	Very high	116 Å²	116	65.7 Å²	65.7	44%	0.438	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.9	175.4	-68.8	-173.3	-177.8	179	1.4	111.2	Q551 Y552 Y554	Q551-R560 CarbonylContact C-O 3.52Å; Q551-R560 WeakPolarHBondContact CA-O 3.32Å; Y552-R560 HydrophobicContact CD1-CB 4.43Å; Y552-R560 WeakPolarHBondContact CD1-O 3.31Å; Y552-R560 HydrophobicContact CE1-CB 3.84Å; Y552-R560 PolarHBondContact N-O 3.07Å; Y552-R560 PolarHBondContact O-N 3.18Å; Y554-R560 VanDerWaalsContact CD1-CZ 3.41Å; Y554-R560 HydrophobicContact CG-CG 4.15Å; Y554-R560 VanDerWaalsContact CZ-CZ 3.45Å
561	L	93.4	Very high	90.7	Very high	126 Å²	126	68.7 Å²	68.7	66%	0.66	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.5	175.8	-77.5	151.5	0	0	0	111.1	Q551	Q551-L561 HydrophobicContact CG-CD2 3.85Å; Q551-L561 HydrophobicContact CG-CG 3.98Å
562	C	91.5	Very high	90.5	Very high	17 Å²	17	68.2 Å²	68.2	12%	0.115	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-68.3	154.6	168.2	-70.4	0	0	0	0	111.4	Y550 M566 C575	Y550-C562 WeakPolarHBondContact O-CB 3.45Å; Y550-C562 PolarHBondContact O-N 3.27Å; C562-M566 HydrophobicContact CB-CB 4.26Å; C562-C575 WeakPolarHBondContact CA-SG 3.23Å; C562-C575 HydrophobicContact CB-CB 3.92Å; C562-C575 WeakPolarHBondContact CB-SG 3.33Å; C562-C575 WeakPolarHBondContact SG-CB 3.17Å; C562-C575 CovalentContact SG-SG 2.04Å; C562-C575 PolarHBondContact SG-SG 3.26Å
563	A	92.3	Very high	90.4	Very high	50 Å²	50	68.9 Å²	68.9	41%	0.413	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-60.7	158.4	173.1	0	0	0	0	0	111.7	Y565 M566	A563-Y565 VanDerWaalsContact C-N 3.27Å; A563-Y565 HydrophobicContact CB-CD1 4.26Å; A563-Y565 HydrophobicContact CB-CE1 3.84Å; A563-Y565 PolarHBondContact O-N 3.43Å; A563-Y565 VanDerWaalsContact O-N 3.13Å; A563-M566 HydrophobicContact CB-CB 4.5Å; A563-M566 HydrophobicContact CB-CG 4.45Å; A563-M566 PolarHBondContact O-N 3.36Å; A563-M566 VanDerWaalsContact O-O 3.13Å
564	Y	86.8	Confident	90.3	Very high	113 Å²	113	69 Å²	69	44%	0.443	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-35.5	-171.3	176.9	-100.1	0	0	0	115	M566 Y731 D732	Y564-M566 VanDerWaalsContact C-N 3.33Å; Y564-Y731 HydrophobicContact CD1-CD2 4.4Å; Y564-Y731 AromaticContact CE1-CD2 3.91Å; Y564-Y731 HydrophobicContact CE1-CD2 3.91Å; Y564-Y731 HydrophobicContact CE1-CG 4.32Å; Y564-D732 PolarHBondContact OH-OD1 2.84Å; Y564-D732 PolarHBondContact OH-OD2 2.75Å
565	Y	86.9	Confident	90.5	Very high	121 Å²	121	66 Å²	66	48%	0.475	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	8.1	179.7	60.2	-84.9	0	0	0	113.6	A563 I578	A563-Y565 VanDerWaalsContact C-N 3.27Å; A563-Y565 HydrophobicContact CB-CD1 4.26Å; A563-Y565 HydrophobicContact CB-CE1 3.84Å; A563-Y565 PolarHBondContact O-N 3.43Å; A563-Y565 VanDerWaalsContact O-N 3.13Å; Y565-I578 PolarHBondContact O-N 3.36Å
566	M	90.6	Very high	90.7	Very high	45 Å²	45	65.4 Å²	65.4	22%	0.222	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	156.3	-175.2	-65.3	-125.6	-176	0	0	112.1	C562 A563 Y564 C575 Q576	C562-M566 HydrophobicContact CB-CB 4.26Å; A563-M566 HydrophobicContact CB-CB 4.5Å; A563-M566 HydrophobicContact CB-CG 4.45Å; A563-M566 PolarHBondContact O-N 3.36Å; A563-M566 VanDerWaalsContact O-O 3.13Å; Y564-M566 VanDerWaalsContact C-N 3.33Å; M566-C575 HydrophobicContact CB-CB 4.09Å; M566-C575 HydrophobicContact SD-CB 4.1Å; M566-Q576 CarbonylContact C-O 3.6Å; M566-Q576 VanDerWaalsContact CA-O 3.28Å; M566-Q576 WeakPolarHBondContact CA-O 3.37Å
567	R	90.6	Very high	90.9	Very high	36 Å²	36	64 Å²	64	14%	0.136	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.7	177	60.8	179	-174.1	171	13.5	109.9	Y550 C575 Q576 I578 P739 M740 A742	Y550-R567 HydrophobicContact CD1-CB 4.39Å; Y550-R567 HydrophobicContact CE1-CB 4.28Å; R567-C575 CarbonylContact O-C 3.45Å; R567-C575 WeakPolarHBondContact O-CA 3.28Å; R567-Q576 HydrophobicContact CG-CG 3.94Å; R567-Q576 PolarHBondContact N-O 2.88Å; R567-Q576 VanDerWaalsContact O-CG 3.26Å; R567-Q576 WeakPolarHBondContact O-CG 3.33Å; R567-Q576 PolarHBondContact O-N 3.19Å; R567-Q576 VanDerWaalsContact O-O 3.05Å; R567-I578 HydrophobicContact CB-CG1 4.01Å; R567-I578 HydrophobicContact CG-CG1 4.07Å; R567-P739 HydrophobicContact CB-CB 4.3Å; R567-P739 WeakPolarHBondContact CD-O 3.3Å; R567-M740 PolarHBondContact NH1-O 2.84Å; R567-A742 PolarHBondContact NH1-O 2.81Å
568	P	93.4	Very high	91	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	153.3	176.1	22.8	-32.3	0	0	0	112.7	G549 A574 Q576 P739	G549-P568 WeakPolarHBondContact O-CG 3.42Å; P568-A574 CarbonylContact C-O 3.47Å; P568-A574 WeakPolarHBondContact CA-O 3.09Å; P568-Q576 PolarHBondContact O-NE2 2.9Å; P568-P739 HydrophobicContact CG-CB 4.04Å; P568-P739 HydrophobicContact CG-CG 4.04Å
569	N	90.4	Very high	90.9	Very high	34 Å²	34	61.5 Å²	61.5	18%	0.182	33%	0.329	C	S	.	.			trans	-73	172.4	169.2	68.1	-13.4	0	0	0	111.3	N571 R572 T573 A574	N569-N571 PolarHBondContact O-N 2.99Å; N569-R572 PolarHBondContact O-N 2.89Å; N569-R572 WeakPolarHBondContact OD1-CA 3.26Å; N569-R572 PolarHBondContact OD1-N 3.43Å; N569-T573 PolarHBondContact ND2-OG1 2.91Å; N569-T573 PolarHBondContact OD1-N 2.89Å; N569-A574 PolarHBondContact N-O 3.16Å; N569-A574 PolarHBondContact OD1-N 3.42Å; N569-A574 VanDerWaalsContact OD1-N 3.15Å; N569-A574 PolarHBondContact OD1-O 2.94Å
570	S	87.3	Confident	90.6	Very high	95 Å²	95	64.6 Å²	64.6	66%	0.664	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-36.2	-179.9	-165.5	0	0	0	0	113.4	R572 M740	S570-R572 VanDerWaalsContact C-N 3.3Å; S570-M740 VanDerWaalsContact CA-CE 3.42Å
571	N	89.1	Confident	90.2	Very high	97 Å²	97	60.7 Å²	60.7	52%	0.519	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	0.3	-179.2	-61.8	-5.1	0	0	0	112.8	G529 N569 T573	G529-N571 WeakPolarHBondContact CA-O 3.48Å; N569-N571 PolarHBondContact O-N 2.99Å; N571-T573 HydrophobicContact CB-CG2 4.3Å; N571-T573 PolarHBondContact O-N 2.83Å; N571-T573 VanDerWaalsContact O-N 3.12Å
572	R	89.2	Confident	89.8	Confident	56 Å²	56	58.7 Å²	58.7	21%	0.211	32%	0.317	C	S	.	.	S	Bend	trans	49.4	32.5	-176.6	-49.1	-172.4	-175.7	-162.3	-1.6	114.5	L546 C547 D548 Y552 Q553 N569 S570	L546-R572 VanDerWaalsContact CD2-NH1 3.31Å; C547-R572 VanDerWaalsContact O-CD 3.22Å; C547-R572 WeakPolarHBondContact O-CD 3.41Å; C547-R572 PolarHBondContact O-NH1 3.32Å; D548-R572 IonicContact OD1-CZ 3.43Å; D548-R572 IonicContact OD1-NH1 2.71Å; D548-R572 PolarHBondContact OD1-NH1 2.86Å; D548-R572 IonicContact OD1-NH2 2.66Å; Y552-R572 CarbonylContact C-O 3.58Å; Y552-R572 VanDerWaalsContact CA-O 3.29Å; Y552-R572 WeakPolarHBondContact CA-O 3.41Å; Y552-R572 WeakPolarHBondContact CB-O 3.33Å; Q553-R572 PolarHBondContact N-O 3.03Å; N569-R572 PolarHBondContact O-N 2.89Å; N569-R572 WeakPolarHBondContact OD1-CA 3.26Å; N569-R572 PolarHBondContact OD1-N 3.43Å; S570-R572 VanDerWaalsContact C-N 3.3Å
573	T	91	Very high	89.4	Confident	61 Å²	61	58.7 Å²	58.7	37%	0.374	32%	0.316	S	S	.	.	S	Bend	trans	-98.9	-17.4	176.7	54.3	0	0	0	0	113.2	Y552 N569 N571	Y552-T573 WeakPolarHBondContact CD2-O 3.43Å; N569-T573 PolarHBondContact ND2-OG1 2.91Å; N569-T573 PolarHBondContact OD1-N 2.89Å; N571-T573 HydrophobicContact CB-CG2 4.3Å; N571-T573 PolarHBondContact O-N 2.83Å; N571-T573 VanDerWaalsContact O-N 3.12Å
574	A	90.9	Very high	89	Confident	42 Å²	42	61.6 Å²	61.6	35%	0.347	32%	0.321	S	S	.	.	S	Bend	trans	-150.6	163.4	-178.3	0	0	0	0	0	111.3	P568 N569	P568-A574 CarbonylContact C-O 3.47Å; P568-A574 WeakPolarHBondContact CA-O 3.09Å; N569-A574 PolarHBondContact N-O 3.16Å; N569-A574 PolarHBondContact OD1-N 3.42Å; N569-A574 VanDerWaalsContact OD1-N 3.15Å; N569-A574 PolarHBondContact OD1-O 2.94Å
575	C	93.2	Very high	89	Confident	44 Å²	44	62 Å²	62	30%	0.297	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	143.7	173.7	-57.2	0	0	0	0	111	Y552 C562 M566 R567	Y552-C575 WeakPolarHBondContact CD1-SG 3.45Å; Y552-C575 VanDerWaalsContact CE1-SG 3.6Å; C562-C575 WeakPolarHBondContact CA-SG 3.23Å; C562-C575 HydrophobicContact CB-CB 3.92Å; C562-C575 WeakPolarHBondContact CB-SG 3.33Å; C562-C575 WeakPolarHBondContact SG-CB 3.17Å; C562-C575 CovalentContact SG-SG 2.04Å; C562-C575 PolarHBondContact SG-SG 3.26Å; M566-C575 HydrophobicContact CB-CB 4.09Å; M566-C575 HydrophobicContact SD-CB 4.1Å; R567-C575 CarbonylContact O-C 3.45Å; R567-C575 WeakPolarHBondContact O-CA 3.28Å
576	Q	93.4	Very high	88.9	Confident	67 Å²	67	64.1 Å²	64.1	31%	0.313	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	152.2	176.1	58.2	175.2	-7.1	0	0	109.9	M566 R567 P568	M566-Q576 CarbonylContact C-O 3.6Å; M566-Q576 VanDerWaalsContact CA-O 3.28Å; M566-Q576 WeakPolarHBondContact CA-O 3.37Å; R567-Q576 HydrophobicContact CG-CG 3.94Å; R567-Q576 PolarHBondContact N-O 2.88Å; R567-Q576 VanDerWaalsContact O-CG 3.26Å; R567-Q576 WeakPolarHBondContact O-CG 3.33Å; R567-Q576 PolarHBondContact O-N 3.19Å; R567-Q576 VanDerWaalsContact O-O 3.05Å; P568-Q576 PolarHBondContact O-NE2 2.9Å
577	P	91.4	Very high	88.7	Confident	87 Å²	87	63 Å²	63	57%	0.565	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	144	-178.9	25.2	-33.7	0	0	0	112.1
578	I	90.6	Very high	88.5	Confident	7 Å²	7	65.7 Å²	65.7	4%	0.036	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-69.4	129.9	173.7	-65	172	0	0	0	108.8	Y550 Y565 R567 Y731 A742	Y550-I578 HydrophobicContact CE1-CD1 4.49Å; Y565-I578 PolarHBondContact O-N 3.36Å; R567-I578 HydrophobicContact CB-CG1 4.01Å; R567-I578 HydrophobicContact CG-CG1 4.07Å; I578-Y731 HydrophobicContact CB-CD1 4.1Å; I578-Y731 HydrophobicContact CB-CE1 3.96Å; I578-Y731 HydrophobicContact CD1-CD1 4.18Å; I578-Y731 HydrophobicContact CG2-CD1 4.02Å; I578-Y731 HydrophobicContact CG2-CE1 4.18Å; I578-A742 HydrophobicContact CG2-CB 4.42Å; I578-A742 WeakPolarHBondContact CG2-O 3.39Å
579	P	89.3	Confident	88.2	Confident	51 Å²	51	70.4 Å²	70.4	33%	0.331	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-66	136.6	-179.7	27.4	-35.2	0	0	0	111.1	R743 G744	P579-R743 HydrophobicContact CG-CG 4.37Å; P579-R743 WeakPolarHBondContact O-CA 3.31Å; P579-G744 PolarHBondContact O-N 3.02Å
580	I	88.3	Confident	88.1	Confident	91 Å²	91	68.9 Å²	68.9	47%	0.467	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.9	-179	-56.6	171	0	0	0	109.1	V729 G744 L746	I580-V729 HydrophobicContact CD1-CG1 4.22Å; I580-V729 HydrophobicContact CD1-CG2 4.12Å; I580-V729 HydrophobicContact CG1-CG1 4.12Å; I580-V729 HydrophobicContact CG2-CG1 4.29Å; I580-G744 CarbonylContact C-O 3.54Å; I580-G744 VanDerWaalsContact CA-O 3.27Å; I580-G744 WeakPolarHBondContact CA-O 3.42Å; I580-L746 HydrophobicContact CG2-CB 3.7Å
581	I	85.5	Confident	88.3	Confident	33 Å²	33	68.7 Å²	68.7	17%	0.169	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	154.2	172.8	62.4	157.9	0	0	0	111.8	R743 G744 V745 L746	I581-R743 HydrophobicContact CG1-CB 4.35Å; I581-R743 HydrophobicContact CG2-CB 4.24Å; I581-R743 HydrophobicContact CG2-CG 4.14Å; I581-G744 WeakPolarHBondContact CG1-O 3.41Å; I581-G744 PolarHBondContact N-O 3.08Å; I581-V745 HydrophobicContact CD1-CG2 4.18Å; I581-V745 HydrophobicContact CG1-CG2 4.12Å; I581-L746 PolarHBondContact O-N 2.84Å
582	K	84.8	Confident	88.3	Confident	84 Å²	84	69 Å²	69	37%	0.365	36%	0.355	S	S	.	.			trans	-145.2	160.7	179.5	60.9	-175	177	-176.7	0	108.9	E584 K648	K582-E584 HydrophobicContact CG-CG 4.5Å; K582-E584 PolarHBondContact O-N 3.41Å; K582-K648 HydrophobicContact CD-CG 4.35Å
583	L	82	Confident	88.5	Confident	18 Å²	18	66.4 Å²	66.4	9%	0.094	35%	0.345	C	S	.	.			trans	-67.9	119.7	171.5	-172	64.6	0	0	0	109.4	I646 Y818 T821	L583-I646 HydrophobicContact CD2-CB 4.44Å; L583-I646 HydrophobicContact CD2-CG1 4.13Å; L583-I646 HydrophobicContact CD2-CG2 4.33Å; L583-Y818 HydrophobicContact CD1-CD1 3.33Å; L583-Y818 HydrophobicContact CD1-CE1 3.56Å; L583-T821 HydrophobicContact CD2-CG2 4.12Å
584	E	84.8	Confident	88.6	Confident	111 Å²	111	64.9 Å²	64.9	52%	0.519	34%	0.336	S	S	.	.			trans	-97.7	145.4	178.5	-61.8	-167.8	160.8	0	0	111.4	K582 H586 S587	K582-E584 HydrophobicContact CG-CG 4.5Å; K582-E584 PolarHBondContact O-N 3.41Å; E584-H586 PolarHBondContact O-N 2.87Å; E584-S587 WeakPolarHBondContact O-CB 3.32Å; E584-S587 PolarHBondContact O-N 3.08Å
585	W	86.3	Confident	88.7	Confident	121 Å²	121	69 Å²	69	46%	0.458	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.5	-179.5	-65.4	95	0	0	0	113.9	S587 V594 F643 I646 A647	W585-S587 VanDerWaalsContact C-N 3.28Å; W585-V594 HydrophobicContact CE3-CG2 4.41Å; W585-V594 HydrophobicContact CZ3-CG2 4.15Å; W585-F643 HydrophobicContact CH2-CB 4.42Å; W585-F643 HydrophobicContact CH2-CD1 4.25Å; W585-F643 HydrophobicContact CZ3-CD1 4.08Å; W585-I646 HydrophobicContact CD2-CG2 3.89Å; W585-I646 HydrophobicContact CE3-CB 4.5Å; W585-I646 HydrophobicContact CE3-CG2 3.62Å; W585-I646 HydrophobicContact CH2-CB 4.31Å; W585-I646 HydrophobicContact CH2-CG2 4.15Å; W585-I646 HydrophobicContact CZ2-CG2 4.4Å; W585-I646 HydrophobicContact CZ3-CB 4.15Å; W585-I646 HydrophobicContact CZ3-CG2 3.76Å; W585-A647 HydrophobicContact CZ2-CB 4.14Å
586	H	84.6	Confident	88.7	Confident	166 Å²	166	69.6 Å²	69.6	77%	0.769	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-5	178.4	-55.7	99.4	0	0	0	113.2	E584	E584-H586 PolarHBondContact O-N 2.87Å
587	S	87	Confident	88.7	Confident	21 Å²	21	66.4 Å²	66.4	15%	0.147	33%	0.331	C	S	.	.	S	Bend	trans	-66.2	136.3	177.8	-178.3	0	0	0	0	110.3	E584 W585 W589 A590 I591	E584-S587 WeakPolarHBondContact O-CB 3.32Å; E584-S587 PolarHBondContact O-N 3.08Å; W585-S587 VanDerWaalsContact C-N 3.28Å; S587-W589 PolarHBondContact O-N 3.21Å; S587-W589 VanDerWaalsContact O-N 3.08Å; S587-A590 PolarHBondContact O-N 2.88Å; S587-I591 WeakPolarHBondContact O-CG1 3.32Å; S587-I591 PolarHBondContact O-N 3.35Å; S587-I591 VanDerWaalsContact O-N 3.14Å
588	P	85.8	Confident	88.9	Confident	93 Å²	93	66.5 Å²	66.5	60%	0.604	33%	0.325	S	S	*	.	H	α-helix	trans	-52.2	-33.8	174.9	-26.9	34.6	0	0	0	113	A590 I591	P588-A590 VanDerWaalsContact C-N 3.28Å; P588-A590 PolarHBondContact O-N 2.95Å; P588-I591 PolarHBondContact O-N 3.23Å
589	W	87.4	Confident	89.1	Confident	100 Å²	100	70.5 Å²	70.5	38%	0.379	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-27.5	177.2	-60.2	111.7	0	0	0	113.7	S587 P593 Y818 I819 T822	S587-W589 PolarHBondContact O-N 3.21Å; S587-W589 VanDerWaalsContact O-N 3.08Å; W589-P593 WeakPolarHBondContact O-CD 3.31Å; W589-Y818 HydrophobicContact CB-CD1 4.47Å; W589-Y818 AromaticContact CD1-CD1 3.95Å; W589-Y818 HydrophobicContact CG-CD1 4.4Å; W589-I819 HydrophobicContact CH2-CG1 4.39Å; W589-T822 HydrophobicContact CE3-CG2 4.31Å; W589-T822 WeakPolarHBondContact O-CG2 3.47Å; W589-T822 PolarHBondContact O-OG1 3.44Å
590	A	89.2	Confident	89.4	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-93	-32.6	179.3	0	0	0	0	0	113	S587 P588 I592 P593 V594 I646	S587-A590 PolarHBondContact O-N 2.88Å; P588-A590 VanDerWaalsContact C-N 3.28Å; P588-A590 PolarHBondContact O-N 2.95Å; A590-I592 PolarHBondContact O-N 3.28Å; A590-P593 WeakPolarHBondContact O-CD 3.23Å; A590-V594 VanDerWaalsContact O-CG2 3.23Å; A590-V594 WeakPolarHBondContact O-CG2 3.23Å; A590-V594 PolarHBondContact O-N 2.89Å; A590-I646 HydrophobicContact CB-CD1 4.1Å; A590-I646 HydrophobicContact CB-CG1 4.44Å; A590-I646 HydrophobicContact CB-CG2 3.86Å
591	I	90.3	Very high	89.8	Confident	91 Å²	91	64.9 Å²	64.9	47%	0.467	32%	0.315	S	S	.	.	H	α-helix	trans	-62.9	-45.7	-174.9	-68.3	167.9	0	0	0	111.8	S587 P588 V594 F595	S587-I591 WeakPolarHBondContact O-CG1 3.32Å; S587-I591 PolarHBondContact O-N 3.35Å; S587-I591 VanDerWaalsContact O-N 3.14Å; P588-I591 PolarHBondContact O-N 3.23Å; I591-V594 PolarHBondContact O-N 3.43Å; I591-F595 WeakPolarHBondContact O-CB 3.13Å; I591-F595 PolarHBondContact O-N 3.45Å
592	I	89.9	Confident	90.2	Very high	105 Å²	105	68.5 Å²	68.5	54%	0.538	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-52.4	-175.4	-62.4	167.5	0	0	0	111.9	A590 V594 F595 L596	A590-I592 PolarHBondContact O-N 3.28Å; I592-V594 PolarHBondContact O-N 3.4Å; I592-F595 PolarHBondContact O-N 3.46Å; I592-L596 HydrophobicContact CG2-CD1 4.46Å; I592-L596 PolarHBondContact O-N 3.01Å
593	P	91.9	Very high	90.7	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.4	-42	175.9	-20.9	27.7	0	0	0	113.6	W589 A590 F595 L596 A597 T642 I646 T822 T825 V826	W589-P593 WeakPolarHBondContact O-CD 3.31Å; A590-P593 WeakPolarHBondContact O-CD 3.23Å; P593-F595 VanDerWaalsContact C-N 3.35Å; P593-F595 PolarHBondContact O-N 3.49Å; P593-L596 PolarHBondContact O-N 2.93Å; P593-A597 WeakPolarHBondContact O-CB 3.47Å; P593-A597 PolarHBondContact O-N 2.81Å; P593-T642 HydrophobicContact CB-CG2 3.66Å; P593-I646 HydrophobicContact CB-CD1 4.41Å; P593-T822 HydrophobicContact CG-CG2 3.94Å; P593-T825 WeakPolarHBondContact CB-OG1 3.1Å; P593-V826 HydrophobicContact CB-CG2 4.42Å; P593-V826 HydrophobicContact CG-CG2 3.96Å
594	V	93.3	Very high	91.3	Very high	30 Å²	30	64.9 Å²	64.9	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-43.1	-178.6	169.4	0	0	0	0	111.1	W585 A590 I591 I592 A597 M598 F643 I646	W585-V594 HydrophobicContact CE3-CG2 4.41Å; W585-V594 HydrophobicContact CZ3-CG2 4.15Å; A590-V594 VanDerWaalsContact O-CG2 3.23Å; A590-V594 WeakPolarHBondContact O-CG2 3.23Å; A590-V594 PolarHBondContact O-N 2.89Å; I591-V594 PolarHBondContact O-N 3.43Å; I592-V594 PolarHBondContact O-N 3.4Å; V594-A597 PolarHBondContact O-N 2.82Å; V594-M598 HydrophobicContact CG1-CG 4.39Å; V594-M598 WeakPolarHBondContact O-CG 3.48Å; V594-M598 PolarHBondContact O-N 2.91Å; V594-F643 HydrophobicContact CG1-CE1 3.84Å; V594-F643 HydrophobicContact CG1-CZ 4.3Å; V594-I646 HydrophobicContact CG2-CD1 3.44Å; V594-I646 VanDerWaalsContact CG2-CD1 3.44Å
595	F	93.4	Very high	91.7	Very high	129 Å²	129	64 Å²	64	57%	0.566	32%	0.32	S	S	*	.	H	α-helix	trans	-61.3	-46	177.8	179.7	-103.6	0	0	0	111.9	I591 I592 P593 A597 M598 L599	I591-F595 WeakPolarHBondContact O-CB 3.13Å; I591-F595 PolarHBondContact O-N 3.45Å; I592-F595 PolarHBondContact O-N 3.46Å; P593-F595 VanDerWaalsContact C-N 3.35Å; P593-F595 PolarHBondContact O-N 3.49Å; F595-A597 VanDerWaalsContact C-N 3.34Å; F595-A597 PolarHBondContact O-N 3.31Å; F595-M598 PolarHBondContact O-N 3.2Å; F595-L599 HydrophobicContact CD1-CD1 4.07Å; F595-L599 HydrophobicContact CE1-CD1 3.44Å; F595-L599 VanDerWaalsContact CE1-CD1 3.44Å; F595-L599 HydrophobicContact CE1-CG 4.34Å; F595-L599 HydrophobicContact CE2-CD1 4.35Å; F595-L599 HydrophobicContact CZ-CD1 3.62Å; F595-L599 HydrophobicContact CZ-CG 4.23Å; F595-L599 PolarHBondContact O-N 2.85Å; F595-L599 VanDerWaalsContact O-N 3.12Å
596	L	92.8	Very high	92.1	Very high	55 Å²	55	63.2 Å²	63.2	29%	0.288	32%	0.32	S	S	.	.	H	α-helix	trans	-61.6	-41.3	175.6	-70.2	175.5	0	0	0	112.1	I592 P593 G600 N829	I592-L596 HydrophobicContact CG2-CD1 4.46Å; I592-L596 PolarHBondContact O-N 3.01Å; P593-L596 PolarHBondContact O-N 2.93Å; L596-G600 PolarHBondContact O-N 2.83Å; L596-N829 HydrophobicContact CB-CB 4.37Å
597	A	95.3	Very high	92.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.1	-42	177.8	0	0	0	0	0	112.4	P593 V594 F595 G600 I601 T642 F643 N829	P593-A597 WeakPolarHBondContact O-CB 3.47Å; P593-A597 PolarHBondContact O-N 2.81Å; V594-A597 PolarHBondContact O-N 2.82Å; F595-A597 VanDerWaalsContact C-N 3.34Å; F595-A597 PolarHBondContact O-N 3.31Å; A597-G600 PolarHBondContact O-N 2.81Å; A597-I601 VanDerWaalsContact O-CG1 3.28Å; A597-I601 WeakPolarHBondContact O-CG1 3.2Å; A597-I601 PolarHBondContact O-N 3.22Å; A597-T642 HydrophobicContact CB-CG2 3.97Å; A597-F643 HydrophobicContact CB-CE2 3.94Å; A597-F643 HydrophobicContact CB-CZ 4.29Å; A597-N829 VanDerWaalsContact CA-OD1 3.22Å; A597-N829 WeakPolarHBondContact CA-OD1 3.4Å; A597-N829 WeakPolarHBondContact CB-OD1 3.38Å; A597-N829 PolarHBondContact N-OD1 2.88Å
598	M	95.2	Very high	92.6	Very high	90 Å²	90	56.6 Å²	56.6	44%	0.443	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-47.1	177.5	-74.8	-59.9	-68.9	0	0	111.9	V594 F595 G600 I601 I602 F643	V594-M598 HydrophobicContact CG1-CG 4.39Å; V594-M598 WeakPolarHBondContact O-CG 3.48Å; V594-M598 PolarHBondContact O-N 2.91Å; F595-M598 PolarHBondContact O-N 3.2Å; M598-G600 VanDerWaalsContact C-N 3.31Å; M598-G600 PolarHBondContact O-N 2.89Å; M598-I601 PolarHBondContact O-N 2.04Å; M598-I602 VanDerWaalsContact O-CG1 3.31Å; M598-I602 WeakPolarHBondContact O-CG1 3.46Å; M598-I602 PolarHBondContact O-N 3.43Å; M598-F643 HydrophobicContact CG-CE1 4.49Å; M598-F643 HydrophobicContact CG-CZ 3.88Å; M598-F643 HydrophobicContact SD-CE1 4.11Å; M598-F643 HydrophobicContact SD-CE2 4.42Å; M598-F643 HydrophobicContact SD-CZ 3.48Å; M598-F643 WeakPolarHBondContact SD-CZ 3.49Å
599	L	95.1	Very high	92.9	Very high	90 Å²	90	54.9 Å²	54.9	47%	0.471	28%	0.281	S	S	.	.	H	α-helix	trans	-60.2	-43.1	174.9	-71.7	179.3	0	0	0	111.5	F595 I602 A603	F595-L599 HydrophobicContact CD1-CD1 4.07Å; F595-L599 HydrophobicContact CE1-CD1 3.44Å; F595-L599 VanDerWaalsContact CE1-CD1 3.44Å; F595-L599 HydrophobicContact CE1-CG 4.34Å; F595-L599 HydrophobicContact CE2-CD1 4.35Å; F595-L599 HydrophobicContact CZ-CD1 3.62Å; F595-L599 HydrophobicContact CZ-CG 4.23Å; F595-L599 PolarHBondContact O-N 2.85Å; F595-L599 VanDerWaalsContact O-N 3.12Å; L599-I602 PolarHBondContact O-N 2.93Å; L599-A603 WeakPolarHBondContact O-CB 3.28Å; L599-A603 PolarHBondContact O-N 2.92Å
600	G	94.5	Very high	93	Very high	5 Å²	5	50.7 Å²	50.7	5%	0.052	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-42.8	176.9	0	0	0	0	0	113.6	L596 A597 M598 A603 T604 Y639	L596-G600 PolarHBondContact O-N 2.83Å; A597-G600 PolarHBondContact O-N 2.81Å; M598-G600 VanDerWaalsContact C-N 3.31Å; M598-G600 PolarHBondContact O-N 2.89Å; G600-A603 PolarHBondContact O-N 3.2Å; G600-T604 WeakPolarHBondContact O-CB 3.32Å; G600-T604 PolarHBondContact O-N 2.94Å; G600-T604 PolarHBondContact O-OG1 2.64Å; G600-Y639 VanDerWaalsContact CA-CZ 3.43Å
601	I	96.1	Very high	93	Very high	20 Å²	20	50.6 Å²	50.6	10%	0.103	27%	0.266	C	S	.	.	H	α-helix	trans	-62.8	-48.6	176.6	-73.5	164.6	0	0	0	110.6	A597 M598 A603 T604 I605 F636 Y639 I640 F643	A597-I601 VanDerWaalsContact O-CG1 3.28Å; A597-I601 WeakPolarHBondContact O-CG1 3.2Å; A597-I601 PolarHBondContact O-N 3.22Å; M598-I601 PolarHBondContact O-N 2.04Å; I601-A603 VanDerWaalsContact C-N 3.33Å; I601-A603 PolarHBondContact O-N 2.75Å; I601-T604 PolarHBondContact O-N 2.82Å; I601-I605 HydrophobicContact CG2-CD1 3.69Å; I601-I605 HydrophobicContact CG2-CG1 4.39Å; I601-I605 VanDerWaalsContact O-CG1 3.32Å; I601-I605 WeakPolarHBondContact O-CG1 3.38Å; I601-I605 PolarHBondContact O-N 3.34Å; I601-F636 HydrophobicContact CG1-CE2 4.5Å; I601-F636 HydrophobicContact CG2-CE2 3.97Å; I601-Y639 HydrophobicContact CG1-CG 4.35Å; I601-I640 HydrophobicContact CD1-CD1 3.79Å; I601-I640 HydrophobicContact CD1-CG1 4.44Å; I601-F643 HydrophobicContact CD1-CE2 3.69Å; I601-F643 HydrophobicContact CD1-CZ 4.43Å
602	I	95.4	Very high	92.9	Very high	108 Å²	108	50.4 Å²	50.4	55%	0.554	27%	0.269	S	S	*	.	H	α-helix	trans	-59.3	-47.2	179	-66.6	166.2	0	0	0	110	M598 L599 T604 I605 F606	M598-I602 VanDerWaalsContact O-CG1 3.31Å; M598-I602 WeakPolarHBondContact O-CG1 3.46Å; M598-I602 PolarHBondContact O-N 3.43Å; L599-I602 PolarHBondContact O-N 2.93Å; I602-T604 PolarHBondContact O-N 3.28Å; I602-I605 PolarHBondContact O-N 3.12Å; I602-F606 WeakPolarHBondContact O-CB 2.94Å; I602-F606 PolarHBondContact O-N 3.24Å
603	A	94.1	Very high	92.9	Very high	25 Å²	25	54.1 Å²	54.1	21%	0.207	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-40.6	177.4	0	0	0	0	0	112.2	L599 G600 I601 F606 V607 L836	L599-A603 WeakPolarHBondContact O-CB 3.28Å; L599-A603 PolarHBondContact O-N 2.92Å; G600-A603 PolarHBondContact O-N 3.2Å; I601-A603 VanDerWaalsContact C-N 3.33Å; I601-A603 PolarHBondContact O-N 2.75Å; A603-F606 PolarHBondContact O-N 3.41Å; A603-V607 VanDerWaalsContact O-CG2 3.3Å; A603-V607 WeakPolarHBondContact O-CG2 3.42Å; A603-V607 PolarHBondContact O-N 2.96Å; A603-L836 HydrophobicContact CB-CD2 3.64Å
604	T	94.3	Very high	92.7	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-42.9	179.1	-56	0	0	0	0	111.6	G600 I601 I602 F606 V607 M608 L632 I635 F636 Y639	G600-T604 WeakPolarHBondContact O-CB 3.32Å; G600-T604 PolarHBondContact O-N 2.94Å; G600-T604 PolarHBondContact O-OG1 2.64Å; I601-T604 PolarHBondContact O-N 2.82Å; I602-T604 PolarHBondContact O-N 3.28Å; T604-F606 VanDerWaalsContact C-N 3.33Å; T604-V607 PolarHBondContact O-N 3.45Å; T604-M608 VanDerWaalsContact O-CB 3.25Å; T604-M608 WeakPolarHBondContact O-CB 3.46Å; T604-M608 PolarHBondContact O-N 3Å; T604-L632 HydrophobicContact CG2-CD2 4.43Å; T604-I635 HydrophobicContact CG2-CG2 4.2Å; T604-F636 HydrophobicContact CG2-CB 4.07Å; T604-Y639 WeakPolarHBondContact OG1-CE2 3.45Å
605	I	94.1	Very high	92.3	Very high	91 Å²	91	59.4 Å²	59.4	47%	0.467	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-42.6	175.4	-67.9	168.5	0	0	0	110.2	I601 I602 M608 A609 F636	I601-I605 HydrophobicContact CG2-CD1 3.69Å; I601-I605 HydrophobicContact CG2-CG1 4.39Å; I601-I605 VanDerWaalsContact O-CG1 3.32Å; I601-I605 WeakPolarHBondContact O-CG1 3.38Å; I601-I605 PolarHBondContact O-N 3.34Å; I602-I605 PolarHBondContact O-N 3.12Å; I605-M608 PolarHBondContact O-N 2.83Å; I605-A609 VanDerWaalsContact O-CB 3.27Å; I605-A609 WeakPolarHBondContact O-CB 3.46Å; I605-A609 PolarHBondContact O-N 2.94Å; I605-F636 HydrophobicContact CD1-CE2 4.44Å; I605-F636 HydrophobicContact CG1-CE2 4.42Å
606	F	93.8	Very high	91.7	Very high	106 Å²	106	58.4 Å²	58.4	47%	0.465	30%	0.297	S	S	.	.	H	α-helix	trans	-60.5	-47.7	176.7	174.9	-103.1	0	0	0	112.5	I602 A603 T604 T610 V844 I848	I602-F606 WeakPolarHBondContact O-CB 2.94Å; I602-F606 PolarHBondContact O-N 3.24Å; A603-F606 PolarHBondContact O-N 3.41Å; T604-F606 VanDerWaalsContact C-N 3.33Å; F606-T610 WeakPolarHBondContact O-CB 3.46Å; F606-T610 PolarHBondContact O-N 3.12Å; F606-T610 PolarHBondContact O-OG1 3.42Å; F606-V844 HydrophobicContact CE1-CG1 3.79Å; F606-V844 HydrophobicContact CZ-CG1 4.42Å; F606-I848 HydrophobicContact CE1-CD1 4.36Å; F606-I848 HydrophobicContact CZ-CD1 3.74Å
607	V	92.4	Very high	91.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-46.3	175.4	172.5	0	0	0	0	110.8	A603 T604 T610 F611 L632 L836 Y840 V844	A603-V607 VanDerWaalsContact O-CG2 3.3Å; A603-V607 WeakPolarHBondContact O-CG2 3.42Å; A603-V607 PolarHBondContact O-N 2.96Å; T604-V607 PolarHBondContact O-N 3.45Å; V607-T610 PolarHBondContact O-N 3.4Å; V607-F611 HydrophobicContact CG1-CD2 4.07Å; V607-F611 HydrophobicContact CG1-CE2 4.16Å; V607-F611 WeakPolarHBondContact O-CD2 3.45Å; V607-F611 PolarHBondContact O-N 3.26Å; V607-L632 HydrophobicContact CB-CD2 4.45Å; V607-L632 HydrophobicContact CG1-CD1 4.18Å; V607-L632 HydrophobicContact CG1-CD2 3.78Å; V607-L836 HydrophobicContact CB-CD1 4.18Å; V607-L836 HydrophobicContact CG1-CD1 4.32Å; V607-L836 HydrophobicContact CG2-CD1 3.91Å; V607-Y840 HydrophobicContact CG1-CD1 4.02Å; V607-Y840 HydrophobicContact CG1-CG 4.06Å; V607-V844 HydrophobicContact CB-CG2 4.4Å; V607-V844 HydrophobicContact CG1-CG2 4.05Å; V607-V844 HydrophobicContact CG2-CG2 4.1Å
608	M	91.5	Very high	90.4	Very high	47 Å²	47	58.6 Å²	58.6	23%	0.232	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-49.6	178.8	-174.5	70	86.5	0	0	111.6	T604 I605 T610 F611 V612 Y629 L632	T604-M608 VanDerWaalsContact O-CB 3.25Å; T604-M608 WeakPolarHBondContact O-CB 3.46Å; T604-M608 PolarHBondContact O-N 3Å; I605-M608 PolarHBondContact O-N 2.83Å; M608-T610 VanDerWaalsContact C-N 3.29Å; M608-T610 PolarHBondContact O-N 2.84Å; M608-F611 PolarHBondContact O-N 2.98Å; M608-V612 WeakPolarHBondContact O-CG2 3.44Å; M608-V612 PolarHBondContact O-N 3.12Å; M608-Y629 HydrophobicContact SD-CD1 3.55Å; M608-Y629 VanDerWaalsContact SD-CD1 3.55Å; M608-Y629 HydrophobicContact SD-CE1 4Å; M608-L632 HydrophobicContact CE-CB 3.39Å; M608-L632 HydrophobicContact CE-CD1 4.25Å; M608-L632 HydrophobicContact CE-CG 4.45Å; M608-L632 HydrophobicContact SD-CB 4.2Å; M608-L632 HydrophobicContact SD-CD1 3.93Å
609	A	90.6	Very high	89.8	Confident	57 Å²	57	56 Å²	56	47%	0.471	29%	0.29	S	S	.	.	H	α-helix	trans	-60.5	-39.8	178.8	0	0	0	0	0	111.7	I605 V612 R613	I605-A609 VanDerWaalsContact O-CB 3.27Å; I605-A609 WeakPolarHBondContact O-CB 3.46Å; I605-A609 PolarHBondContact O-N 2.94Å; A609-V612 PolarHBondContact O-N 3.04Å; A609-R613 VanDerWaalsContact O-CB 3.23Å; A609-R613 WeakPolarHBondContact O-CB 3.43Å; A609-R613 PolarHBondContact O-N 2.9Å
610	T	89.9	Confident	89.2	Confident	12 Å²	12	51.8 Å²	51.8	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-46	176.1	-56	0	0	0	0	111.1	F606 V607 M608 V612 R613 Y614 V844 I847 I848	F606-T610 WeakPolarHBondContact O-CB 3.46Å; F606-T610 PolarHBondContact O-N 3.12Å; F606-T610 PolarHBondContact O-OG1 3.42Å; V607-T610 PolarHBondContact O-N 3.4Å; M608-T610 VanDerWaalsContact C-N 3.29Å; M608-T610 PolarHBondContact O-N 2.84Å; T610-V612 PolarHBondContact O-N 3.47Å; T610-R613 PolarHBondContact O-N 2.96Å; T610-Y614 HydrophobicContact CG2-CD2 3.91Å; T610-Y614 HydrophobicContact CG2-CE2 4.35Å; T610-Y614 WeakPolarHBondContact O-CB 3.43Å; T610-Y614 WeakPolarHBondContact O-CD2 3.21Å; T610-Y614 PolarHBondContact O-N 3.4Å; T610-V844 HydrophobicContact CG2-CG1 4.26Å; T610-I847 HydrophobicContact CG2-CG2 4.18Å; T610-I848 HydrophobicContact CG2-CD1 4.22Å; T610-I848 HydrophobicContact CG2-CG1 4.29Å
611	F	88.8	Confident	88.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-39.4	178.5	-91.2	-121.8	0	0	0	112.4	V607 M608 Y614 N615 V620 Y629 Y840 K843 V844 I847	V607-F611 HydrophobicContact CG1-CD2 4.07Å; V607-F611 HydrophobicContact CG1-CE2 4.16Å; V607-F611 WeakPolarHBondContact O-CD2 3.45Å; V607-F611 PolarHBondContact O-N 3.26Å; M608-F611 PolarHBondContact O-N 2.98Å; F611-Y614 CarbonylContact O-C 3.34Å; F611-N615 VanDerWaalsContact O-CA 3.23Å; F611-N615 WeakPolarHBondContact O-CA 3.43Å; F611-N615 PolarHBondContact O-N 3Å; F611-N615 VanDerWaalsContact O-N 3.08Å; F611-V620 HydrophobicContact CD1-CG1 3.94Å; F611-V620 HydrophobicContact CD1-CG2 4.19Å; F611-V620 HydrophobicContact CE1-CG1 4.36Å; F611-V620 HydrophobicContact CE1-CG2 4.27Å; F611-V620 HydrophobicContact CG-CG2 4.42Å; F611-Y629 HydrophobicContact CB-CE1 4.13Å; F611-Y629 PolarHBondContact O-OH 3.03Å; F611-Y840 HydrophobicContact CD1-CE1 4.47Å; F611-Y840 AromaticContact CE1-CD1 3.87Å; F611-Y840 HydrophobicContact CE1-CD1 3.87Å; F611-Y840 AromaticContact CE1-CE1 3.78Å; F611-Y840 HydrophobicContact CE1-CE1 3.78Å; F611-Y840 AromaticContact CE2-CD1 3.99Å; F611-Y840 HydrophobicContact CE2-CD1 3.99Å; F611-Y840 AromaticContact CZ-CD1 3.49Å; F611-Y840 HydrophobicContact CZ-CD1 3.49Å; F611-Y840 VanDerWaalsContact CZ-CD1 3.49Å; F611-Y840 AromaticContact CZ-CE1 3.91Å; F611-Y840 HydrophobicContact CZ-CE1 3.91Å; F611-K843 HydrophobicContact CZ-CB 4.2Å; F611-K843 HydrophobicContact CZ-CD 4.19Å; F611-V844 HydrophobicContact CD2-CG2 4.16Å; F611-V844 HydrophobicContact CE2-CG2 3.71Å; F611-I847 HydrophobicContact CE2-CD1 4.41Å
612	V	88.9	Confident	87.5	Confident	86 Å²	86	59.9 Å²	59.9	52%	0.521	31%	0.308	S	S	.	.	H	α-helix	trans	-68.1	-43.2	175.2	173.2	0	0	0	0	111.1	M608 A609 T610 Y614 N615 Y629	M608-V612 WeakPolarHBondContact O-CG2 3.44Å; M608-V612 PolarHBondContact O-N 3.12Å; A609-V612 PolarHBondContact O-N 3.04Å; T610-V612 PolarHBondContact O-N 3.47Å; V612-Y614 VanDerWaalsContact C-N 3.33Å; V612-Y614 PolarHBondContact O-N 2.64Å; V612-N615 WeakPolarHBondContact O-CB 3.15Å; V612-N615 PolarHBondContact O-N 2.87Å; V612-Y629 HydrophobicContact CG2-CE1 3.8Å
613	R	89.4	Confident	86.6	Confident	183 Å²	183	54.9 Å²	54.9	69%	0.691	28%	0.283	S	S	*	.	H	α-helix	trans	-67	-32.5	-179.3	-178.7	59.4	-179.6	78.9	-0.2	113.3	A609 T610	A609-R613 VanDerWaalsContact O-CB 3.23Å; A609-R613 WeakPolarHBondContact O-CB 3.43Å; A609-R613 PolarHBondContact O-N 2.9Å; T610-R613 PolarHBondContact O-N 2.96Å
614	Y	87.2	Confident	86	Confident	95 Å²	95	54.2 Å²	54.2	37%	0.373	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	30.4	-178.8	-66.1	-72.9	0	0	0	112.6	T610 F611 V612 D616 T617 I847	T610-Y614 HydrophobicContact CG2-CD2 3.91Å; T610-Y614 HydrophobicContact CG2-CE2 4.35Å; T610-Y614 WeakPolarHBondContact O-CB 3.43Å; T610-Y614 WeakPolarHBondContact O-CD2 3.21Å; T610-Y614 PolarHBondContact O-N 3.4Å; F611-Y614 CarbonylContact O-C 3.34Å; V612-Y614 VanDerWaalsContact C-N 3.33Å; V612-Y614 PolarHBondContact O-N 2.64Å; Y614-D616 PolarHBondContact O-N 3.47Å; Y614-T617 HydrophobicContact CD1-CG2 4.16Å; Y614-T617 HydrophobicContact CG-CG2 4.41Å; Y614-T617 WeakPolarHBondContact O-CB 3.28Å; Y614-T617 WeakPolarHBondContact O-CG2 3.41Å; Y614-T617 PolarHBondContact O-N 3.11Å; Y614-T617 PolarHBondContact O-OG1 3.22Å; Y614-I847 HydrophobicContact CD1-CG2 4.44Å; Y614-I847 HydrophobicContact CD2-CG2 3.65Å; Y614-I847 HydrophobicContact CE2-CG2 4.18Å; Y614-I847 HydrophobicContact CG-CG2 3.8Å
615	N	84.8	Confident	85.5	Confident	47 Å²	47	57.6 Å²	57.6	25%	0.251	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.7	-172.2	-166.8	33.1	0	0	0	115.1	F611 V612 R625 Y629	F611-N615 VanDerWaalsContact O-CA 3.23Å; F611-N615 WeakPolarHBondContact O-CA 3.43Å; F611-N615 PolarHBondContact O-N 3Å; F611-N615 VanDerWaalsContact O-N 3.08Å; V612-N615 WeakPolarHBondContact O-CB 3.15Å; V612-N615 PolarHBondContact O-N 2.87Å; N615-R625 VanDerWaalsContact O-CD 3.29Å; N615-R625 WeakPolarHBondContact O-CD 3.46Å; N615-R625 PolarHBondContact O-NH1 2.66Å; N615-R625 VanDerWaalsContact OD1-CD 3.27Å; N615-R625 WeakPolarHBondContact OD1-CD 3.13Å; N615-Y629 VanDerWaalsContact CG-OH 3.3Å; N615-Y629 PolarHBondContact OD1-OH 3.34Å
616	D	81.4	Confident	85.2	Confident	107 Å²	107	57.1 Å²	57.1	57%	0.572	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-3.5	178.8	-69.6	-42.7	0	0	0	114.3	Y614 R621 R625	Y614-D616 PolarHBondContact O-N 3.47Å; D616-R621 IonicContact OD1-CZ 2.76Å; D616-R621 IonicContact OD1-NE 3.25Å; D616-R621 IonicContact OD1-NH2 2.71Å; D616-R621 PolarHBondContact OD1-NH2 3.15Å; D616-R625 IonicContact OD1-NH1 3.41Å; D616-R625 PolarHBondContact OD1-NH1 2.96Å
617	T	83.5	Confident	84.9	Confident	19 Å²	19	52.2 Å²	52.2	12%	0.117	27%	0.265	C	S	.	.	S	Bend	trans	-67.2	143.9	178	60.1	0	0	0	0	112	Y614 I619 V620 R621 N854	Y614-T617 HydrophobicContact CD1-CG2 4.16Å; Y614-T617 HydrophobicContact CG-CG2 4.41Å; Y614-T617 WeakPolarHBondContact O-CB 3.28Å; Y614-T617 WeakPolarHBondContact O-CG2 3.41Å; Y614-T617 PolarHBondContact O-N 3.11Å; Y614-T617 PolarHBondContact O-OG1 3.22Å; T617-I619 PolarHBondContact O-N 2.96Å; T617-V620 PolarHBondContact O-N 2.83Å; T617-V620 VanDerWaalsContact OG1-CG2 3.3Å; T617-V620 WeakPolarHBondContact OG1-CG2 3.42Å; T617-R621 PolarHBondContact O-N 3.44Å; T617-N854 WeakPolarHBondContact CB-ND2 3.18Å; T617-N854 WeakPolarHBondContact CB-OD1 3.22Å; T617-N854 WeakPolarHBondContact CG2-ND2 3.22Å
618	P	78.4	Confident	84.8	Confident	41 Å²	41	52.2 Å²	52.2	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-60.7	-30.8	-177.3	22.3	-33	0	0	0	112.9	A622 N854	P618-A622 WeakPolarHBondContact O-CB 3.07Å; P618-A622 PolarHBondContact O-N 3.08Å; P618-N854 VanDerWaalsContact CD-OD1 3.25Å; P618-N854 WeakPolarHBondContact CD-OD1 3.28Å; P618-N854 VanDerWaalsContact CG-O 3.23Å; P618-N854 WeakPolarHBondContact CG-O 3.31Å; P618-N854 WeakPolarHBondContact CG-OD1 2.94Å
619	I	81.3	Confident	84.8	Confident	36 Å²	36	51.9 Å²	51.9	19%	0.185	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-47.6	176.7	-64.5	172.5	0	0	0	111.3	T617 A622 S623 K843 I846 I847 N854	T617-I619 PolarHBondContact O-N 2.96Å; I619-A622 PolarHBondContact O-N 3.07Å; I619-S623 PolarHBondContact O-N 3.32Å; I619-K843 HydrophobicContact CG2-CB 4.43Å; I619-K843 HydrophobicContact CG2-CG 4.45Å; I619-I846 HydrophobicContact CD1-CB 4.41Å; I619-I846 HydrophobicContact CD1-CG2 3.56Å; I619-I847 HydrophobicContact CD1-CG1 4.39Å; I619-I847 HydrophobicContact CG2-CD1 4.34Å; I619-I847 HydrophobicContact CG2-CG1 4.45Å; I619-N854 HydrophobicContact CD1-CB 4.06Å; I619-N854 WeakPolarHBondContact CD1-OD1 3.44Å; I619-N854 WeakPolarHBondContact CG1-OD1 3.22Å
620	V	82.9	Confident	84.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.5	-39.2	179.4	177.8	0	0	0	0	110.9	F611 T617 R625 I847	F611-V620 HydrophobicContact CD1-CG1 3.94Å; F611-V620 HydrophobicContact CD1-CG2 4.19Å; F611-V620 HydrophobicContact CE1-CG1 4.36Å; F611-V620 HydrophobicContact CE1-CG2 4.27Å; F611-V620 HydrophobicContact CG-CG2 4.42Å; T617-V620 PolarHBondContact O-N 2.83Å; T617-V620 VanDerWaalsContact OG1-CG2 3.3Å; T617-V620 WeakPolarHBondContact OG1-CG2 3.42Å; V620-R625 HydrophobicContact CG1-CG 4.17Å; V620-I847 HydrophobicContact CG2-CD1 3.72Å
621	R	80	Confident	85.1	Confident	134 Å²	134	50.7 Å²	50.7	51%	0.506	25%	0.248	S	C	.	.	H	α-helix	trans	-64.8	-40.4	174.4	-75.6	178.6	174.2	-170.5	0.4	113	D616 T617 G624 R625	D616-R621 IonicContact OD1-CZ 2.76Å; D616-R621 IonicContact OD1-NE 3.25Å; D616-R621 IonicContact OD1-NH2 2.71Å; D616-R621 PolarHBondContact OD1-NH2 3.15Å; T617-R621 PolarHBondContact O-N 3.44Å; R621-G624 PolarHBondContact O-N 3.12Å; R621-R625 HydrophobicContact CG-CG 4.28Å
622	A	74.3	Confident	85.3	Confident	62 Å²	62	50.7 Å²	50.7	51%	0.512	25%	0.248	S	C	.	.	H	α-helix	trans	-65.6	-40.7	179.2	0	0	0	0	0	112.6	P618 I619 G624	P618-A622 WeakPolarHBondContact O-CB 3.07Å; P618-A622 PolarHBondContact O-N 3.08Å; I619-A622 PolarHBondContact O-N 3.07Å; A622-G624 PolarHBondContact O-N 3Å; A622-G624 VanDerWaalsContact O-N 3.11Å
623	S	77.6	Confident	85.5	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.021	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.3	177.2	178.7	0	0	0	0	114.2	I619 S628 K675 E785 K843	I619-S623 PolarHBondContact O-N 3.32Å; S623-S628 PolarHBondContact O-OG 2.99Å; S623-S628 PolarHBondContact OG-OG 3.39Å; S623-S628 VanDerWaalsContact OG-OG 3.14Å; S623-K675 VanDerWaalsContact O-CE 3.27Å; S623-K675 WeakPolarHBondContact O-CE 3.43Å; S623-K675 PolarHBondContact O-NZ 3.08Å; S623-K675 PolarHBondContact OG-NZ 3.36Å; S623-E785 PolarHBondContact OG-OE1 3.42Å; S623-K843 PolarHBondContact OG-NZ 2.84Å
624	G	81.6	Confident	85.6	Confident	11 Å²	11	41 Å²	41	11%	0.113	21%	0.21	C	C	.	.			trans	77.8	92.9	-174.2	0	0	0	0	0	111.3	R621 A622 E626 L627 S628	R621-G624 PolarHBondContact O-N 3.12Å; A622-G624 PolarHBondContact O-N 3Å; A622-G624 VanDerWaalsContact O-N 3.11Å; G624-E626 PolarHBondContact O-N 2.76Å; G624-L627 PolarHBondContact O-N 3.04Å; G624-S628 WeakPolarHBondContact O-CB 3.4Å; G624-S628 PolarHBondContact O-N 3.2Å; G624-S628 PolarHBondContact O-OG 3.25Å
625	R	83.7	Confident	86	Confident	72 Å²	72	36.5 Å²	36.5	27%	0.272	19%	0.192	S	C	.	.	H	α-helix	trans	-52.7	-54.5	-172.9	-54.3	-167.4	-69.9	-178.7	3.5	112.8	N615 D616 V620 R621 S628 Y629	N615-R625 VanDerWaalsContact O-CD 3.29Å; N615-R625 WeakPolarHBondContact O-CD 3.46Å; N615-R625 PolarHBondContact O-NH1 2.66Å; N615-R625 VanDerWaalsContact OD1-CD 3.27Å; N615-R625 WeakPolarHBondContact OD1-CD 3.13Å; D616-R625 IonicContact OD1-NH1 3.41Å; D616-R625 PolarHBondContact OD1-NH1 2.96Å; V620-R625 HydrophobicContact CG1-CG 4.17Å; R621-R625 HydrophobicContact CG-CG 4.28Å; R625-S628 WeakPolarHBondContact O-CB 3.46Å; R625-S628 PolarHBondContact O-N 2.99Å; R625-S628 VanDerWaalsContact O-N 3.15Å; R625-Y629 HydrophobicContact CB-CE2 4.33Å; R625-Y629 VanDerWaalsContact O-CD2 3.22Å; R625-Y629 WeakPolarHBondContact O-CD2 3.47Å; R625-Y629 PolarHBondContact O-N 3.28Å
626	E	87.9	Confident	86.5	Confident	81 Å²	81	37.7 Å²	37.7	38%	0.379	20%	0.195	S	C	.	.	H	α-helix	trans	-62.1	-48.9	-174.9	-49.2	-54.1	145.3	0	0	112.5	G624 S628 Y629 V630 I702	G624-E626 PolarHBondContact O-N 2.76Å; E626-S628 VanDerWaalsContact C-N 3.26Å; E626-S628 PolarHBondContact O-N 3.18Å; E626-Y629 PolarHBondContact O-N 2.99Å; E626-V630 WeakPolarHBondContact O-CG2 3.46Å; E626-V630 PolarHBondContact O-N 3.42Å; E626-V630 VanDerWaalsContact O-N 3.08Å; E626-I702 HydrophobicContact CB-CD1 3.65Å; E626-I702 HydrophobicContact CB-CG1 3.96Å; E626-I702 HydrophobicContact CG-CD1 3.92Å
627	L	87.4	Confident	87	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-65.3	-31.5	176.9	-68.5	-178.7	0	0	0	112.5	G624 V630 L631 T674 K675 Q701 T705	G624-L627 PolarHBondContact O-N 3.04Å; L627-V630 PolarHBondContact O-N 3.11Å; L627-L631 WeakPolarHBondContact O-CB 3.35Å; L627-L631 PolarHBondContact O-N 2.92Å; L627-T674 HydrophobicContact CD1-CG2 4.06Å; L627-T674 HydrophobicContact CD2-CG2 4.21Å; L627-K675 HydrophobicContact CD1-CB 4.38Å; L627-Q701 HydrophobicContact CD1-CB 4.07Å; L627-Q701 HydrophobicContact CD1-CG 4.42Å; L627-Q701 HydrophobicContact CD2-CB 4.24Å; L627-Q701 HydrophobicContact CG-CB 4.27Å; L627-T705 VanDerWaalsContact CD2-OG1 3.24Å; L627-T705 WeakPolarHBondContact CD2-OG1 3.46Å
628	S	90	Very high	87.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.7	-35.3	178.1	-59	0	0	0	0	111.5	S623 G624 R625 E626 L632 Y840	S623-S628 PolarHBondContact O-OG 2.99Å; S623-S628 PolarHBondContact OG-OG 3.39Å; S623-S628 VanDerWaalsContact OG-OG 3.14Å; G624-S628 WeakPolarHBondContact O-CB 3.4Å; G624-S628 PolarHBondContact O-N 3.2Å; G624-S628 PolarHBondContact O-OG 3.25Å; R625-S628 WeakPolarHBondContact O-CB 3.46Å; R625-S628 PolarHBondContact O-N 2.99Å; R625-S628 VanDerWaalsContact O-N 3.15Å; E626-S628 VanDerWaalsContact C-N 3.26Å; E626-S628 PolarHBondContact O-N 3.18Å; S628-L632 WeakPolarHBondContact O-CB 3.27Å; S628-L632 VanDerWaalsContact O-CG 3.28Å; S628-L632 WeakPolarHBondContact O-CG 3.45Å; S628-L632 PolarHBondContact O-N 3.11Å; S628-Y840 VanDerWaalsContact CA-OH 3.32Å; S628-Y840 WeakPolarHBondContact CA-OH 3.34Å; S628-Y840 PolarHBondContact O-OH 3.11Å
629	Y	91.7	Very high	88.2	Confident	41 Å²	41	31.5 Å²	31.5	16%	0.161	16%	0.159	C	C	.	.	H	α-helix	trans	-70.5	-40.1	172.6	-66.3	-48.7	0	0	0	112.7	M608 F611 V612 N615 R625 E626 L632 T633	M608-Y629 HydrophobicContact SD-CD1 3.55Å; M608-Y629 VanDerWaalsContact SD-CD1 3.55Å; M608-Y629 HydrophobicContact SD-CE1 4Å; F611-Y629 HydrophobicContact CB-CE1 4.13Å; F611-Y629 PolarHBondContact O-OH 3.03Å; V612-Y629 HydrophobicContact CG2-CE1 3.8Å; N615-Y629 VanDerWaalsContact CG-OH 3.3Å; N615-Y629 PolarHBondContact OD1-OH 3.34Å; R625-Y629 HydrophobicContact CB-CE2 4.33Å; R625-Y629 VanDerWaalsContact O-CD2 3.22Å; R625-Y629 WeakPolarHBondContact O-CD2 3.47Å; R625-Y629 PolarHBondContact O-N 3.28Å; E626-Y629 PolarHBondContact O-N 2.99Å; Y629-L632 PolarHBondContact O-N 3.23Å; Y629-T633 WeakPolarHBondContact O-CB 3.42Å; Y629-T633 PolarHBondContact O-N 3.42Å; Y629-T633 PolarHBondContact O-OG1 2.86Å
630	V	93.1	Very high	88.8	Confident	41 Å²	41	32.3 Å²	32.3	25%	0.248	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-45.4	174.4	177.1	0	0	0	0	110.7	E626 L627 T633 G634 I667 A671 T705 I709	E626-V630 WeakPolarHBondContact O-CG2 3.46Å; E626-V630 PolarHBondContact O-N 3.42Å; E626-V630 VanDerWaalsContact O-N 3.08Å; L627-V630 PolarHBondContact O-N 3.11Å; V630-T633 WeakPolarHBondContact O-CB 3.37Å; V630-T633 PolarHBondContact O-N 2.89Å; V630-G634 PolarHBondContact O-N 3.43Å; V630-I667 HydrophobicContact CG1-CG2 3.81Å; V630-I667 WeakPolarHBondContact O-CG2 3.48Å; V630-A671 HydrophobicContact CB-CB 4.43Å; V630-A671 HydrophobicContact CG1-CB 4.1Å; V630-T705 HydrophobicContact CG1-CG2 4.06Å; V630-I709 HydrophobicContact CG1-CD1 4.33Å
631	L	92.8	Very high	89.2	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-46.4	176.8	177.5	55.3	0	0	0	112.3	L627 T633 G634 I635 S668 A671 L672 L839 Y840	L627-L631 WeakPolarHBondContact O-CB 3.35Å; L627-L631 PolarHBondContact O-N 2.92Å; L631-T633 VanDerWaalsContact C-N 3.27Å; L631-T633 PolarHBondContact O-N 3.07Å; L631-G634 PolarHBondContact O-N 3.04Å; L631-I635 HydrophobicContact CD1-CD1 4.16Å; L631-I635 HydrophobicContact CD1-CG1 4.33Å; L631-I635 HydrophobicContact CG-CD1 4.07Å; L631-I635 WeakPolarHBondContact O-CG1 3.37Å; L631-I635 PolarHBondContact O-N 3.28Å; L631-S668 WeakPolarHBondContact CD1-O 3.4Å; L631-A671 HydrophobicContact CB-CB 3.87Å; L631-L672 HydrophobicContact CD1-CD1 4.05Å; L631-L672 HydrophobicContact CD1-CG 3.9Å; L631-L672 HydrophobicContact CD2-CD2 3.74Å; L631-L672 HydrophobicContact CD2-CG 3.86Å; L631-L839 HydrophobicContact CD2-CD1 4.02Å; L631-Y840 WeakPolarHBondContact CB-OH 3.38Å; L631-Y840 HydrophobicContact CD2-CE2 3.77Å; L631-Y840 WeakPolarHBondContact CD2-OH 3.26Å; L631-Y840 HydrophobicContact CG-CE2 4.08Å
632	L	93.1	Very high	89.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.7	-32.8	176.9	-73.3	167.5	0	0	0	112.4	T604 V607 M608 S628 Y629 I635 F636 L836 Y840	T604-L632 HydrophobicContact CG2-CD2 4.43Å; V607-L632 HydrophobicContact CB-CD2 4.45Å; V607-L632 HydrophobicContact CG1-CD1 4.18Å; V607-L632 HydrophobicContact CG1-CD2 3.78Å; M608-L632 HydrophobicContact CE-CB 3.39Å; M608-L632 HydrophobicContact CE-CD1 4.25Å; M608-L632 HydrophobicContact CE-CG 4.45Å; M608-L632 HydrophobicContact SD-CB 4.2Å; M608-L632 HydrophobicContact SD-CD1 3.93Å; S628-L632 WeakPolarHBondContact O-CB 3.27Å; S628-L632 VanDerWaalsContact O-CG 3.28Å; S628-L632 WeakPolarHBondContact O-CG 3.45Å; S628-L632 PolarHBondContact O-N 3.11Å; Y629-L632 PolarHBondContact O-N 3.23Å; L632-I635 PolarHBondContact O-N 2.8Å; L632-F636 WeakPolarHBondContact O-CB 3.12Å; L632-F636 PolarHBondContact O-N 3.3Å; L632-L836 HydrophobicContact CD2-CD1 3.95Å; L632-Y840 HydrophobicContact CD1-CD1 4.48Å; L632-Y840 HydrophobicContact CD1-CE1 4.01Å; L632-Y840 HydrophobicContact CD2-CD1 4.32Å; L632-Y840 HydrophobicContact CD2-CD2 4.11Å; L632-Y840 HydrophobicContact CD2-CE1 4.21Å; L632-Y840 HydrophobicContact CD2-CE2 4.01Å; L632-Y840 HydrophobicContact CD2-CG 4.26Å; L632-Y840 HydrophobicContact CG-CE1 4.01Å; L632-Y840 HydrophobicContact CG-CE2 4.25Å
633	T	93.1	Very high	90.6	Very high	66 Å²	66	25.6 Å²	25.6	41%	0.405	13%	0.127	S	C	.	.	H	α-helix	trans	-66.8	-42	173.3	-55.4	0	0	0	0	111.3	Y629 V630 L631 F636 L637	Y629-T633 WeakPolarHBondContact O-CB 3.42Å; Y629-T633 PolarHBondContact O-N 3.42Å; Y629-T633 PolarHBondContact O-OG1 2.86Å; V630-T633 WeakPolarHBondContact O-CB 3.37Å; V630-T633 PolarHBondContact O-N 2.89Å; L631-T633 VanDerWaalsContact C-N 3.27Å; L631-T633 PolarHBondContact O-N 3.07Å; T633-F636 PolarHBondContact O-N 3.39Å; T633-L637 HydrophobicContact CG2-CD1 4.42Å; T633-L637 WeakPolarHBondContact O-CG 3.29Å; T633-L637 PolarHBondContact O-N 3.18Å
634	G	93	Very high	91.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.7	-45.7	173	0	0	0	0	0	112.5	V630 L631 F636 L637 C638 S668	V630-G634 PolarHBondContact O-N 3.43Å; L631-G634 PolarHBondContact O-N 3.04Å; G634-F636 VanDerWaalsContact C-N 3.35Å; G634-F636 PolarHBondContact O-N 3.08Å; G634-L637 PolarHBondContact O-N 3.19Å; G634-C638 PolarHBondContact O-N 3.43Å; G634-C638 PolarHBondContact O-SG 3.21Å; G634-S668 WeakPolarHBondContact CA-OG 3.49Å
635	I	94.3	Very high	91.6	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-59.8	-44.8	176.5	-69.5	168.4	0	0	0	110.8	T604 L631 L632 L637 C638 Y639 S668 A832 A835 Y840	T604-I635 HydrophobicContact CG2-CG2 4.2Å; L631-I635 HydrophobicContact CD1-CD1 4.16Å; L631-I635 HydrophobicContact CD1-CG1 4.33Å; L631-I635 HydrophobicContact CG-CD1 4.07Å; L631-I635 WeakPolarHBondContact O-CG1 3.37Å; L631-I635 PolarHBondContact O-N 3.28Å; L632-I635 PolarHBondContact O-N 2.8Å; I635-L637 PolarHBondContact O-N 2.84Å; I635-C638 WeakPolarHBondContact O-CB 3.45Å; I635-C638 PolarHBondContact O-N 2.88Å; I635-Y639 HydrophobicContact CG2-CD2 4.12Å; I635-Y639 HydrophobicContact CG2-CE2 3.63Å; I635-Y639 VanDerWaalsContact O-CD2 3.25Å; I635-Y639 WeakPolarHBondContact O-CD2 3.31Å; I635-Y639 PolarHBondContact O-N 2.98Å; I635-S668 PolarHBondContact N-OG 3.3Å; I635-A832 HydrophobicContact CG2-CB 4.23Å; I635-A835 HydrophobicContact CD1-CB 3.97Å; I635-A835 HydrophobicContact CG1-CB 4.4Å; I635-Y840 HydrophobicContact CD1-CE2 4.27Å
636	F	94.6	Very high	91.9	Very high	71 Å²	71	24.1 Å²	24.1	31%	0.311	12%	0.121	S	C	.	.	H	α-helix	trans	-59.4	-45.5	176.1	179.5	-99.7	0	0	0	112	I601 T604 I605 L632 T633 G634 C638 Y639 I640	I601-F636 HydrophobicContact CG1-CE2 4.5Å; I601-F636 HydrophobicContact CG2-CE2 3.97Å; T604-F636 HydrophobicContact CG2-CB 4.07Å; I605-F636 HydrophobicContact CD1-CE2 4.44Å; I605-F636 HydrophobicContact CG1-CE2 4.42Å; L632-F636 WeakPolarHBondContact O-CB 3.12Å; L632-F636 PolarHBondContact O-N 3.3Å; T633-F636 PolarHBondContact O-N 3.39Å; G634-F636 VanDerWaalsContact C-N 3.35Å; G634-F636 PolarHBondContact O-N 3.08Å; F636-C638 VanDerWaalsContact C-N 3.33Å; F636-C638 PolarHBondContact O-N 3.35Å; F636-Y639 PolarHBondContact O-N 3.1Å; F636-Y639 VanDerWaalsContact O-N 3.14Å; F636-I640 HydrophobicContact CD1-CG1 4.09Å; F636-I640 HydrophobicContact CE1-CD1 4.18Å; F636-I640 HydrophobicContact CE1-CG1 3.69Å; F636-I640 HydrophobicContact CE2-CD1 4.39Å; F636-I640 HydrophobicContact CE2-CG1 4.36Å; F636-I640 HydrophobicContact CZ-CD1 3.86Å; F636-I640 HydrophobicContact CZ-CG1 3.85Å; F636-I640 WeakPolarHBondContact O-CG1 3.45Å; F636-I640 PolarHBondContact O-N 3.37Å; F636-I640 VanDerWaalsContact O-N 3.08Å
637	L	92.3	Very high	92.1	Very high	33 Å²	33	21.2 Å²	21.2	17%	0.173	11%	0.11	C	C	.	.	H	α-helix	trans	-64	-35.5	177.2	-70.2	172.1	0	0	0	112.7	T633 G634 I635 Y639 I640 I641 F660 I667	T633-L637 HydrophobicContact CG2-CD1 4.42Å; T633-L637 WeakPolarHBondContact O-CG 3.29Å; T633-L637 PolarHBondContact O-N 3.18Å; G634-L637 PolarHBondContact O-N 3.19Å; I635-L637 PolarHBondContact O-N 2.84Å; L637-Y639 VanDerWaalsContact C-N 3.26Å; L637-Y639 PolarHBondContact O-N 3.33Å; L637-I640 PolarHBondContact O-N 2.66Å; L637-I641 PolarHBondContact O-N 2.97Å; L637-I641 VanDerWaalsContact O-N 3.14Å; L637-F660 HydrophobicContact CD2-CD1 4.15Å; L637-F660 HydrophobicContact CD2-CE1 3.96Å; L637-I667 HydrophobicContact CD1-CD1 3.75Å
638	C	93.1	Very high	92.1	Very high	4 Å²	4	27 Å²	27	3%	0.027	14%	0.136	C	C	.	.	H	α-helix	trans	-64.9	-25.2	174	-69.5	0	0	0	0	113.6	G634 I635 F636 I641 A832	G634-C638 PolarHBondContact O-N 3.43Å; G634-C638 PolarHBondContact O-SG 3.21Å; I635-C638 WeakPolarHBondContact O-CB 3.45Å; I635-C638 PolarHBondContact O-N 2.88Å; F636-C638 VanDerWaalsContact C-N 3.33Å; F636-C638 PolarHBondContact O-N 3.35Å; C638-I641 WeakPolarHBondContact O-CG2 3.42Å; C638-A832 HydrophobicContact CB-CB 3.96Å
639	Y	94.7	Very high	92.1	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-83.2	-42	172.2	-69	-58.5	0	0	0	112.1	G600 I601 T604 I635 F636 L637 I641 T642 N829 A832 S833	G600-Y639 VanDerWaalsContact CA-CZ 3.43Å; I601-Y639 HydrophobicContact CG1-CG 4.35Å; T604-Y639 WeakPolarHBondContact OG1-CE2 3.45Å; I635-Y639 HydrophobicContact CG2-CD2 4.12Å; I635-Y639 HydrophobicContact CG2-CE2 3.63Å; I635-Y639 VanDerWaalsContact O-CD2 3.25Å; I635-Y639 WeakPolarHBondContact O-CD2 3.31Å; I635-Y639 PolarHBondContact O-N 2.98Å; F636-Y639 PolarHBondContact O-N 3.1Å; F636-Y639 VanDerWaalsContact O-N 3.14Å; L637-Y639 VanDerWaalsContact C-N 3.26Å; L637-Y639 PolarHBondContact O-N 3.33Å; Y639-I641 VanDerWaalsContact C-N 3.27Å; Y639-I641 PolarHBondContact O-N 3.25Å; Y639-T642 VanDerWaalsContact O-CB 3.3Å; Y639-T642 WeakPolarHBondContact O-CB 3.44Å; Y639-T642 PolarHBondContact O-N 3.32Å; Y639-T642 PolarHBondContact O-OG1 3.32Å; Y639-T642 VanDerWaalsContact O-OG1 3.07Å; Y639-N829 WeakPolarHBondContact CD1-OD1 3.05Å; Y639-N829 HydrophobicContact CE1-CB 4.43Å; Y639-A832 HydrophobicContact CD1-CB 4.34Å; Y639-A832 HydrophobicContact CD2-CB 4.41Å; Y639-A832 HydrophobicContact CE1-CB 3.82Å; Y639-A832 HydrophobicContact CE2-CB 3.9Å; Y639-S833 WeakPolarHBondContact OH-CA 3.26Å; Y639-S833 WeakPolarHBondContact OH-CB 3.32Å; Y639-S833 PolarHBondContact OH-N 3.25Å; Y639-S833 PolarHBondContact OH-OG 3.33Å
640	I	92.8	Very high	92	Very high	53 Å²	53	30 Å²	30	27%	0.272	16%	0.155	S	C	.	.	H	α-helix	trans	-59.6	-35.6	-179.9	-69.4	-68.5	0	0	0	112.5	I601 F636 L637 T642 F643	I601-I640 HydrophobicContact CD1-CD1 3.79Å; I601-I640 HydrophobicContact CD1-CG1 4.44Å; F636-I640 HydrophobicContact CD1-CG1 4.09Å; F636-I640 HydrophobicContact CE1-CD1 4.18Å; F636-I640 HydrophobicContact CE1-CG1 3.69Å; F636-I640 HydrophobicContact CE2-CD1 4.39Å; F636-I640 HydrophobicContact CE2-CG1 4.36Å; F636-I640 HydrophobicContact CZ-CD1 3.86Å; F636-I640 HydrophobicContact CZ-CG1 3.85Å; F636-I640 WeakPolarHBondContact O-CG1 3.45Å; F636-I640 PolarHBondContact O-N 3.37Å; F636-I640 VanDerWaalsContact O-N 3.08Å; L637-I640 PolarHBondContact O-N 2.66Å; I640-T642 PolarHBondContact O-N 3.18Å; I640-T642 VanDerWaalsContact O-N 3.13Å; I640-F643 PolarHBondContact O-N 3.44Å; I640-F643 VanDerWaalsContact O-N 3.14Å
641	I	92	Very high	91.9	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.015	16%	0.163	C	C	.	.	H	α-helix	trans	-59.2	-27	179.1	-166.5	170.2	0	0	0	114.2	L637 C638 Y639 F643 L644 M645 F660 L661 M828	L637-I641 PolarHBondContact O-N 2.97Å; L637-I641 VanDerWaalsContact O-N 3.14Å; C638-I641 WeakPolarHBondContact O-CG2 3.42Å; Y639-I641 VanDerWaalsContact C-N 3.27Å; Y639-I641 PolarHBondContact O-N 3.25Å; I641-F643 PolarHBondContact O-N 2.84Å; I641-L644 WeakPolarHBondContact O-CB 3.31Å; I641-L644 PolarHBondContact O-N 3.21Å; I641-M645 HydrophobicContact CG1-CG 4.11Å; I641-M645 WeakPolarHBondContact O-CG 3.19Å; I641-M645 PolarHBondContact O-N 3.28Å; I641-F660 VanDerWaalsContact CD1-C 3.48Å; I641-F660 HydrophobicContact CD1-CB 4.17Å; I641-F660 HydrophobicContact CG1-CB 4.42Å; I641-L661 HydrophobicContact CD1-CB 3.76Å; I641-L661 HydrophobicContact CD1-CD1 3.65Å; I641-L661 HydrophobicContact CD1-CG 4.29Å; I641-M828 HydrophobicContact CD1-SD 4.31Å; I641-M828 HydrophobicContact CG2-SD 4.01Å
642	T	92.4	Very high	91.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-55.2	-42	177.3	-53.2	0	0	0	0	111.2	P593 A597 Y639 I640 M645 I646 T825 N829	P593-T642 HydrophobicContact CB-CG2 3.66Å; A597-T642 HydrophobicContact CB-CG2 3.97Å; Y639-T642 VanDerWaalsContact O-CB 3.3Å; Y639-T642 WeakPolarHBondContact O-CB 3.44Å; Y639-T642 PolarHBondContact O-N 3.32Å; Y639-T642 PolarHBondContact O-OG1 3.32Å; Y639-T642 VanDerWaalsContact O-OG1 3.07Å; I640-T642 PolarHBondContact O-N 3.18Å; I640-T642 VanDerWaalsContact O-N 3.13Å; T642-M645 PolarHBondContact O-N 3.25Å; T642-I646 HydrophobicContact CG2-CD1 4.15Å; T642-I646 WeakPolarHBondContact O-CG1 3.5Å; T642-I646 PolarHBondContact O-N 3.12Å; T642-T825 HydrophobicContact CG2-CG2 4.37Å; T642-N829 PolarHBondContact OG1-ND2 2.94Å
643	F	92.6	Very high	91.7	Very high	52 Å²	52	34.8 Å²	34.8	23%	0.228	19%	0.19	C	C	.	.	H	α-helix	trans	-68.2	-39.7	177.5	-61.1	-85.6	0	0	0	111.8	W585 V594 A597 M598 I601 I640 I641 M645 I646 A647	W585-F643 HydrophobicContact CH2-CB 4.42Å; W585-F643 HydrophobicContact CH2-CD1 4.25Å; W585-F643 HydrophobicContact CZ3-CD1 4.08Å; V594-F643 HydrophobicContact CG1-CE1 3.84Å; V594-F643 HydrophobicContact CG1-CZ 4.3Å; A597-F643 HydrophobicContact CB-CE2 3.94Å; A597-F643 HydrophobicContact CB-CZ 4.29Å; M598-F643 HydrophobicContact CG-CE1 4.49Å; M598-F643 HydrophobicContact CG-CZ 3.88Å; M598-F643 HydrophobicContact SD-CE1 4.11Å; M598-F643 HydrophobicContact SD-CE2 4.42Å; M598-F643 HydrophobicContact SD-CZ 3.48Å; M598-F643 WeakPolarHBondContact SD-CZ 3.49Å; I601-F643 HydrophobicContact CD1-CE2 3.69Å; I601-F643 HydrophobicContact CD1-CZ 4.43Å; I640-F643 PolarHBondContact O-N 3.44Å; I640-F643 VanDerWaalsContact O-N 3.14Å; I641-F643 PolarHBondContact O-N 2.84Å; F643-M645 VanDerWaalsContact C-N 3.33Å; F643-M645 PolarHBondContact O-N 2.99Å; F643-I646 PolarHBondContact O-N 3.41Å; F643-A647 WeakPolarHBondContact O-CB 3.26Å; F643-A647 PolarHBondContact O-N 2.91Å
644	L	91.3	Very high	91.6	Very high	34 Å²	34	31.7 Å²	31.7	18%	0.178	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-39.8	177.8	-65.4	175	0	0	0	111.4	I641 I646 V653 F656 R657 F660	I641-L644 WeakPolarHBondContact O-CB 3.31Å; I641-L644 PolarHBondContact O-N 3.21Å; L644-I646 VanDerWaalsContact C-N 3.32Å; L644-I646 PolarHBondContact O-N 3.09Å; L644-V653 WeakPolarHBondContact O-CG1 3.42Å; L644-F656 HydrophobicContact CD1-CB 3.96Å; L644-F656 HydrophobicContact CD2-CB 4.14Å; L644-R657 HydrophobicContact CB-CG 4.29Å; L644-R657 PolarHBondContact O-NE 3.12Å; L644-R657 PolarHBondContact O-NH2 3.3Å; L644-F660 HydrophobicContact CD1-CB 4.42Å; L644-F660 HydrophobicContact CD1-CD2 3.57Å; L644-F660 HydrophobicContact CD1-CE2 4.29Å; L644-F660 HydrophobicContact CD1-CG 4.36Å
645	M	88.5	Confident	91.5	Very high	17 Å²	17	32.6 Å²	32.6	8%	0.084	18%	0.178	C	C	.	.	H	α-helix	trans	-69.7	-25.7	179.2	-70.4	-64.4	-76.8	0	0	113.7	I641 T642 F643 R657 L661 T821 L824 T825	I641-M645 HydrophobicContact CG1-CG 4.11Å; I641-M645 WeakPolarHBondContact O-CG 3.19Å; I641-M645 PolarHBondContact O-N 3.28Å; T642-M645 PolarHBondContact O-N 3.25Å; F643-M645 VanDerWaalsContact C-N 3.33Å; F643-M645 PolarHBondContact O-N 2.99Å; M645-R657 VanDerWaalsContact C-NH2 3.25Å; M645-R657 VanDerWaalsContact O-CZ 3.3Å; M645-R657 PolarHBondContact O-NH2 3.32Å; M645-R657 HydrophobicContact SD-CB 4.31Å; M645-R657 HydrophobicContact SD-CG 3.83Å; M645-L661 HydrophobicContact CE-CD1 4.43Å; M645-L661 HydrophobicContact SD-CD1 4.3Å; M645-T821 HydrophobicContact CB-CG2 4.27Å; M645-T821 HydrophobicContact CE-CG2 4.45Å; M645-L824 HydrophobicContact CE-CD2 3.64Å; M645-T825 HydrophobicContact CB-CG2 3.64Å; M645-T825 HydrophobicContact CG-CG2 4Å
646	I	90.2	Very high	91.3	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-94.4	-26.7	179.3	-65.7	167.5	0	0	0	112.4	L583 W585 A590 P593 V594 T642 F643 L644	L583-I646 HydrophobicContact CD2-CB 4.44Å; L583-I646 HydrophobicContact CD2-CG1 4.13Å; L583-I646 HydrophobicContact CD2-CG2 4.33Å; W585-I646 HydrophobicContact CD2-CG2 3.89Å; W585-I646 HydrophobicContact CE3-CB 4.5Å; W585-I646 HydrophobicContact CE3-CG2 3.62Å; W585-I646 HydrophobicContact CH2-CB 4.31Å; W585-I646 HydrophobicContact CH2-CG2 4.15Å; W585-I646 HydrophobicContact CZ2-CG2 4.4Å; W585-I646 HydrophobicContact CZ3-CB 4.15Å; W585-I646 HydrophobicContact CZ3-CG2 3.76Å; A590-I646 HydrophobicContact CB-CD1 4.1Å; A590-I646 HydrophobicContact CB-CG1 4.44Å; A590-I646 HydrophobicContact CB-CG2 3.86Å; P593-I646 HydrophobicContact CB-CD1 4.41Å; V594-I646 HydrophobicContact CG2-CD1 3.44Å; V594-I646 VanDerWaalsContact CG2-CD1 3.44Å; T642-I646 HydrophobicContact CG2-CD1 4.15Å; T642-I646 WeakPolarHBondContact O-CG1 3.5Å; T642-I646 PolarHBondContact O-N 3.12Å; F643-I646 PolarHBondContact O-N 3.41Å; L644-I646 VanDerWaalsContact C-N 3.32Å; L644-I646 PolarHBondContact O-N 3.09Å
647	A	90.4	Very high	91.1	Very high	20 Å²	20	35.2 Å²	35.2	17%	0.165	19%	0.189	C	C	.	.	S	Bend	trans	-53.6	155	179.3	0	0	0	0	0	112.8	W585 F643 P649 V653 R657	W585-A647 HydrophobicContact CZ2-CB 4.14Å; F643-A647 WeakPolarHBondContact O-CB 3.26Å; F643-A647 PolarHBondContact O-N 2.91Å; A647-P649 WeakPolarHBondContact O-CD 3.4Å; A647-V653 HydrophobicContact CB-CG1 4.02Å; A647-V653 HydrophobicContact CB-CG2 4.43Å; A647-R657 PolarHBondContact O-NH2 3.13Å
648	K	89	Confident	90.9	Very high	125 Å²	125	33.9 Å²	33.9	54%	0.543	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-55.5	127.6	175.6	-177.4	-174	173.2	-169.1	0	109.1	K582 D650	K582-K648 HydrophobicContact CD-CG 4.35Å; K648-D650 PolarHBondContact O-N 3.42Å
649	P	89.5	Confident	90.7	Very high	15 Å²	15	35.6 Å²	35.6	10%	0.097	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-57.7	123.7	174.3	-24.4	34.5	0	0	0	110.1	A647 T727 L746	A647-P649 WeakPolarHBondContact O-CD 3.4Å; P649-T727 HydrophobicContact CB-CG2 4.26Å; P649-L746 HydrophobicContact CB-CG 4.3Å; P649-L746 HydrophobicContact CG-CG 4.41Å
650	D	89.7	Confident	90.4	Very high	89 Å²	89	38 Å²	38	48%	0.476	20%	0.2	S	C	.	.			trans	-147.2	159	175.9	-175.3	26.6	0	0	0	106.9	K648 A652 V653 C654	K648-D650 PolarHBondContact O-N 3.42Å; D650-A652 PolarHBondContact O-N 3.16Å; D650-V653 HydrophobicContact CB-CB 4.4Å; D650-V653 HydrophobicContact CB-CG2 4.16Å; D650-V653 CarbonylContact O-C 3.1Å; D650-V653 PolarHBondContact O-N 3.08Å; D650-C654 WeakPolarHBondContact O-CB 3.26Å; D650-C654 PolarHBondContact O-N 3.35Å; D650-C654 PolarHBondContact O-SG 3.02Å
651	V	90.1	Very high	90.1	Very high	69 Å²	69	35.9 Å²	35.9	42%	0.418	19%	0.19	S	C	.	.	H	α-helix	trans	-53.1	-44.9	-175.4	175.8	0	0	0	0	111	C654 A655	V651-C654 PolarHBondContact O-N 3.33Å; V651-A655 WeakPolarHBondContact O-CB 3.41Å; V651-A655 PolarHBondContact O-N 3.25Å
652	A	90.3	Very high	89.9	Confident	49 Å²	49	35.7 Å²	35.7	41%	0.405	19%	0.189	S	C	.	.	H	α-helix	trans	-65.2	-44.4	176.8	0	0	0	0	0	112.6	D650 C654 A655 F656	D650-A652 PolarHBondContact O-N 3.16Å; A652-C654 PolarHBondContact O-N 3.29Å; A652-A655 WeakPolarHBondContact O-CB 3.22Å; A652-A655 PolarHBondContact O-N 3.26Å; A652-F656 WeakPolarHBondContact O-CD2 3.21Å; A652-F656 PolarHBondContact O-N 3.21Å
653	V	91.9	Very high	89.8	Confident	26 Å²	26	36.7 Å²	36.7	16%	0.158	19%	0.194	C	C	.	.	H	α-helix	trans	-63.7	-42.6	179.2	176	0	0	0	0	110.6	L644 A647 D650 A655 F656 R657	L644-V653 WeakPolarHBondContact O-CG1 3.42Å; A647-V653 HydrophobicContact CB-CG1 4.02Å; A647-V653 HydrophobicContact CB-CG2 4.43Å; D650-V653 HydrophobicContact CB-CB 4.4Å; D650-V653 HydrophobicContact CB-CG2 4.16Å; D650-V653 CarbonylContact O-C 3.1Å; D650-V653 PolarHBondContact O-N 3.08Å; V653-A655 PolarHBondContact O-N 2.89Å; V653-F656 PolarHBondContact O-N 2.94Å; V653-R657 HydrophobicContact CG1-CG 4.45Å; V653-R657 WeakPolarHBondContact O-CB 3.12Å; V653-R657 VanDerWaalsContact O-CG 3.28Å; V653-R657 WeakPolarHBondContact O-CG 3.31Å; V653-R657 PolarHBondContact O-N 2.99Å
654	C	90.9	Very high	89.7	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-38.5	177.6	-61.7	0	0	0	0	111.9	D650 V651 A652 R657 R658 P725 C748	D650-C654 WeakPolarHBondContact O-CB 3.26Å; D650-C654 PolarHBondContact O-N 3.35Å; D650-C654 PolarHBondContact O-SG 3.02Å; V651-C654 PolarHBondContact O-N 3.33Å; A652-C654 PolarHBondContact O-N 3.29Å; C654-R657 PolarHBondContact O-N 3.21Å; C654-R658 WeakPolarHBondContact O-CG 3.3Å; C654-R658 PolarHBondContact O-N 2.78Å; C654-R658 VanDerWaalsContact O-N 3.12Å; C654-P725 HydrophobicContact CB-CB 4.37Å; C654-C748 WeakPolarHBondContact CA-SG 3.34Å; C654-C748 HydrophobicContact CB-CB 3.73Å; C654-C748 WeakPolarHBondContact CB-SG 3.32Å; C654-C748 WeakPolarHBondContact SG-CA 3.21Å; C654-C748 WeakPolarHBondContact SG-CB 3.41Å; C654-C748 CovalentContact SG-SG 2.03Å; C654-C748 PolarHBondContact SG-SG 3.2Å
655	A	90.3	Very high	89.6	Confident	20 Å²	20	33 Å²	33	17%	0.165	18%	0.177	C	C	.	.	H	α-helix	trans	-61.5	-50.5	172.4	0	0	0	0	0	111.5	V651 A652 V653 R657 R658 I659 F720 P725	V651-A655 WeakPolarHBondContact O-CB 3.41Å; V651-A655 PolarHBondContact O-N 3.25Å; A652-A655 WeakPolarHBondContact O-CB 3.22Å; A652-A655 PolarHBondContact O-N 3.26Å; V653-A655 PolarHBondContact O-N 2.89Å; A655-R657 VanDerWaalsContact C-N 3.34Å; A655-R657 PolarHBondContact O-N 2.61Å; A655-R658 PolarHBondContact O-N 3Å; A655-I659 WeakPolarHBondContact O-CG1 3.32Å; A655-I659 PolarHBondContact O-N 3.39Å; A655-I659 VanDerWaalsContact O-N 3.09Å; A655-F720 HydrophobicContact CB-CZ 4.08Å; A655-P725 HydrophobicContact CB-CB 4.1Å; A655-P725 HydrophobicContact CB-CG 3.8Å
656	F	90.8	Very high	89.9	Confident	99 Å²	99	32.1 Å²	32.1	43%	0.434	17%	0.173	S	C	.	.	H	α-helix	trans	-64.2	-36.3	179.1	-73.3	-57.3	0	0	0	113.1	L644 A652 V653 I659 F660	L644-F656 HydrophobicContact CD1-CB 3.96Å; L644-F656 HydrophobicContact CD2-CB 4.14Å; A652-F656 WeakPolarHBondContact O-CD2 3.21Å; A652-F656 PolarHBondContact O-N 3.21Å; V653-F656 PolarHBondContact O-N 2.94Å; F656-I659 HydrophobicContact CD1-CD1 4.46Å; F656-I659 PolarHBondContact O-N 3.19Å; F656-F660 HydrophobicContact CB-CD2 4.17Å; F656-F660 HydrophobicContact CB-CE2 4.3Å; F656-F660 HydrophobicContact CD1-CD2 4.23Å; F656-F660 AromaticContact CD1-CE2 3.57Å; F656-F660 HydrophobicContact CD1-CE2 3.57Å; F656-F660 HydrophobicContact CD1-CZ 4.49Å; F656-F660 HydrophobicContact CE1-CE2 4.31Å; F656-F660 HydrophobicContact CG-CE2 4.31Å; F656-F660 VanDerWaalsContact O-CD2 3.27Å; F656-F660 WeakPolarHBondContact O-CD2 3.47Å; F656-F660 PolarHBondContact O-N 2.7Å
657	R	89.9	Confident	90.1	Very high	28 Å²	28	32.9 Å²	32.9	11%	0.106	18%	0.176	C	C	.	.	H	α-helix	trans	-56.3	-51.8	171.6	-76.7	176.9	-171.4	-166.5	-0.5	110.8	L644 M645 A647 V653 C654 A655 I659 L661	L644-R657 HydrophobicContact CB-CG 4.29Å; L644-R657 PolarHBondContact O-NE 3.12Å; L644-R657 PolarHBondContact O-NH2 3.3Å; M645-R657 VanDerWaalsContact C-NH2 3.25Å; M645-R657 VanDerWaalsContact O-CZ 3.3Å; M645-R657 PolarHBondContact O-NH2 3.32Å; M645-R657 HydrophobicContact SD-CB 4.31Å; M645-R657 HydrophobicContact SD-CG 3.83Å; A647-R657 PolarHBondContact O-NH2 3.13Å; V653-R657 HydrophobicContact CG1-CG 4.45Å; V653-R657 WeakPolarHBondContact O-CB 3.12Å; V653-R657 VanDerWaalsContact O-CG 3.28Å; V653-R657 WeakPolarHBondContact O-CG 3.31Å; V653-R657 PolarHBondContact O-N 2.99Å; C654-R657 PolarHBondContact O-N 3.21Å; A655-R657 VanDerWaalsContact C-N 3.34Å; A655-R657 PolarHBondContact O-N 2.61Å; R657-I659 VanDerWaalsContact C-N 3.31Å; R657-I659 PolarHBondContact O-N 2.86Å; R657-L661 WeakPolarHBondContact O-CB 3.12Å; R657-L661 PolarHBondContact O-N 3.05Å; R657-L661 VanDerWaalsContact O-N 3.1Å
658	R	88.5	Confident	90.2	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-60.2	-38	-179.7	-73.2	179.6	175.1	-156.8	0.7	112.7	C654 A655 W719 F720 D723 D749 I750	C654-R658 WeakPolarHBondContact O-CG 3.3Å; C654-R658 PolarHBondContact O-N 2.78Å; C654-R658 VanDerWaalsContact O-N 3.12Å; A655-R658 PolarHBondContact O-N 3Å; R658-W719 HydrophobicContact CG-CH2 4.31Å; R658-W719 HydrophobicContact CG-CZ2 4.45Å; R658-F720 HydrophobicContact CB-CE1 3.83Å; R658-F720 HydrophobicContact CB-CZ 4.35Å; R658-F720 HydrophobicContact CG-CE1 4.49Å; R658-D723 IonicContact CZ-OD2 2.67Å; R658-D723 PolarHBondContact NH1-O 3.44Å; R658-D723 IonicContact NH1-OD2 2.7Å; R658-D723 IonicContact NH2-OD1 2.82Å; R658-D723 IonicContact NH2-OD2 2.93Å; R658-D723 PolarHBondContact NH2-OD2 3.31Å; R658-D749 PolarHBondContact NH2-O 3.07Å; R658-I750 HydrophobicContact CG-CD1 3.58Å; R658-I750 HydrophobicContact CG-CG1 4.33Å
659	I	88.8	Confident	90.5	Very high	40 Å²	40	26.9 Å²	26.9	21%	0.205	15%	0.147	C	C	.	.	H	α-helix	trans	-69.7	-56.2	179	-63.5	165.2	0	0	0	111.2	A655 F656 R657 L661 L663 V716 F720	A655-I659 WeakPolarHBondContact O-CG1 3.32Å; A655-I659 PolarHBondContact O-N 3.39Å; A655-I659 VanDerWaalsContact O-N 3.09Å; F656-I659 HydrophobicContact CD1-CD1 4.46Å; F656-I659 PolarHBondContact O-N 3.19Å; R657-I659 VanDerWaalsContact C-N 3.31Å; R657-I659 PolarHBondContact O-N 2.86Å; I659-L661 PolarHBondContact O-N 2.96Å; I659-L663 HydrophobicContact CG2-CD2 4.17Å; I659-L663 WeakPolarHBondContact O-CB 3.29Å; I659-L663 PolarHBondContact O-N 2.74Å; I659-V716 HydrophobicContact CG1-CG1 4.04Å; I659-F720 HydrophobicContact CD1-CE2 3.75Å; I659-F720 HydrophobicContact CD1-CZ 3.86Å; I659-F720 HydrophobicContact CG1-CE2 3.66Å; I659-F720 HydrophobicContact CG1-CZ 3.55Å
660	F	89.4	Confident	90.7	Very high	51 Å²	51	26.1 Å²	26.1	22%	0.224	14%	0.143	C	C	.	.	H	α-helix	trans	-78.9	-22.4	-167	-68.8	-62.2	0	0	0	113.5	L637 I641 L644 F656 G662 L663 G664	L637-F660 HydrophobicContact CD2-CD1 4.15Å; L637-F660 HydrophobicContact CD2-CE1 3.96Å; I641-F660 VanDerWaalsContact CD1-C 3.48Å; I641-F660 HydrophobicContact CD1-CB 4.17Å; I641-F660 HydrophobicContact CG1-CB 4.42Å; L644-F660 HydrophobicContact CD1-CB 4.42Å; L644-F660 HydrophobicContact CD1-CD2 3.57Å; L644-F660 HydrophobicContact CD1-CE2 4.29Å; L644-F660 HydrophobicContact CD1-CG 4.36Å; F656-F660 HydrophobicContact CB-CD2 4.17Å; F656-F660 HydrophobicContact CB-CE2 4.3Å; F656-F660 HydrophobicContact CD1-CD2 4.23Å; F656-F660 AromaticContact CD1-CE2 3.57Å; F656-F660 HydrophobicContact CD1-CE2 3.57Å; F656-F660 HydrophobicContact CD1-CZ 4.49Å; F656-F660 HydrophobicContact CE1-CE2 4.31Å; F656-F660 HydrophobicContact CG-CE2 4.31Å; F656-F660 VanDerWaalsContact O-CD2 3.27Å; F656-F660 WeakPolarHBondContact O-CD2 3.47Å; F656-F660 PolarHBondContact O-N 2.7Å; F660-G662 PolarHBondContact O-N 3.34Å; F660-L663 PolarHBondContact O-N 3Å; F660-G664 PolarHBondContact O-N 3.2Å; F660-G664 VanDerWaalsContact O-N 3.11Å
661	L	86.5	Confident	90.8	Very high	9 Å²	9	22 Å²	22	5%	0.047	12%	0.12	C	C	.	.	H	α-helix	trans	-58.3	-48.7	-177.5	-167.4	76.3	0	0	0	113.2	I641 M645 R657 I659 I755 L759 L824 M828	I641-L661 HydrophobicContact CD1-CB 3.76Å; I641-L661 HydrophobicContact CD1-CD1 3.65Å; I641-L661 HydrophobicContact CD1-CG 4.29Å; M645-L661 HydrophobicContact CE-CD1 4.43Å; M645-L661 HydrophobicContact SD-CD1 4.3Å; R657-L661 WeakPolarHBondContact O-CB 3.12Å; R657-L661 PolarHBondContact O-N 3.05Å; R657-L661 VanDerWaalsContact O-N 3.1Å; I659-L661 PolarHBondContact O-N 2.96Å; L661-I755 HydrophobicContact CD2-CG2 4.16Å; L661-L759 HydrophobicContact CG-CD2 4.22Å; L661-L824 HydrophobicContact CD1-CD2 4.06Å; L661-L824 HydrophobicContact CD1-CG 4.46Å; L661-M828 HydrophobicContact CD1-CE 3.41Å; L661-M828 VanDerWaalsContact CD1-CE 3.41Å; L661-M828 HydrophobicContact CD1-SD 3.98Å; L661-M828 HydrophobicContact CG-CE 3.97Å
662	G	86.7	Confident	90.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-82.8	-39.4	174	0	0	0	0	0	112.8	F660 C666 S762	F660-G662 PolarHBondContact O-N 3.34Å; G662-C666 VanDerWaalsContact O-CB 3.28Å; G662-C666 WeakPolarHBondContact O-CB 3.33Å; G662-C666 PolarHBondContact O-N 3.05Å; G662-S762 PolarHBondContact O-OG 3.13Å; G662-S762 VanDerWaalsContact O-OG 3.09Å
663	L	90.4	Very high	91	Very high	21 Å²	21	17.1 Å²	17.1	11%	0.11	9%	0.085	C	C	.	.	H	α-helix	trans	-70.5	-39.7	-166.5	-167.6	68.2	0	0	0	113.6	I659 F660 M665 C666 I667 I709 Q712	I659-L663 HydrophobicContact CG2-CD2 4.17Å; I659-L663 WeakPolarHBondContact O-CB 3.29Å; I659-L663 PolarHBondContact O-N 2.74Å; F660-L663 PolarHBondContact O-N 3Å; L663-M665 PolarHBondContact O-N 3.16Å; L663-C666 PolarHBondContact O-N 2.52Å; L663-I667 HydrophobicContact CG-CD1 3.98Å; L663-I667 HydrophobicContact CG-CG1 4.43Å; L663-I667 VanDerWaalsContact O-CG1 3.26Å; L663-I667 WeakPolarHBondContact O-CG1 3.38Å; L663-I667 PolarHBondContact O-N 2.79Å; L663-I709 HydrophobicContact CD1-CG2 4Å; L663-Q712 HydrophobicContact CD1-CG 4.4Å
664	G	90	Very high	90.9	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-61.5	-46.9	-179.8	0	0	0	0	0	112.8	F660 I667 S668	F660-G664 PolarHBondContact O-N 3.2Å; F660-G664 VanDerWaalsContact O-N 3.11Å; G664-I667 PolarHBondContact O-N 2.95Å; G664-S668 PolarHBondContact O-N 3.12Å; G664-S668 PolarHBondContact O-OG 3.36Å
665	M	90.3	Very high	90.8	Very high	6 Å²	6	16.6 Å²	16.6	3%	0.03	8%	0.081	C	C	.	.	H	α-helix	trans	-66.5	-40.1	176.1	-64.8	-65	-59.3	0	0	111.3	L663 S668 Y669 W800 M828	L663-M665 PolarHBondContact O-N 3.16Å; M665-S668 PolarHBondContact O-N 3.23Å; M665-Y669 HydrophobicContact CE-CD2 4.18Å; M665-Y669 HydrophobicContact CE-CE2 3.23Å; M665-Y669 WeakPolarHBondContact CE-OH 3.32Å; M665-Y669 WeakPolarHBondContact O-CD2 3.48Å; M665-Y669 PolarHBondContact O-N 2.95Å; M665-W800 HydrophobicContact CE-CZ2 3.59Å; M665-W800 HydrophobicContact CG-CZ2 4.44Å; M665-W800 HydrophobicContact SD-CZ2 4.19Å; M665-M828 HydrophobicContact CG-CE 4.44Å
666	C	94.2	Very high	90.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.1	-45.1	177.4	-179	0	0	0	0	112	G662 L663 S668 A670 Q712 S762	G662-C666 VanDerWaalsContact O-CB 3.28Å; G662-C666 WeakPolarHBondContact O-CB 3.33Å; G662-C666 PolarHBondContact O-N 3.05Å; L663-C666 PolarHBondContact O-N 2.52Å; C666-S668 VanDerWaalsContact C-N 3.31Å; C666-S668 PolarHBondContact O-N 3.15Å; C666-A670 WeakPolarHBondContact O-CB 3.34Å; C666-A670 PolarHBondContact O-N 2.93Å; C666-Q712 HydrophobicContact CB-CB 4.08Å; C666-Q712 HydrophobicContact CB-CG 3.97Å; C666-Q712 VanDerWaalsContact SG-CB 3.55Å; C666-S762 PolarHBondContact N-OG 3.01Å
667	I	94.4	Very high	90.5	Very high	19 Å²	19	12.8 Å²	12.8	10%	0.097	6%	0.063	C	C	.	.	H	α-helix	trans	-59.8	-45.2	177.4	-68.3	165	0	0	0	110.3	V630 L637 L663 G664 A671 I709	V630-I667 HydrophobicContact CG1-CG2 3.81Å; V630-I667 WeakPolarHBondContact O-CG2 3.48Å; L637-I667 HydrophobicContact CD1-CD1 3.75Å; L663-I667 HydrophobicContact CG-CD1 3.98Å; L663-I667 HydrophobicContact CG-CG1 4.43Å; L663-I667 VanDerWaalsContact O-CG1 3.26Å; L663-I667 WeakPolarHBondContact O-CG1 3.38Å; L663-I667 PolarHBondContact O-N 2.79Å; G664-I667 PolarHBondContact O-N 2.95Å; I667-A671 WeakPolarHBondContact O-CB 3.37Å; I667-A671 PolarHBondContact O-N 3.29Å; I667-A671 VanDerWaalsContact O-N 3.15Å; I667-I709 HydrophobicContact CB-CD1 4.37Å; I667-I709 HydrophobicContact CG1-CD1 3.97Å; I667-I709 HydrophobicContact CG1-CG1 4.09Å; I667-I709 HydrophobicContact CG1-CG2 4.09Å; I667-I709 HydrophobicContact CG2-CD1 4.34Å
668	S	93.4	Very high	90.3	Very high	8 Å²	8	14.5 Å²	14.5	6%	0.056	7%	0.069	C	C	.	.	H	α-helix	trans	-62.5	-52.3	179.9	-56.2	0	0	0	0	111.8	L631 G634 I635 G664 M665 C666 A671 L672	L631-S668 WeakPolarHBondContact CD1-O 3.4Å; G634-S668 WeakPolarHBondContact CA-OG 3.49Å; I635-S668 PolarHBondContact N-OG 3.3Å; G664-S668 PolarHBondContact O-N 3.12Å; G664-S668 PolarHBondContact O-OG 3.36Å; M665-S668 PolarHBondContact O-N 3.23Å; C666-S668 VanDerWaalsContact C-N 3.31Å; C666-S668 PolarHBondContact O-N 3.15Å; S668-A671 PolarHBondContact O-N 3.34Å; S668-L672 PolarHBondContact O-N 3.47Å
669	Y	93.8	Very high	90	Very high	10 Å²	10	15.3 Å²	15.3	4%	0.039	7%	0.074	C	C	.	.	H	α-helix	trans	-74	-30.6	-178.3	-67	-47.6	0	0	0	113.5	M665 L672 L673 S762 M766 C769 M793	M665-Y669 HydrophobicContact CE-CD2 4.18Å; M665-Y669 HydrophobicContact CE-CE2 3.23Å; M665-Y669 WeakPolarHBondContact CE-OH 3.32Å; M665-Y669 WeakPolarHBondContact O-CD2 3.48Å; M665-Y669 PolarHBondContact O-N 2.95Å; Y669-L672 HydrophobicContact CD1-CD1 4.12Å; Y669-L672 PolarHBondContact O-N 2.84Å; Y669-L673 VanDerWaalsContact O-CB 3.25Å; Y669-L673 WeakPolarHBondContact O-CB 3.49Å; Y669-L673 PolarHBondContact O-N 3.41Å; Y669-S762 WeakPolarHBondContact CD2-O 3.26Å; Y669-M766 HydrophobicContact CD1-CB 4.33Å; Y669-M766 HydrophobicContact CD1-CG 4.49Å; Y669-M766 HydrophobicContact CD2-CB 3.92Å; Y669-M766 HydrophobicContact CE1-CB 4.2Å; Y669-M766 HydrophobicContact CE1-CG 3.96Å; Y669-M766 HydrophobicContact CE2-CB 3.72Å; Y669-M766 HydrophobicContact CE2-CG 4.07Å; Y669-M766 HydrophobicContact CE2-SD 4.33Å; Y669-M766 HydrophobicContact CG-CB 4.22Å; Y669-C769 PolarHBondContact O-SG 3.25Å; Y669-C769 VanDerWaalsContact O-SG 3.37Å; Y669-M793 HydrophobicContact CD1-CE 4.3Å; Y669-M793 HydrophobicContact CD1-SD 4.49Å; Y669-M793 HydrophobicContact CE1-CE 4.22Å
670	A	94.4	Very high	89.8	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64.8	-40.3	173.7	0	0	0	0	0	111.8	C666 T674 T705 L708 I709 L765	C666-A670 WeakPolarHBondContact O-CB 3.34Å; C666-A670 PolarHBondContact O-N 2.93Å; A670-T674 WeakPolarHBondContact O-CB 3.16Å; A670-T674 PolarHBondContact O-N 3.46Å; A670-T674 PolarHBondContact O-OG1 2.99Å; A670-T705 HydrophobicContact CB-CG2 4.12Å; A670-L708 HydrophobicContact CB-CB 3.9Å; A670-L708 HydrophobicContact CB-CD1 4.29Å; A670-I709 HydrophobicContact CB-CG1 3.99Å; A670-L765 HydrophobicContact CB-CD1 4.44Å
671	A	92.5	Very high	89.3	Confident	1 Å²	1	15.8 Å²	15.8	1%	0.008	7%	0.072	C	C	.	.	H	α-helix	trans	-67.4	-43.2	175.6	0	0	0	0	0	111.5	V630 L631 I667 S668 T674 K675 T705	V630-A671 HydrophobicContact CB-CB 4.43Å; V630-A671 HydrophobicContact CG1-CB 4.1Å; L631-A671 HydrophobicContact CB-CB 3.87Å; I667-A671 WeakPolarHBondContact O-CB 3.37Å; I667-A671 PolarHBondContact O-N 3.29Å; I667-A671 VanDerWaalsContact O-N 3.15Å; S668-A671 PolarHBondContact O-N 3.34Å; A671-T674 PolarHBondContact O-N 3.15Å; A671-K675 VanDerWaalsContact O-CB 3.31Å; A671-K675 WeakPolarHBondContact O-CB 3.36Å; A671-K675 PolarHBondContact O-N 2.98Å; A671-T705 HydrophobicContact CB-CG2 4.29Å
672	L	91.3	Very high	89	Confident	2 Å²	2	17.7 Å²	17.7	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-62.2	-45.4	174.1	-78.9	166.2	0	0	0	112.1	L631 S668 Y669 T674 K675 T676 M793 L839	L631-L672 HydrophobicContact CD1-CD1 4.05Å; L631-L672 HydrophobicContact CD1-CG 3.9Å; L631-L672 HydrophobicContact CD2-CD2 3.74Å; L631-L672 HydrophobicContact CD2-CG 3.86Å; S668-L672 PolarHBondContact O-N 3.47Å; Y669-L672 HydrophobicContact CD1-CD1 4.12Å; Y669-L672 PolarHBondContact O-N 2.84Å; L672-T674 VanDerWaalsContact C-N 3.34Å; L672-T674 PolarHBondContact O-N 2.95Å; L672-K675 WeakPolarHBondContact O-CB 3.5Å; L672-K675 PolarHBondContact O-N 3.37Å; L672-T676 PolarHBondContact O-N 3.31Å; L672-T676 PolarHBondContact O-OG1 2.95Å; L672-M793 HydrophobicContact CD1-SD 4.3Å; L672-L839 HydrophobicContact CD2-CD1 3.55Å
673	L	92.3	Very high	88.5	Confident	14 Å²	14	20 Å²	20	7%	0.073	9%	0.091	C	C	.	.	H	α-helix	trans	-57.9	-48.5	177.7	-173.5	53.4	0	0	0	111	Y669 K675 T676 N677 L708 L765 T768 C769 Y772	Y669-L673 VanDerWaalsContact O-CB 3.25Å; Y669-L673 WeakPolarHBondContact O-CB 3.49Å; Y669-L673 PolarHBondContact O-N 3.41Å; L673-K675 VanDerWaalsContact C-N 3.27Å; L673-K675 PolarHBondContact O-N 3.46Å; L673-T676 PolarHBondContact O-N 3.24Å; L673-N677 WeakPolarHBondContact O-CB 3.34Å; L673-N677 PolarHBondContact O-N 3.15Å; L673-L708 HydrophobicContact CD2-CD1 4.03Å; L673-L765 HydrophobicContact CD2-CD2 3.97Å; L673-T768 HydrophobicContact CD1-CG2 4Å; L673-T768 HydrophobicContact CD2-CG2 4.25Å; L673-C769 WeakPolarHBondContact CA-SG 3.23Å; L673-C769 WeakPolarHBondContact CB-SG 3.43Å; L673-C769 HydrophobicContact CD1-CB 4.44Å; L673-C769 PolarHBondContact N-SG 3.01Å; L673-Y772 HydrophobicContact CD1-CD2 3.6Å; L673-Y772 HydrophobicContact CD1-CE2 4.12Å; L673-Y772 HydrophobicContact CD1-CG 4.47Å
674	T	90.9	Very high	87.8	Confident	6 Å²	6	21.9 Å²	21.9	4%	0.037	10%	0.1	C	C	.	.	H	α-helix	trans	-63.5	-37.7	-179.6	-57.5	0	0	0	0	111	L627 A670 A671 L672 R678 Q701 I704 T705	L627-T674 HydrophobicContact CD1-CG2 4.06Å; L627-T674 HydrophobicContact CD2-CG2 4.21Å; A670-T674 WeakPolarHBondContact O-CB 3.16Å; A670-T674 PolarHBondContact O-N 3.46Å; A670-T674 PolarHBondContact O-OG1 2.99Å; A671-T674 PolarHBondContact O-N 3.15Å; L672-T674 VanDerWaalsContact C-N 3.34Å; L672-T674 PolarHBondContact O-N 2.95Å; T674-R678 WeakPolarHBondContact O-CB 3.45Å; T674-R678 PolarHBondContact O-N 3.49Å; T674-Q701 HydrophobicContact CG2-CB 4.04Å; T674-Q701 HydrophobicContact CG2-CG 4.34Å; T674-I704 HydrophobicContact CG2-CB 4.45Å; T674-I704 HydrophobicContact CG2-CG2 4.37Å; T674-T705 WeakPolarHBondContact CB-OG1 3.26Å; T674-T705 PolarHBondContact OG1-OG1 3.38Å; T674-T705 VanDerWaalsContact OG1-OG1 3.06Å
675	K	87.6	Confident	86.7	Confident	10 Å²	10	25.2 Å²	25.2	4%	0.043	12%	0.115	C	C	.	.	H	α-helix	trans	-66.9	-45.3	176.5	-167.9	169	-177.6	165.3	0	112.4	S623 L627 A671 L672 L673 R678 I679 E785 I789	S623-K675 VanDerWaalsContact O-CE 3.27Å; S623-K675 WeakPolarHBondContact O-CE 3.43Å; S623-K675 PolarHBondContact O-NZ 3.08Å; S623-K675 PolarHBondContact OG-NZ 3.36Å; L627-K675 HydrophobicContact CD1-CB 4.38Å; A671-K675 VanDerWaalsContact O-CB 3.31Å; A671-K675 WeakPolarHBondContact O-CB 3.36Å; A671-K675 PolarHBondContact O-N 2.98Å; L672-K675 WeakPolarHBondContact O-CB 3.5Å; L672-K675 PolarHBondContact O-N 3.37Å; L673-K675 VanDerWaalsContact C-N 3.27Å; L673-K675 PolarHBondContact O-N 3.46Å; K675-R678 WeakPolarHBondContact O-CB 3.21Å; K675-R678 PolarHBondContact O-N 3.29Å; K675-I679 WeakPolarHBondContact O-CG1 3.26Å; K675-I679 PolarHBondContact O-N 3.26Å; K675-E785 WeakPolarHBondContact CE-OE1 3.43Å; K675-E785 IonicContact NZ-OE1 3.54Å; K675-E785 PolarHBondContact NZ-OE1 2.84Å; K675-I789 HydrophobicContact CD-CD1 4.33Å; K675-I789 HydrophobicContact CG-CD1 4.29Å
676	T	88.1	Confident	85.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-69.5	-40.9	177.4	-49.8	0	0	0	0	111.7	L672 L673 R678 I679 Y680 A773 T776 I789	L672-T676 PolarHBondContact O-N 3.31Å; L672-T676 PolarHBondContact O-OG1 2.95Å; L673-T676 PolarHBondContact O-N 3.24Å; T676-R678 VanDerWaalsContact C-N 3.32Å; T676-R678 PolarHBondContact O-N 3.14Å; T676-I679 WeakPolarHBondContact O-CB 3.33Å; T676-I679 PolarHBondContact O-N 3.2Å; T676-I679 VanDerWaalsContact O-N 3.14Å; T676-Y680 PolarHBondContact O-N 2.97Å; T676-A773 HydrophobicContact CG2-CB 4.31Å; T676-T776 HydrophobicContact CG2-CG2 4.37Å; T676-I789 WeakPolarHBondContact OG1-CG2 3.29Å
677	N	87.2	Confident	84.3	Confident	39 Å²	39	35 Å²	35	21%	0.209	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-39	176.1	-174.1	14.6	0	0	0	111.3	L673 I679 Y680 R681	L673-N677 WeakPolarHBondContact O-CB 3.34Å; L673-N677 PolarHBondContact O-N 3.15Å; N677-I679 VanDerWaalsContact C-N 3.34Å; N677-I679 PolarHBondContact O-N 3.1Å; N677-Y680 PolarHBondContact O-N 3.01Å; N677-R681 WeakPolarHBondContact O-CB 3.43Å; N677-R681 VanDerWaalsContact O-CG 3.26Å; N677-R681 WeakPolarHBondContact O-CG 3.11Å; N677-R681 PolarHBondContact O-N 3.24Å; N677-R681 WeakPolarHBondContact OD1-CD 3.32Å; N677-R681 WeakPolarHBondContact OD1-CG 3.44Å
678	R	85.3	Confident	82.9	Confident	64 Å²	64	41.3 Å²	41.3	24%	0.242	20%	0.202	C	C	.	.	H	α-helix	trans	-56.9	-47.8	171.6	179.3	-159.4	172.1	-167.1	-11.4	111.2	T674 K675 T676 R681 I682 Q701	T674-R678 WeakPolarHBondContact O-CB 3.45Å; T674-R678 PolarHBondContact O-N 3.49Å; K675-R678 WeakPolarHBondContact O-CB 3.21Å; K675-R678 PolarHBondContact O-N 3.29Å; T676-R678 VanDerWaalsContact C-N 3.32Å; T676-R678 PolarHBondContact O-N 3.14Å; R678-R681 PolarHBondContact O-N 3.17Å; R678-I682 HydrophobicContact CG-CD1 3.91Å; R678-I682 WeakPolarHBondContact O-CD1 3.47Å; R678-I682 VanDerWaalsContact O-CG1 3.25Å; R678-I682 WeakPolarHBondContact O-CG1 3.25Å; R678-I682 PolarHBondContact O-N 3.44Å; R678-I682 VanDerWaalsContact O-N 3.1Å; R678-Q701 VanDerWaalsContact CD-NE2 3.27Å
679	I	83.3	Confident	81.6	Confident	21 Å²	21	44.1 Å²	44.1	11%	0.108	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-51.7	178.1	-64.7	169.3	0	0	0	109.5	K675 T676 N677 R681 I682 F683 T776 V779 I789	K675-I679 WeakPolarHBondContact O-CG1 3.26Å; K675-I679 PolarHBondContact O-N 3.26Å; T676-I679 WeakPolarHBondContact O-CB 3.33Å; T676-I679 PolarHBondContact O-N 3.2Å; T676-I679 VanDerWaalsContact O-N 3.14Å; N677-I679 VanDerWaalsContact C-N 3.34Å; N677-I679 PolarHBondContact O-N 3.1Å; I679-R681 VanDerWaalsContact C-N 3.33Å; I679-R681 PolarHBondContact O-N 2.91Å; I679-I682 PolarHBondContact O-N 3.43Å; I679-F683 HydrophobicContact CG2-CD2 3.85Å; I679-F683 HydrophobicContact CG2-CE2 3.99Å; I679-F683 VanDerWaalsContact O-CD2 3.3Å; I679-F683 WeakPolarHBondContact O-CD2 3.31Å; I679-F683 PolarHBondContact O-N 3.16Å; I679-F683 VanDerWaalsContact O-N 3.14Å; I679-T776 HydrophobicContact CB-CG2 4.35Å; I679-T776 HydrophobicContact CG2-CG2 3.95Å; I679-V779 HydrophobicContact CG2-CG2 4.29Å; I679-I789 HydrophobicContact CD1-CD1 3.94Å
680	Y	83.2	Confident	80.1	Confident	51 Å²	51	51 Å²	51	20%	0.2	26%	0.262	C	S	.	.	H	α-helix	trans	-52.8	-48.3	178.1	175.1	-112.2	0	0	0	112.6	T676 N677 I682 F683 E684 Y772 K775 T776	T676-Y680 PolarHBondContact O-N 2.97Å; N677-Y680 PolarHBondContact O-N 3.01Å; Y680-I682 PolarHBondContact O-N 2.93Å; Y680-F683 PolarHBondContact O-N 3.13Å; Y680-E684 HydrophobicContact CD2-CB 4.48Å; Y680-E684 HydrophobicContact CE2-CB 4.1Å; Y680-E684 HydrophobicContact CE2-CG 4.19Å; Y680-E684 VanDerWaalsContact O-CB 3.26Å; Y680-E684 WeakPolarHBondContact O-CB 3.48Å; Y680-E684 PolarHBondContact O-N 3.48Å; Y680-Y772 AromaticContact CD1-CD1 3.93Å; Y680-Y772 HydrophobicContact CD1-CD1 3.93Å; Y680-Y772 AromaticContact CD1-CE1 3.77Å; Y680-Y772 HydrophobicContact CD1-CE1 3.77Å; Y680-Y772 HydrophobicContact CE1-CD1 4.49Å; Y680-Y772 HydrophobicContact CE1-CE1 4.04Å; Y680-Y772 HydrophobicContact CG-CD1 4.08Å; Y680-Y772 HydrophobicContact CG-CE1 4.38Å; Y680-K775 HydrophobicContact CD2-CB 4.02Å; Y680-K775 HydrophobicContact CE2-CB 4.09Å; Y680-K775 HydrophobicContact CE2-CD 3.94Å; Y680-T776 HydrophobicContact CD2-CG2 4.4Å
681	R	80.6	Confident	78.6	Confident	49 Å²	49	56 Å²	56	19%	0.185	29%	0.292	C	S	.	.	H	α-helix	trans	-66.7	-35.6	-178.6	-69.8	179.9	67	-110.8	-18.2	113.4	N677 R678 I679 Q685 R694 F695	N677-R681 WeakPolarHBondContact O-CB 3.43Å; N677-R681 VanDerWaalsContact O-CG 3.26Å; N677-R681 WeakPolarHBondContact O-CG 3.11Å; N677-R681 PolarHBondContact O-N 3.24Å; N677-R681 WeakPolarHBondContact OD1-CD 3.32Å; N677-R681 WeakPolarHBondContact OD1-CG 3.44Å; R678-R681 PolarHBondContact O-N 3.17Å; I679-R681 VanDerWaalsContact C-N 3.33Å; I679-R681 PolarHBondContact O-N 2.91Å; R681-Q685 WeakPolarHBondContact O-CB 3.22Å; R681-Q685 PolarHBondContact O-N 3.28Å; R681-R694 PolarHBondContact NH1-O 3.26Å; R681-R694 PolarHBondContact NH2-O 3.16Å; R681-F695 PolarHBondContact NH1-O 3.37Å
682	I	79.2	Confident	77	Confident	50 Å²	50	60.1 Å²	60.1	26%	0.256	33%	0.327	S	S	.	.	H	α-helix	trans	-63.8	-45.6	176	-71.3	167	0	0	0	110.4	R678 I679 Y680 G686 I696	R678-I682 HydrophobicContact CG-CD1 3.91Å; R678-I682 WeakPolarHBondContact O-CD1 3.47Å; R678-I682 VanDerWaalsContact O-CG1 3.25Å; R678-I682 WeakPolarHBondContact O-CG1 3.25Å; R678-I682 PolarHBondContact O-N 3.44Å; R678-I682 VanDerWaalsContact O-N 3.1Å; I679-I682 PolarHBondContact O-N 3.43Å; Y680-I682 PolarHBondContact O-N 2.93Å; I682-G686 PolarHBondContact O-N 3.36Å; I682-G686 VanDerWaalsContact O-N 3.15Å; I682-I696 HydrophobicContact CD1-CD1 4.45Å; I682-I696 HydrophobicContact CG1-CD1 3.82Å; I682-I696 HydrophobicContact CG1-CG1 4.43Å
683	F	75.7	Confident	75.7	Confident	47 Å²	47	61.1 Å²	61.1	21%	0.206	33%	0.333	C	S	.	.	H	α-helix	trans	-77.4	-39.9	-177.6	-77.9	-79.3	0	0	0	113.2	I679 Y680 G686 K687 V779 P780 F783	I679-F683 HydrophobicContact CG2-CD2 3.85Å; I679-F683 HydrophobicContact CG2-CE2 3.99Å; I679-F683 VanDerWaalsContact O-CD2 3.3Å; I679-F683 WeakPolarHBondContact O-CD2 3.31Å; I679-F683 PolarHBondContact O-N 3.16Å; I679-F683 VanDerWaalsContact O-N 3.14Å; Y680-F683 PolarHBondContact O-N 3.13Å; F683-G686 PolarHBondContact O-N 3.35Å; F683-K687 WeakPolarHBondContact O-CG 3.41Å; F683-K687 PolarHBondContact O-N 3.14Å; F683-V779 HydrophobicContact CB-CG2 4.37Å; F683-V779 HydrophobicContact CD1-CG1 4.44Å; F683-V779 HydrophobicContact CD1-CG2 4.06Å; F683-V779 HydrophobicContact CD2-CB 4.39Å; F683-V779 HydrophobicContact CD2-CG1 4.04Å; F683-V779 HydrophobicContact CD2-CG2 3.44Å; F683-V779 VanDerWaalsContact CD2-CG2 3.44Å; F683-V779 HydrophobicContact CE1-CB 4.46Å; F683-V779 HydrophobicContact CE1-CG1 3.79Å; F683-V779 HydrophobicContact CE1-CG2 4.25Å; F683-V779 HydrophobicContact CE2-CB 4.16Å; F683-V779 HydrophobicContact CE2-CG1 3.34Å; F683-V779 HydrophobicContact CE2-CG2 3.69Å; F683-V779 HydrophobicContact CG-CG2 3.67Å; F683-V779 HydrophobicContact CZ-CB 4.21Å; F683-V779 HydrophobicContact CZ-CG1 3.21Å; F683-V779 HydrophobicContact CZ-CG2 4.1Å; F683-P780 HydrophobicContact CE1-CG 4.23Å; F683-F783 HydrophobicContact CE1-CD2 4.47Å; F683-F783 HydrophobicContact CE2-CB 4.33Å; F683-F783 HydrophobicContact CE2-CD2 4.46Å; F683-F783 HydrophobicContact CE2-CG 4.27Å; F683-F783 HydrophobicContact CZ-CB 4.01Å; F683-F783 AromaticContact CZ-CD2 3.62Å; F683-F783 HydrophobicContact CZ-CD2 3.62Å; F683-F783 HydrophobicContact CZ-CE2 4.19Å; F683-F783 AromaticContact CZ-CG 3.83Å; F683-F783 HydrophobicContact CZ-CG 3.83Å
684	E	75.8	Confident	74.6	Confident	61 Å²	61	70.5 Å²	70.5	29%	0.285	37%	0.368	S	S	.	.	H	α-helix	trans	-72	-41.5	-176.5	-164.9	66.3	-179.8	0	0	112.3	Y680 G686 K687	Y680-E684 HydrophobicContact CD2-CB 4.48Å; Y680-E684 HydrophobicContact CE2-CB 4.1Å; Y680-E684 HydrophobicContact CE2-CG 4.19Å; Y680-E684 VanDerWaalsContact O-CB 3.26Å; Y680-E684 WeakPolarHBondContact O-CB 3.48Å; Y680-E684 PolarHBondContact O-N 3.48Å; E684-G686 VanDerWaalsContact C-N 3.34Å; E684-K687 PolarHBondContact O-N 3.06Å; E684-K687 IonicContact OE2-NZ 2.73Å; E684-K687 PolarHBondContact OE2-NZ 3.2Å
685	Q	68.4	Low	73.6	Confident	72 Å²	72	76.7 Å²	76.7	34%	0.336	40%	0.395	S	S	.	.	H	α-helix	trans	-74.7	-26.3	173.5	-72.6	-172.2	-51.3	0	0	112.5	R681 K687 Q688 T689 P693	R681-Q685 WeakPolarHBondContact O-CB 3.22Å; R681-Q685 PolarHBondContact O-N 3.28Å; Q685-K687 PolarHBondContact O-N 2.94Å; Q685-Q688 PolarHBondContact O-N 2.97Å; Q685-Q688 VanDerWaalsContact O-N 3.11Å; Q685-T689 PolarHBondContact O-N 2.91Å; Q685-T689 VanDerWaalsContact O-O 3.1Å; Q685-T689 PolarHBondContact O-OG1 3.4Å; Q685-P693 HydrophobicContact CB-CG 3.99Å
686	G	65.1	Low	72.9	Confident	55 Å²	55	78.7 Å²	78.7	57%	0.567	41%	0.405	S	S	*	.	H	α-helix	trans	-65.6	-23.3	171.8	0	0	0	0	0	113.9	I682 F683 E684	I682-G686 PolarHBondContact O-N 3.36Å; I682-G686 VanDerWaalsContact O-N 3.15Å; F683-G686 PolarHBondContact O-N 3.35Å; E684-G686 VanDerWaalsContact C-N 3.34Å
687	K	68.4	Low	72.5	Confident	157 Å²	157	81.4 Å²	81.4	68%	0.683	42%	0.424	S	S	*	.	H	α-helix	trans	-74.6	-26.1	170.4	-68.2	171.3	-170.7	165.2	0	113.1	F683 E684 Q685	F683-K687 WeakPolarHBondContact O-CG 3.41Å; F683-K687 PolarHBondContact O-N 3.14Å; E684-K687 PolarHBondContact O-N 3.06Å; E684-K687 IonicContact OE2-NZ 2.73Å; E684-K687 PolarHBondContact OE2-NZ 3.2Å; Q685-K687 PolarHBondContact O-N 2.94Å
688	Q	65.1	Low	72.1	Confident	150 Å²	150	83.1 Å²	83.1	70%	0.701	44%	0.437	S	S	*	.	H	α-helix	trans	-105.2	-31.9	-171.9	-65.1	-176.6	-1.1	0	0	113.7	Q685	Q685-Q688 PolarHBondContact O-N 2.97Å; Q685-Q688 VanDerWaalsContact O-N 3.11Å
689	T	66.3	Low	72	Confident	68 Å²	68	85.2 Å²	85.2	42%	0.417	46%	0.457	S	S	.	.			trans	-150	154.5	-173.4	62.6	0	0	0	0	112.5	Q685 T691	Q685-T689 PolarHBondContact O-N 2.91Å; Q685-T689 VanDerWaalsContact O-O 3.1Å; Q685-T689 PolarHBondContact O-OG1 3.4Å; T689-T691 VanDerWaalsContact C-N 3.34Å; T689-T691 PolarHBondContact OG1-OG1 3.48Å
690	V	61.1	Low	72.1	Confident	155 Å²	155	85.2 Å²	85.2	94%	0.939	46%	0.459	S	S	*	.	S	Bend	trans	-87.5	-5.7	177.1	-167.6	0	0	0	0	111.9
691	T	62.7	Low	72.2	Confident	103 Å²	103	83.3 Å²	83.3	63%	0.632	45%	0.452	S	S	*	.	S	Bend	trans	-80	139.4	178.8	46.5	0	0	0	0	112.1	T689	T689-T691 VanDerWaalsContact C-N 3.34Å; T689-T691 PolarHBondContact OG1-OG1 3.48Å
692	A	59.3	Low	72.6	Confident	89 Å²	89	84.2 Å²	84.2	74%	0.736	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-61.9	132	176.8	0	0	0	0	0	111.3
693	P	65.1	Low	73.2	Confident	22 Å²	22	84.7 Å²	84.7	14%	0.143	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-51.4	142.9	172.5	-31	35.6	0	0	0	113.6	Q685 I696	Q685-P693 HydrophobicContact CB-CG 3.99Å; P693-I696 HydrophobicContact CB-CD1 3.45Å; P693-I696 VanDerWaalsContact CB-CD1 3.45Å; P693-I696 HydrophobicContact CB-CG1 3.89Å; P693-I696 VanDerWaalsContact CD-CD1 3.49Å; P693-I696 HydrophobicContact CG-CD1 3.55Å; P693-I696 HydrophobicContact CG-CG1 4.46Å
694	R	68.1	Low	73.8	Confident	211 Å²	211	85.4 Å²	85.4	80%	0.796	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	161	166.5	-68.1	-175.2	172.7	175.1	-2.1	110.4	R681 I696	R681-R694 PolarHBondContact NH1-O 3.26Å; R681-R694 PolarHBondContact NH2-O 3.16Å; R694-I696 PolarHBondContact O-N 3.4Å
695	F	69.6	Low	74.6	Confident	137 Å²	137	82.7 Å²	82.7	60%	0.601	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	30.8	175.7	-45.1	-69.7	0	0	0	117.8	R681 S700	R681-F695 PolarHBondContact NH1-O 3.37Å; F695-S700 VanDerWaalsContact C-OG 3.28Å; F695-S700 WeakPolarHBondContact CA-OG 3.34Å; F695-S700 PolarHBondContact O-OG 3.08Å
696	I	73.9	Confident	75.7	Confident	51 Å²	51	82.2 Å²	82.2	26%	0.262	47%	0.469	S	S	.	.			trans	-88.6	-16.8	170.1	-71.6	175	0	0	0	112.2	I682 P693 R694 Q701	I682-I696 HydrophobicContact CD1-CD1 4.45Å; I682-I696 HydrophobicContact CG1-CD1 3.82Å; I682-I696 HydrophobicContact CG1-CG1 4.43Å; P693-I696 HydrophobicContact CB-CD1 3.45Å; P693-I696 VanDerWaalsContact CB-CD1 3.45Å; P693-I696 HydrophobicContact CB-CG1 3.89Å; P693-I696 VanDerWaalsContact CD-CD1 3.49Å; P693-I696 HydrophobicContact CG-CD1 3.55Å; P693-I696 HydrophobicContact CG-CG1 4.46Å; R694-I696 PolarHBondContact O-N 3.4Å; I696-Q701 PolarHBondContact O-NE2 2.78Å
697	S	79.4	Confident	77	Confident	57 Å²	57	83.6 Å²	83.6	40%	0.399	47%	0.47	S	S	.	.	S	Bend	trans	-60	142.1	-177.1	-179	0	0	0	0	112.1	T699 S700 Q701	S697-T699 PolarHBondContact O-N 3.45Å; S697-T699 PolarHBondContact OG-N 3.31Å; S697-T699 PolarHBondContact OG-OG1 3.37Å; S697-S700 PolarHBondContact N-OG 3.07Å; S697-S700 PolarHBondContact O-N 3.25Å; S697-S700 PolarHBondContact O-OG 2.82Å; S697-Q701 WeakPolarHBondContact O-CG 3.38Å; S697-Q701 PolarHBondContact O-N 2.77Å
698	P	79.3	Confident	78.3	Confident	76 Å²	76	78 Å²	78	49%	0.494	45%	0.448	S	S	.	.	H	α-helix	trans	-51	-38.2	172.4	-27.1	34.9	0	0	0	113.1	S700 Q701 I702	P698-S700 PolarHBondContact O-N 3.29Å; P698-Q701 PolarHBondContact O-N 3.13Å; P698-I702 WeakPolarHBondContact O-CG1 3.49Å; P698-I702 PolarHBondContact O-N 3.26Å
699	T	82.8	Confident	79.7	Confident	107 Å²	107	72.4 Å²	72.4	66%	0.656	42%	0.422	S	S	*	.	H	α-helix	trans	-62.9	-43.2	177.3	51	0	0	0	0	112.5	S697 Q701 A703	S697-T699 PolarHBondContact O-N 3.45Å; S697-T699 PolarHBondContact OG-N 3.31Å; S697-T699 PolarHBondContact OG-OG1 3.37Å; T699-Q701 VanDerWaalsContact C-N 3.35Å; T699-Q701 PolarHBondContact O-N 3.04Å; T699-A703 PolarHBondContact O-N 3.47Å; T699-A703 VanDerWaalsContact O-N 3.09Å
700	S	84.8	Confident	80.9	Confident	21 Å²	21	72 Å²	72	15%	0.147	42%	0.422	C	S	.	.	H	α-helix	trans	-69.2	-30.7	176.1	52.2	0	0	0	0	113.2	F695 S697 P698 A703 I704	F695-S700 VanDerWaalsContact C-OG 3.28Å; F695-S700 WeakPolarHBondContact CA-OG 3.34Å; F695-S700 PolarHBondContact O-OG 3.08Å; S697-S700 PolarHBondContact N-OG 3.07Å; S697-S700 PolarHBondContact O-N 3.25Å; S697-S700 PolarHBondContact O-OG 2.82Å; P698-S700 PolarHBondContact O-N 3.29Å; S700-A703 PolarHBondContact O-N 2.83Å; S700-I704 WeakPolarHBondContact O-CD1 3.32Å; S700-I704 VanDerWaalsContact O-CG1 3.27Å; S700-I704 WeakPolarHBondContact O-CG1 3.21Å; S700-I704 PolarHBondContact O-N 3.48Å
701	Q	86.6	Confident	82.4	Confident	11 Å²	11	70.1 Å²	70.1	5%	0.051	40%	0.404	C	S	.	.	H	α-helix	trans	-70.8	-42.4	177.5	-69.7	173.7	18.8	0	0	111.9	L627 T674 R678 I696 S697 P698 T699 A703 I704 T705	L627-Q701 HydrophobicContact CD1-CB 4.07Å; L627-Q701 HydrophobicContact CD1-CG 4.42Å; L627-Q701 HydrophobicContact CD2-CB 4.24Å; L627-Q701 HydrophobicContact CG-CB 4.27Å; T674-Q701 HydrophobicContact CG2-CB 4.04Å; T674-Q701 HydrophobicContact CG2-CG 4.34Å; R678-Q701 VanDerWaalsContact CD-NE2 3.27Å; I696-Q701 PolarHBondContact O-NE2 2.78Å; S697-Q701 WeakPolarHBondContact O-CG 3.38Å; S697-Q701 PolarHBondContact O-N 2.77Å; P698-Q701 PolarHBondContact O-N 3.13Å; T699-Q701 VanDerWaalsContact C-N 3.35Å; T699-Q701 PolarHBondContact O-N 3.04Å; Q701-A703 VanDerWaalsContact C-N 3.32Å; Q701-I704 PolarHBondContact O-N 2.8Å; Q701-T705 WeakPolarHBondContact O-CB 3.37Å; Q701-T705 PolarHBondContact O-N 3.14Å; Q701-T705 PolarHBondContact O-OG1 3.33Å
702	I	89.2	Confident	83.9	Confident	68 Å²	68	65.9 Å²	65.9	35%	0.349	38%	0.377	S	S	.	.	H	α-helix	trans	-63.1	-42.1	173.3	-63.7	170.5	0	0	0	110	E626 P698 I704 T705 S706	E626-I702 HydrophobicContact CB-CD1 3.65Å; E626-I702 HydrophobicContact CB-CG1 3.96Å; E626-I702 HydrophobicContact CG-CD1 3.92Å; P698-I702 WeakPolarHBondContact O-CG1 3.49Å; P698-I702 PolarHBondContact O-N 3.26Å; I702-I704 PolarHBondContact O-N 3.33Å; I702-T705 PolarHBondContact O-N 3.3Å; I702-S706 WeakPolarHBondContact O-CB 3.37Å; I702-S706 PolarHBondContact O-N 3.36Å
703	A	90.4	Very high	85.4	Confident	61 Å²	61	65.1 Å²	65.1	50%	0.504	36%	0.36	S	S	.	.	H	α-helix	trans	-60.8	-44.5	178	0	0	0	0	0	112.7	T699 S700 Q701 S706 S707	T699-A703 PolarHBondContact O-N 3.47Å; T699-A703 VanDerWaalsContact O-N 3.09Å; S700-A703 PolarHBondContact O-N 2.83Å; Q701-A703 VanDerWaalsContact C-N 3.32Å; A703-S706 PolarHBondContact O-N 3.07Å; A703-S707 WeakPolarHBondContact O-CB 3.48Å; A703-S707 PolarHBondContact O-N 2.8Å
704	I	89.7	Confident	86.7	Confident	62 Å²	62	69.4 Å²	69.4	32%	0.318	38%	0.381	S	S	.	.	H	α-helix	trans	-62.3	-47	175.4	-67.3	163.7	0	0	0	110.7	T674 S700 Q701 I702 S706 S707 L708	T674-I704 HydrophobicContact CG2-CB 4.45Å; T674-I704 HydrophobicContact CG2-CG2 4.37Å; S700-I704 WeakPolarHBondContact O-CD1 3.32Å; S700-I704 VanDerWaalsContact O-CG1 3.27Å; S700-I704 WeakPolarHBondContact O-CG1 3.21Å; S700-I704 PolarHBondContact O-N 3.48Å; Q701-I704 PolarHBondContact O-N 2.8Å; I702-I704 PolarHBondContact O-N 3.33Å; I704-S706 PolarHBondContact O-N 2.83Å; I704-S707 WeakPolarHBondContact O-CB 3.22Å; I704-S707 PolarHBondContact O-N 3.34Å; I704-L708 HydrophobicContact CG2-CD1 4.4Å; I704-L708 WeakPolarHBondContact O-CG 3.21Å; I704-L708 PolarHBondContact O-N 2.93Å; I704-L708 VanDerWaalsContact O-N 3.1Å
705	T	91.8	Very high	87.7	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.018	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-44	179.9	-52.3	0	0	0	0	111.1	L627 V630 A670 A671 T674 Q701 I702 S707 L708 I709	L627-T705 VanDerWaalsContact CD2-OG1 3.24Å; L627-T705 WeakPolarHBondContact CD2-OG1 3.46Å; V630-T705 HydrophobicContact CG1-CG2 4.06Å; A670-T705 HydrophobicContact CB-CG2 4.12Å; A671-T705 HydrophobicContact CB-CG2 4.29Å; T674-T705 WeakPolarHBondContact CB-OG1 3.26Å; T674-T705 PolarHBondContact OG1-OG1 3.38Å; T674-T705 VanDerWaalsContact OG1-OG1 3.06Å; Q701-T705 WeakPolarHBondContact O-CB 3.37Å; Q701-T705 PolarHBondContact O-N 3.14Å; Q701-T705 PolarHBondContact O-OG1 3.33Å; I702-T705 PolarHBondContact O-N 3.3Å; T705-S707 VanDerWaalsContact C-N 3.33Å; T705-S707 PolarHBondContact O-N 3.27Å; T705-L708 PolarHBondContact O-N 3.31Å; T705-I709 HydrophobicContact CG2-CD1 3.87Å; T705-I709 VanDerWaalsContact O-CG1 3.29Å; T705-I709 WeakPolarHBondContact O-CG1 3.47Å; T705-I709 PolarHBondContact O-N 3.34Å
706	S	91.6	Very high	88.7	Confident	63 Å²	63	54.9 Å²	54.9	44%	0.441	34%	0.336	S	S	.	.	H	α-helix	trans	-63.3	-38	176.7	-169.4	0	0	0	0	111.8	I702 A703 I704 I709 S710	I702-S706 WeakPolarHBondContact O-CB 3.37Å; I702-S706 PolarHBondContact O-N 3.36Å; A703-S706 PolarHBondContact O-N 3.07Å; I704-S706 PolarHBondContact O-N 2.83Å; S706-I709 PolarHBondContact O-N 3.33Å; S706-S710 WeakPolarHBondContact O-CB 3.38Å; S706-S710 PolarHBondContact O-N 2.93Å; S706-S710 PolarHBondContact O-OG 2.93Å
707	S	93.1	Very high	89.4	Confident	84 Å²	84	57.3 Å²	57.3	59%	0.587	35%	0.348	S	S	*	.	H	α-helix	trans	-63.5	-42.5	175.8	-173.9	0	0	0	0	111.9	A703 I704 T705 S710 M711	A703-S707 WeakPolarHBondContact O-CB 3.48Å; A703-S707 PolarHBondContact O-N 2.8Å; I704-S707 WeakPolarHBondContact O-CB 3.22Å; I704-S707 PolarHBondContact O-N 3.34Å; T705-S707 VanDerWaalsContact C-N 3.33Å; T705-S707 PolarHBondContact O-N 3.27Å; S707-S710 PolarHBondContact O-N 3.47Å; S707-M711 PolarHBondContact O-N 2.91Å
708	L	93.7	Very high	89.9	Confident	40 Å²	40	58.5 Å²	58.5	21%	0.209	35%	0.353	C	S	.	.	H	α-helix	trans	-66.7	-41.7	177	-66.7	172	0	0	0	111.6	A670 L673 I704 T705 S710 M711 Y761 L765	A670-L708 HydrophobicContact CB-CB 3.9Å; A670-L708 HydrophobicContact CB-CD1 4.29Å; L673-L708 HydrophobicContact CD2-CD1 4.03Å; I704-L708 HydrophobicContact CG2-CD1 4.4Å; I704-L708 WeakPolarHBondContact O-CG 3.21Å; I704-L708 PolarHBondContact O-N 2.93Å; I704-L708 VanDerWaalsContact O-N 3.1Å; T705-L708 PolarHBondContact O-N 3.31Å; L708-S710 VanDerWaalsContact C-N 3.35Å; L708-S710 PolarHBondContact O-N 3.4Å; L708-M711 PolarHBondContact O-N 3.17Å; L708-Y761 PolarHBondContact O-OH 3.02Å; L708-L765 HydrophobicContact CD2-CD2 4.4Å
709	I	94.8	Very high	90.3	Very high	31 Å²	31	56.9 Å²	56.9	16%	0.159	34%	0.337	C	S	.	.	H	α-helix	trans	-64.9	-39.6	176	-65.7	163.3	0	0	0	111.3	V630 L663 I667 A670 T705 S706 M711 Q712 L713	V630-I709 HydrophobicContact CG1-CD1 4.33Å; L663-I709 HydrophobicContact CD1-CG2 4Å; I667-I709 HydrophobicContact CB-CD1 4.37Å; I667-I709 HydrophobicContact CG1-CD1 3.97Å; I667-I709 HydrophobicContact CG1-CG1 4.09Å; I667-I709 HydrophobicContact CG1-CG2 4.09Å; I667-I709 HydrophobicContact CG2-CD1 4.34Å; A670-I709 HydrophobicContact CB-CG1 3.99Å; T705-I709 HydrophobicContact CG2-CD1 3.87Å; T705-I709 VanDerWaalsContact O-CG1 3.29Å; T705-I709 WeakPolarHBondContact O-CG1 3.47Å; T705-I709 PolarHBondContact O-N 3.34Å; S706-I709 PolarHBondContact O-N 3.33Å; I709-M711 PolarHBondContact O-N 3.22Å; I709-Q712 PolarHBondContact O-N 3.23Å; I709-Q712 VanDerWaalsContact O-N 3.17Å; I709-L713 PolarHBondContact O-N 3.31Å
710	S	92.9	Very high	90.6	Very high	59 Å²	59	54.4 Å²	54.4	41%	0.413	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-30.9	-179.2	-60.1	0	0	0	0	112.4	S706 S707 L708 L713 L714	S706-S710 WeakPolarHBondContact O-CB 3.38Å; S706-S710 PolarHBondContact O-N 2.93Å; S706-S710 PolarHBondContact O-OG 2.93Å; S707-S710 PolarHBondContact O-N 3.47Å; L708-S710 VanDerWaalsContact C-N 3.35Å; L708-S710 PolarHBondContact O-N 3.4Å; S710-L713 PolarHBondContact O-N 3.23Å; S710-L714 WeakPolarHBondContact O-CB 3.4Å; S710-L714 PolarHBondContact O-N 3.36Å
711	M	92.6	Very high	90.8	Very high	117 Å²	117	57.6 Å²	57.6	58%	0.576	35%	0.345	S	S	*	.	H	α-helix	trans	-63.2	-44.2	175.6	-174.9	173.3	174.6	0	0	111.8	S707 L708 I709 G715 Y761	S707-M711 PolarHBondContact O-N 2.91Å; L708-M711 PolarHBondContact O-N 3.17Å; I709-M711 PolarHBondContact O-N 3.22Å; M711-G715 PolarHBondContact O-N 3.44Å; M711-G715 VanDerWaalsContact O-N 3.16Å; M711-Y761 HydrophobicContact CB-CE1 4.37Å; M711-Y761 HydrophobicContact CE-CD2 4.24Å; M711-Y761 HydrophobicContact CE-CE2 3.87Å; M711-Y761 HydrophobicContact CG-CE2 4.18Å; M711-Y761 HydrophobicContact SD-CD2 4.31Å; M711-Y761 HydrophobicContact SD-CE2 3.43Å; M711-Y761 WeakPolarHBondContact SD-CE2 3.27Å
712	Q	93	Very high	90.9	Very high	14 Å²	14	62.8 Å²	62.8	7%	0.065	38%	0.377	C	S	.	.	H	α-helix	trans	-66.9	-42.3	175.2	-176.3	64.6	25.7	0	0	111.6	L663 C666 I709 L714 G715 V716 S758 Y761	L663-Q712 HydrophobicContact CD1-CG 4.4Å; C666-Q712 HydrophobicContact CB-CB 4.08Å; C666-Q712 HydrophobicContact CB-CG 3.97Å; C666-Q712 VanDerWaalsContact SG-CB 3.55Å; I709-Q712 PolarHBondContact O-N 3.23Å; I709-Q712 VanDerWaalsContact O-N 3.17Å; Q712-L714 VanDerWaalsContact C-N 3.34Å; Q712-L714 PolarHBondContact O-N 2.92Å; Q712-G715 PolarHBondContact O-N 2.88Å; Q712-V716 WeakPolarHBondContact O-CG2 3.27Å; Q712-V716 PolarHBondContact O-N 2.91Å; Q712-S758 PolarHBondContact NE2-O 3.49Å; Q712-S758 VanDerWaalsContact NE2-O 3.15Å; Q712-Y761 HydrophobicContact CB-CD1 3.94Å; Q712-Y761 HydrophobicContact CB-CE1 4.16Å; Q712-Y761 VanDerWaalsContact OE1-CB 3.24Å
713	L	91.4	Very high	90.8	Very high	73 Å²	73	61.1 Å²	61.1	38%	0.382	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-42.8	179.8	-175.1	63.3	0	0	0	111.5	I709 S710 G715 V716 L717	I709-L713 PolarHBondContact O-N 3.31Å; S710-L713 PolarHBondContact O-N 3.23Å; L713-G715 VanDerWaalsContact C-N 3.33Å; L713-G715 PolarHBondContact O-N 3.49Å; L713-V716 PolarHBondContact O-N 3.3Å; L713-L717 HydrophobicContact CG-CD1 4.44Å; L713-L717 WeakPolarHBondContact O-CG 3.44Å; L713-L717 PolarHBondContact O-N 2.94Å
714	L	91.9	Very high	90.7	Very high	111 Å²	111	61.6 Å²	61.6	58%	0.581	37%	0.367	S	S	*	.	H	α-helix	trans	-60.6	-43.1	174.6	-176.6	64.3	0	0	0	111.5	S710 Q712 V716 L717 V718	S710-L714 WeakPolarHBondContact O-CB 3.4Å; S710-L714 PolarHBondContact O-N 3.36Å; Q712-L714 VanDerWaalsContact C-N 3.34Å; Q712-L714 PolarHBondContact O-N 2.92Å; L714-V716 VanDerWaalsContact C-N 3.33Å; L714-V716 PolarHBondContact O-N 3Å; L714-L717 PolarHBondContact O-N 2.79Å; L714-V718 HydrophobicContact CD1-CG2 4.49Å; L714-V718 WeakPolarHBondContact O-CG2 3.36Å; L714-V718 PolarHBondContact O-N 3Å
715	G	90	Very high	90.6	Very high	40 Å²	40	59.8 Å²	59.8	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-58.2	-42.9	175.8	0	0	0	0	0	112.9	M711 Q712 L713 W719	M711-G715 PolarHBondContact O-N 3.44Å; M711-G715 VanDerWaalsContact O-N 3.16Å; Q712-G715 PolarHBondContact O-N 2.88Å; L713-G715 VanDerWaalsContact C-N 3.33Å; L713-G715 PolarHBondContact O-N 3.49Å; G715-W719 WeakPolarHBondContact O-CB 3.39Å; G715-W719 PolarHBondContact O-N 3.23Å
716	V	89.1	Confident	90.5	Very high	4 Å²	4	63.3 Å²	63.3	2%	0.024	38%	0.378	C	S	.	.	H	α-helix	trans	-66.4	-41.8	175.9	174.6	0	0	0	0	111.6	I659 Q712 L713 L714 W719 F720	I659-V716 HydrophobicContact CG1-CG1 4.04Å; Q712-V716 WeakPolarHBondContact O-CG2 3.27Å; Q712-V716 PolarHBondContact O-N 2.91Å; L713-V716 PolarHBondContact O-N 3.3Å; L714-V716 VanDerWaalsContact C-N 3.33Å; L714-V716 PolarHBondContact O-N 3Å; V716-W719 WeakPolarHBondContact O-CB 3.5Å; V716-W719 PolarHBondContact O-N 2.85Å; V716-F720 HydrophobicContact CG1-CE2 4.49Å; V716-F720 PolarHBondContact O-N 3.47Å
717	L	89.9	Confident	90.4	Very high	101 Å²	101	62.9 Å²	62.9	53%	0.529	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-42.4	178.6	-70.4	173.8	0	0	0	112.2	L713 L714 W719 F720 A721	L713-L717 HydrophobicContact CG-CD1 4.44Å; L713-L717 WeakPolarHBondContact O-CG 3.44Å; L713-L717 PolarHBondContact O-N 2.94Å; L714-L717 PolarHBondContact O-N 2.79Å; L717-W719 VanDerWaalsContact C-N 3.29Å; L717-W719 PolarHBondContact O-N 2.68Å; L717-F720 PolarHBondContact O-N 3.3Å; L717-A721 PolarHBondContact O-N 3.45Å
718	V	90.4	Very high	90.3	Very high	83 Å²	83	61.9 Å²	61.9	50%	0.503	36%	0.36	S	S	.	.	H	α-helix	trans	-61.4	-42.1	173.4	171.4	0	0	0	0	110.3	L714 F720 A721 V722	L714-V718 HydrophobicContact CD1-CG2 4.49Å; L714-V718 WeakPolarHBondContact O-CG2 3.36Å; L714-V718 PolarHBondContact O-N 3Å; V718-F720 PolarHBondContact O-N 3.45Å; V718-A721 WeakPolarHBondContact O-CB 3.44Å; V718-A721 PolarHBondContact O-N 2.71Å; V718-A721 VanDerWaalsContact O-N 3.14Å; V718-V722 HydrophobicContact CG1-CG2 4.47Å; V718-V722 WeakPolarHBondContact O-CG2 3.37Å; V718-V722 PolarHBondContact O-N 2.89Å; V718-V722 VanDerWaalsContact O-N 3.1Å
719	W	87.7	Confident	90	Very high	41 Å²	41	62.4 Å²	62.4	16%	0.155	37%	0.365	C	S	.	.	H	α-helix	trans	-63	-41.3	179	-172.2	7.5	0	0	0	112.3	R658 G715 V716 L717 A721 V722 D723 I750 Q754	R658-W719 HydrophobicContact CG-CH2 4.31Å; R658-W719 HydrophobicContact CG-CZ2 4.45Å; G715-W719 WeakPolarHBondContact O-CB 3.39Å; G715-W719 PolarHBondContact O-N 3.23Å; V716-W719 WeakPolarHBondContact O-CB 3.5Å; V716-W719 PolarHBondContact O-N 2.85Å; L717-W719 VanDerWaalsContact C-N 3.29Å; L717-W719 PolarHBondContact O-N 2.68Å; W719-A721 VanDerWaalsContact C-N 3.28Å; W719-A721 PolarHBondContact O-N 3.12Å; W719-V722 PolarHBondContact O-N 3.26Å; W719-D723 PolarHBondContact O-N 3.46Å; W719-I750 HydrophobicContact CH2-CG2 4.36Å; W719-I750 HydrophobicContact CZ2-CG2 4.21Å; W719-Q754 HydrophobicContact CH2-CB 3.87Å; W719-Q754 HydrophobicContact CH2-CG 4.5Å; W719-Q754 HydrophobicContact CZ2-CB 3.41Å; W719-Q754 VanDerWaalsContact CZ2-CB 3.41Å; W719-Q754 HydrophobicContact CZ2-CG 3.63Å
720	F	88.5	Confident	89.5	Confident	56 Å²	56	62.7 Å²	62.7	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-62.9	-30.5	173	-80	-14.8	0	0	0	114.5	A655 R658 I659 V716 L717 V718 P725	A655-F720 HydrophobicContact CB-CZ 4.08Å; R658-F720 HydrophobicContact CB-CE1 3.83Å; R658-F720 HydrophobicContact CB-CZ 4.35Å; R658-F720 HydrophobicContact CG-CE1 4.49Å; I659-F720 HydrophobicContact CD1-CE2 3.75Å; I659-F720 HydrophobicContact CD1-CZ 3.86Å; I659-F720 HydrophobicContact CG1-CE2 3.66Å; I659-F720 HydrophobicContact CG1-CZ 3.55Å; V716-F720 HydrophobicContact CG1-CE2 4.49Å; V716-F720 PolarHBondContact O-N 3.47Å; L717-F720 PolarHBondContact O-N 3.3Å; V718-F720 PolarHBondContact O-N 3.45Å; F720-P725 HydrophobicContact CE1-CG 4.26Å
721	A	87.8	Confident	89	Confident	87 Å²	87	61.8 Å²	61.8	72%	0.719	36%	0.355	S	S	*	.	H	α-helix	trans	-73.8	-34.9	176.8	0	0	0	0	0	112.4	L717 V718 W719	L717-A721 PolarHBondContact O-N 3.45Å; V718-A721 WeakPolarHBondContact O-CB 3.44Å; V718-A721 PolarHBondContact O-N 2.71Å; V718-A721 VanDerWaalsContact O-N 3.14Å; W719-A721 VanDerWaalsContact C-N 3.28Å; W719-A721 PolarHBondContact O-N 3.12Å
722	V	89.2	Confident	88.3	Confident	120 Å²	120	61 Å²	61	73%	0.727	35%	0.353	S	S	*	.	H	α-helix	trans	-80.6	-41.5	-179.5	175.6	0	0	0	0	111.8	V718 W719	V718-V722 HydrophobicContact CG1-CG2 4.47Å; V718-V722 WeakPolarHBondContact O-CG2 3.37Å; V718-V722 PolarHBondContact O-N 2.89Å; V718-V722 VanDerWaalsContact O-N 3.1Å; W719-V722 PolarHBondContact O-N 3.26Å
723	D	86.7	Confident	87.2	Confident	34 Å²	34	63.6 Å²	63.6	18%	0.182	37%	0.365	C	S	.	.	S	Bend	trans	-138.1	99.6	-173.3	-179.3	26.3	0	0	0	109.6	R658 W719 Q754	R658-D723 IonicContact CZ-OD2 2.67Å; R658-D723 PolarHBondContact NH1-O 3.44Å; R658-D723 IonicContact NH1-OD2 2.7Å; R658-D723 IonicContact NH2-OD1 2.82Å; R658-D723 IonicContact NH2-OD2 2.93Å; R658-D723 PolarHBondContact NH2-OD2 3.31Å; W719-D723 PolarHBondContact O-N 3.46Å; D723-Q754 PolarHBondContact OD2-NE2 3.22Å
724	P	88.7	Confident	86.5	Confident	70 Å²	70	62 Å²	62	46%	0.455	36%	0.355	S	S	.	.			trans	-69.4	144.8	-177.7	27.9	-33.4	0	0	0	111.5	N726	P724-N726 PolarHBondContact O-N 3.06Å
725	P	87.9	Confident	85.8	Confident	24 Å²	24	60.5 Å²	60.5	16%	0.156	34%	0.344	C	S	.	.			trans	-67.1	117.8	-178.9	27	-32.9	0	0	0	111.1	C654 A655 F720	C654-P725 HydrophobicContact CB-CB 4.37Å; A655-P725 HydrophobicContact CB-CB 4.1Å; A655-P725 HydrophobicContact CB-CG 3.8Å; F720-P725 HydrophobicContact CE1-CG 4.26Å
726	N	89.2	Confident	85.4	Confident	78 Å²	78	61.2 Å²	61.2	42%	0.417	34%	0.341	S	S	.	.			trans	-128.4	169.7	175	-78.5	-42.8	0	0	0	111.7	P724 D749	P724-N726 PolarHBondContact O-N 3.06Å; N726-D749 HydrophobicContact CB-CB 4.24Å; N726-D749 WeakPolarHBondContact O-CB 3.27Å; N726-D749 PolarHBondContact O-N 3.4Å
727	T	90.8	Very high	85	Confident	53 Å²	53	69 Å²	69	33%	0.325	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.6	172.4	54.5	0	0	0	0	110.1	P649	P649-T727 HydrophobicContact CB-CG2 4.26Å
728	I	89.6	Confident	84.6	Confident	64 Å²	64	68 Å²	68	33%	0.328	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	149.2	177.8	58.3	169.2	0	0	0	110.6	K747 D749	I728-K747 HydrophobicContact CD1-CG 4.45Å; I728-K747 HydrophobicContact CG1-CG 4Å; I728-K747 PolarHBondContact N-O 2.87Å; I728-K747 PolarHBondContact O-N 3.1Å; I728-K747 VanDerWaalsContact O-O 3.1Å; I728-D749 HydrophobicContact CD1-CB 4.48Å; I728-D749 HydrophobicContact CG1-CB 4.3Å; I728-D749 HydrophobicContact CG2-CB 4.02Å
729	V	87.3	Confident	84.3	Confident	51 Å²	51	64.5 Å²	64.5	31%	0.309	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115.3	170.5	-175.1	0	0	0	0	107.7	I580 Y731 V745 L746	I580-V729 HydrophobicContact CD1-CG1 4.22Å; I580-V729 HydrophobicContact CD1-CG2 4.12Å; I580-V729 HydrophobicContact CG1-CG1 4.12Å; I580-V729 HydrophobicContact CG2-CG1 4.29Å; V729-Y731 HydrophobicContact CB-CE2 4.11Å; V729-Y731 HydrophobicContact CG1-CD1 4.35Å; V729-Y731 HydrophobicContact CG1-CD2 4.26Å; V729-Y731 HydrophobicContact CG1-CE1 3.84Å; V729-Y731 HydrophobicContact CG1-CE2 3.74Å; V729-V745 WeakPolarHBondContact CA-O 3.34Å; V729-L746 HydrophobicContact CG2-CD1 3.81Å
730	D	84.4	Confident	84.1	Confident	36 Å²	36	66.2 Å²	66.2	19%	0.193	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.6	178.3	-169.4	-24.3	0	0	0	109.2	D732 E733 G744 V745 K747	D730-D732 PolarHBondContact OD1-N 3.3Å; D730-E733 PolarHBondContact OD1-N 3.27Å; D730-G744 CarbonylContact O-C 3.48Å; D730-G744 WeakPolarHBondContact O-CA 3.46Å; D730-V745 PolarHBondContact N-O 3.09Å; D730-V745 PolarHBondContact O-N 3.31Å; D730-K747 WeakPolarHBondContact OD2-CE 3.35Å; D730-K747 IonicContact OD2-NZ 3.53Å; D730-K747 PolarHBondContact OD2-NZ 3.25Å
731	Y	82.8	Confident	83.9	Confident	41 Å²	41	67.7 Å²	67.7	16%	0.161	38%	0.375	C	S	.	.	S	Bend	trans	-92.7	-14	179.6	-66.4	-76.7	0	0	0	112.7	Y564 I578 V729 K735	Y564-Y731 HydrophobicContact CD1-CD2 4.4Å; Y564-Y731 AromaticContact CE1-CD2 3.91Å; Y564-Y731 HydrophobicContact CE1-CD2 3.91Å; Y564-Y731 HydrophobicContact CE1-CG 4.32Å; I578-Y731 HydrophobicContact CB-CD1 4.1Å; I578-Y731 HydrophobicContact CB-CE1 3.96Å; I578-Y731 HydrophobicContact CD1-CD1 4.18Å; I578-Y731 HydrophobicContact CG2-CD1 4.02Å; I578-Y731 HydrophobicContact CG2-CE1 4.18Å; V729-Y731 HydrophobicContact CB-CE2 4.11Å; V729-Y731 HydrophobicContact CG1-CD1 4.35Å; V729-Y731 HydrophobicContact CG1-CD2 4.26Å; V729-Y731 HydrophobicContact CG1-CE1 3.84Å; V729-Y731 HydrophobicContact CG1-CE2 3.74Å; Y731-K735 WeakPolarHBondContact O-CB 3.46Å; Y731-K735 PolarHBondContact O-N 3.26Å
732	D	77.4	Confident	83.8	Confident	101 Å²	101	63.6 Å²	63.6	54%	0.54	34%	0.341	S	S	.	.	S	Bend	trans	-82.9	-35	-174.5	-76.5	-19.9	0	0	0	112	Y564 D730 Q734 K735	Y564-D732 PolarHBondContact OH-OD1 2.84Å; Y564-D732 PolarHBondContact OH-OD2 2.75Å; D730-D732 PolarHBondContact OD1-N 3.3Å; D732-Q734 PolarHBondContact O-N 3.28Å; D732-Q734 VanDerWaalsContact O-N 3.09Å; D732-K735 PolarHBondContact O-N 3.18Å
733	E	71.5	Confident	83.7	Confident	68 Å²	68	62.9 Å²	62.9	32%	0.318	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.3	-179.4	-78	-174.4	176.7	0	0	113.4	D730 V745 K747	D730-E733 PolarHBondContact OD1-N 3.27Å; E733-V745 HydrophobicContact CB-CG2 4.44Å; E733-K747 IonicContact OE1-NZ 3.64Å; E733-K747 PolarHBondContact OE1-NZ 2.74Å; E733-K747 IonicContact OE2-NZ 2.86Å
734	Q	76.6	Confident	83.7	Confident	38 Å²	38	61.3 Å²	61.3	18%	0.178	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	31	179.7	-67.5	-163.9	-12.6	0	0	113.8	D732 T736 R743 V745 A814	D732-Q734 PolarHBondContact O-N 3.28Å; D732-Q734 VanDerWaalsContact O-N 3.09Å; Q734-T736 PolarHBondContact O-N 3.25Å; Q734-R743 HydrophobicContact CB-CB 4.21Å; Q734-R743 WeakPolarHBondContact CB-O 3.33Å; Q734-R743 PolarHBondContact O-N 3.06Å; Q734-V745 HydrophobicContact CG-CG2 4.01Å; Q734-A814 PolarHBondContact NE2-O 2.88Å
735	K	77.3	Confident	83.7	Confident	80 Å²	80	58.1 Å²	58.1	35%	0.348	30%	0.296	S	S	.	.			trans	-81.3	96.2	172.4	-156.8	167.4	-177.6	168.3	0	111	Y550 Y731 D732	Y550-K735 HydrophobicContact CE2-CG 4.49Å; Y550-K735 VanDerWaalsContact OH-CG 3.32Å; Y550-K735 WeakPolarHBondContact OH-CG 3.28Å; Y731-K735 WeakPolarHBondContact O-CB 3.46Å; Y731-K735 PolarHBondContact O-N 3.26Å; D732-K735 PolarHBondContact O-N 3.18Å
736	T	80.2	Confident	83.7	Confident	56 Å²	56	58.2 Å²	58.2	34%	0.344	30%	0.295	S	S	.	.			trans	-81.6	157.4	176.3	49.3	0	0	0	0	112.1	Y550 Q734 N738 L741 A742	Y550-T736 PolarHBondContact OH-O 3.14Å; Q734-T736 PolarHBondContact O-N 3.25Å; T736-N738 PolarHBondContact O-N 3.11Å; T736-N738 PolarHBondContact OG1-O 3.24Å; T736-L741 HydrophobicContact CG2-CB 4.48Å; T736-L741 WeakPolarHBondContact OG1-CB 3.44Å; T736-A742 PolarHBondContact OG1-N 3.44Å
737	I	80.3	Confident	83.6	Confident	168 Å²	168	56.7 Å²	56.7	86%	0.862	29%	0.285	S	S	*	.	S	Bend	trans	-56.5	-40.6	170.4	-61	172.6	0	0	0	110	P739	I737-P739 WeakPolarHBondContact O-CD 3.35Å
738	N	82.8	Confident	83.5	Confident	80 Å²	80	54.6 Å²	54.6	43%	0.428	27%	0.272	S	S	.	.	S	Bend	trans	-77.6	114.4	172.4	-171.1	-23.3	0	0	0	110	T736 M740 L741	T736-N738 PolarHBondContact O-N 3.11Å; T736-N738 PolarHBondContact OG1-O 3.24Å; N738-M740 PolarHBondContact O-N 3.32Å; N738-M740 WeakPolarHBondContact OD1-CB 3.13Å; N738-M740 PolarHBondContact OD1-N 3Å; N738-L741 HydrophobicContact CB-CD1 4.29Å; N738-L741 HydrophobicContact CB-CG 4.47Å; N738-L741 PolarHBondContact O-N 2.89Å
739	P	84.4	Confident	83.4	Confident	8 Å²	8	54 Å²	54	5%	0.052	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-63.1	-27.3	-177.6	27.3	-37.4	0	0	0	113	G549 Y550 R567 P568 I737 L741 A742	G549-P739 WeakPolarHBondContact O-CG 3.46Å; Y550-P739 HydrophobicContact CD1-CB 4.23Å; Y550-P739 HydrophobicContact CE1-CB 4.06Å; Y550-P739 HydrophobicContact CE2-CB 4.37Å; Y550-P739 HydrophobicContact CG-CB 4.47Å; R567-P739 HydrophobicContact CB-CB 4.3Å; R567-P739 WeakPolarHBondContact CD-O 3.3Å; P568-P739 HydrophobicContact CG-CB 4.04Å; P568-P739 HydrophobicContact CG-CG 4.04Å; I737-P739 WeakPolarHBondContact O-CD 3.35Å; P739-L741 VanDerWaalsContact C-N 3.26Å; P739-L741 PolarHBondContact O-N 3.47Å; P739-A742 VanDerWaalsContact O-CB 3.31Å; P739-A742 WeakPolarHBondContact O-CB 3.34Å; P739-A742 PolarHBondContact O-N 3.46Å
740	M	82.8	Confident	83.3	Confident	78 Å²	78	53.3 Å²	53.3	38%	0.384	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-69.2	-25	-178.9	-69.4	-62.1	-172.9	0	0	113.4	R567 S570 N738	R567-M740 PolarHBondContact NH1-O 2.84Å; S570-M740 VanDerWaalsContact CA-CE 3.42Å; N738-M740 PolarHBondContact O-N 3.32Å; N738-M740 WeakPolarHBondContact OD1-CB 3.13Å; N738-M740 PolarHBondContact OD1-N 3Å
741	L	84.1	Confident	83.3	Confident	87 Å²	87	54.9 Å²	54.9	46%	0.455	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-95.4	-6.7	179.6	-61.7	176.6	0	0	0	112.8	T736 N738 P739 R743	T736-L741 HydrophobicContact CG2-CB 4.48Å; T736-L741 WeakPolarHBondContact OG1-CB 3.44Å; N738-L741 HydrophobicContact CB-CD1 4.29Å; N738-L741 HydrophobicContact CB-CG 4.47Å; N738-L741 PolarHBondContact O-N 2.89Å; P739-L741 VanDerWaalsContact C-N 3.26Å; P739-L741 PolarHBondContact O-N 3.47Å; L741-R743 PolarHBondContact O-NH1 3.25Å
742	A	85.9	Confident	83.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.			trans	-63.5	134.7	179	0	0	0	0	0	110.8	Y550 R567 I578 T736 P739	Y550-A742 HydrophobicContact CE1-CB 4.34Å; Y550-A742 WeakPolarHBondContact OH-CB 3.28Å; R567-A742 PolarHBondContact NH1-O 2.81Å; I578-A742 HydrophobicContact CG2-CB 4.42Å; I578-A742 WeakPolarHBondContact CG2-O 3.39Å; T736-A742 PolarHBondContact OG1-N 3.44Å; P739-A742 VanDerWaalsContact O-CB 3.31Å; P739-A742 WeakPolarHBondContact O-CB 3.34Å; P739-A742 PolarHBondContact O-N 3.46Å
743	R	86.7	Confident	83.5	Confident	106 Å²	106	56.3 Å²	56.3	40%	0.4	29%	0.285	S	S	.	.			trans	-138.5	146.5	-178.7	-69.7	171.2	179.5	99.5	-7.9	109.2	P579 I581 Q734 L741	P579-R743 HydrophobicContact CG-CG 4.37Å; P579-R743 WeakPolarHBondContact O-CA 3.31Å; I581-R743 HydrophobicContact CG1-CB 4.35Å; I581-R743 HydrophobicContact CG2-CB 4.24Å; I581-R743 HydrophobicContact CG2-CG 4.14Å; Q734-R743 HydrophobicContact CB-CB 4.21Å; Q734-R743 WeakPolarHBondContact CB-O 3.33Å; Q734-R743 PolarHBondContact O-N 3.06Å; L741-R743 PolarHBondContact O-NH1 3.25Å
744	G	86.8	Confident	84.1	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	141.3	169.9	0	0	0	0	0	110.5	P579 I580 I581 D730	P579-G744 PolarHBondContact O-N 3.02Å; I580-G744 CarbonylContact C-O 3.54Å; I580-G744 VanDerWaalsContact CA-O 3.27Å; I580-G744 WeakPolarHBondContact CA-O 3.42Å; I581-G744 WeakPolarHBondContact CG1-O 3.41Å; I581-G744 PolarHBondContact N-O 3.08Å; D730-G744 CarbonylContact O-C 3.48Å; D730-G744 WeakPolarHBondContact O-CA 3.46Å
745	V	88.4	Confident	84.5	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.018	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.9	-179.7	-177.4	0	0	0	0	109.7	I581 V729 D730 E733 Q734 L817	I581-V745 HydrophobicContact CD1-CG2 4.18Å; I581-V745 HydrophobicContact CG1-CG2 4.12Å; V729-V745 WeakPolarHBondContact CA-O 3.34Å; D730-V745 PolarHBondContact N-O 3.09Å; D730-V745 PolarHBondContact O-N 3.31Å; E733-V745 HydrophobicContact CB-CG2 4.44Å; Q734-V745 HydrophobicContact CG-CG2 4.01Å; V745-L817 HydrophobicContact CG1-CD2 3.72Å
746	L	88.8	Confident	84.8	Confident	27 Å²	27	53.2 Å²	53.2	14%	0.141	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	116.7	173.1	-178.5	67.4	0	0	0	110.1	I580 I581 P649 V729	I580-L746 HydrophobicContact CG2-CB 3.7Å; I581-L746 PolarHBondContact O-N 2.84Å; P649-L746 HydrophobicContact CB-CG 4.3Å; P649-L746 HydrophobicContact CG-CG 4.41Å; V729-L746 HydrophobicContact CG2-CD1 3.81Å
747	K	87.4	Confident	85	Confident	45 Å²	45	54.6 Å²	54.6	20%	0.196	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	163	177.7	62.5	-175.7	174.4	-168.7	0	112.1	I728 D730 E733	I728-K747 HydrophobicContact CD1-CG 4.45Å; I728-K747 HydrophobicContact CG1-CG 4Å; I728-K747 PolarHBondContact N-O 2.87Å; I728-K747 PolarHBondContact O-N 3.1Å; I728-K747 VanDerWaalsContact O-O 3.1Å; D730-K747 WeakPolarHBondContact OD2-CE 3.35Å; D730-K747 IonicContact OD2-NZ 3.53Å; D730-K747 PolarHBondContact OD2-NZ 3.25Å; E733-K747 IonicContact OE1-NZ 3.64Å; E733-K747 PolarHBondContact OE1-NZ 2.74Å; E733-K747 IonicContact OE2-NZ 2.86Å
748	C	88.9	Confident	85.3	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.061	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	144	166.1	-64.6	0	0	0	0	108.7	C654 I750	C654-C748 WeakPolarHBondContact CA-SG 3.34Å; C654-C748 HydrophobicContact CB-CB 3.73Å; C654-C748 WeakPolarHBondContact CB-SG 3.32Å; C654-C748 WeakPolarHBondContact SG-CA 3.21Å; C654-C748 WeakPolarHBondContact SG-CB 3.41Å; C654-C748 CovalentContact SG-SG 2.03Å; C654-C748 PolarHBondContact SG-SG 3.2Å; C748-I750 HydrophobicContact CB-CD1 3.81Å; C748-I750 HydrophobicContact CB-CG1 3.84Å; C748-I750 PolarHBondContact O-N 3.04Å
749	D	87.6	Confident	85.5	Confident	53 Å²	53	43.3 Å²	43.3	28%	0.283	23%	0.226	S	C	.	.	S	Bend	trans	-71.6	78.1	174.3	-168.3	8.9	0	0	0	109.3	R658 N726 I728	R658-D749 PolarHBondContact NH2-O 3.07Å; N726-D749 HydrophobicContact CB-CB 4.24Å; N726-D749 WeakPolarHBondContact O-CB 3.27Å; N726-D749 PolarHBondContact O-N 3.4Å; I728-D749 HydrophobicContact CD1-CB 4.48Å; I728-D749 HydrophobicContact CG1-CB 4.3Å; I728-D749 HydrophobicContact CG2-CB 4.02Å
750	I	84.3	Confident	85.8	Confident	35 Å²	35	44.5 Å²	44.5	18%	0.179	24%	0.24	C	C	.	.			trans	-140.1	124.4	-178.5	-52	179.6	0	0	0	107	R658 W719 C748 Q754 I755	R658-I750 HydrophobicContact CG-CD1 3.58Å; R658-I750 HydrophobicContact CG-CG1 4.33Å; W719-I750 HydrophobicContact CH2-CG2 4.36Å; W719-I750 HydrophobicContact CZ2-CG2 4.21Å; C748-I750 HydrophobicContact CB-CD1 3.81Å; C748-I750 HydrophobicContact CB-CG1 3.84Å; C748-I750 PolarHBondContact O-N 3.04Å; I750-Q754 HydrophobicContact CG2-CB 4.03Å; I750-I755 HydrophobicContact CG2-CD1 4.38Å; I750-I755 HydrophobicContact CG2-CG1 3.72Å
751	T	84.4	Confident	86.2	Confident	70 Å²	70	42.4 Å²	42.4	43%	0.429	23%	0.228	S	C	.	.			trans	-80.6	155.2	178.3	63.9	0	0	0	0	111.7	L753 Q754 I755	T751-L753 PolarHBondContact O-N 3.23Å; T751-Q754 WeakPolarHBondContact O-CB 3.32Å; T751-Q754 PolarHBondContact O-N 3.11Å; T751-Q754 VanDerWaalsContact O-N 3.1Å; T751-Q754 WeakPolarHBondContact OG1-CB 3.27Å; T751-Q754 WeakPolarHBondContact OG1-CG 3.1Å; T751-Q754 PolarHBondContact OG1-N 3.3Å; T751-Q754 PolarHBondContact OG1-OE1 2.94Å; T751-I755 PolarHBondContact O-N 3.01Å; T751-I755 VanDerWaalsContact O-N 3.11Å
752	D	82.9	Confident	86.5	Confident	50 Å²	50	38.4 Å²	38.4	27%	0.267	21%	0.207	S	C	.	.	H	α-helix	trans	-58.8	-37.2	177.5	-63.4	-20.4	0	0	0	111.5	I755 I756 F807 K816	D752-I755 PolarHBondContact O-N 3.18Å; D752-I756 WeakPolarHBondContact O-CD1 3.37Å; D752-I756 WeakPolarHBondContact O-CG1 3.49Å; D752-I756 PolarHBondContact O-N 3.37Å; D752-I756 VanDerWaalsContact O-N 3.16Å; D752-F807 HydrophobicContact CB-CE1 4.24Å; D752-F807 HydrophobicContact CB-CZ 4.38Å; D752-K816 IonicContact OD1-NZ 2.78Å; D752-K816 WeakPolarHBondContact OD2-CE 3.36Å; D752-K816 IonicContact OD2-NZ 3.95Å; D752-K816 PolarHBondContact OD2-NZ 2.01Å
753	L	81.6	Confident	86.8	Confident	121 Å²	121	40.4 Å²	40.4	63%	0.634	22%	0.218	S	C	*	.	H	α-helix	trans	-62.5	-44.1	175.7	-178.7	63.5	0	0	0	111.9	T751 I755 I756 C757	T751-L753 PolarHBondContact O-N 3.23Å; L753-I755 VanDerWaalsContact C-N 3.34Å; L753-I755 PolarHBondContact O-N 2.95Å; L753-I756 PolarHBondContact O-N 3.39Å; L753-C757 WeakPolarHBondContact O-CB 3.33Å; L753-C757 PolarHBondContact O-N 2.97Å; L753-C757 PolarHBondContact O-SG 3.39Å
754	Q	84.6	Confident	87.1	Confident	40 Å²	40	40.3 Å²	40.3	19%	0.187	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-40.8	177.4	-86.7	174.5	-12.5	0	0	112.3	W719 D723 I750 T751 I756 C757 S758	W719-Q754 HydrophobicContact CH2-CB 3.87Å; W719-Q754 HydrophobicContact CH2-CG 4.5Å; W719-Q754 HydrophobicContact CZ2-CB 3.41Å; W719-Q754 VanDerWaalsContact CZ2-CB 3.41Å; W719-Q754 HydrophobicContact CZ2-CG 3.63Å; D723-Q754 PolarHBondContact OD2-NE2 3.22Å; I750-Q754 HydrophobicContact CG2-CB 4.03Å; T751-Q754 WeakPolarHBondContact O-CB 3.32Å; T751-Q754 PolarHBondContact O-N 3.11Å; T751-Q754 VanDerWaalsContact O-N 3.1Å; T751-Q754 WeakPolarHBondContact OG1-CB 3.27Å; T751-Q754 WeakPolarHBondContact OG1-CG 3.1Å; T751-Q754 PolarHBondContact OG1-N 3.3Å; T751-Q754 PolarHBondContact OG1-OE1 2.94Å; Q754-I756 VanDerWaalsContact C-N 3.33Å; Q754-I756 PolarHBondContact O-N 2.97Å; Q754-C757 PolarHBondContact O-N 2.67Å; Q754-S758 WeakPolarHBondContact O-CB 3.48Å; Q754-S758 PolarHBondContact O-N 3.48Å
755	I	84.9	Confident	87.3	Confident	27 Å²	27	40.7 Å²	40.7	14%	0.138	23%	0.226	C	C	.	.	H	α-helix	trans	-58	-47.1	173.6	-67.5	174	0	0	0	110.1	L661 I750 T751 D752 L753 S758 L759 F807 L824	L661-I755 HydrophobicContact CD2-CG2 4.16Å; I750-I755 HydrophobicContact CG2-CD1 4.38Å; I750-I755 HydrophobicContact CG2-CG1 3.72Å; T751-I755 PolarHBondContact O-N 3.01Å; T751-I755 VanDerWaalsContact O-N 3.11Å; D752-I755 PolarHBondContact O-N 3.18Å; L753-I755 VanDerWaalsContact C-N 3.34Å; L753-I755 PolarHBondContact O-N 2.95Å; I755-S758 PolarHBondContact O-N 3.12Å; I755-S758 PolarHBondContact O-OG 3.13Å; I755-L759 HydrophobicContact CG2-CD1 4.38Å; I755-L759 PolarHBondContact O-N 3.18Å; I755-F807 HydrophobicContact CG2-CZ 4.37Å; I755-L824 HydrophobicContact CG2-CD2 4.2Å
756	I	84.1	Confident	87.5	Confident	54 Å²	54	40.9 Å²	40.9	28%	0.277	23%	0.227	S	C	.	.	H	α-helix	trans	-66.3	-45.7	-179.6	-65.2	156.6	0	0	0	111.4	D752 L753 Q754 S758 L759 G760 F807 F808	D752-I756 WeakPolarHBondContact O-CD1 3.37Å; D752-I756 WeakPolarHBondContact O-CG1 3.49Å; D752-I756 PolarHBondContact O-N 3.37Å; D752-I756 VanDerWaalsContact O-N 3.16Å; L753-I756 PolarHBondContact O-N 3.39Å; Q754-I756 VanDerWaalsContact C-N 3.33Å; Q754-I756 PolarHBondContact O-N 2.97Å; I756-S758 PolarHBondContact O-N 2.93Å; I756-L759 PolarHBondContact O-N 2.8Å; I756-L759 VanDerWaalsContact O-N 3.09Å; I756-G760 PolarHBondContact O-N 2.98Å; I756-F807 HydrophobicContact CD1-CE1 4.12Å; I756-F807 HydrophobicContact CG1-CE1 4.28Å; I756-F808 HydrophobicContact CD1-CE1 3.75Å; I756-F808 HydrophobicContact CD1-CE2 4.11Å; I756-F808 HydrophobicContact CD1-CZ 3.27Å; I756-F808 HydrophobicContact CG1-CZ 4.46Å
757	C	84.2	Confident	87.6	Confident	85 Å²	85	42.9 Å²	42.9	57%	0.574	24%	0.24	S	C	*	.	H	α-helix	trans	-56.9	-39.4	176.7	-72.5	0	0	0	0	111.6	L753 Q754 L759 G760	L753-C757 WeakPolarHBondContact O-CB 3.33Å; L753-C757 PolarHBondContact O-N 2.97Å; L753-C757 PolarHBondContact O-SG 3.39Å; Q754-C757 PolarHBondContact O-N 2.67Å; C757-L759 VanDerWaalsContact C-N 3.29Å; C757-L759 PolarHBondContact O-N 3.19Å; C757-G760 PolarHBondContact O-N 3.04Å
758	S	85.9	Confident	87.8	Confident	7 Å²	7	42.8 Å²	42.8	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-31.8	178.4	83.6	0	0	0	0	113.6	Q712 Q754 I755 I756	Q712-S758 PolarHBondContact NE2-O 3.49Å; Q712-S758 VanDerWaalsContact NE2-O 3.15Å; Q754-S758 WeakPolarHBondContact O-CB 3.48Å; Q754-S758 PolarHBondContact O-N 3.48Å; I755-S758 PolarHBondContact O-N 3.12Å; I755-S758 PolarHBondContact O-OG 3.13Å; I756-S758 PolarHBondContact O-N 2.93Å
759	L	87.8	Confident	88	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-89.9	-19.2	179.1	-65.5	171.6	0	0	0	112.7	L661 I755 I756 C757 Y761 S762 I763 W800 L824 M828	L661-L759 HydrophobicContact CG-CD2 4.22Å; I755-L759 HydrophobicContact CG2-CD1 4.38Å; I755-L759 PolarHBondContact O-N 3.18Å; I756-L759 PolarHBondContact O-N 2.8Å; I756-L759 VanDerWaalsContact O-N 3.09Å; C757-L759 VanDerWaalsContact C-N 3.29Å; C757-L759 PolarHBondContact O-N 3.19Å; L759-Y761 PolarHBondContact O-N 3.2Å; L759-S762 WeakPolarHBondContact O-CB 3.25Å; L759-S762 PolarHBondContact O-N 2.79Å; L759-S762 VanDerWaalsContact O-N 3.11Å; L759-I763 HydrophobicContact CB-CD1 4.36Å; L759-I763 WeakPolarHBondContact O-CG1 3.35Å; L759-I763 PolarHBondContact O-N 3.3Å; L759-W800 HydrophobicContact CD1-CH2 4.25Å; L759-W800 HydrophobicContact CD1-CZ3 4.09Å; L759-W800 HydrophobicContact CD2-CH2 4.19Å; L759-L824 HydrophobicContact CD1-CD1 3.86Å; L759-M828 HydrophobicContact CD2-CE 3.55Å
760	G	89.8	Confident	88.1	Confident	33 Å²	33	40.7 Å²	40.7	34%	0.34	23%	0.232	S	C	.	.	H	α-helix	trans	-56.5	-43.9	-174	0	0	0	0	0	113.6	I756 C757 I763 L764	I756-G760 PolarHBondContact O-N 2.98Å; C757-G760 PolarHBondContact O-N 3.04Å; G760-I763 PolarHBondContact O-N 3.01Å; G760-L764 WeakPolarHBondContact O-CB 3.44Å; G760-L764 PolarHBondContact O-N 3.18Å
761	Y	91.7	Very high	88.5	Confident	34 Å²	34	43.2 Å²	43.2	13%	0.133	25%	0.246	C	C	.	.	H	α-helix	trans	-66.8	-40.2	177.1	-177.7	-111.7	0	0	0	112.4	L708 M711 Q712 L759 I763 L764 L765	L708-Y761 PolarHBondContact O-OH 3.02Å; M711-Y761 HydrophobicContact CB-CE1 4.37Å; M711-Y761 HydrophobicContact CE-CD2 4.24Å; M711-Y761 HydrophobicContact CE-CE2 3.87Å; M711-Y761 HydrophobicContact CG-CE2 4.18Å; M711-Y761 HydrophobicContact SD-CD2 4.31Å; M711-Y761 HydrophobicContact SD-CE2 3.43Å; M711-Y761 WeakPolarHBondContact SD-CE2 3.27Å; Q712-Y761 HydrophobicContact CB-CD1 3.94Å; Q712-Y761 HydrophobicContact CB-CE1 4.16Å; Q712-Y761 VanDerWaalsContact OE1-CB 3.24Å; L759-Y761 PolarHBondContact O-N 3.2Å; Y761-I763 VanDerWaalsContact C-N 3.33Å; Y761-I763 PolarHBondContact O-N 2.8Å; Y761-L764 HydrophobicContact CD2-CD2 4.47Å; Y761-L764 WeakPolarHBondContact O-CB 3.34Å; Y761-L764 PolarHBondContact O-N 2.81Å; Y761-L765 HydrophobicContact CD1-CD1 4Å; Y761-L765 HydrophobicContact CD1-CG 4.36Å; Y761-L765 HydrophobicContact CE1-CD1 3.57Å; Y761-L765 HydrophobicContact CE1-CD2 4.44Å; Y761-L765 HydrophobicContact CE1-CG 4.02Å; Y761-L765 HydrophobicContact CE2-CD2 4.49Å; Y761-L765 HydrophobicContact CE2-CG 4.46Å; Y761-L765 WeakPolarHBondContact O-CG 3.28Å; Y761-L765 PolarHBondContact O-N 3.06Å
762	S	90.8	Very high	88.6	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-38	175.3	-66.2	0	0	0	0	112.2	G662 C666 Y669 L759 L765 M766	G662-S762 PolarHBondContact O-OG 3.13Å; G662-S762 VanDerWaalsContact O-OG 3.09Å; C666-S762 PolarHBondContact N-OG 3.01Å; Y669-S762 WeakPolarHBondContact CD2-O 3.26Å; L759-S762 WeakPolarHBondContact O-CB 3.25Å; L759-S762 PolarHBondContact O-N 2.79Å; L759-S762 VanDerWaalsContact O-N 3.11Å; S762-L765 PolarHBondContact O-N 2.98Å; S762-M766 WeakPolarHBondContact O-CB 3.47Å; S762-M766 PolarHBondContact O-N 3.33Å
763	I	91.2	Very high	88.9	Confident	43 Å²	43	41 Å²	41	22%	0.221	23%	0.227	C	C	.	.	H	α-helix	trans	-66.5	-41.8	173.2	-66.8	168.4	0	0	0	110.5	L759 G760 Y761 L765 M766 V767 W800	L759-I763 HydrophobicContact CB-CD1 4.36Å; L759-I763 WeakPolarHBondContact O-CG1 3.35Å; L759-I763 PolarHBondContact O-N 3.3Å; G760-I763 PolarHBondContact O-N 3.01Å; Y761-I763 VanDerWaalsContact C-N 3.33Å; Y761-I763 PolarHBondContact O-N 2.8Å; I763-L765 PolarHBondContact O-N 3.16Å; I763-M766 HydrophobicContact CG2-CE 4.18Å; I763-M766 WeakPolarHBondContact O-CB 3.27Å; I763-M766 PolarHBondContact O-N 3.34Å; I763-V767 HydrophobicContact CG2-CG2 4.48Å; I763-V767 WeakPolarHBondContact O-CG2 3.06Å; I763-V767 PolarHBondContact O-N 2.99Å; I763-W800 HydrophobicContact CD1-CE3 4.32Å; I763-W800 HydrophobicContact CG1-CE3 4.44Å
764	L	92.4	Very high	89.1	Confident	104 Å²	104	38.9 Å²	38.9	55%	0.545	22%	0.215	S	C	.	.	H	α-helix	trans	-60.9	-43.9	175.2	-178.1	68.7	0	0	0	111.8	G760 Y761 M766 V767 T768	G760-L764 WeakPolarHBondContact O-CB 3.44Å; G760-L764 PolarHBondContact O-N 3.18Å; Y761-L764 HydrophobicContact CD2-CD2 4.47Å; Y761-L764 WeakPolarHBondContact O-CB 3.34Å; Y761-L764 PolarHBondContact O-N 2.81Å; L764-M766 VanDerWaalsContact C-N 3.34Å; L764-V767 PolarHBondContact O-N 3.23Å; L764-T768 WeakPolarHBondContact O-CB 3.49Å; L764-T768 PolarHBondContact O-N 3.47Å; L764-T768 PolarHBondContact O-OG1 2.59Å
765	L	92.4	Very high	89.2	Confident	7 Å²	7	42.8 Å²	42.8	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-44	173.6	-72.2	179.3	0	0	0	111.2	A670 L673 L708 Y761 S762 I763 T768 C769	A670-L765 HydrophobicContact CB-CD1 4.44Å; L673-L765 HydrophobicContact CD2-CD2 3.97Å; L708-L765 HydrophobicContact CD2-CD2 4.4Å; Y761-L765 HydrophobicContact CD1-CD1 4Å; Y761-L765 HydrophobicContact CD1-CG 4.36Å; Y761-L765 HydrophobicContact CE1-CD1 3.57Å; Y761-L765 HydrophobicContact CE1-CD2 4.44Å; Y761-L765 HydrophobicContact CE1-CG 4.02Å; Y761-L765 HydrophobicContact CE2-CD2 4.49Å; Y761-L765 HydrophobicContact CE2-CG 4.46Å; Y761-L765 WeakPolarHBondContact O-CG 3.28Å; Y761-L765 PolarHBondContact O-N 3.06Å; S762-L765 PolarHBondContact O-N 2.98Å; I763-L765 PolarHBondContact O-N 3.16Å; L765-T768 PolarHBondContact O-N 3.31Å; L765-C769 WeakPolarHBondContact O-CB 3.26Å; L765-C769 PolarHBondContact O-N 3.37Å; L765-C769 PolarHBondContact O-SG 3.4Å
766	M	91.8	Very high	89	Confident	7 Å²	7	41.7 Å²	41.7	3%	0.034	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-49.7	176.5	-178	-168	63.4	0	0	111.6	Y669 S762 I763 L764 T768 C769 T770 M793 W800	Y669-M766 HydrophobicContact CD1-CB 4.33Å; Y669-M766 HydrophobicContact CD1-CG 4.49Å; Y669-M766 HydrophobicContact CD2-CB 3.92Å; Y669-M766 HydrophobicContact CE1-CB 4.2Å; Y669-M766 HydrophobicContact CE1-CG 3.96Å; Y669-M766 HydrophobicContact CE2-CB 3.72Å; Y669-M766 HydrophobicContact CE2-CG 4.07Å; Y669-M766 HydrophobicContact CE2-SD 4.33Å; Y669-M766 HydrophobicContact CG-CB 4.22Å; S762-M766 WeakPolarHBondContact O-CB 3.47Å; S762-M766 PolarHBondContact O-N 3.33Å; I763-M766 HydrophobicContact CG2-CE 4.18Å; I763-M766 WeakPolarHBondContact O-CB 3.27Å; I763-M766 PolarHBondContact O-N 3.34Å; L764-M766 VanDerWaalsContact C-N 3.34Å; M766-T768 VanDerWaalsContact C-N 3.31Å; M766-T768 PolarHBondContact O-N 3.33Å; M766-C769 WeakPolarHBondContact O-CB 3.45Å; M766-C769 PolarHBondContact O-N 3.26Å; M766-T770 PolarHBondContact O-N 2.85Å; M766-T770 PolarHBondContact O-OG1 3.25Å; M766-M793 HydrophobicContact CB-CE 4.37Å; M766-M793 HydrophobicContact CG-CE 3.68Å; M766-M793 VanDerWaalsContact O-CE 3.23Å; M766-M793 WeakPolarHBondContact O-CE 3.49Å; M766-W800 HydrophobicContact CE-CB 3.92Å; M766-W800 HydrophobicContact CE-CG 4.21Å; M766-W800 HydrophobicContact SD-CB 4.23Å; M766-W800 VanDerWaalsContact SD-CD1 3.53Å; M766-W800 HydrophobicContact SD-CG 4.04Å
767	V	91.7	Very high	88.9	Confident	69 Å²	69	46.8 Å²	46.8	42%	0.418	24%	0.242	S	C	.	.	H	α-helix	trans	-60.4	-43.2	177.9	172	0	0	0	0	110.8	I763 L764 C769 T770 I771	I763-V767 HydrophobicContact CG2-CG2 4.48Å; I763-V767 WeakPolarHBondContact O-CG2 3.06Å; I763-V767 PolarHBondContact O-N 2.99Å; L764-V767 PolarHBondContact O-N 3.23Å; V767-C769 PolarHBondContact O-N 3Å; V767-T770 WeakPolarHBondContact O-CB 3.31Å; V767-T770 PolarHBondContact O-N 3.48Å; V767-I771 HydrophobicContact CG1-CD1 4.26Å; V767-I771 WeakPolarHBondContact O-CG1 3.46Å; V767-I771 PolarHBondContact O-N 2.83Å
768	T	91.9	Very high	88.5	Confident	43 Å²	43	48.9 Å²	48.9	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-43.9	177.1	-54.4	0	0	0	0	110.9	L673 L764 L765 M766 T770 I771 Y772	L673-T768 HydrophobicContact CD1-CG2 4Å; L673-T768 HydrophobicContact CD2-CG2 4.25Å; L764-T768 WeakPolarHBondContact O-CB 3.49Å; L764-T768 PolarHBondContact O-N 3.47Å; L764-T768 PolarHBondContact O-OG1 2.59Å; L765-T768 PolarHBondContact O-N 3.31Å; M766-T768 VanDerWaalsContact C-N 3.31Å; M766-T768 PolarHBondContact O-N 3.33Å; T768-T770 VanDerWaalsContact C-N 3.3Å; T768-T770 PolarHBondContact O-N 3.3Å; T768-I771 PolarHBondContact O-N 3.43Å; T768-Y772 HydrophobicContact CG2-CD2 3.95Å; T768-Y772 HydrophobicContact CG2-CE2 3.75Å; T768-Y772 VanDerWaalsContact O-CD2 3.24Å; T768-Y772 WeakPolarHBondContact O-CD2 3.4Å; T768-Y772 PolarHBondContact O-N 3.18Å; T768-Y772 VanDerWaalsContact O-N 3.11Å
769	C	91.3	Very high	88	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57.3	-43.4	173.8	-70.8	0	0	0	0	111.8	Y669 L673 L765 M766 V767 Y772 A773 M793	Y669-C769 PolarHBondContact O-SG 3.25Å; Y669-C769 VanDerWaalsContact O-SG 3.37Å; L673-C769 WeakPolarHBondContact CA-SG 3.23Å; L673-C769 WeakPolarHBondContact CB-SG 3.43Å; L673-C769 HydrophobicContact CD1-CB 4.44Å; L673-C769 PolarHBondContact N-SG 3.01Å; L765-C769 WeakPolarHBondContact O-CB 3.26Å; L765-C769 PolarHBondContact O-N 3.37Å; L765-C769 PolarHBondContact O-SG 3.4Å; M766-C769 WeakPolarHBondContact O-CB 3.45Å; M766-C769 PolarHBondContact O-N 3.26Å; V767-C769 PolarHBondContact O-N 3Å; C769-Y772 PolarHBondContact O-N 3.38Å; C769-A773 WeakPolarHBondContact O-CB 3.19Å; C769-A773 PolarHBondContact O-N 3.23Å; C769-M793 HydrophobicContact CB-CE 3.3Å; C769-M793 HydrophobicContact CB-CG 4.28Å; C769-M793 HydrophobicContact CB-SD 3.66Å
770	T	91	Very high	87	Confident	18 Å²	18	52.8 Å²	52.8	11%	0.11	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-42.3	179.3	-56.8	0	0	0	0	111.6	M766 V767 T768 Y772 A773 I774 Y794 C797	M766-T770 PolarHBondContact O-N 2.85Å; M766-T770 PolarHBondContact O-OG1 3.25Å; V767-T770 WeakPolarHBondContact O-CB 3.31Å; V767-T770 PolarHBondContact O-N 3.48Å; T768-T770 VanDerWaalsContact C-N 3.3Å; T768-T770 PolarHBondContact O-N 3.3Å; T770-Y772 VanDerWaalsContact C-N 3.34Å; T770-Y772 PolarHBondContact O-N 2.89Å; T770-A773 PolarHBondContact O-N 2.99Å; T770-I774 HydrophobicContact CG2-CD1 4.27Å; T770-I774 VanDerWaalsContact O-CG1 3.31Å; T770-I774 WeakPolarHBondContact O-CG1 3.38Å; T770-I774 PolarHBondContact O-N 3.28Å; T770-Y794 HydrophobicContact CG2-CD1 3.96Å; T770-Y794 HydrophobicContact CG2-CE1 3.97Å; T770-C797 PolarHBondContact OG1-SG 3.25Å
771	I	91.2	Very high	85.6	Confident	89 Å²	89	57.2 Å²	57.2	46%	0.456	28%	0.284	S	S	.	.	H	α-helix	trans	-59.3	-45.7	175	-66.1	167.4	0	0	0	110.8	V767 T768 I774 K775	V767-I771 HydrophobicContact CG1-CD1 4.26Å; V767-I771 WeakPolarHBondContact O-CG1 3.46Å; V767-I771 PolarHBondContact O-N 2.83Å; T768-I771 PolarHBondContact O-N 3.43Å; I771-I774 PolarHBondContact O-N 3.27Å; I771-K775 PolarHBondContact O-N 2.98Å
772	Y	88.1	Confident	83.9	Confident	70 Å²	70	62.8 Å²	62.8	28%	0.275	32%	0.317	S	S	.	.	H	α-helix	trans	-67.3	-37	176.7	-79.6	-72.1	0	0	0	112.4	L673 Y680 T768 C769 T770 I774 K775 T776	L673-Y772 HydrophobicContact CD1-CD2 3.6Å; L673-Y772 HydrophobicContact CD1-CE2 4.12Å; L673-Y772 HydrophobicContact CD1-CG 4.47Å; Y680-Y772 AromaticContact CD1-CD1 3.93Å; Y680-Y772 HydrophobicContact CD1-CD1 3.93Å; Y680-Y772 AromaticContact CD1-CE1 3.77Å; Y680-Y772 HydrophobicContact CD1-CE1 3.77Å; Y680-Y772 HydrophobicContact CE1-CD1 4.49Å; Y680-Y772 HydrophobicContact CE1-CE1 4.04Å; Y680-Y772 HydrophobicContact CG-CD1 4.08Å; Y680-Y772 HydrophobicContact CG-CE1 4.38Å; T768-Y772 HydrophobicContact CG2-CD2 3.95Å; T768-Y772 HydrophobicContact CG2-CE2 3.75Å; T768-Y772 VanDerWaalsContact O-CD2 3.24Å; T768-Y772 WeakPolarHBondContact O-CD2 3.4Å; T768-Y772 PolarHBondContact O-N 3.18Å; T768-Y772 VanDerWaalsContact O-N 3.11Å; C769-Y772 PolarHBondContact O-N 3.38Å; T770-Y772 VanDerWaalsContact C-N 3.34Å; T770-Y772 PolarHBondContact O-N 2.89Å; Y772-I774 VanDerWaalsContact C-N 3.34Å; Y772-I774 PolarHBondContact O-N 2.81Å; Y772-K775 PolarHBondContact O-N 3.11Å; Y772-T776 WeakPolarHBondContact O-CG2 3.21Å; Y772-T776 PolarHBondContact O-N 3.02Å; Y772-T776 VanDerWaalsContact O-N 3.08Å; Y772-T776 PolarHBondContact O-OG1 3.48Å
773	A	87.6	Confident	82.4	Confident	3 Å²	3	68.7 Å²	68.7	3%	0.025	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-41.8	177.7	0	0	0	0	0	111.6	T676 C769 T770 K775 T776 R777 M793	T676-A773 HydrophobicContact CG2-CB 4.31Å; C769-A773 WeakPolarHBondContact O-CB 3.19Å; C769-A773 PolarHBondContact O-N 3.23Å; T770-A773 PolarHBondContact O-N 2.99Å; A773-K775 PolarHBondContact O-N 2.94Å; A773-T776 WeakPolarHBondContact CA-OG1 3.44Å; A773-T776 PolarHBondContact O-N 2.95Å; A773-T776 VanDerWaalsContact O-N 3.14Å; A773-T776 PolarHBondContact O-OG1 2.88Å; A773-R777 PolarHBondContact O-N 2.85Å; A773-M793 HydrophobicContact CB-CB 4.42Å; A773-M793 HydrophobicContact CB-CG 4.27Å
774	I	87.7	Confident	81.1	Confident	76 Å²	76	72.8 Å²	72.8	39%	0.39	36%	0.364	S	S	.	.	H	α-helix	trans	-59.8	-45.8	173.7	-66.8	163.8	0	0	0	110.4	T770 I771 Y772 T776 R777 Y794	T770-I774 HydrophobicContact CG2-CD1 4.27Å; T770-I774 VanDerWaalsContact O-CG1 3.31Å; T770-I774 WeakPolarHBondContact O-CG1 3.38Å; T770-I774 PolarHBondContact O-N 3.28Å; I771-I774 PolarHBondContact O-N 3.27Å; Y772-I774 VanDerWaalsContact C-N 3.34Å; Y772-I774 PolarHBondContact O-N 2.81Å; I774-T776 PolarHBondContact O-N 2.81Å; I774-R777 WeakPolarHBondContact O-CB 3.19Å; I774-R777 VanDerWaalsContact O-CG 3.26Å; I774-R777 WeakPolarHBondContact O-CG 3.48Å; I774-R777 PolarHBondContact O-N 3.25Å; I774-Y794 HydrophobicContact CD1-CE1 4.37Å; I774-Y794 HydrophobicContact CG1-CE1 3.81Å; I774-Y794 WeakPolarHBondContact CG1-OH 3.39Å
775	K	85.4	Confident	80.3	Confident	122 Å²	122	69.7 Å²	69.7	53%	0.53	35%	0.347	S	S	.	.	H	α-helix	trans	-63.5	-22.7	177.8	-74.4	-170.2	172	-174	0	113.7	Y680 I771 Y772 A773	Y680-K775 HydrophobicContact CD2-CB 4.02Å; Y680-K775 HydrophobicContact CE2-CB 4.09Å; Y680-K775 HydrophobicContact CE2-CD 3.94Å; I771-K775 PolarHBondContact O-N 2.98Å; Y772-K775 PolarHBondContact O-N 3.11Å; A773-K775 PolarHBondContact O-N 2.94Å
776	T	81	Confident	79.7	Confident	5 Å²	5	69.8 Å²	69.8	3%	0.031	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	6	179.5	54.5	0	0	0	0	114.4	T676 I679 Y680 Y772 A773 I774 D778 V779	T676-T776 HydrophobicContact CG2-CG2 4.37Å; I679-T776 HydrophobicContact CB-CG2 4.35Å; I679-T776 HydrophobicContact CG2-CG2 3.95Å; Y680-T776 HydrophobicContact CD2-CG2 4.4Å; Y772-T776 WeakPolarHBondContact O-CG2 3.21Å; Y772-T776 PolarHBondContact O-N 3.02Å; Y772-T776 VanDerWaalsContact O-N 3.08Å; Y772-T776 PolarHBondContact O-OG1 3.48Å; A773-T776 WeakPolarHBondContact CA-OG1 3.44Å; A773-T776 PolarHBondContact O-N 2.95Å; A773-T776 VanDerWaalsContact O-N 3.14Å; A773-T776 PolarHBondContact O-OG1 2.88Å; I774-T776 PolarHBondContact O-N 2.81Å; T776-D778 VanDerWaalsContact C-N 3.34Å; T776-D778 PolarHBondContact O-N 2.85Å; T776-V779 WeakPolarHBondContact O-CB 3.08Å; T776-V779 WeakPolarHBondContact O-CG2 3.45Å; T776-V779 PolarHBondContact O-N 2.87Å
777	R	82	Confident	79.2	Confident	160 Å²	160	74.5 Å²	74.5	60%	0.604	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-29.6	-174.7	79	-174.1	-176.2	172.6	-2.3	114.2	A773 I774 V779	A773-R777 PolarHBondContact O-N 2.85Å; I774-R777 WeakPolarHBondContact O-CB 3.19Å; I774-R777 VanDerWaalsContact O-CG 3.26Å; I774-R777 WeakPolarHBondContact O-CG 3.48Å; I774-R777 PolarHBondContact O-N 3.25Å; R777-V779 PolarHBondContact O-N 3.01Å
778	D	76.3	Confident	79	Confident	130 Å²	130	73.2 Å²	73.2	70%	0.695	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	14.8	-175.2	-56.2	-46.3	0	0	0	112.6	T776	T776-D778 VanDerWaalsContact C-N 3.34Å; T776-D778 PolarHBondContact O-N 2.85Å
779	V	73.9	Confident	78.8	Confident	18 Å²	18	71.3 Å²	71.3	11%	0.109	35%	0.35	C	S	.	.			trans	-72.4	128.3	177.4	165.1	0	0	0	0	110.3	I679 F683 T776 R777 F783 A786	I679-V779 HydrophobicContact CG2-CG2 4.29Å; F683-V779 HydrophobicContact CB-CG2 4.37Å; F683-V779 HydrophobicContact CD1-CG1 4.44Å; F683-V779 HydrophobicContact CD1-CG2 4.06Å; F683-V779 HydrophobicContact CD2-CB 4.39Å; F683-V779 HydrophobicContact CD2-CG1 4.04Å; F683-V779 HydrophobicContact CD2-CG2 3.44Å; F683-V779 VanDerWaalsContact CD2-CG2 3.44Å; F683-V779 HydrophobicContact CE1-CB 4.46Å; F683-V779 HydrophobicContact CE1-CG1 3.79Å; F683-V779 HydrophobicContact CE1-CG2 4.25Å; F683-V779 HydrophobicContact CE2-CB 4.16Å; F683-V779 HydrophobicContact CE2-CG1 3.34Å; F683-V779 HydrophobicContact CE2-CG2 3.69Å; F683-V779 HydrophobicContact CG-CG2 3.67Å; F683-V779 HydrophobicContact CZ-CB 4.21Å; F683-V779 HydrophobicContact CZ-CG1 3.21Å; F683-V779 HydrophobicContact CZ-CG2 4.1Å; T776-V779 WeakPolarHBondContact O-CB 3.08Å; T776-V779 WeakPolarHBondContact O-CG2 3.45Å; T776-V779 PolarHBondContact O-N 2.87Å; R777-V779 PolarHBondContact O-N 3.01Å; V779-F783 HydrophobicContact CG1-CB 3.95Å; V779-A786 HydrophobicContact CB-CB 4.35Å
780	P	66.8	Low	78.6	Confident	75 Å²	75	71.6 Å²	71.6	49%	0.487	35%	0.353	S	S	.	.			trans	-62.1	149.4	-179.2	22.9	-32.5	0	0	0	112.9	F683 D782 F783	F683-P780 HydrophobicContact CE1-CG 4.23Å; P780-D782 PolarHBondContact O-N 2.91Å; P780-F783 PolarHBondContact O-N 2.88Å; P780-F783 VanDerWaalsContact O-N 3.12Å
781	E	60.6	Low	78.5	Confident	125 Å²	125	76.7 Å²	76.7	58%	0.584	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-61.9	-15.9	-167.8	-59.8	-166.6	146.2	0	0	114.9	F783 N784 K787	E781-F783 PolarHBondContact O-N 3.14Å; E781-F783 VanDerWaalsContact O-N 3.08Å; E781-N784 PolarHBondContact O-N 3.09Å; E781-N784 PolarHBondContact O-ND2 2.71Å; E781-N784 PolarHBondContact O-OD1 3.28Å; E781-K787 IonicContact OE1-NZ 3.55Å; E781-K787 PolarHBondContact OE1-NZ 3.37Å
782	D	57.7	Low	78.5	Confident	152 Å²	152	72.5 Å²	72.5	81%	0.813	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-61.9	-18.6	173.9	-67.4	-40.5	0	0	0	113.2	P780	P780-D782 PolarHBondContact O-N 2.91Å
783	F	59.2	Low	78.6	Confident	126 Å²	126	69.2 Å²	69.2	55%	0.553	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-109	64.5	168.5	-76.2	-93.1	0	0	0	111.2	F683 V779 P780 E781 E785	F683-F783 HydrophobicContact CE1-CD2 4.47Å; F683-F783 HydrophobicContact CE2-CB 4.33Å; F683-F783 HydrophobicContact CE2-CD2 4.46Å; F683-F783 HydrophobicContact CE2-CG 4.27Å; F683-F783 HydrophobicContact CZ-CB 4.01Å; F683-F783 AromaticContact CZ-CD2 3.62Å; F683-F783 HydrophobicContact CZ-CD2 3.62Å; F683-F783 HydrophobicContact CZ-CE2 4.19Å; F683-F783 AromaticContact CZ-CG 3.83Å; F683-F783 HydrophobicContact CZ-CG 3.83Å; V779-F783 HydrophobicContact CG1-CB 3.95Å; P780-F783 PolarHBondContact O-N 2.88Å; P780-F783 VanDerWaalsContact O-N 3.12Å; E781-F783 PolarHBondContact O-N 3.14Å; E781-F783 VanDerWaalsContact O-N 3.08Å; F783-E785 PolarHBondContact O-N 3.21Å
784	N	62.4	Low	78.8	Confident	129 Å²	129	73 Å²	73	69%	0.69	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	12.9	-175.6	-90.7	-30	0	0	0	118.6	E781	E781-N784 PolarHBondContact O-N 3.09Å; E781-N784 PolarHBondContact O-ND2 2.71Å; E781-N784 PolarHBondContact O-OD1 3.28Å
785	E	75.5	Confident	79	Confident	40 Å²	40	71.6 Å²	71.6	19%	0.187	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-19.1	-175.1	-164.8	164	-151.5	0	0	114	S623 K675 F783 I789 K843	S623-E785 PolarHBondContact OG-OE1 3.42Å; K675-E785 WeakPolarHBondContact CE-OE1 3.43Å; K675-E785 IonicContact NZ-OE1 3.54Å; K675-E785 PolarHBondContact NZ-OE1 2.84Å; F783-E785 PolarHBondContact O-N 3.21Å; E785-I789 HydrophobicContact CG-CD1 3.98Å; E785-I789 WeakPolarHBondContact O-CD1 3.39Å; E785-I789 VanDerWaalsContact O-CG1 3.27Å; E785-I789 WeakPolarHBondContact O-CG1 3.45Å; E785-K843 IonicContact OE1-NZ 3.67Å; E785-K843 PolarHBondContact OE1-NZ 3.2Å
786	A	79.8	Confident	79.3	Confident	9 Å²	9	65.8 Å²	65.8	7%	0.074	32%	0.324	C	S	.	.	H	α-helix	trans	-72.9	-39.8	-175.7	0	0	0	0	0	114	V779 I789 G790	V779-A786 HydrophobicContact CB-CB 4.35Å; A786-I789 PolarHBondContact O-N 2.96Å; A786-G790 PolarHBondContact O-N 2.99Å
787	K	82.6	Confident	79.7	Confident	106 Å²	106	66.7 Å²	66.7	46%	0.461	33%	0.33	S	S	.	.	H	α-helix	trans	-63.7	-49	-178.8	-66	179.3	180	179.9	0	112.7	E781 I789 G790 F791	E781-K787 IonicContact OE1-NZ 3.55Å; E781-K787 PolarHBondContact OE1-NZ 3.37Å; K787-I789 VanDerWaalsContact C-N 3.29Å; K787-I789 PolarHBondContact O-N 3.37Å; K787-G790 PolarHBondContact O-N 2.79Å; K787-G790 VanDerWaalsContact O-N 3.16Å; K787-F791 HydrophobicContact CB-CE2 4.43Å; K787-F791 WeakPolarHBondContact O-CD2 3.34Å; K787-F791 PolarHBondContact O-N 3.26Å
788	P	86.3	Confident	80.2	Confident	42 Å²	42	64.6 Å²	64.6	27%	0.273	33%	0.33	S	S	.	.	H	α-helix	trans	-61.7	-33.7	176.4	-23.4	34.7	0	0	0	113.7	T792 L839	P788-T792 WeakPolarHBondContact O-CB 3.42Å; P788-T792 PolarHBondContact O-N 2.96Å; P788-T792 PolarHBondContact O-OG1 3.21Å; P788-L839 HydrophobicContact CB-CD2 4.35Å
789	I	87.9	Confident	81	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-45.6	173.5	-67.6	171.1	0	0	0	110.8	K675 T676 I679 E785 A786 K787 T792 M793 L839	K675-I789 HydrophobicContact CD-CD1 4.33Å; K675-I789 HydrophobicContact CG-CD1 4.29Å; T676-I789 WeakPolarHBondContact OG1-CG2 3.29Å; I679-I789 HydrophobicContact CD1-CD1 3.94Å; E785-I789 HydrophobicContact CG-CD1 3.98Å; E785-I789 WeakPolarHBondContact O-CD1 3.39Å; E785-I789 VanDerWaalsContact O-CG1 3.27Å; E785-I789 WeakPolarHBondContact O-CG1 3.45Å; A786-I789 PolarHBondContact O-N 2.96Å; K787-I789 VanDerWaalsContact C-N 3.29Å; K787-I789 PolarHBondContact O-N 3.37Å; I789-T792 WeakPolarHBondContact O-CB 3.48Å; I789-T792 PolarHBondContact O-N 2.97Å; I789-M793 HydrophobicContact CG2-CG 4.5Å; I789-M793 WeakPolarHBondContact O-CG 3.3Å; I789-M793 PolarHBondContact O-N 2.97Å; I789-L839 HydrophobicContact CB-CD2 4.29Å; I789-L839 HydrophobicContact CG1-CD2 3.58Å
790	G	87.6	Confident	81.7	Confident	6 Å²	6	59.1 Å²	59.1	6%	0.062	30%	0.3	C	S	.	.	H	α-helix	trans	-56.6	-50.5	174.9	0	0	0	0	0	112.6	A786 K787 T792 M793 Y794	A786-G790 PolarHBondContact O-N 2.99Å; K787-G790 PolarHBondContact O-N 2.79Å; K787-G790 VanDerWaalsContact O-N 3.16Å; G790-T792 PolarHBondContact O-N 2.96Å; G790-M793 PolarHBondContact O-N 3.4Å; G790-Y794 WeakPolarHBondContact O-CD2 3.25Å; G790-Y794 PolarHBondContact O-N 3.41Å
791	F	88.9	Confident	82.8	Confident	126 Å²	126	61.5 Å²	61.5	55%	0.553	31%	0.308	S	S	*	.	H	α-helix	trans	-59.6	-44.1	177.5	-71.9	-61	0	0	0	112.6	K787 M793 Y794 T795 M838	K787-F791 HydrophobicContact CB-CE2 4.43Å; K787-F791 WeakPolarHBondContact O-CD2 3.34Å; K787-F791 PolarHBondContact O-N 3.26Å; F791-M793 VanDerWaalsContact C-N 3.34Å; F791-M793 PolarHBondContact O-N 2.73Å; F791-Y794 PolarHBondContact O-N 2.94Å; F791-T795 WeakPolarHBondContact O-CB 3.41Å; F791-T795 PolarHBondContact O-N 3.38Å; F791-T795 PolarHBondContact O-OG1 2.98Å; F791-T795 VanDerWaalsContact O-OG1 3.12Å; F791-M838 HydrophobicContact CB-SD 3.93Å
792	T	91.3	Very high	84.2	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	30%	0.3	C	S	.	.	H	α-helix	trans	-55.9	-49.8	175.7	-57.3	0	0	0	0	110.9	P788 I789 G790 T796 V834 A835 M838 L839	P788-T792 WeakPolarHBondContact O-CB 3.42Å; P788-T792 PolarHBondContact O-N 2.96Å; P788-T792 PolarHBondContact O-OG1 3.21Å; I789-T792 WeakPolarHBondContact O-CB 3.48Å; I789-T792 PolarHBondContact O-N 2.97Å; G790-T792 PolarHBondContact O-N 2.96Å; T792-T796 VanDerWaalsContact O-CG2 3.29Å; T792-T796 WeakPolarHBondContact O-CG2 3.35Å; T792-T796 PolarHBondContact O-N 3.22Å; T792-T796 PolarHBondContact O-OG1 3.42Å; T792-T796 VanDerWaalsContact O-OG1 3.08Å; T792-V834 HydrophobicContact CG2-CG1 4.25Å; T792-A835 HydrophobicContact CG2-CB 4.03Å; T792-M838 WeakPolarHBondContact OG1-CB 3.42Å; T792-L839 HydrophobicContact CG2-CD1 4.08Å; T792-L839 HydrophobicContact CG2-CG 4.25Å; T792-L839 WeakPolarHBondContact OG1-CD2 3.06Å; T792-L839 WeakPolarHBondContact OG1-CG 3.41Å
793	M	90.6	Very high	85.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-45.4	-179	-67.9	-50.8	-46	0	0	112.2	Y669 L672 M766 C769 A773 I789 G790 F791 T795 T796 C797	Y669-M793 HydrophobicContact CD1-CE 4.3Å; Y669-M793 HydrophobicContact CD1-SD 4.49Å; Y669-M793 HydrophobicContact CE1-CE 4.22Å; L672-M793 HydrophobicContact CD1-SD 4.3Å; M766-M793 HydrophobicContact CB-CE 4.37Å; M766-M793 HydrophobicContact CG-CE 3.68Å; M766-M793 VanDerWaalsContact O-CE 3.23Å; M766-M793 WeakPolarHBondContact O-CE 3.49Å; C769-M793 HydrophobicContact CB-CE 3.3Å; C769-M793 HydrophobicContact CB-CG 4.28Å; C769-M793 HydrophobicContact CB-SD 3.66Å; A773-M793 HydrophobicContact CB-CB 4.42Å; A773-M793 HydrophobicContact CB-CG 4.27Å; I789-M793 HydrophobicContact CG2-CG 4.5Å; I789-M793 WeakPolarHBondContact O-CG 3.3Å; I789-M793 PolarHBondContact O-N 2.97Å; G790-M793 PolarHBondContact O-N 3.4Å; F791-M793 VanDerWaalsContact C-N 3.34Å; F791-M793 PolarHBondContact O-N 2.73Å; M793-T795 PolarHBondContact O-N 3.28Å; M793-T796 WeakPolarHBondContact CA-OG1 3.4Å; M793-T796 PolarHBondContact O-N 3.01Å; M793-T796 PolarHBondContact O-OG1 3.32Å; M793-C797 PolarHBondContact O-N 3.32Å; M793-C797 PolarHBondContact O-SG 3.01Å; M793-C797 VanDerWaalsContact O-SG 3.36Å
794	Y	91.2	Very high	86.9	Confident	83 Å²	83	48.5 Å²	48.5	33%	0.325	25%	0.254	S	S	.	.	H	α-helix	trans	-61.4	-46	179.2	-58.5	-36.5	0	0	0	112.5	T770 I774 G790 F791 C797 I798	T770-Y794 HydrophobicContact CG2-CD1 3.96Å; T770-Y794 HydrophobicContact CG2-CE1 3.97Å; I774-Y794 HydrophobicContact CD1-CE1 4.37Å; I774-Y794 HydrophobicContact CG1-CE1 3.81Å; I774-Y794 WeakPolarHBondContact CG1-OH 3.39Å; G790-Y794 WeakPolarHBondContact O-CD2 3.25Å; G790-Y794 PolarHBondContact O-N 3.41Å; F791-Y794 PolarHBondContact O-N 2.94Å; Y794-C797 PolarHBondContact O-N 3.12Å; Y794-I798 WeakPolarHBondContact O-CG1 3.39Å; Y794-I798 PolarHBondContact O-N 2.7Å
795	T	91.9	Very high	88.1	Confident	46 Å²	46	46.2 Å²	46.2	28%	0.282	25%	0.246	S	C	.	.	H	α-helix	trans	-66	-41.4	179.3	-57.8	0	0	0	0	111.4	F791 M793 C797 I798 V799 V834 M838	F791-T795 WeakPolarHBondContact O-CB 3.41Å; F791-T795 PolarHBondContact O-N 3.38Å; F791-T795 PolarHBondContact O-OG1 2.98Å; F791-T795 VanDerWaalsContact O-OG1 3.12Å; M793-T795 PolarHBondContact O-N 3.28Å; T795-C797 PolarHBondContact O-N 3.39Å; T795-I798 PolarHBondContact O-N 3.14Å; T795-V799 WeakPolarHBondContact O-CG2 3.43Å; T795-V799 PolarHBondContact O-N 3Å; T795-V834 HydrophobicContact CG2-CB 4.45Å; T795-V834 HydrophobicContact CG2-CG1 3.82Å; T795-V834 HydrophobicContact CG2-CG2 3.7Å; T795-M838 HydrophobicContact CG2-CE 4.33Å
796	T	91.1	Very high	88.7	Confident	1 Å²	1	48 Å²	48	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-38.9	175.4	56.7	0	0	0	0	112.7	T792 M793 I798 V799 W800 V834	T792-T796 VanDerWaalsContact O-CG2 3.29Å; T792-T796 WeakPolarHBondContact O-CG2 3.35Å; T792-T796 PolarHBondContact O-N 3.22Å; T792-T796 PolarHBondContact O-OG1 3.42Å; T792-T796 VanDerWaalsContact O-OG1 3.08Å; M793-T796 WeakPolarHBondContact CA-OG1 3.4Å; M793-T796 PolarHBondContact O-N 3.01Å; M793-T796 PolarHBondContact O-OG1 3.32Å; T796-I798 VanDerWaalsContact C-N 3.33Å; T796-I798 PolarHBondContact O-N 2.75Å; T796-V799 PolarHBondContact O-N 3.42Å; T796-W800 VanDerWaalsContact O-CD1 3.27Å; T796-W800 PolarHBondContact O-N 3.2Å; T796-W800 VanDerWaalsContact O-N 3.13Å; T796-V834 HydrophobicContact CG2-CB 4.32Å; T796-V834 HydrophobicContact CG2-CG1 4.07Å
797	C	91	Very high	88.9	Confident	23 Å²	23	47.7 Å²	47.7	16%	0.155	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-40.9	175.1	-73.4	0	0	0	0	112.5	T770 M793 Y794 T795 W800 L801	T770-C797 PolarHBondContact OG1-SG 3.25Å; M793-C797 PolarHBondContact O-N 3.32Å; M793-C797 PolarHBondContact O-SG 3.01Å; M793-C797 VanDerWaalsContact O-SG 3.36Å; Y794-C797 PolarHBondContact O-N 3.12Å; T795-C797 PolarHBondContact O-N 3.39Å; C797-W800 PolarHBondContact O-N 2.82Å; C797-L801 WeakPolarHBondContact O-CB 3.43Å; C797-L801 VanDerWaalsContact O-CG 3.29Å; C797-L801 WeakPolarHBondContact O-CG 3.36Å; C797-L801 PolarHBondContact O-N 2.84Å
798	I	92.1	Very high	89	Confident	117 Å²	117	48.2 Å²	48.2	60%	0.6	26%	0.256	S	S	*	.	H	α-helix	trans	-62.7	-43.4	177.6	-66.5	167.7	0	0	0	110.9	Y794 T795 T796 W800 L801 A802	Y794-I798 WeakPolarHBondContact O-CG1 3.39Å; Y794-I798 PolarHBondContact O-N 2.7Å; T795-I798 PolarHBondContact O-N 3.14Å; T796-I798 VanDerWaalsContact C-N 3.33Å; T796-I798 PolarHBondContact O-N 2.75Å; I798-W800 VanDerWaalsContact C-N 3.34Å; I798-W800 PolarHBondContact O-N 2.69Å; I798-L801 PolarHBondContact O-N 2.63Å; I798-A802 PolarHBondContact O-N 2.73Å
799	V	91.7	Very high	88.8	Confident	25 Å²	25	49.3 Å²	49.3	15%	0.152	28%	0.275	C	S	.	.	H	α-helix	trans	-59.3	-44.4	177.6	173.6	0	0	0	0	111.3	T795 T796 A802 F803 L830	T795-V799 WeakPolarHBondContact O-CG2 3.43Å; T795-V799 PolarHBondContact O-N 3Å; T796-V799 PolarHBondContact O-N 3.42Å; V799-A802 PolarHBondContact O-N 3.48Å; V799-F803 PolarHBondContact O-N 2.86Å; V799-F803 VanDerWaalsContact O-N 3.1Å; V799-L830 HydrophobicContact CG1-CB 4.24Å
800	W	90.1	Very high	88.5	Confident	7 Å²	7	50.3 Å²	50.3	3%	0.027	28%	0.281	C	S	.	.	H	α-helix	trans	-74.7	-32	179.9	-77.7	98.8	0	0	0	113.5	M665 L759 I763 M766 T796 C797 I798 A802 F803 I804 M828 S831	M665-W800 HydrophobicContact CE-CZ2 3.59Å; M665-W800 HydrophobicContact CG-CZ2 4.44Å; M665-W800 HydrophobicContact SD-CZ2 4.19Å; L759-W800 HydrophobicContact CD1-CH2 4.25Å; L759-W800 HydrophobicContact CD1-CZ3 4.09Å; L759-W800 HydrophobicContact CD2-CH2 4.19Å; I763-W800 HydrophobicContact CD1-CE3 4.32Å; I763-W800 HydrophobicContact CG1-CE3 4.44Å; M766-W800 HydrophobicContact CE-CB 3.92Å; M766-W800 HydrophobicContact CE-CG 4.21Å; M766-W800 HydrophobicContact SD-CB 4.23Å; M766-W800 VanDerWaalsContact SD-CD1 3.53Å; M766-W800 HydrophobicContact SD-CG 4.04Å; T796-W800 VanDerWaalsContact O-CD1 3.27Å; T796-W800 PolarHBondContact O-N 3.2Å; T796-W800 VanDerWaalsContact O-N 3.13Å; C797-W800 PolarHBondContact O-N 2.82Å; I798-W800 VanDerWaalsContact C-N 3.34Å; I798-W800 PolarHBondContact O-N 2.69Å; W800-A802 VanDerWaalsContact C-N 3.3Å; W800-A802 PolarHBondContact O-N 2.98Å; W800-F803 HydrophobicContact CE3-CB 4.41Å; W800-F803 AromaticContact CE3-CD1 3.78Å; W800-F803 HydrophobicContact CE3-CD1 3.78Å; W800-F803 HydrophobicContact CE3-CE1 4.44Å; W800-F803 HydrophobicContact CE3-CG 4.24Å; W800-F803 AromaticContact CZ3-CD1 3.78Å; W800-F803 HydrophobicContact CZ3-CD1 3.78Å; W800-F803 HydrophobicContact CZ3-CE1 4.02Å; W800-F803 HydrophobicContact CZ3-CG 4.28Å; W800-F803 PolarHBondContact O-N 2.92Å; W800-I804 PolarHBondContact O-N 2.87Å; W800-M828 HydrophobicContact CH2-CE 4.22Å; W800-M828 HydrophobicContact CH2-CG 4.28Å; W800-M828 HydrophobicContact CZ2-CG 4.29Å; W800-S831 PolarHBondContact NE1-OG 3.19Å
801	L	89.2	Confident	87.7	Confident	125 Å²	125	51.9 Å²	51.9	65%	0.654	29%	0.293	S	S	*	.	H	α-helix	trans	-65	-34.3	171.4	-75.9	173.5	0	0	0	112.1	C797 I798 P805	C797-L801 WeakPolarHBondContact O-CB 3.43Å; C797-L801 VanDerWaalsContact O-CG 3.29Å; C797-L801 WeakPolarHBondContact O-CG 3.36Å; C797-L801 PolarHBondContact O-N 2.84Å; I798-L801 PolarHBondContact O-N 2.63Å; L801-P805 WeakPolarHBondContact O-CD 3.29Å
802	A	89.9	Confident	86.7	Confident	50 Å²	50	55.2 Å²	55.2	41%	0.413	31%	0.31	S	S	.	.	H	α-helix	trans	-73.9	-34.1	174.6	0	0	0	0	0	112.9	I798 V799 W800 P805 I806	I798-A802 PolarHBondContact O-N 2.73Å; V799-A802 PolarHBondContact O-N 3.48Å; W800-A802 VanDerWaalsContact C-N 3.3Å; W800-A802 PolarHBondContact O-N 2.98Å; A802-P805 WeakPolarHBondContact O-CD 3.48Å; A802-P805 WeakPolarHBondContact O-CG 3.34Å; A802-I806 VanDerWaalsContact O-CD1 3.3Å; A802-I806 WeakPolarHBondContact O-CD1 3.4Å; A802-I806 VanDerWaalsContact O-CG1 3.3Å; A802-I806 WeakPolarHBondContact O-CG1 3.44Å
803	F	88.9	Confident	85.9	Confident	9 Å²	9	57.3 Å²	57.3	4%	0.039	33%	0.325	C	S	.	.	H	α-helix	trans	-60.7	-48	179.9	165.6	-101.4	0	0	0	113.2	V799 W800 I806 F807 T823 L824	V799-F803 PolarHBondContact O-N 2.86Å; V799-F803 VanDerWaalsContact O-N 3.1Å; W800-F803 HydrophobicContact CE3-CB 4.41Å; W800-F803 AromaticContact CE3-CD1 3.78Å; W800-F803 HydrophobicContact CE3-CD1 3.78Å; W800-F803 HydrophobicContact CE3-CE1 4.44Å; W800-F803 HydrophobicContact CE3-CG 4.24Å; W800-F803 AromaticContact CZ3-CD1 3.78Å; W800-F803 HydrophobicContact CZ3-CD1 3.78Å; W800-F803 HydrophobicContact CZ3-CE1 4.02Å; W800-F803 HydrophobicContact CZ3-CG 4.28Å; W800-F803 PolarHBondContact O-N 2.92Å; F803-I806 PolarHBondContact O-N 2.82Å; F803-F807 HydrophobicContact CE1-CB 4.32Å; F803-F807 HydrophobicContact CE1-CG 4.48Å; F803-F807 HydrophobicContact CE2-CB 4.02Å; F803-F807 AromaticContact CE2-CD2 3.91Å; F803-F807 HydrophobicContact CE2-CD2 3.91Å; F803-F807 HydrophobicContact CE2-CG 4.26Å; F803-F807 HydrophobicContact CZ-CB 3.87Å; F803-F807 AromaticContact CZ-CD2 3.66Å; F803-F807 HydrophobicContact CZ-CD2 3.66Å; F803-F807 HydrophobicContact CZ-CE2 4.41Å; F803-F807 AromaticContact CZ-CG 3.83Å; F803-F807 HydrophobicContact CZ-CG 3.83Å; F803-F807 PolarHBondContact O-N 2.77Å; F803-T823 HydrophobicContact CD2-CG2 4.02Å; F803-L824 HydrophobicContact CE2-CB 3.91Å; F803-L824 HydrophobicContact CE2-CD1 3.82Å; F803-L824 HydrophobicContact CE2-CG 4.47Å; F803-L824 HydrophobicContact CZ-CB 4.47Å; F803-L824 HydrophobicContact CZ-CD1 3.74Å
804	I	85.1	Confident	84.6	Confident	72 Å²	72	61.1 Å²	61.1	37%	0.369	36%	0.357	S	S	.	.	H	α-helix	trans	-54.3	-54.4	-173.1	-65	169.8	0	0	0	112.7	W800 I806 F807 F808	W800-I804 PolarHBondContact O-N 2.87Å; I804-I806 VanDerWaalsContact C-N 3.33Å; I804-I806 PolarHBondContact O-N 3.33Å; I804-F807 PolarHBondContact O-N 3.42Å; I804-F808 HydrophobicContact CG2-CD2 4.12Å; I804-F808 HydrophobicContact CG2-CE2 4.12Å; I804-F808 WeakPolarHBondContact O-CD2 3.49Å; I804-F808 PolarHBondContact O-N 3.48Å
805	P	87.6	Confident	83.8	Confident	80 Å²	80	61.6 Å²	61.6	52%	0.519	36%	0.362	S	S	.	.	H	α-helix	trans	-65.9	-32.5	-179.8	24.4	-33.5	0	0	0	113.2	L801 A802 G809	L801-P805 WeakPolarHBondContact O-CD 3.29Å; A802-P805 WeakPolarHBondContact O-CD 3.48Å; A802-P805 WeakPolarHBondContact O-CG 3.34Å; P805-G809 PolarHBondContact O-N 3.05Å
806	I	87.9	Confident	83.2	Confident	77 Å²	77	61.3 Å²	61.3	40%	0.395	36%	0.357	S	S	.	.	H	α-helix	trans	-68.6	-40.8	178.3	-61.5	169.5	0	0	0	110.8	A802 F803 I804 T810 T823	A802-I806 VanDerWaalsContact O-CD1 3.3Å; A802-I806 WeakPolarHBondContact O-CD1 3.4Å; A802-I806 VanDerWaalsContact O-CG1 3.3Å; A802-I806 WeakPolarHBondContact O-CG1 3.44Å; F803-I806 PolarHBondContact O-N 2.82Å; I804-I806 VanDerWaalsContact C-N 3.33Å; I804-I806 PolarHBondContact O-N 3.33Å; I806-T810 VanDerWaalsContact O-CG2 3.29Å; I806-T810 WeakPolarHBondContact O-CG2 3.32Å; I806-T810 PolarHBondContact O-N 3.47Å; I806-T810 PolarHBondContact O-OG1 3.12Å; I806-T823 HydrophobicContact CB-CG2 4.11Å; I806-T823 HydrophobicContact CG2-CG2 3.6Å
807	F	84.9	Confident	82.8	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.018	37%	0.366	C	S	.	.	H	α-helix	trans	-63.4	-42.3	-179.5	-176	-95.6	0	0	0	112.7	D752 I755 I756 F803 I804 T810 Q820	D752-F807 HydrophobicContact CB-CE1 4.24Å; D752-F807 HydrophobicContact CB-CZ 4.38Å; I755-F807 HydrophobicContact CG2-CZ 4.37Å; I756-F807 HydrophobicContact CD1-CE1 4.12Å; I756-F807 HydrophobicContact CG1-CE1 4.28Å; F803-F807 HydrophobicContact CE1-CB 4.32Å; F803-F807 HydrophobicContact CE1-CG 4.48Å; F803-F807 HydrophobicContact CE2-CB 4.02Å; F803-F807 AromaticContact CE2-CD2 3.91Å; F803-F807 HydrophobicContact CE2-CD2 3.91Å; F803-F807 HydrophobicContact CE2-CG 4.26Å; F803-F807 HydrophobicContact CZ-CB 3.87Å; F803-F807 AromaticContact CZ-CD2 3.66Å; F803-F807 HydrophobicContact CZ-CD2 3.66Å; F803-F807 HydrophobicContact CZ-CE2 4.41Å; F803-F807 AromaticContact CZ-CG 3.83Å; F803-F807 HydrophobicContact CZ-CG 3.83Å; F803-F807 PolarHBondContact O-N 2.77Å; I804-F807 PolarHBondContact O-N 3.42Å; F807-T810 PolarHBondContact O-OG1 3.43Å; F807-Q820 HydrophobicContact CD2-CB 4.17Å; F807-Q820 HydrophobicContact CD2-CG 4.1Å; F807-Q820 HydrophobicContact CE2-CB 3.97Å; F807-Q820 HydrophobicContact CE2-CG 4.09Å; F807-Q820 PolarHBondContact O-NE2 2.92Å
808	F	83.5	Confident	82.4	Confident	116 Å²	116	64.1 Å²	64.1	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-80.8	-36.4	178.6	-73.4	-68.9	0	0	0	113.4	I756 I804 T810 A811	I756-F808 HydrophobicContact CD1-CE1 3.75Å; I756-F808 HydrophobicContact CD1-CE2 4.11Å; I756-F808 HydrophobicContact CD1-CZ 3.27Å; I756-F808 HydrophobicContact CG1-CZ 4.46Å; I804-F808 HydrophobicContact CG2-CD2 4.12Å; I804-F808 HydrophobicContact CG2-CE2 4.12Å; I804-F808 WeakPolarHBondContact O-CD2 3.49Å; I804-F808 PolarHBondContact O-N 3.48Å; F808-T810 PolarHBondContact O-N 2.8Å; F808-A811 VanDerWaalsContact O-CB 3.3Å; F808-A811 WeakPolarHBondContact O-CB 3.32Å; F808-A811 PolarHBondContact O-N 2.87Å
809	G	82.3	Confident	82.1	Confident	65 Å²	65	60.1 Å²	60.1	67%	0.67	35%	0.347	S	S	*	.	H	α-helix	trans	-64.3	-21.3	179.6	0	0	0	0	0	113.7	P805	P805-G809 PolarHBondContact O-N 3.05Å
810	T	82.6	Confident	81.8	Confident	24 Å²	24	59.8 Å²	59.8	15%	0.147	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	2.2	-178.7	54.6	0	0	0	0	113.2	I806 F807 F808 Q812 S813 I819	I806-T810 VanDerWaalsContact O-CG2 3.29Å; I806-T810 WeakPolarHBondContact O-CG2 3.32Å; I806-T810 PolarHBondContact O-N 3.47Å; I806-T810 PolarHBondContact O-OG1 3.12Å; F807-T810 PolarHBondContact O-OG1 3.43Å; F808-T810 PolarHBondContact O-N 2.8Å; T810-Q812 PolarHBondContact O-N 3.01Å; T810-S813 PolarHBondContact O-N 3.41Å; T810-S813 PolarHBondContact O-OG 2.67Å; T810-S813 VanDerWaalsContact O-OG 3.09Å; T810-I819 HydrophobicContact CG2-CB 4.38Å; T810-I819 HydrophobicContact CG2-CD1 4.47Å; T810-I819 HydrophobicContact CG2-CG2 3.52Å
811	A	70.6	Confident	81.7	Confident	38 Å²	38	60.4 Å²	60.4	31%	0.314	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.5	-177.4	0	0	0	0	0	114.2	F808	F808-A811 VanDerWaalsContact O-CB 3.3Å; F808-A811 WeakPolarHBondContact O-CB 3.32Å; F808-A811 PolarHBondContact O-N 2.87Å
812	Q	67.9	Low	81.7	Confident	196 Å²	196	55.2 Å²	55.2	92%	0.916	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-0.3	179.7	-67	-166.4	-20.7	0	0	114.5	T810	T810-Q812 PolarHBondContact O-N 3.01Å
813	S	73.5	Confident	81.7	Confident	45 Å²	45	54.1 Å²	54.1	32%	0.315	31%	0.309	S	S	.	.	S	Bend	trans	-83	148.3	-177.5	69.3	0	0	0	0	112.2	T810 E815 K816	T810-S813 PolarHBondContact O-N 3.41Å; T810-S813 PolarHBondContact O-OG 2.67Å; T810-S813 VanDerWaalsContact O-OG 3.09Å; S813-E815 PolarHBondContact O-N 3.06Å; S813-E815 VanDerWaalsContact O-N 3.08Å; S813-K816 WeakPolarHBondContact O-CB 3.21Å; S813-K816 PolarHBondContact O-N 2.8Å; S813-K816 PolarHBondContact OG-N 2.93Å
814	A	64.4	Low	81.7	Confident	80 Å²	80	53.8 Å²	53.8	66%	0.661	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.5	174.6	0	0	0	0	0	113.4	Q734	Q734-A814 PolarHBondContact NE2-O 2.88Å
815	E	72.7	Confident	82	Confident	94 Å²	94	50.4 Å²	50.4	44%	0.439	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	19.9	177.3	-60.1	-170.5	156.2	0	0	112.6	S813 L817 Y818 I819	S813-E815 PolarHBondContact O-N 3.06Å; S813-E815 VanDerWaalsContact O-N 3.08Å; E815-L817 PolarHBondContact O-N 3.48Å; E815-L817 VanDerWaalsContact O-N 3.11Å; E815-Y818 HydrophobicContact CB-CD2 4.12Å; E815-Y818 HydrophobicContact CG-CD2 4.48Å; E815-Y818 PolarHBondContact O-N 2.82Å; E815-I819 HydrophobicContact CB-CD1 4.09Å; E815-I819 HydrophobicContact CB-CG1 4.29Å; E815-I819 PolarHBondContact O-N 3.08Å
816	K	81.4	Confident	82.2	Confident	39 Å²	39	48.2 Å²	48.2	17%	0.17	28%	0.276	C	S	.	.	H	α-helix	trans	-42.1	-50.7	-179.5	179.2	-173.7	178.6	-177.2	0	112.6	D752 S813 Y818 I819 Q820	D752-K816 IonicContact OD1-NZ 2.78Å; D752-K816 WeakPolarHBondContact OD2-CE 3.36Å; D752-K816 IonicContact OD2-NZ 3.95Å; D752-K816 PolarHBondContact OD2-NZ 2.01Å; S813-K816 WeakPolarHBondContact O-CB 3.21Å; S813-K816 PolarHBondContact O-N 2.8Å; S813-K816 PolarHBondContact OG-N 2.93Å; K816-Y818 PolarHBondContact O-N 3.06Å; K816-I819 PolarHBondContact O-N 3.49Å; K816-Q820 HydrophobicContact CG-CG 4.27Å; K816-Q820 WeakPolarHBondContact O-CB 3.35Å; K816-Q820 WeakPolarHBondContact O-CG 3.21Å; K816-Q820 PolarHBondContact O-N 3.1Å
817	L	80.6	Confident	82.4	Confident	39 Å²	39	45 Å²	45	20%	0.204	26%	0.26	C	S	.	.	H	α-helix	trans	-55.7	-47.4	-179.5	178.3	70.5	0	0	0	112.4	V745 E815 T821	V745-L817 HydrophobicContact CG1-CD2 3.72Å; E815-L817 PolarHBondContact O-N 3.48Å; E815-L817 VanDerWaalsContact O-N 3.11Å; L817-T821 VanDerWaalsContact O-CB 3.29Å; L817-T821 WeakPolarHBondContact O-CB 3.48Å; L817-T821 PolarHBondContact O-N 3.37Å; L817-T821 PolarHBondContact O-OG1 3.37Å
818	Y	83.6	Confident	82.7	Confident	44 Å²	44	44.9 Å²	44.9	17%	0.173	26%	0.26	C	S	.	.	H	α-helix	trans	-67.8	-50.5	-176.4	-62.1	-77.7	0	0	0	110.2	L583 W589 E815 K816 T822	L583-Y818 HydrophobicContact CD1-CD1 3.33Å; L583-Y818 HydrophobicContact CD1-CE1 3.56Å; W589-Y818 HydrophobicContact CB-CD1 4.47Å; W589-Y818 AromaticContact CD1-CD1 3.95Å; W589-Y818 HydrophobicContact CG-CD1 4.4Å; E815-Y818 HydrophobicContact CB-CD2 4.12Å; E815-Y818 HydrophobicContact CG-CD2 4.48Å; E815-Y818 PolarHBondContact O-N 2.82Å; K816-Y818 PolarHBondContact O-N 3.06Å; Y818-T822 WeakPolarHBondContact O-CB 3.49Å; Y818-T822 PolarHBondContact O-N 3.38Å; Y818-T822 VanDerWaalsContact O-N 3.1Å; Y818-T822 PolarHBondContact O-OG1 3.15Å
819	I	85.4	Confident	83.2	Confident	34 Å²	34	39.4 Å²	39.4	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-69.2	-49	-172.4	-58.2	171.7	0	0	0	110.9	W589 T810 E815 K816 T821 T822 T823	W589-I819 HydrophobicContact CH2-CG1 4.39Å; T810-I819 HydrophobicContact CG2-CB 4.38Å; T810-I819 HydrophobicContact CG2-CD1 4.47Å; T810-I819 HydrophobicContact CG2-CG2 3.52Å; E815-I819 HydrophobicContact CB-CD1 4.09Å; E815-I819 HydrophobicContact CB-CG1 4.29Å; E815-I819 PolarHBondContact O-N 3.08Å; K816-I819 PolarHBondContact O-N 3.49Å; I819-T821 PolarHBondContact O-N 3.2Å; I819-T822 PolarHBondContact O-N 2.7Å; I819-T823 WeakPolarHBondContact O-CB 3.49Å; I819-T823 PolarHBondContact O-N 3.41Å; I819-T823 PolarHBondContact O-OG1 3.45Å
820	Q	86.5	Confident	83.7	Confident	17 Å²	17	39.9 Å²	39.9	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-42.2	-177.5	-72.2	-174	-29	0	0	112.5	F807 K816 L824	F807-Q820 HydrophobicContact CD2-CB 4.17Å; F807-Q820 HydrophobicContact CD2-CG 4.1Å; F807-Q820 HydrophobicContact CE2-CB 3.97Å; F807-Q820 HydrophobicContact CE2-CG 4.09Å; F807-Q820 PolarHBondContact O-NE2 2.92Å; K816-Q820 HydrophobicContact CG-CG 4.27Å; K816-Q820 WeakPolarHBondContact O-CB 3.35Å; K816-Q820 WeakPolarHBondContact O-CG 3.21Å; K816-Q820 PolarHBondContact O-N 3.1Å; Q820-L824 VanDerWaalsContact O-CB 3.24Å; Q820-L824 WeakPolarHBondContact O-CB 3.43Å; Q820-L824 PolarHBondContact O-N 3.26Å
821	T	87.6	Confident	84.2	Confident	20 Å²	20	38.9 Å²	38.9	12%	0.123	22%	0.217	C	C	.	.	H	α-helix	trans	-66.2	-44.1	179.3	-54.5	0	0	0	0	111.3	L583 M645 L817 I819 T825	L583-T821 HydrophobicContact CD2-CG2 4.12Å; M645-T821 HydrophobicContact CB-CG2 4.27Å; M645-T821 HydrophobicContact CE-CG2 4.45Å; L817-T821 VanDerWaalsContact O-CB 3.29Å; L817-T821 WeakPolarHBondContact O-CB 3.48Å; L817-T821 PolarHBondContact O-N 3.37Å; L817-T821 PolarHBondContact O-OG1 3.37Å; I819-T821 PolarHBondContact O-N 3.2Å; T821-T825 WeakPolarHBondContact O-CG2 3.12Å; T821-T825 PolarHBondContact O-N 2.87Å; T821-T825 VanDerWaalsContact O-N 3.1Å; T821-T825 PolarHBondContact O-OG1 2.77Å
822	T	89.3	Confident	85.3	Confident	17 Å²	17	37.3 Å²	37.3	10%	0.104	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-46	178.7	-63.4	0	0	0	0	111.7	W589 P593 Y818 I819 L824 T825 V826	W589-T822 HydrophobicContact CE3-CG2 4.31Å; W589-T822 WeakPolarHBondContact O-CG2 3.47Å; W589-T822 PolarHBondContact O-OG1 3.44Å; P593-T822 HydrophobicContact CG-CG2 3.94Å; Y818-T822 WeakPolarHBondContact O-CB 3.49Å; Y818-T822 PolarHBondContact O-N 3.38Å; Y818-T822 VanDerWaalsContact O-N 3.1Å; Y818-T822 PolarHBondContact O-OG1 3.15Å; I819-T822 PolarHBondContact O-N 2.7Å; T822-L824 PolarHBondContact O-N 3.18Å; T822-T825 PolarHBondContact O-N 3.27Å; T822-T825 PolarHBondContact O-OG1 3.15Å; T822-V826 HydrophobicContact CG2-CG2 4.26Å; T822-V826 WeakPolarHBondContact O-CB 3.05Å; T822-V826 VanDerWaalsContact O-CG2 3.27Å; T822-V826 WeakPolarHBondContact O-CG2 3.08Å; T822-V826 PolarHBondContact O-N 2.76Å
823	T	89.3	Confident	86.5	Confident	26 Å²	26	30.2 Å²	30.2	16%	0.16	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-45.5	178.9	-55.4	0	0	0	0	111.2	F803 I806 I819 T825 V826 S827	F803-T823 HydrophobicContact CD2-CG2 4.02Å; I806-T823 HydrophobicContact CB-CG2 4.11Å; I806-T823 HydrophobicContact CG2-CG2 3.6Å; I819-T823 WeakPolarHBondContact O-CB 3.49Å; I819-T823 PolarHBondContact O-N 3.41Å; I819-T823 PolarHBondContact O-OG1 3.45Å; T823-T825 PolarHBondContact O-N 3.25Å; T823-V826 PolarHBondContact O-N 3Å; T823-S827 WeakPolarHBondContact O-CB 3.11Å; T823-S827 PolarHBondContact O-N 3.35Å; T823-S827 PolarHBondContact O-OG 3.44Å; T823-S827 VanDerWaalsContact O-OG 3.11Å
824	L	89.6	Confident	87.5	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-47.5	178.6	177.8	56.9	0	0	0	112.1	M645 L661 I755 L759 F803 Q820 T822 S827 M828	M645-L824 HydrophobicContact CE-CD2 3.64Å; L661-L824 HydrophobicContact CD1-CD2 4.06Å; L661-L824 HydrophobicContact CD1-CG 4.46Å; I755-L824 HydrophobicContact CG2-CD2 4.2Å; L759-L824 HydrophobicContact CD1-CD1 3.86Å; F803-L824 HydrophobicContact CE2-CB 3.91Å; F803-L824 HydrophobicContact CE2-CD1 3.82Å; F803-L824 HydrophobicContact CE2-CG 4.47Å; F803-L824 HydrophobicContact CZ-CB 4.47Å; F803-L824 HydrophobicContact CZ-CD1 3.74Å; Q820-L824 VanDerWaalsContact O-CB 3.24Å; Q820-L824 WeakPolarHBondContact O-CB 3.43Å; Q820-L824 PolarHBondContact O-N 3.26Å; T822-L824 PolarHBondContact O-N 3.18Å; L824-S827 PolarHBondContact O-N 2.96Å; L824-M828 HydrophobicContact CD1-CE 3.94Å; L824-M828 HydrophobicContact CD1-SD 4.49Å; L824-M828 WeakPolarHBondContact O-CG 3.22Å; L824-M828 PolarHBondContact O-N 2.95Å; L824-M828 VanDerWaalsContact O-N 3.15Å
825	T	91.4	Very high	88.8	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-66.6	-42.7	179	51.1	0	0	0	0	112.1	P593 T642 M645 T821 T822 T823 S827 M828 N829	P593-T825 WeakPolarHBondContact CB-OG1 3.1Å; T642-T825 HydrophobicContact CG2-CG2 4.37Å; M645-T825 HydrophobicContact CB-CG2 3.64Å; M645-T825 HydrophobicContact CG-CG2 4Å; T821-T825 WeakPolarHBondContact O-CG2 3.12Å; T821-T825 PolarHBondContact O-N 2.87Å; T821-T825 VanDerWaalsContact O-N 3.1Å; T821-T825 PolarHBondContact O-OG1 2.77Å; T822-T825 PolarHBondContact O-N 3.27Å; T822-T825 PolarHBondContact O-OG1 3.15Å; T823-T825 PolarHBondContact O-N 3.25Å; T825-S827 PolarHBondContact O-N 3.16Å; T825-M828 PolarHBondContact O-N 3.22Å; T825-N829 PolarHBondContact O-N 3.27Å; T825-N829 PolarHBondContact O-ND2 2.96Å
826	V	92.3	Very high	89.7	Confident	34 Å²	34	21.5 Å²	21.5	21%	0.206	12%	0.119	C	C	.	.	H	α-helix	trans	-61.1	-44.5	176.3	171.5	0	0	0	0	111.5	P593 T822 T823 M828 N829 L830	P593-V826 HydrophobicContact CB-CG2 4.42Å; P593-V826 HydrophobicContact CG-CG2 3.96Å; T822-V826 HydrophobicContact CG2-CG2 4.26Å; T822-V826 WeakPolarHBondContact O-CB 3.05Å; T822-V826 VanDerWaalsContact O-CG2 3.27Å; T822-V826 WeakPolarHBondContact O-CG2 3.08Å; T822-V826 PolarHBondContact O-N 2.76Å; T823-V826 PolarHBondContact O-N 3Å; V826-M828 VanDerWaalsContact C-N 3.31Å; V826-M828 PolarHBondContact O-N 3.11Å; V826-N829 PolarHBondContact O-N 2.89Å; V826-L830 HydrophobicContact CG1-CD1 3.76Å; V826-L830 HydrophobicContact CG1-CG 4.19Å; V826-L830 WeakPolarHBondContact O-CB 3.43Å; V826-L830 VanDerWaalsContact O-CG 3.32Å; V826-L830 WeakPolarHBondContact O-CG 3.22Å; V826-L830 PolarHBondContact O-N 2.82Å
827	S	91.5	Very high	90.2	Very high	10 Å²	10	21.1 Å²	21.1	7%	0.07	13%	0.127	C	C	.	.	H	α-helix	trans	-61.1	-38.2	177.7	-66.5	0	0	0	0	112.6	T823 L824 T825 S831	T823-S827 WeakPolarHBondContact O-CB 3.11Å; T823-S827 PolarHBondContact O-N 3.35Å; T823-S827 PolarHBondContact O-OG 3.44Å; T823-S827 VanDerWaalsContact O-OG 3.11Å; L824-S827 PolarHBondContact O-N 2.96Å; T825-S827 PolarHBondContact O-N 3.16Å; S827-S831 WeakPolarHBondContact O-CB 3.3Å; S827-S831 PolarHBondContact O-N 3.01Å; S827-S831 PolarHBondContact O-OG 3.15Å
828	M	91.3	Very high	90.6	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-66.8	-47.2	174.5	-72.6	-176.8	164.9	0	0	112.3	I641 L661 M665 L759 W800 L824 T825 V826 L830 S831 A832	I641-M828 HydrophobicContact CD1-SD 4.31Å; I641-M828 HydrophobicContact CG2-SD 4.01Å; L661-M828 HydrophobicContact CD1-CE 3.41Å; L661-M828 VanDerWaalsContact CD1-CE 3.41Å; L661-M828 HydrophobicContact CD1-SD 3.98Å; L661-M828 HydrophobicContact CG-CE 3.97Å; M665-M828 HydrophobicContact CG-CE 4.44Å; L759-M828 HydrophobicContact CD2-CE 3.55Å; W800-M828 HydrophobicContact CH2-CE 4.22Å; W800-M828 HydrophobicContact CH2-CG 4.28Å; W800-M828 HydrophobicContact CZ2-CG 4.29Å; L824-M828 HydrophobicContact CD1-CE 3.94Å; L824-M828 HydrophobicContact CD1-SD 4.49Å; L824-M828 WeakPolarHBondContact O-CG 3.22Å; L824-M828 PolarHBondContact O-N 2.95Å; L824-M828 VanDerWaalsContact O-N 3.15Å; T825-M828 PolarHBondContact O-N 3.22Å; V826-M828 VanDerWaalsContact C-N 3.31Å; V826-M828 PolarHBondContact O-N 3.11Å; M828-L830 PolarHBondContact O-N 3.43Å; M828-S831 PolarHBondContact O-N 2.96Å; M828-A832 PolarHBondContact O-N 2.91Å
829	N	93.9	Very high	90.8	Very high	1 Å²	1	21 Å²	21	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-58.8	-46	176.7	-80	-76.2	0	0	0	111.6	L596 A597 Y639 T642 T825 V826 A832 S833	L596-N829 HydrophobicContact CB-CB 4.37Å; A597-N829 VanDerWaalsContact CA-OD1 3.22Å; A597-N829 WeakPolarHBondContact CA-OD1 3.4Å; A597-N829 WeakPolarHBondContact CB-OD1 3.38Å; A597-N829 PolarHBondContact N-OD1 2.88Å; Y639-N829 WeakPolarHBondContact CD1-OD1 3.05Å; Y639-N829 HydrophobicContact CE1-CB 4.43Å; T642-N829 PolarHBondContact OG1-ND2 2.94Å; T825-N829 PolarHBondContact O-N 3.27Å; T825-N829 PolarHBondContact O-ND2 2.96Å; V826-N829 PolarHBondContact O-N 2.89Å; N829-A832 PolarHBondContact O-N 3.16Å; N829-S833 WeakPolarHBondContact O-CB 3.27Å; N829-S833 PolarHBondContact O-N 3.14Å; N829-S833 PolarHBondContact O-OG 3.22Å
830	L	92.9	Very high	91	Very high	74 Å²	74	19.4 Å²	19.4	39%	0.387	12%	0.12	S	C	.	.	H	α-helix	trans	-62.6	-43.3	178	-72.7	173.2	0	0	0	111.6	V799 V826 M828 A832 S833 V834	V799-L830 HydrophobicContact CG1-CB 4.24Å; V826-L830 HydrophobicContact CG1-CD1 3.76Å; V826-L830 HydrophobicContact CG1-CG 4.19Å; V826-L830 WeakPolarHBondContact O-CB 3.43Å; V826-L830 VanDerWaalsContact O-CG 3.32Å; V826-L830 WeakPolarHBondContact O-CG 3.22Å; V826-L830 PolarHBondContact O-N 2.82Å; M828-L830 PolarHBondContact O-N 3.43Å; L830-A832 VanDerWaalsContact C-N 3.34Å; L830-A832 PolarHBondContact O-N 3.48Å; L830-S833 PolarHBondContact O-N 3.5Å; L830-V834 VanDerWaalsContact O-CG2 3.23Å; L830-V834 WeakPolarHBondContact O-CG2 3.22Å; L830-V834 PolarHBondContact O-N 2.81Å
831	S	92.3	Very high	91.1	Very high	4 Å²	4	22.6 Å²	22.6	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-60.3	-43.7	177.5	-60.9	0	0	0	0	112	W800 S827 M828 A835	W800-S831 PolarHBondContact NE1-OG 3.19Å; S827-S831 WeakPolarHBondContact O-CB 3.3Å; S827-S831 PolarHBondContact O-N 3.01Å; S827-S831 PolarHBondContact O-OG 3.15Å; M828-S831 PolarHBondContact O-N 2.96Å; S831-A835 PolarHBondContact O-N 3.27Å
832	A	93.1	Very high	91.1	Very high	5 Å²	5	24.7 Å²	24.7	4%	0.041	15%	0.149	C	C	.	.	H	α-helix	trans	-65.2	-42.9	176.2	0	0	0	0	0	112	I635 C638 Y639 M828 N829 L830 V834 A835 L836	I635-A832 HydrophobicContact CG2-CB 4.23Å; C638-A832 HydrophobicContact CB-CB 3.96Å; Y639-A832 HydrophobicContact CD1-CB 4.34Å; Y639-A832 HydrophobicContact CD2-CB 4.41Å; Y639-A832 HydrophobicContact CE1-CB 3.82Å; Y639-A832 HydrophobicContact CE2-CB 3.9Å; M828-A832 PolarHBondContact O-N 2.91Å; N829-A832 PolarHBondContact O-N 3.16Å; L830-A832 VanDerWaalsContact C-N 3.34Å; L830-A832 PolarHBondContact O-N 3.48Å; A832-V834 PolarHBondContact O-N 2.93Å; A832-A835 PolarHBondContact O-N 3.31Å; A832-L836 PolarHBondContact O-N 3.41Å
833	S	94.4	Very high	91	Very high	47 Å²	47	25.3 Å²	25.3	33%	0.329	15%	0.151	S	C	.	.	H	α-helix	trans	-65.1	-38.9	179.6	-65.2	0	0	0	0	112.7	Y639 N829 L830 L836 G837	Y639-S833 WeakPolarHBondContact OH-CA 3.26Å; Y639-S833 WeakPolarHBondContact OH-CB 3.32Å; Y639-S833 PolarHBondContact OH-N 3.25Å; Y639-S833 PolarHBondContact OH-OG 3.33Å; N829-S833 WeakPolarHBondContact O-CB 3.27Å; N829-S833 PolarHBondContact O-N 3.14Å; N829-S833 PolarHBondContact O-OG 3.22Å; L830-S833 PolarHBondContact O-N 3.5Å; S833-L836 PolarHBondContact O-N 3.02Å; S833-G837 PolarHBondContact O-N 3.35Å
834	V	94	Very high	90.9	Very high	23 Å²	23	24.3 Å²	24.3	14%	0.139	14%	0.144	C	C	.	.	H	α-helix	trans	-62.7	-45.9	175	169.8	0	0	0	0	110.4	T792 T795 T796 L830 A832 G837 M838	T792-V834 HydrophobicContact CG2-CG1 4.25Å; T795-V834 HydrophobicContact CG2-CB 4.45Å; T795-V834 HydrophobicContact CG2-CG1 3.82Å; T795-V834 HydrophobicContact CG2-CG2 3.7Å; T796-V834 HydrophobicContact CG2-CB 4.32Å; T796-V834 HydrophobicContact CG2-CG1 4.07Å; L830-V834 VanDerWaalsContact O-CG2 3.23Å; L830-V834 WeakPolarHBondContact O-CG2 3.22Å; L830-V834 PolarHBondContact O-N 2.81Å; A832-V834 PolarHBondContact O-N 2.93Å; V834-G837 PolarHBondContact O-N 3.04Å; V834-M838 HydrophobicContact CG1-CE 4.22Å; V834-M838 HydrophobicContact CG1-CG 4.49Å; V834-M838 HydrophobicContact CG1-SD 3.94Å; V834-M838 WeakPolarHBondContact O-CB 3.45Å; V834-M838 PolarHBondContact O-N 3.02Å
835	A	91	Very high	90.8	Very high	6 Å²	6	30.4 Å²	30.4	5%	0.05	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-42.3	177.3	0	0	0	0	0	112.4	I635 T792 S831 A832 L839	I635-A835 HydrophobicContact CD1-CB 3.97Å; I635-A835 HydrophobicContact CG1-CB 4.4Å; T792-A835 HydrophobicContact CG2-CB 4.03Å; S831-A835 PolarHBondContact O-N 3.27Å; A832-A835 PolarHBondContact O-N 3.31Å; A835-L839 HydrophobicContact CB-CD1 4.42Å; A835-L839 WeakPolarHBondContact O-CB 3.46Å; A835-L839 WeakPolarHBondContact O-CG 3.22Å; A835-L839 PolarHBondContact O-N 2.94Å
836	L	92.7	Very high	90.5	Very high	6 Å²	6	33 Å²	33	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-48.2	177.4	-169.9	68.6	0	0	0	111.9	A603 V607 L632 A832 S833 Y840 M841	A603-L836 HydrophobicContact CB-CD2 3.64Å; V607-L836 HydrophobicContact CB-CD1 4.18Å; V607-L836 HydrophobicContact CG1-CD1 4.32Å; V607-L836 HydrophobicContact CG2-CD1 3.91Å; L632-L836 HydrophobicContact CD2-CD1 3.95Å; A832-L836 PolarHBondContact O-N 3.41Å; S833-L836 PolarHBondContact O-N 3.02Å; L836-Y840 WeakPolarHBondContact O-CB 3.13Å; L836-Y840 PolarHBondContact O-N 3.29Å; L836-Y840 VanDerWaalsContact O-N 3.14Å; L836-M841 PolarHBondContact O-N 3.3Å
837	G	90.9	Very high	90.1	Very high	32 Å²	32	31.7 Å²	31.7	33%	0.33	17%	0.173	S	C	.	.	H	α-helix	trans	-68.3	-45.2	-175.8	0	0	0	0	0	113.4	S833 V834 M841 P842	S833-G837 PolarHBondContact O-N 3.35Å; V834-G837 PolarHBondContact O-N 3.04Å; G837-M841 WeakPolarHBondContact O-CB 3.47Å; G837-P842 WeakPolarHBondContact O-CD 3.2Å
838	M	89.4	Confident	89.9	Confident	69 Å²	69	34.3 Å²	34.3	34%	0.34	19%	0.186	S	C	.	.	H	α-helix	trans	-83.4	-31.8	-175.2	-64.5	-172.1	-179.4	0	0	113.1	F791 T792 T795 V834	F791-M838 HydrophobicContact CB-SD 3.93Å; T792-M838 WeakPolarHBondContact OG1-CB 3.42Å; T795-M838 HydrophobicContact CG2-CE 4.33Å; V834-M838 HydrophobicContact CG1-CE 4.22Å; V834-M838 HydrophobicContact CG1-CG 4.49Å; V834-M838 HydrophobicContact CG1-SD 3.94Å; V834-M838 WeakPolarHBondContact O-CB 3.45Å; V834-M838 PolarHBondContact O-N 3.02Å
839	L	88.1	Confident	89.6	Confident	11 Å²	11	40.8 Å²	40.8	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-93.5	-36.2	-175.3	-59.7	172.7	0	0	0	114.2	L631 L672 P788 I789 T792 A835 K843	L631-L839 HydrophobicContact CD2-CD1 4.02Å; L672-L839 HydrophobicContact CD2-CD1 3.55Å; P788-L839 HydrophobicContact CB-CD2 4.35Å; I789-L839 HydrophobicContact CB-CD2 4.29Å; I789-L839 HydrophobicContact CG1-CD2 3.58Å; T792-L839 HydrophobicContact CG2-CD1 4.08Å; T792-L839 HydrophobicContact CG2-CG 4.25Å; T792-L839 WeakPolarHBondContact OG1-CD2 3.06Å; T792-L839 WeakPolarHBondContact OG1-CG 3.41Å; A835-L839 HydrophobicContact CB-CD1 4.42Å; A835-L839 WeakPolarHBondContact O-CB 3.46Å; A835-L839 WeakPolarHBondContact O-CG 3.22Å; A835-L839 PolarHBondContact O-N 2.94Å; L839-K843 WeakPolarHBondContact O-CD 3.04Å; L839-K843 WeakPolarHBondContact O-CE 3.07Å
840	Y	90.1	Very high	89	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-36.3	-167.5	-70	-82.8	0	0	0	113.4	V607 F611 S628 L631 L632 I635 L836 K843 V844	V607-Y840 HydrophobicContact CG1-CD1 4.02Å; V607-Y840 HydrophobicContact CG1-CG 4.06Å; F611-Y840 HydrophobicContact CD1-CE1 4.47Å; F611-Y840 AromaticContact CE1-CD1 3.87Å; F611-Y840 HydrophobicContact CE1-CD1 3.87Å; F611-Y840 AromaticContact CE1-CE1 3.78Å; F611-Y840 HydrophobicContact CE1-CE1 3.78Å; F611-Y840 AromaticContact CE2-CD1 3.99Å; F611-Y840 HydrophobicContact CE2-CD1 3.99Å; F611-Y840 AromaticContact CZ-CD1 3.49Å; F611-Y840 HydrophobicContact CZ-CD1 3.49Å; F611-Y840 VanDerWaalsContact CZ-CD1 3.49Å; F611-Y840 AromaticContact CZ-CE1 3.91Å; F611-Y840 HydrophobicContact CZ-CE1 3.91Å; S628-Y840 VanDerWaalsContact CA-OH 3.32Å; S628-Y840 WeakPolarHBondContact CA-OH 3.34Å; S628-Y840 PolarHBondContact O-OH 3.11Å; L631-Y840 WeakPolarHBondContact CB-OH 3.38Å; L631-Y840 HydrophobicContact CD2-CE2 3.77Å; L631-Y840 WeakPolarHBondContact CD2-OH 3.26Å; L631-Y840 HydrophobicContact CG-CE2 4.08Å; L632-Y840 HydrophobicContact CD1-CD1 4.48Å; L632-Y840 HydrophobicContact CD1-CE1 4.01Å; L632-Y840 HydrophobicContact CD2-CD1 4.32Å; L632-Y840 HydrophobicContact CD2-CD2 4.11Å; L632-Y840 HydrophobicContact CD2-CE1 4.21Å; L632-Y840 HydrophobicContact CD2-CE2 4.01Å; L632-Y840 HydrophobicContact CD2-CG 4.26Å; L632-Y840 HydrophobicContact CG-CE1 4.01Å; L632-Y840 HydrophobicContact CG-CE2 4.25Å; I635-Y840 HydrophobicContact CD1-CE2 4.27Å; L836-Y840 WeakPolarHBondContact O-CB 3.13Å; L836-Y840 PolarHBondContact O-N 3.29Å; L836-Y840 VanDerWaalsContact O-N 3.14Å; Y840-K843 WeakPolarHBondContact O-CB 3.49Å; Y840-K843 PolarHBondContact O-N 3.06Å; Y840-V844 WeakPolarHBondContact O-CG2 3.48Å; Y840-V844 PolarHBondContact O-N 3.39Å
841	M	88.3	Confident	88.3	Confident	84 Å²	84	43.9 Å²	43.9	41%	0.414	23%	0.233	S	C	.	.	H	α-helix	trans	-57.2	-44.1	178	-72.7	-67.7	-159.6	0	0	113.5	L836 G837 K843 V844 Y845	L836-M841 PolarHBondContact O-N 3.3Å; G837-M841 WeakPolarHBondContact O-CB 3.47Å; M841-K843 PolarHBondContact O-N 3.39Å; M841-V844 PolarHBondContact O-N 3.48Å; M841-Y845 VanDerWaalsContact O-CB 3.28Å; M841-Y845 WeakPolarHBondContact O-CB 3.38Å; M841-Y845 PolarHBondContact O-N 2.77Å
842	P	86.9	Confident	87.4	Confident	63 Å²	63	49.2 Å²	49.2	41%	0.409	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-34.2	176.3	-24.8	34.7	0	0	0	112.8	G837 I846	G837-P842 WeakPolarHBondContact O-CD 3.2Å; P842-I846 WeakPolarHBondContact O-CD1 3.35Å; P842-I846 VanDerWaalsContact O-CG1 3.28Å; P842-I846 WeakPolarHBondContact O-CG1 3.13Å; P842-I846 PolarHBondContact O-N 3.45Å
843	K	86.9	Confident	86.2	Confident	31 Å²	31	54.3 Å²	54.3	14%	0.135	28%	0.284	C	S	.	.	H	α-helix	trans	-74.5	-44.2	179.4	-65.3	176.7	-179.5	166.6	0	111.8	F611 I619 S623 E785 L839 Y840 M841 Y845 I846 I847	F611-K843 HydrophobicContact CZ-CB 4.2Å; F611-K843 HydrophobicContact CZ-CD 4.19Å; I619-K843 HydrophobicContact CG2-CB 4.43Å; I619-K843 HydrophobicContact CG2-CG 4.45Å; S623-K843 PolarHBondContact OG-NZ 2.84Å; E785-K843 IonicContact OE1-NZ 3.67Å; E785-K843 PolarHBondContact OE1-NZ 3.2Å; L839-K843 WeakPolarHBondContact O-CD 3.04Å; L839-K843 WeakPolarHBondContact O-CE 3.07Å; Y840-K843 WeakPolarHBondContact O-CB 3.49Å; Y840-K843 PolarHBondContact O-N 3.06Å; M841-K843 PolarHBondContact O-N 3.39Å; K843-Y845 VanDerWaalsContact C-N 3.32Å; K843-I846 PolarHBondContact O-N 3.27Å; K843-I847 WeakPolarHBondContact O-CB 3.31Å; K843-I847 WeakPolarHBondContact O-CD1 3.46Å; K843-I847 WeakPolarHBondContact O-CG1 3.12Å; K843-I847 PolarHBondContact O-N 2.03Å
844	V	88.5	Confident	84.9	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.03	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-40.8	176.3	172.4	0	0	0	0	110.7	F606 V607 T610 F611 Y840 M841 I846 I847 I848	F606-V844 HydrophobicContact CE1-CG1 3.79Å; F606-V844 HydrophobicContact CZ-CG1 4.42Å; V607-V844 HydrophobicContact CB-CG2 4.4Å; V607-V844 HydrophobicContact CG1-CG2 4.05Å; V607-V844 HydrophobicContact CG2-CG2 4.1Å; T610-V844 HydrophobicContact CG2-CG1 4.26Å; F611-V844 HydrophobicContact CD2-CG2 4.16Å; F611-V844 HydrophobicContact CE2-CG2 3.71Å; Y840-V844 WeakPolarHBondContact O-CG2 3.48Å; Y840-V844 PolarHBondContact O-N 3.39Å; M841-V844 PolarHBondContact O-N 3.48Å; V844-I846 PolarHBondContact O-N 2.7Å; V844-I847 PolarHBondContact O-N 2.89Å; V844-I848 HydrophobicContact CG1-CD1 3.66Å; V844-I848 HydrophobicContact CG1-CG1 4.36Å; V844-I848 WeakPolarHBondContact O-CG1 3.37Å; V844-I848 PolarHBondContact O-N 2.74Å
845	Y	86.9	Confident	83.7	Confident	130 Å²	130	57.2 Å²	57.2	51%	0.51	30%	0.298	S	S	.	.	H	α-helix	trans	-56.9	-48.6	175	-179.2	-97.1	0	0	0	111.7	M841 K843 I848 F849 H850	M841-Y845 VanDerWaalsContact O-CB 3.28Å; M841-Y845 WeakPolarHBondContact O-CB 3.38Å; M841-Y845 PolarHBondContact O-N 2.77Å; K843-Y845 VanDerWaalsContact C-N 3.32Å; Y845-I848 PolarHBondContact O-N 2.96Å; Y845-F849 AromaticContact CD2-CD2 3.66Å; Y845-F849 HydrophobicContact CD2-CD2 3.66Å; Y845-F849 HydrophobicContact CD2-CE2 4.25Å; Y845-F849 HydrophobicContact CD2-CG 4.4Å; Y845-F849 HydrophobicContact CE2-CB 4.33Å; Y845-F849 AromaticContact CE2-CD2 3.88Å; Y845-F849 HydrophobicContact CE2-CD2 3.88Å; Y845-F849 HydrophobicContact CE2-CG 4.23Å; Y845-F849 HydrophobicContact CG-CD2 4.39Å; Y845-F849 WeakPolarHBondContact O-CB 3.16Å; Y845-F849 PolarHBondContact O-N 2.96Å; Y845-H850 AromaticContact CE1-CD2 3.48Å; Y845-H850 VanDerWaalsContact CE1-CD2 3.48Å; Y845-H850 WeakPolarHBondContact CE1-CD2 3.23Å; Y845-H850 AromaticContact CE1-NE2 3.73Å; Y845-H850 AromaticContact CZ-NE2 3.92Å; Y845-H850 PolarHBondContact OH-NE2 3.29Å
846	I	84.2	Confident	82.1	Confident	55 Å²	55	65.3 Å²	65.3	28%	0.282	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-42	177.3	-64.7	165.7	0	0	0	111.4	I619 P842 K843 V844 I848 H850 L853	I619-I846 HydrophobicContact CD1-CB 4.41Å; I619-I846 HydrophobicContact CD1-CG2 3.56Å; P842-I846 WeakPolarHBondContact O-CD1 3.35Å; P842-I846 VanDerWaalsContact O-CG1 3.28Å; P842-I846 WeakPolarHBondContact O-CG1 3.13Å; P842-I846 PolarHBondContact O-N 3.45Å; K843-I846 PolarHBondContact O-N 3.27Å; V844-I846 PolarHBondContact O-N 2.7Å; I846-I848 VanDerWaalsContact C-N 3.33Å; I846-I848 PolarHBondContact O-N 3.15Å; I846-H850 CarbonylContact O-C 3.53Å; I846-H850 WeakPolarHBondContact O-CA 3.4Å; I846-H850 PolarHBondContact O-N 3.43Å; I846-H850 VanDerWaalsContact O-N 3.13Å; I846-H850 VanDerWaalsContact O-O 3.07Å; I846-L853 HydrophobicContact CG2-CB 3.94Å; I846-L853 HydrophobicContact CG2-CD1 4.48Å
847	I	85.5	Confident	80.2	Confident	6 Å²	6	74.3 Å²	74.3	3%	0.031	37%	0.374	C	S	.	.	H	α-helix	trans	-63.2	-37.3	-178.7	-70.5	163.7	0	0	0	112.1	T610 F611 Y614 I619 V620 K843 V844	T610-I847 HydrophobicContact CG2-CG2 4.18Å; F611-I847 HydrophobicContact CE2-CD1 4.41Å; Y614-I847 HydrophobicContact CD1-CG2 4.44Å; Y614-I847 HydrophobicContact CD2-CG2 3.65Å; Y614-I847 HydrophobicContact CE2-CG2 4.18Å; Y614-I847 HydrophobicContact CG-CG2 3.8Å; I619-I847 HydrophobicContact CD1-CG1 4.39Å; I619-I847 HydrophobicContact CG2-CD1 4.34Å; I619-I847 HydrophobicContact CG2-CG1 4.45Å; V620-I847 HydrophobicContact CG2-CD1 3.72Å; K843-I847 WeakPolarHBondContact O-CB 3.31Å; K843-I847 WeakPolarHBondContact O-CD1 3.46Å; K843-I847 WeakPolarHBondContact O-CG1 3.12Å; K843-I847 PolarHBondContact O-N 2.03Å; V844-I847 PolarHBondContact O-N 2.89Å
848	I	85.9	Confident	77.6	Confident	66 Å²	66	84.5 Å²	84.5	34%	0.338	40%	0.403	S	S	.	.	H	α-helix	trans	-90.4	-48.6	-175.1	-64.2	177	0	0	0	112.1	F606 T610 V844 Y845 I846	F606-I848 HydrophobicContact CE1-CD1 4.36Å; F606-I848 HydrophobicContact CZ-CD1 3.74Å; T610-I848 HydrophobicContact CG2-CD1 4.22Å; T610-I848 HydrophobicContact CG2-CG1 4.29Å; V844-I848 HydrophobicContact CG1-CD1 3.66Å; V844-I848 HydrophobicContact CG1-CG1 4.36Å; V844-I848 WeakPolarHBondContact O-CG1 3.37Å; V844-I848 PolarHBondContact O-N 2.74Å; Y845-I848 PolarHBondContact O-N 2.96Å; I846-I848 VanDerWaalsContact C-N 3.33Å; I846-I848 PolarHBondContact O-N 3.15Å
849	F	85.4	Confident	75.2	Confident	137 Å²	137	90.9 Å²	90.9	60%	0.601	43%	0.428	S	S	*	.	H	α-helix	trans	-97.3	-21.3	-169.3	-66.2	-78.6	0	0	0	114.1	Y845 P851	Y845-F849 AromaticContact CD2-CD2 3.66Å; Y845-F849 HydrophobicContact CD2-CD2 3.66Å; Y845-F849 HydrophobicContact CD2-CE2 4.25Å; Y845-F849 HydrophobicContact CD2-CG 4.4Å; Y845-F849 HydrophobicContact CE2-CB 4.33Å; Y845-F849 AromaticContact CE2-CD2 3.88Å; Y845-F849 HydrophobicContact CE2-CD2 3.88Å; Y845-F849 HydrophobicContact CE2-CG 4.23Å; Y845-F849 HydrophobicContact CG-CD2 4.39Å; Y845-F849 WeakPolarHBondContact O-CB 3.16Å; Y845-F849 PolarHBondContact O-N 2.96Å; F849-P851 VanDerWaalsContact C-CD 3.47Å
850	H	82.1	Confident	72.8	Confident	59 Å²	59	101.7 Å²	101.7	27%	0.273	47%	0.468	S	S	.	.			trans	-130.7	59.9	-178	-68.4	-70.6	0	0	0	112.8	Y845 I846 E852 L853	Y845-H850 AromaticContact CE1-CD2 3.48Å; Y845-H850 VanDerWaalsContact CE1-CD2 3.48Å; Y845-H850 WeakPolarHBondContact CE1-CD2 3.23Å; Y845-H850 AromaticContact CE1-NE2 3.73Å; Y845-H850 AromaticContact CZ-NE2 3.92Å; Y845-H850 PolarHBondContact OH-NE2 3.29Å; I846-H850 CarbonylContact O-C 3.53Å; I846-H850 WeakPolarHBondContact O-CA 3.4Å; I846-H850 PolarHBondContact O-N 3.43Å; I846-H850 VanDerWaalsContact O-N 3.13Å; I846-H850 VanDerWaalsContact O-O 3.07Å; H850-E852 VanDerWaalsContact CA-OE2 3.23Å; H850-E852 WeakPolarHBondContact CA-OE2 3.33Å; H850-E852 WeakPolarHBondContact CB-OE1 3.25Å; H850-E852 IonicContact CE1-OE1 2.63Å; H850-E852 IonicContact CG-OE1 3.48Å; H850-E852 IonicContact ND1-OE1 3.99Å; H850-E852 PolarHBondContact ND1-OE1 3.34Å; H850-E852 PolarHBondContact O-N 2.72Å; H850-E852 VanDerWaalsContact O-N 3.12Å; H850-L853 HydrophobicContact CB-CD1 3.93Å; H850-L853 HydrophobicContact CB-CG 4.33Å; H850-L853 PolarHBondContact O-N 2.97Å
851	P	77.4	Confident	70.4	Confident	81 Å²	81	105.1 Å²	105.1	53%	0.526	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-60.6	-21.3	-179	27.2	-35.4	0	0	0	113.4	F849 L853 N854	F849-P851 VanDerWaalsContact C-CD 3.47Å; P851-L853 PolarHBondContact O-N 3.1Å; P851-N854 WeakPolarHBondContact O-CB 3.16Å; P851-N854 PolarHBondContact O-N 2.98Å
852	E	72.7	Confident	68.6	Low	117 Å²	117	109.7 Å²	109.7	55%	0.547	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-63.5	-23.2	174.7	70.5	-75.7	177.6	0	0	113.6	H850 N854 V855	H850-E852 VanDerWaalsContact CA-OE2 3.23Å; H850-E852 WeakPolarHBondContact CA-OE2 3.33Å; H850-E852 WeakPolarHBondContact CB-OE1 3.25Å; H850-E852 IonicContact CE1-OE1 2.63Å; H850-E852 IonicContact CG-OE1 3.48Å; H850-E852 IonicContact ND1-OE1 3.99Å; H850-E852 PolarHBondContact ND1-OE1 3.34Å; H850-E852 PolarHBondContact O-N 2.72Å; H850-E852 VanDerWaalsContact O-N 3.12Å; E852-N854 VanDerWaalsContact C-N 3.31Å; E852-V855 WeakPolarHBondContact O-CG2 3.41Å
853	L	68.1	Low	66.5	Low	111 Å²	111	114.9 Å²	114.9	58%	0.581	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-86.4	-4.3	175	-63.5	174.7	0	0	0	112.3	I846 H850 P851 V855	I846-L853 HydrophobicContact CG2-CB 3.94Å; I846-L853 HydrophobicContact CG2-CD1 4.48Å; H850-L853 HydrophobicContact CB-CD1 3.93Å; H850-L853 HydrophobicContact CB-CG 4.33Å; H850-L853 PolarHBondContact O-N 2.97Å; P851-L853 PolarHBondContact O-N 3.1Å; L853-V855 VanDerWaalsContact C-N 3.34Å; L853-V855 PolarHBondContact O-N 3.28Å
854	N	68.1	Low	64.4	Low	27 Å²	27	116.6 Å²	116.6	14%	0.144	55%	0.546	C	S	.	.			trans	-94.3	38.7	-175	-162.1	14.9	0	0	0	113.4	T617 P618 I619 P851 E852	T617-N854 WeakPolarHBondContact CB-ND2 3.18Å; T617-N854 WeakPolarHBondContact CB-OD1 3.22Å; T617-N854 WeakPolarHBondContact CG2-ND2 3.22Å; P618-N854 VanDerWaalsContact CD-OD1 3.25Å; P618-N854 WeakPolarHBondContact CD-OD1 3.28Å; P618-N854 VanDerWaalsContact CG-O 3.23Å; P618-N854 WeakPolarHBondContact CG-O 3.31Å; P618-N854 WeakPolarHBondContact CG-OD1 2.94Å; I619-N854 HydrophobicContact CD1-CB 4.06Å; I619-N854 WeakPolarHBondContact CD1-OD1 3.44Å; I619-N854 WeakPolarHBondContact CG1-OD1 3.22Å; P851-N854 WeakPolarHBondContact O-CB 3.16Å; P851-N854 PolarHBondContact O-N 2.98Å; E852-N854 VanDerWaalsContact C-N 3.31Å
855	V	69.1	Low	62.6	Low	104 Å²	104	121.3 Å²	121.3	63%	0.63	58%	0.575	S	S	*	*	S	Bend	trans	-113.5	146.2	178.7	-89	0	0	0	0	112.1	E852 L853 K857	E852-V855 WeakPolarHBondContact O-CG2 3.41Å; L853-V855 VanDerWaalsContact C-N 3.34Å; L853-V855 PolarHBondContact O-N 3.28Å; V855-K857 PolarHBondContact O-N 2.92Å; V855-K857 VanDerWaalsContact O-N 3.07Å
856	Q	56.6	Low	61	Low	176 Å²	176	119.4 Å²	119.4	82%	0.822	58%	0.577	S	S	*	*			trans	-71.3	102	179.7	-151.3	174.9	22	0	0	109.5	R858	Q856-R858 PolarHBondContact O-N 3.04Å
857	K	52.2	Low	59.1	Low	196 Å²	196	121 Å²	121	85%	0.852	59%	0.589	S	S	*	*			trans	-59.1	115.5	172.6	-72.8	-174	-179.9	180	0	108.7	V855 K859	V855-K857 PolarHBondContact O-N 2.92Å; V855-K857 VanDerWaalsContact O-N 3.07Å; K857-K859 PolarHBondContact O-N 3.48Å
858	R	36.5	Very low	57.3	Low	246 Å²	246	124.2 Å²	124.2	93%	0.928	62%	0.617	S	S	*	*			trans	-53.3	124.3	177.4	-102.9	-179.9	-176.4	174.1	1.9	109.5	Q856 R860	Q856-R858 PolarHBondContact O-N 3.04Å; R858-R860 PolarHBondContact O-N 3.37Å; R858-R860 VanDerWaalsContact O-N 3.1Å
859	K	39.7	Very low	55.4	Low	202 Å²	202	124.7 Å²	124.7	88%	0.878	63%	0.63	S	S	*	*			trans	-54.2	112.2	172.3	-70.7	179.2	176.8	179.1	0	109.7	K857 S861	K857-K859 PolarHBondContact O-N 3.48Å; K859-S861 PolarHBondContact O-N 2.88Å
860	R	37.2	Very low	53.6	Low	238 Å²	238	123 Å²	123	90%	0.898	63%	0.631	S	S	*	*			trans	-67	112.2	154.5	-94.3	-177.9	173	172.3	-1.9	106.3	R858 F862	R858-R860 PolarHBondContact O-N 3.37Å; R858-R860 VanDerWaalsContact O-N 3.1Å; R860-F862 PolarHBondContact O-N 2.86Å
861	S	40.1	Very low	51.8	Low	73 Å²	73	128.2 Å²	128.2	51%	0.51	66%	0.658	S	S	.	*			trans	-53.8	123.3	179.7	-177.3	0	0	0	0	110.5	K859 K863 A864	K859-S861 PolarHBondContact O-N 2.88Å; S861-K863 PolarHBondContact O-N 3.16Å; S861-A864 PolarHBondContact O-N 3.18Å
862	F	49.9	Very low	50.3	Low	181 Å²	181	129.8 Å²	129.8	79%	0.794	67%	0.67	S	S	*	*	H	α-helix	trans	-53.7	-17.7	174.3	-133	-99.6	0	0	0	112.8	R860 A864	R860-F862 PolarHBondContact O-N 2.86Å; F862-A864 VanDerWaalsContact C-N 3.35Å; F862-A864 PolarHBondContact O-N 3.48Å
863	K	43.3	Very low	48.8	Very low	172 Å²	172	128.7 Å²	128.7	75%	0.748	68%	0.676	S	S	*	*	H	α-helix	trans	-67.9	-24.9	174.4	-115.3	178.3	178.9	-177.2	0	114.1	S861 T867	S861-K863 PolarHBondContact O-N 3.16Å; K863-T867 PolarHBondContact O-OG1 3.42Å
864	A	44	Very low	47.7	Very low	66 Å²	66	134.3 Å²	134.3	55%	0.545	69%	0.689	S	S	.	*	H	α-helix	trans	-89	-28.2	-173.9	0	0	0	0	0	114	S861 F862 A868	S861-A864 PolarHBondContact O-N 3.18Å; F862-A864 VanDerWaalsContact C-N 3.35Å; F862-A864 PolarHBondContact O-N 3.48Å; A864-A868 PolarHBondContact O-N 2.95Å
865	V	50.2	Low	46.2	Very low	104 Å²	104	141.2 Å²	141.2	63%	0.63	73%	0.725	S	S	*	*	H	α-helix	trans	-76.6	-33.6	-179.6	179.2	0	0	0	0	111.3	A869	V865-A869 PolarHBondContact O-N 3.36Å
866	V	52.2	Low	44.3	Very low	90 Å²	90	141.4 Å²	141.4	55%	0.545	73%	0.731	S	S	.	*	H	α-helix	trans	-72.6	-33.6	179.2	-179.6	0	0	0	0	111.9	A869 T870	V866-A869 PolarHBondContact O-N 3.24Å; V866-T870 PolarHBondContact O-N 3.49Å; V866-T870 PolarHBondContact O-OG1 3.27Å
867	T	46	Very low	43.1	Very low	90 Å²	90	141.6 Å²	141.6	55%	0.552	73%	0.732	S	S	*	*	H	α-helix	trans	-72.3	-29.6	176.6	-46.2	0	0	0	0	112.9	K863	K863-T867 PolarHBondContact O-OG1 3.42Å
868	A	46.8	Very low	42	Very low	73 Å²	73	142.1 Å²	142.1	60%	0.603	73%	0.734	S	S	*	*	H	α-helix	trans	-74.4	-29.2	173.8	0	0	0	0	0	112.6	A864	A864-A868 PolarHBondContact O-N 2.95Å
869	A	46.4	Very low	42.2	Very low	75 Å²	75	135.8 Å²	135.8	62%	0.62	73%	0.725	S	S	*	*	H	α-helix	trans	-81.1	-16.4	179.6	0	0	0	0	0	114.5	V865 V866	V865-A869 PolarHBondContact O-N 3.36Å; V866-A869 PolarHBondContact O-N 3.24Å
870	T	47.3	Very low	41.6	Very low	101 Å²	101	130.7 Å²	130.7	62%	0.62	72%	0.715	S	S	*	*	H	α-helix	trans	-94.4	-11.7	179.2	8.7	0	0	0	0	114.8	V866	V866-T870 PolarHBondContact O-N 3.49Å; V866-T870 PolarHBondContact O-OG1 3.27Å
871	M	45	Very low	41.1	Very low	170 Å²	170	127.9 Å²	127.9	84%	0.837	71%	0.712	S	S	*	*	S	Bend	trans	-92	-11.4	-179.6	-79.7	-94.7	-168.8	0	0	114.1
872	S	44.6	Very low	40.7	Very low	113 Å²	113	135.8 Å²	135.8	79%	0.79	73%	0.731	S	S	*	*	S	Bend	trans	-99.6	2.8	-175	-161.6	0	0	0	0	115.2
873	S	41.2	Very low	40.4	Very low	94 Å²	94	132.3 Å²	132.3	66%	0.657	73%	0.726	S	S	*	*	S	Bend	trans	-115.3	22.5	-174.3	78.4	0	0	0	0	115.3
874	R	44.9	Very low	39.6	Very low	230 Å²	230	132.1 Å²	132.1	87%	0.868	73%	0.733	S	S	*	*			trans	-133.4	80.1	169.3	-78.2	-167.4	179	-173.3	1	111.1
875	L	37.2	Very low	38.9	Very low	172 Å²	172	132.7 Å²	132.7	90%	0.901	75%	0.746	S	S	*	*	S	Bend	trans	-166.4	119.3	148.3	-106.2	142	0	0	0	111.3
876	S	29.3	Very low	37.8	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	76%	0.761	S	S	*	*			trans	64.2	102.9	156.8	-131.7	0	0	0	0	118.4
877	Q	32	Very low	36.7	Very low	180 Å²	180	137.5 Å²	137.5	84%	0.841	77%	0.772	S	S	*	*				54.1	111.3	63.1	-82.5	-170.4	-9.9	0	0	117.2
878	K	27.7	Very low	35.7	Very low	206 Å²	206	142.8 Å²	142.8	90%	0.896	79%	0.787	S	S	*	*			trans	89	151.5	142.9	-87.3	-152.4	167.2	174.9	0	121.9
879	P	41.5	Very low	34.9	Very low	113 Å²	113	146.1 Å²	146.1	73%	0.734	80%	0.8	S	S	*	*			trans	-121.2	165.8	-144.8	42.2	-28.1	0	0	0	114.7
880	S	26	Very low	34.2	Very low	96 Å²	96	151.4 Å²	151.4	67%	0.671	81%	0.812	S	S	*	*			trans	178.3	153.7	138.4	-156.9	0	0	0	0	112.2
881	E	28.5	Very low	33.3	Very low	179 Å²	179	154 Å²	154	84%	0.836	82%	0.821	S	S	*	*			trans	77.1	107.8	150.6	-81	150.9	-131	0	0	122.7
882	R	30.4	Very low	32.5	Very low	239 Å²	239	152.3 Å²	152.3	90%	0.902	82%	0.824	S	S	*	*			trans	-74.3	170.7	138	-74.6	-178.8	175.2	168.8	-1.9	109.1
883	P	43.8	Very low	31.8	Very low	107 Å²	107	154.1 Å²	154.1	70%	0.695	82%	0.82	S	S	*	*			cis	-140.8	176.1	12.8	33.9	-11	0	0	0	116.9
884	N	26.1	Very low	31.3	Very low	168 Å²	168	156 Å²	156	90%	0.898	82%	0.823	S	S	*	*			trans	59.4	127.8	145.9	-70.3	1.7	0	0	0	122
885	G	29.8	Very low	31.2	Very low	79 Å²	79	150.9 Å²	150.9	81%	0.814	82%	0.82	S	S	*	*			trans	173.2	83.4	162.1	0	0	0	0	0	111.3
886	E	27.9	Very low	30.8	Very low	201 Å²	201	147.4 Å²	147.4	94%	0.939	82%	0.816	S	S	*	*			trans	-60.3	141.9	171.8	-67.9	170.1	127.2	0	0	112.6
887	A	27.8	Very low	30.7	Very low	94 Å²	94	147.2 Å²	147.2	78%	0.777	82%	0.821	S	S	*	*			trans	-168.4	105.5	135.2	0	0	0	0	0	111.8
888	K	26	Very low	30.4	Very low	201 Å²	201	145.8 Å²	145.8	87%	0.874	82%	0.819	S	S	*	*			trans	43.9	117.1	140	-66.6	179.9	175.6	178.8	0	120
889	T	30.5	Very low	31.4	Very low	142 Å²	142	140.9 Å²	140.9	87%	0.871	81%	0.808	S	S	*	*				-161.5	113.7	122.3	12.3	0	0	0	0	111.6
890	E	30.9	Very low	30.7	Very low	187 Å²	187	143.7 Å²	143.7	87%	0.874	81%	0.814	S	S	*	*			trans	33.4	113.8	150	-61	-168.5	155.7	0	0	122.7
891	L	28.9	Very low	30.6	Very low	154 Å²	154	144.5 Å²	144.5	81%	0.806	81%	0.814	S	S	*	*			trans	-92.1	133.6	154.5	-159.4	90.6	0	0	0	107.7
892	C	27.6	Very low	30.5	Very low	135 Å²	135	143.9 Å²	143.9	91%	0.912	81%	0.812	S	S	*	*			trans	-138	146.5	156	-87.3	0	0	0	0	110
893	E	29.3	Very low	30.4	Very low	151 Å²	151	141.8 Å²	141.8	71%	0.706	81%	0.812	S	S	*	*			trans	-124.2	142.5	-154.4	172.2	176	-172.6	0	0	110.1
894	N	31	Very low	29.5	Very low	133 Å²	133	144.2 Å²	144.2	71%	0.711	82%	0.818	S	S	*	*			trans	66.8	164.2	153.2	-73.6	-18.4	0	0	0	121.5
895	P	43.2	Very low	29.4	Very low	123 Å²	123	144.4 Å²	144.4	80%	0.799	81%	0.811	S	S	*	*			cis	-132.9	179.7	4.6	19.6	7	0	0	0	117.1
896	A	28.3	Very low	29.1	Very low	99 Å²	99	152.4 Å²	152.4	82%	0.818	82%	0.817	S	S	*	*			trans	-59.5	162.8	179.6	0	0	0	0	0	118.3
897	A	26.6	Very low	29.1	Very low	104 Å²	104	151.2 Å²	151.2	86%	0.86	81%	0.814	S	S	*	*				179.3	147.8	129.5	0	0	0	0	0	112.5
898	D	27	Very low	29	Very low	151 Å²	151	157.1 Å²	157.1	81%	0.807	82%	0.816	S	S	*	*			trans	-119	177.4	167.9	-160.1	26.3	0	0	0	106.5
899	P	48.3	Very low	29	Very low	102 Å²	102	155.4 Å²	155.4	66%	0.662	82%	0.816	S	S	*	*			cis	-125.3	-174.7	-38.6	19.8	4	0	0	0	113.1
900	M	26.4	Very low	28.8	Very low	173 Å²	173	152.4 Å²	152.4	85%	0.852	81%	0.813	S	S	*	*			trans	92.9	123.2	142.6	-125.9	-170.5	-148.1	0	0	122.2
901	T	25.2	Very low	28.5	Very low	112 Å²	112	148 Å²	148	69%	0.687	80%	0.804	S	S	*	*			trans	95	134.2	140	2.2	0	0	0	0	122.9
902	Q	25.3	Very low	28.3	Very low	167 Å²	167	151.7 Å²	151.7	78%	0.78	81%	0.807	S	S	*	*			trans	81.2	115.3	151.8	-79.7	170.3	-2.2	0	0	119.5
903	H	28	Very low	28.2	Very low	195 Å²	195	149 Å²	149	90%	0.903	79%	0.794	S	S	*	*				-159.1	115.3	110.1	-98.7	-69.5	0	0	0	110.7
904	L	25.2	Very low	28.3	Very low	157 Å²	157	147.4 Å²	147.4	82%	0.822	80%	0.8	S	S	*	*			trans	-137.1	107	169	-154.1	159.4	0	0	0	104.4
905	F	24.6	Very low	28.2	Very low	172 Å²	172	151.3 Å²	151.3	75%	0.754	83%	0.828	S	S	*	*			trans	-163.4	108.1	160.7	-112.5	-75.2	0	0	0	108.8
906	W	23.8	Very low	27.4	Very low	247 Å²	247	152.8 Å²	152.8	94%	0.936	83%	0.829	S	S	*	*			trans	-159.8	104.1	130.9	-100	97.3	0	0	0	107.7
907	M	26.5	Very low	27.4	Very low	177 Å²	177	155.6 Å²	155.6	87%	0.872	83%	0.83	S	S	*	*			trans	145.3	97.1	144.5	-79.8	-169.3	-178.2	0	0	110.8
908	R	26.3	Very low	27.4	Very low	217 Å²	217	158.4 Å²	158.4	82%	0.819	83%	0.828	S	S	*	*			trans	-144.5	112.8	156	-160.6	-179.4	-166.1	-176.9	3.6	107.8
909	N	27.1	Very low	27.5	Very low	165 Å²	165	158.9 Å²	158.9	88%	0.882	83%	0.83	S	S	*	*				-178.4	129.4	126.9	-96.2	-6.1	0	0	0	110.5
910	G	24.3	Very low	26.2	Very low	79 Å²	79	162.4 Å²	162.4	81%	0.814	84%	0.84	S	S	*	*			trans	168.2	89.4	179.1	0	0	0	0	0	110.2
911	S	25.1	Very low	26.2	Very low	96 Å²	96	161.7 Å²	161.7	67%	0.671	84%	0.839	S	S	*	*			trans	-52.4	176.6	178.3	161.7	0	0	0	0	115.7
912	W	24.3	Very low	26.2	Very low	231 Å²	231	165.3 Å²	165.3	88%	0.875	85%	0.85	S	S	*	*			trans	109.7	93	163.3	-57.6	98	0	0	0	112.8
913	A	27.1	Very low	26.3	Very low	79 Å²	79	165.2 Å²	165.2	65%	0.653	86%	0.856	S	S	*	*				74	109.7	76.6	0	0	0	0	0	111.9
914	S	29.9	Very low	26.1	Very low	116 Å²	116	162.7 Å²	162.7	81%	0.811	85%	0.852	S	S	*	*			trans	-28	122.1	162.8	43.3	0	0	0	0	116.2
915	V	29.5	Very low	26.2	Very low	216 Å²	216	163.2 Å²	163.2	100%	1.309	85%	0.854	S	S	*	*				-138.1	0	116.2	173.5	0	0	0	0	107.4

Retrieved 915 of 915 residues in 1764.2 ms (Link to these results)

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