A0A087YDR6_POEFO Loading...

Autophagy-related protein 9

Phospholipid scramblase involved in autophagy by mediating autophagosomal membrane expansion. Cycles between the preautophagosomal structure/phagophore assembly site (PAS) and the cytoplasmic vesicle pool and supplies membrane for the growing autophagosome. Lipid scramblase activity plays a key role in preautophagosomal structure/phagophore assembly by distributing the phospholipids that arrive through ATG2 (ATG2A or ATG2B) from the cytoplasmic to the luminal leaflet of the bilayer, thereby driving autophagosomal membrane expansion. Also required to supply phosphatidylinositol 4-phosphate to the autophagosome initiation site by recruiting the phosphatidylinositol 4-kinase beta (PI4KB) in a process dependent on ARFIP2, but not ARFIP1. In addition to autophagy, also plays a role in necrotic cell death. Phospholipid scramblase involved in autophagy. Cycles between the preautophagosomal structure/phagophore assembly site (PAS) and the cytoplasmic vesicle pool and supplies membrane for the growing autophagosome. Lipid scramblase activity plays a key role in preautophagosomal structure/phagophore assembly by distributing the phospholipids that arrive through ATG2 from the cytoplasmic to the luminal leaflet of the bilayer, thereby driving autophagosomal membrane expansion.

AlphaFold DB , UniProt , Accession A0A087YDR6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 853 aa.

						>A0A087YDR6_POEFO|A0A087YDR6
MAHFETEYQRLEASYSDSPPGEENLLMHVPEGSKSQWHHIENLDLFFQRVYNLHQKNGFTCMLLGEIFELVQLLFVVGFTVFLANCVDYDVLFANKFVNHTDSSKVTLPDAILPMDVCNAHIRDNAFVIFVLIISGVFWLHRLVKFLYNVCCYWEIRSFYINALKMSMSELPYATWQEVQARIIEIQKEHQICIHKKELTELDIYHRILRFKNYMVAMVNKSLLPVRFRLPVLGDSVFYTRGLKYNFELIFFWGPGSLFENEWSLKQEYKRGGNRLELADRLASRILWIGIANLLLCPVILVWQILYAFFSYTEIIKREPGSLGARCWSLYGRCYLRHFNELDHELMSRLSKGYKAASKYMNCFLSPLLTVVAKNVAFFAGSLLAVLIALTIYDEDVLAVEHVLSSVTLLGVCITVCRSFIPDKHMVFCPEQLLRVILAHIHYMPDHWQGNAHRYETRDQFSQLFQYKAVFILEELLSPVVTPIILIFCLRRKSLEIIDFFRNFTVEVIGVGDTCSFAQMDIRQHGHPAWMSEGKTEASIYQQAEDGKTELSLMHFAITNPHWQPPRETTHFISQLKERVNREAAGASSETHPLSLSESEPRSLVANILAGPSTLGSVHFACDSSLANNAVTGMPGGATALRSLSPISSSLHLRGSLSAAHRVSGFTGRAMTGSGTDARTVSSGSSAWEGQLTSLVLSEYASTEMSIHALYIHELHKQQSRGDLSRHTWHRQESDESSDSIPDEVRSEPNTRSRNFPRSQTFPATLPSPGASSASATGGTNMGQDGEKAQSSSQRRHSGPAADHFGTAGKVVRTAHVPMGGWAEDGKESSRHHEPVQEETSEDELPPHIHKVT
					

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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	M	32.7	Very low	30.5	Very low	246 Å²	246	179.7 Å²	179.7	100%	1.212	87%	0.868	S	S	*	*				0	148.3	0	-78.8	174.6	165.1	0	0	108
2	A	33.8	Very low	30.3	Very low	101 Å²	101	177.2 Å²	177.2	84%	0.835	85%	0.854	S	S	*	*			trans	56.8	133.7	161.9	0	0	0	0	0	120.4
3	H	32.4	Very low	30.2	Very low	160 Å²	160	170.2 Å²	170.2	74%	0.741	84%	0.843	S	S	*	*			trans	-58.7	158.3	167.3	-74.6	-117.6	0	0	0	113.6
4	F	30.1	Very low	29.9	Very low	189 Å²	189	167.4 Å²	167.4	83%	0.829	85%	0.848	S	S	*	*				-163.4	168.6	93.8	-109.6	-78.9	0	0	0	113.4
5	E	32.6	Very low	29.9	Very low	145 Å²	145	169.9 Å²	169.9	68%	0.678	85%	0.845	S	S	*	*			trans	-92.8	159.3	-164.3	-54.8	143.8	132.2	0	0	112.8
6	T	29.5	Very low	29.9	Very low	140 Å²	140	166.6 Å²	166.6	86%	0.859	84%	0.843	S	S	*	*				178.5	165.7	117.7	26.3	0	0	0	0	111.9
7	E	27.3	Very low	30	Very low	184 Å²	184	166.1 Å²	166.1	86%	0.86	84%	0.843	S	S	*	*			trans	-76.1	155.6	-172.1	-61.9	169	107.2	0	0	114.2
8	Y	31.1	Very low	30.1	Very low	235 Å²	235	162.6 Å²	162.6	92%	0.922	84%	0.836	S	S	*	*			trans	-127.4	104.2	164.1	-99.7	-93.4	0	0	0	109.8
9	Q	28	Very low	30.3	Very low	197 Å²	197	160.5 Å²	160.5	92%	0.921	84%	0.835	S	S	*	*			trans	-106.2	114.8	168	-164.8	172.5	18	0	0	108.8
10	R	28.2	Very low	30.6	Very low	204 Å²	204	159.3 Å²	159.3	77%	0.77	84%	0.837	S	S	*	*			trans	-111.6	129.3	-175.3	-175	179.1	176	126.5	0.2	110.4	E12	R10-E12 IonicContact CZ-OE1 3.47Å; R10-E12 IonicContact NE-OE1 3.66Å; R10-E12 PolarHBondContact NE-OE1 3.36Å; R10-E12 IonicContact NH2-OE1 2.97Å; R10-E12 PolarHBondContact NH2-OE1 2.95Å
11	L	29.8	Very low	30.6	Very low	176 Å²	176	155.1 Å²	155.1	92%	0.921	83%	0.833	S	S	*	*			trans	-86.7	115	179.5	-84.6	159.6	0	0	0	111.8
12	E	28.4	Very low	30.5	Very low	149 Å²	149	152 Å²	152	70%	0.696	82%	0.815	S	S	*	*			trans	-148.8	142.7	162.9	-63.5	-180	-162.7	0	0	107.5	R10	R10-E12 IonicContact CZ-OE1 3.47Å; R10-E12 IonicContact NE-OE1 3.66Å; R10-E12 PolarHBondContact NE-OE1 3.36Å; R10-E12 IonicContact NH2-OE1 2.97Å; R10-E12 PolarHBondContact NH2-OE1 2.95Å
13	A	29.2	Very low	30.8	Very low	87 Å²	87	157 Å²	157	72%	0.719	82%	0.821	S	S	*	*			cis	-156.9	128.1	-26.9	0	0	0	0	0	107.1
14	S	25.6	Very low	30.8	Very low	130 Å²	130	156.3 Å²	156.3	91%	0.909	82%	0.823	S	S	*	*			trans	-91.6	119.5	-178.9	-169.4	0	0	0	0	111.4
15	Y	29.6	Very low	31	Very low	206 Å²	206	154.9 Å²	154.9	81%	0.808	82%	0.823	S	S	*	*			trans	-109.9	118.6	171.6	-99	-84.6	0	0	0	110.3
16	S	30.3	Very low	31.3	Very low	116 Å²	116	156.4 Å²	156.4	81%	0.811	84%	0.835	S	S	*	*			trans	-166.3	107.6	147.8	-81.6	0	0	0	0	109.2
17	D	31.1	Very low	31.4	Very low	158 Å²	158	157.3 Å²	157.3	85%	0.845	83%	0.831	S	S	*	*			trans	-63.5	154.1	167.9	-90	-55.7	0	0	0	111.1
18	S	32.2	Very low	31.7	Very low	103 Å²	103	156.4 Å²	156.4	72%	0.72	83%	0.827	S	S	*	*			trans	-138.2	140	164.1	-71.4	0	0	0	0	108.5
19	P	33.1	Very low	31.9	Very low	124 Å²	124	150.3 Å²	150.3	81%	0.805	81%	0.814	S	S	*	*			trans	-68.3	141.9	-170.4	27.4	-34.8	0	0	0	111.8
20	P	37.3	Very low	32.4	Very low	136 Å²	136	146 Å²	146	88%	0.883	80%	0.802	S	S	*	*			trans	-80.8	129.3	-179.2	31.7	-33.7	0	0	0	111.6
21	G	31	Very low	32.9	Very low	72 Å²	72	143.2 Å²	143.2	74%	0.742	80%	0.799	S	S	*	*			trans	156.6	71.7	169.5	0	0	0	0	0	116.4
22	E	29.3	Very low	33.3	Very low	181 Å²	181	137.8 Å²	137.8	85%	0.846	79%	0.785	S	S	*	*				175.9	132.1	125.1	-97.7	177.4	-170.2	0	0	111.3	N24	E22-N24 PolarHBondContact O-N 3.07Å; E22-N24 VanDerWaalsContact O-N 3.07Å
23	E	40.5	Very low	33.9	Very low	204 Å²	204	136.2 Å²	136.2	95%	0.953	79%	0.791	S	S	*	*			trans	-77.2	93.2	-171.8	-63	-177	152.7	0	0	111.8
24	N	33.2	Very low	34.8	Very low	146 Å²	146	139.5 Å²	139.5	78%	0.781	79%	0.789	S	S	*	*			trans	-82.4	122	173.5	-88	-88.7	0	0	0	111.9	E22 L26	E22-N24 PolarHBondContact O-N 3.07Å; E22-N24 VanDerWaalsContact O-N 3.07Å; N24-L26 PolarHBondContact O-N 3.36Å
25	L	34.4	Very low	36.3	Very low	160 Å²	160	134.8 Å²	134.8	84%	0.838	76%	0.755	S	S	*	*			trans	-50.2	124.2	-177.7	-152.3	81.3	0	0	0	111.9	M27	L25-M27 PolarHBondContact O-N 3Å
26	L	37.3	Very low	38	Very low	176 Å²	176	131.3 Å²	131.3	92%	0.921	75%	0.746	S	S	*	*			trans	-72	70	174.7	-92.3	166.8	0	0	0	111.6	N24 H28	N24-L26 PolarHBondContact O-N 3.36Å; L26-H28 VanDerWaalsContact C-N 3.35Å; L26-H28 PolarHBondContact O-N 2.78Å
27	M	32.7	Very low	40.1	Very low	159 Å²	159	126.4 Å²	126.4	78%	0.783	71%	0.71	S	S	*	*			trans	-73.8	90.6	169.6	-168.1	172	-163.2	0	0	108.9	L25 V29	L25-M27 PolarHBondContact O-N 3Å; M27-V29 VanDerWaalsContact C-N 3.27Å; M27-V29 PolarHBondContact O-N 3.36Å
28	H	32.9	Very low	41.9	Very low	166 Å²	166	123.5 Å²	123.5	77%	0.769	69%	0.691	S	S	*	*			trans	-68.7	83.4	176.9	-171.5	75.6	0	0	0	110.6	L26	L26-H28 VanDerWaalsContact C-N 3.35Å; L26-H28 PolarHBondContact O-N 2.78Å
29	V	35.4	Very low	43.9	Very low	107 Å²	107	123.1 Å²	123.1	65%	0.648	68%	0.678	S	S	*	*			trans	-62.7	125.5	167.1	-179.3	0	0	0	0	107.2	M27	M27-V29 VanDerWaalsContact C-N 3.27Å; M27-V29 PolarHBondContact O-N 3.36Å
30	P	38.4	Very low	46.1	Very low	105 Å²	105	118.8 Å²	118.8	68%	0.682	65%	0.648	S	S	*	*			trans	-62.2	145.4	-179.2	26.5	-34.9	0	0	0	110.4	G32	P30-G32 PolarHBondContact O-N 3.5Å
31	E	40.2	Very low	47.9	Very low	147 Å²	147	119.8 Å²	119.8	69%	0.687	64%	0.641	S	S	*	*			trans	-72.2	71.3	-178.8	-62	-162.1	127.1	0	0	112.3	K34	E31-K34 WeakPolarHBondContact OE1-CE 3.45Å; E31-K34 IonicContact OE1-NZ 2.73Å; E31-K34 PolarHBondContact OE1-NZ 2.68Å
32	G	38	Very low	50.5	Low	62 Å²	62	118.7 Å²	118.7	64%	0.639	62%	0.618	S	S	*	*			trans	-54	136.8	152.9	0	0	0	0	0	108.5	P30 K34	P30-G32 PolarHBondContact O-N 3.5Å; G32-K34 PolarHBondContact O-N 2.81Å
33	S	40.7	Very low	53.3	Low	116 Å²	116	110.6 Å²	110.6	81%	0.811	58%	0.58	S	S	*	*			trans	-46.8	108.2	-168.2	53.9	0	0	0	0	112.2	S35	S33-S35 PolarHBondContact O-N 3.25Å
34	K	47.7	Very low	55.8	Low	156 Å²	156	101 Å²	101	68%	0.678	54%	0.535	S	S	*	.			trans	-53.4	106.7	177.8	-71.1	171.6	-176.6	162	0	108.5	E31 G32	E31-K34 WeakPolarHBondContact OE1-CE 3.45Å; E31-K34 IonicContact OE1-NZ 2.73Å; E31-K34 PolarHBondContact OE1-NZ 2.68Å; G32-K34 PolarHBondContact O-N 2.81Å
35	S	57.5	Low	58.5	Low	30 Å²	30	96.2 Å²	96.2	21%	0.21	51%	0.509	C	S	.	.			trans	-64	140.2	-176.1	55	0	0	0	0	110	S33 W37 H38 H190	S33-S35 PolarHBondContact O-N 3.25Å; S35-W37 PolarHBondContact O-N 2.99Å; S35-H38 VanDerWaalsContact O-CB 3.28Å; S35-H38 WeakPolarHBondContact O-CB 3.45Å; S35-H38 PolarHBondContact O-N 3.49Å; S35-H190 WeakPolarHBondContact CB-ND1 3.47Å; S35-H190 PolarHBondContact OG-ND1 3.37Å
36	Q	65.6	Low	61.3	Low	133 Å²	133	89.1 Å²	89.1	62%	0.621	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-22.9	-179.2	-175.8	175.3	-5.9	0	0	114.2
37	W	72.6	Confident	64	Low	14 Å²	14	80.8 Å²	80.8	5%	0.053	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	0.2	-178	-43.4	120.4	0	0	0	114.9	S35 H39 E155 F159	S35-W37 PolarHBondContact O-N 2.99Å; W37-H39 PolarHBondContact O-N 3.24Å; W37-E155 HydrophobicContact CH2-CG 3.7Å; W37-E155 VanDerWaalsContact CH2-O 3.31Å; W37-E155 WeakPolarHBondContact CH2-O 3.34Å; W37-E155 HydrophobicContact CZ3-CG 3.53Å; W37-F159 HydrophobicContact CD2-CB 4.33Å; W37-F159 AromaticContact CD2-CD2 3.85Å; W37-F159 HydrophobicContact CD2-CD2 3.85Å; W37-F159 HydrophobicContact CE3-CB 4.41Å; W37-F159 HydrophobicContact CE3-CD2 4.34Å; W37-F159 AromaticContact CG-CD2 3.89Å; W37-F159 HydrophobicContact CG-CD2 3.89Å; W37-F159 HydrophobicContact CG-CE2 4.46Å; W37-F159 HydrophobicContact CH2-CB 4Å; W37-F159 HydrophobicContact CZ2-CB 3.88Å; W37-F159 HydrophobicContact CZ3-CB 4.26Å
38	H	70.3	Confident	67	Low	96 Å²	96	76.2 Å²	76.2	44%	0.444	41%	0.405	S	S	.	.	S	Bend	trans	-77	116.5	-179.7	-177.7	-68.7	0	0	0	110.1	S35	S35-H38 VanDerWaalsContact O-CB 3.28Å; S35-H38 WeakPolarHBondContact O-CB 3.45Å; S35-H38 PolarHBondContact O-N 3.49Å
39	H	73.9	Confident	70	Confident	96 Å²	96	69.6 Å²	69.6	44%	0.444	37%	0.373	S	S	.	.	S	Bend	trans	61.8	89.3	-172.6	-173.9	-106.1	0	0	0	114.8	W37 I194	W37-H39 PolarHBondContact O-N 3.24Å; H39-I194 HydrophobicContact CB-CD1 3.84Å; H39-I194 HydrophobicContact CB-CG1 4.2Å; H39-I194 VanDerWaalsContact CD2-CD1 3.41Å; H39-I194 WeakPolarHBondContact CD2-CD1 3.46Å
40	I	79.1	Confident	72.8	Confident	33 Å²	33	64.5 Å²	64.5	17%	0.169	34%	0.343	C	S	.	.			trans	-92.6	117.8	169.8	-57.6	-174.7	0	0	0	109.4	N42 L43 F46 I192	I40-N42 VanDerWaalsContact C-N 3.35Å; I40-N42 PolarHBondContact O-N 2.68Å; I40-L43 HydrophobicContact CB-CD2 4Å; I40-F46 HydrophobicContact CD1-CD1 4.14Å; I40-F46 HydrophobicContact CD1-CD2 3.47Å; I40-F46 VanDerWaalsContact CD1-CD2 3.47Å; I40-F46 HydrophobicContact CD1-CE1 4.08Å; I40-F46 HydrophobicContact CD1-CE2 3.41Å; I40-F46 VanDerWaalsContact CD1-CE2 3.41Å; I40-F46 HydrophobicContact CD1-CG 3.85Å; I40-F46 HydrophobicContact CD1-CZ 3.73Å; I40-F46 HydrophobicContact CG2-CB 4.07Å; I40-F46 HydrophobicContact CG2-CD2 4.4Å; I40-F46 HydrophobicContact CG2-CG 4.32Å; I40-I192 HydrophobicContact CD1-CG2 3.61Å; I40-I192 HydrophobicContact CG1-CG2 3.96Å
41	E	74.8	Confident	75.6	Confident	157 Å²	157	60.1 Å²	60.1	73%	0.734	31%	0.312	S	S	*	.	S	Bend	trans	-60.6	-37.7	-175.6	-64.1	-177.2	165.6	0	0	113.7	W263	E41-W263 WeakPolarHBondContact O-CH2 3.31Å; E41-W263 VanDerWaalsContact O-CZ3 3.26Å; E41-W263 WeakPolarHBondContact O-CZ3 3.39Å
42	N	85.8	Confident	78.2	Confident	49 Å²	49	55.4 Å²	55.4	26%	0.262	29%	0.292	S	S	.	.			trans	-119	84.9	175.5	-173.2	-11.5	0	0	0	111.2	I40 D44 L45 F46 E262	I40-N42 VanDerWaalsContact C-N 3.35Å; I40-N42 PolarHBondContact O-N 2.68Å; N42-D44 VanDerWaalsContact C-N 3.27Å; N42-D44 PolarHBondContact O-N 3.04Å; N42-D44 PolarHBondContact OD1-N 2.95Å; N42-D44 VanDerWaalsContact OD1-N 3.13Å; N42-L45 HydrophobicContact CB-CB 4.42Å; N42-L45 WeakPolarHBondContact ND2-CB 3.36Å; N42-L45 PolarHBondContact OD1-N 3.06Å; N42-F46 WeakPolarHBondContact O-CB 3.3Å; N42-F46 PolarHBondContact O-N 3.47Å; N42-F46 VanDerWaalsContact O-N 3.11Å; N42-E262 VanDerWaalsContact ND2-CD 3.33Å; N42-E262 PolarHBondContact ND2-OE2 3.13Å
43	L	89.3	Confident	81	Confident	10 Å²	10	52.5 Å²	52.5	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-31.6	175.2	-70	170.2	0	0	0	113.1	I40 F46 F47 I192 C193	I40-L43 HydrophobicContact CB-CD2 4Å; L43-F46 PolarHBondContact O-N 2.83Å; L43-F47 HydrophobicContact CB-CD2 4.34Å; L43-F47 HydrophobicContact CB-CE2 4.14Å; L43-F47 HydrophobicContact CD2-CE2 4.11Å; L43-F47 WeakPolarHBondContact O-CD2 3.3Å; L43-F47 PolarHBondContact O-N 2.73Å; L43-I192 HydrophobicContact CD2-CG2 3.84Å; L43-C193 HydrophobicContact CD1-CB 3.95Å
44	D	91.3	Very high	83.6	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.011	23%	0.227	C	C	.	.	H	α-helix	trans	-69.8	-50.6	-176.1	-78.4	42.6	0	0	0	111.2	N42 F46 F47 Q48 R207 R210	N42-D44 VanDerWaalsContact C-N 3.27Å; N42-D44 PolarHBondContact O-N 3.04Å; N42-D44 PolarHBondContact OD1-N 2.95Å; N42-D44 VanDerWaalsContact OD1-N 3.13Å; D44-F46 VanDerWaalsContact C-N 3.28Å; D44-F46 PolarHBondContact O-N 2.9Å; D44-F47 PolarHBondContact O-N 3.11Å; D44-Q48 WeakPolarHBondContact O-CB 3.27Å; D44-Q48 WeakPolarHBondContact O-CG 3.24Å; D44-Q48 PolarHBondContact O-N 3.39Å; D44-R207 VanDerWaalsContact OD1-CG 3.26Å; D44-R207 WeakPolarHBondContact OD1-CG 3.33Å; D44-R207 IonicContact OD1-CZ 3.86Å; D44-R207 IonicContact OD1-NH1 3.4Å; D44-R207 PolarHBondContact OD1-NH1 2.73Å; D44-R210 VanDerWaalsContact CG-NH2 3.31Å; D44-R210 IonicContact OD1-NH2 2.73Å; D44-R210 PolarHBondContact OD1-NH2 2.87Å; D44-R210 IonicContact OD2-CZ 2.67Å; D44-R210 IonicContact OD2-NE 2.6Å; D44-R210 PolarHBondContact OD2-NE 3.19Å; D44-R210 IonicContact OD2-NH2 2.98Å; D44-R210 PolarHBondContact OD2-NH2 3.43Å
45	L	91.6	Very high	85.8	Confident	46 Å²	46	43.3 Å²	43.3	24%	0.241	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-34.4	172.8	-177.2	58.8	0	0	0	111.9	N42 R49	N42-L45 HydrophobicContact CB-CB 4.42Å; N42-L45 WeakPolarHBondContact ND2-CB 3.36Å; N42-L45 PolarHBondContact OD1-N 3.06Å; L45-R49 HydrophobicContact CD1-CG 4.29Å; L45-R49 WeakPolarHBondContact O-CB 3.39Å; L45-R49 WeakPolarHBondContact O-CD 3.16Å; L45-R49 WeakPolarHBondContact O-CG 3.41Å; L45-R49 PolarHBondContact O-N 3.03Å
46	F	92.9	Very high	87.6	Confident	11 Å²	11	45.3 Å²	45.3	5%	0.048	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-57	173.8	175.7	-97.7	0	0	0	111.7	I40 N42 L43 D44 Q48 R49 V50 I156 F159 I192	I40-F46 HydrophobicContact CD1-CD1 4.14Å; I40-F46 HydrophobicContact CD1-CD2 3.47Å; I40-F46 VanDerWaalsContact CD1-CD2 3.47Å; I40-F46 HydrophobicContact CD1-CE1 4.08Å; I40-F46 HydrophobicContact CD1-CE2 3.41Å; I40-F46 VanDerWaalsContact CD1-CE2 3.41Å; I40-F46 HydrophobicContact CD1-CG 3.85Å; I40-F46 HydrophobicContact CD1-CZ 3.73Å; I40-F46 HydrophobicContact CG2-CB 4.07Å; I40-F46 HydrophobicContact CG2-CD2 4.4Å; I40-F46 HydrophobicContact CG2-CG 4.32Å; N42-F46 WeakPolarHBondContact O-CB 3.3Å; N42-F46 PolarHBondContact O-N 3.47Å; N42-F46 VanDerWaalsContact O-N 3.11Å; L43-F46 PolarHBondContact O-N 2.83Å; D44-F46 VanDerWaalsContact C-N 3.28Å; D44-F46 PolarHBondContact O-N 2.9Å; F46-Q48 VanDerWaalsContact C-N 3.32Å; F46-Q48 PolarHBondContact O-N 2.89Å; F46-R49 PolarHBondContact O-N 2.75Å; F46-R49 VanDerWaalsContact O-N 3.09Å; F46-V50 HydrophobicContact CD1-CG2 4.21Å; F46-V50 HydrophobicContact CE1-CG2 3.89Å; F46-V50 HydrophobicContact CE2-CG2 4.25Å; F46-V50 HydrophobicContact CZ-CG2 3.91Å; F46-V50 WeakPolarHBondContact O-CG2 3.43Å; F46-V50 PolarHBondContact O-N 2.7Å; F46-I156 HydrophobicContact CD2-CD1 3.35Å; F46-I156 HydrophobicContact CE2-CD1 3.44Å; F46-I156 VanDerWaalsContact CE2-CD1 3.44Å; F46-I156 HydrophobicContact CG-CD1 4.36Å; F46-I156 HydrophobicContact CZ-CD1 4.5Å; F46-F159 HydrophobicContact CE1-CE1 4.28Å; F46-F159 HydrophobicContact CE1-CZ 4.32Å; F46-F159 HydrophobicContact CE2-CD1 4.43Å; F46-F159 HydrophobicContact CE2-CG 4.33Å; F46-F159 AromaticContact CZ-CD1 3.77Å; F46-F159 HydrophobicContact CZ-CD1 3.77Å; F46-F159 HydrophobicContact CZ-CD2 4Å; F46-F159 AromaticContact CZ-CE1 3.74Å; F46-F159 HydrophobicContact CZ-CE1 3.74Å; F46-F159 AromaticContact CZ-CE2 3.99Å; F46-F159 HydrophobicContact CZ-CE2 3.99Å; F46-F159 AromaticContact CZ-CG 3.91Å; F46-F159 HydrophobicContact CZ-CG 3.91Å; F46-F159 AromaticContact CZ-CZ 3.86Å; F46-F159 HydrophobicContact CZ-CZ 3.86Å; F46-I192 HydrophobicContact CE1-CG2 4.29Å
47	F	94.2	Very high	88.9	Confident	1 Å²	1	43.2 Å²	43.2	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-65.8	-32.9	-179.5	-69.1	-61.3	0	0	0	112.7	L43 D44 V50 Y51 I183 L199 R207 I208	L43-F47 HydrophobicContact CB-CD2 4.34Å; L43-F47 HydrophobicContact CB-CE2 4.14Å; L43-F47 HydrophobicContact CD2-CE2 4.11Å; L43-F47 WeakPolarHBondContact O-CD2 3.3Å; L43-F47 PolarHBondContact O-N 2.73Å; D44-F47 PolarHBondContact O-N 3.11Å; F47-V50 PolarHBondContact O-N 2.82Å; F47-Y51 VanDerWaalsContact O-CB 3.31Å; F47-Y51 WeakPolarHBondContact O-CB 3.44Å; F47-Y51 PolarHBondContact O-N 2.73Å; F47-I183 HydrophobicContact CE1-CG2 3.8Å; F47-L199 HydrophobicContact CE1-CD2 4.42Å; F47-L199 HydrophobicContact CE2-CD2 4.4Å; F47-L199 HydrophobicContact CZ-CD2 3.75Å; F47-R207 HydrophobicContact CD2-CB 4.28Å; F47-R207 VanDerWaalsContact CD2-CD 3.42Å; F47-I208 HydrophobicContact CB-CD1 4.31Å; F47-I208 HydrophobicContact CB-CG1 3.84Å
48	Q	94.7	Very high	89.9	Confident	64 Å²	64	42.7 Å²	42.7	30%	0.299	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-39.6	171.7	-72.3	172.2	41	0	0	112.3	D44 F46 N52 R207	D44-Q48 WeakPolarHBondContact O-CB 3.27Å; D44-Q48 WeakPolarHBondContact O-CG 3.24Å; D44-Q48 PolarHBondContact O-N 3.39Å; F46-Q48 VanDerWaalsContact C-N 3.32Å; F46-Q48 PolarHBondContact O-N 2.89Å; Q48-N52 VanDerWaalsContact O-CB 3.32Å; Q48-N52 WeakPolarHBondContact O-CB 3.29Å; Q48-N52 PolarHBondContact O-N 3.28Å; Q48-R207 PolarHBondContact NE2-O 3.09Å
49	R	95.3	Very high	91	Very high	27 Å²	27	38.8 Å²	38.8	10%	0.102	19%	0.187	C	C	.	.	H	α-helix	trans	-70.7	-42.1	174.9	-72.3	168	168.7	167.9	-5.2	112.2	L45 F46 N52 L53 Y148 C152 Y153 I156	L45-R49 HydrophobicContact CD1-CG 4.29Å; L45-R49 WeakPolarHBondContact O-CB 3.39Å; L45-R49 WeakPolarHBondContact O-CD 3.16Å; L45-R49 WeakPolarHBondContact O-CG 3.41Å; L45-R49 PolarHBondContact O-N 3.03Å; F46-R49 PolarHBondContact O-N 2.75Å; F46-R49 VanDerWaalsContact O-N 3.09Å; R49-N52 PolarHBondContact O-N 3.49Å; R49-L53 WeakPolarHBondContact O-CB 3.11Å; R49-L53 PolarHBondContact O-N 2.96Å; R49-Y148 PolarHBondContact NH2-OH 2.95Å; R49-C152 PolarHBondContact NH2-SG 2.77Å; R49-C152 VanDerWaalsContact NH2-SG 3.37Å; R49-Y153 HydrophobicContact CB-CD1 4.25Å; R49-Y153 HydrophobicContact CB-CE1 3.63Å; R49-Y153 HydrophobicContact CG-CE1 3.85Å; R49-Y153 WeakPolarHBondContact O-CE1 3.37Å; R49-I156 HydrophobicContact CB-CD1 4.35Å; R49-I156 HydrophobicContact CB-CG1 3.91Å
50	V	95.4	Very high	91.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-55.4	-53.3	173	170.3	0	0	0	0	110	F46 F47 N52 L53 H54 I156 F159 Y160 W176 I183	F46-V50 HydrophobicContact CD1-CG2 4.21Å; F46-V50 HydrophobicContact CE1-CG2 3.89Å; F46-V50 HydrophobicContact CE2-CG2 4.25Å; F46-V50 HydrophobicContact CZ-CG2 3.91Å; F46-V50 WeakPolarHBondContact O-CG2 3.43Å; F46-V50 PolarHBondContact O-N 2.7Å; F47-V50 PolarHBondContact O-N 2.82Å; V50-N52 PolarHBondContact O-N 3.36Å; V50-L53 PolarHBondContact O-N 2.94Å; V50-H54 PolarHBondContact O-N 2.67Å; V50-I156 HydrophobicContact CB-CG2 4.48Å; V50-I156 HydrophobicContact CG2-CD1 4.25Å; V50-I156 HydrophobicContact CG2-CG2 3.85Å; V50-F159 HydrophobicContact CG2-CD1 4.29Å; V50-F159 HydrophobicContact CG2-CE1 4.34Å; V50-Y160 HydrophobicContact CB-CE2 4.48Å; V50-Y160 HydrophobicContact CG1-CE2 3.93Å; V50-Y160 WeakPolarHBondContact CG1-OH 3.25Å; V50-Y160 PolarHBondContact O-OH 2.98Å; V50-W176 HydrophobicContact CG1-CH2 4.29Å; V50-W176 HydrophobicContact CG1-CZ3 4.34Å; V50-I183 HydrophobicContact CG1-CD1 3.87Å
51	Y	96.4	Very high	92.7	Very high	13 Å²	13	41.1 Å²	41.1	5%	0.051	21%	0.212	C	C	.	.	H	α-helix	trans	-57.6	-48.3	176.2	177.2	-99	0	0	0	112.6	F47 L53 H54 Q55 W176 I208 L342 D343 H344	F47-Y51 VanDerWaalsContact O-CB 3.31Å; F47-Y51 WeakPolarHBondContact O-CB 3.44Å; F47-Y51 PolarHBondContact O-N 2.73Å; Y51-L53 VanDerWaalsContact C-N 3.34Å; Y51-L53 PolarHBondContact O-N 2.75Å; Y51-H54 WeakPolarHBondContact O-CB 3.48Å; Y51-H54 PolarHBondContact O-N 3.36Å; Y51-Q55 HydrophobicContact CD1-CG 4.01Å; Y51-Q55 HydrophobicContact CD2-CG 4.2Å; Y51-Q55 HydrophobicContact CE1-CG 3.56Å; Y51-Q55 HydrophobicContact CE2-CG 3.76Å; Y51-Q55 VanDerWaalsContact CE2-NE2 3.33Å; Y51-Q55 HydrophobicContact CG-CG 4.3Å; Y51-Q55 VanDerWaalsContact CZ-CG 3.41Å; Y51-Q55 VanDerWaalsContact O-CG 3.32Å; Y51-Q55 WeakPolarHBondContact O-CG 3.23Å; Y51-Q55 PolarHBondContact O-N 3.32Å; Y51-W176 AromaticContact CD2-CD2 3.85Å; Y51-W176 HydrophobicContact CD2-CD2 3.85Å; Y51-W176 AromaticContact CD2-CE2 3.95Å; Y51-W176 AromaticContact CD2-CE3 3.83Å; Y51-W176 HydrophobicContact CD2-CE3 3.83Å; Y51-W176 AromaticContact CD2-CH2 4Å; Y51-W176 HydrophobicContact CD2-CH2 4Å; Y51-W176 HydrophobicContact CD2-CZ2 4.02Å; Y51-W176 AromaticContact CD2-CZ3 3.91Å; Y51-W176 HydrophobicContact CD2-CZ3 3.91Å; Y51-W176 HydrophobicContact CE2-CD2 4.29Å; Y51-W176 HydrophobicContact CG-CH2 4.46Å; Y51-W176 HydrophobicContact CG-CZ3 4.46Å; Y51-I208 HydrophobicContact CD1-CG2 4.22Å; Y51-I208 HydrophobicContact CG-CD1 4.41Å; Y51-I208 HydrophobicContact CG-CG2 4.23Å; Y51-L342 HydrophobicContact CD2-CD1 4.38Å; Y51-L342 HydrophobicContact CD2-CD2 4.14Å; Y51-L342 HydrophobicContact CE2-CB 4.13Å; Y51-L342 HydrophobicContact CE2-CD1 3.88Å; Y51-L342 HydrophobicContact CE2-CD2 3.77Å; Y51-L342 HydrophobicContact CE2-CG 4.14Å; Y51-D343 PolarHBondContact OH-N 2.79Å; Y51-H344 AromaticContact CE2-CE1 3.95Å; Y51-H344 AromaticContact CE2-ND1 3.62Å; Y51-H344 AromaticContact CZ-ND1 3.75Å; Y51-H344 PolarHBondContact OH-N 2.6Å; Y51-H344 PolarHBondContact OH-ND1 3.47Å
52	N	95.4	Very high	93.6	Very high	48 Å²	48	34.1 Å²	34.1	26%	0.257	18%	0.179	S	C	.	.	H	α-helix	trans	-64.9	-35.1	-179.2	-170.9	43.7	0	0	0	112.8	Q48 R49 V50 Q55 K56 Y153	Q48-N52 VanDerWaalsContact O-CB 3.32Å; Q48-N52 WeakPolarHBondContact O-CB 3.29Å; Q48-N52 PolarHBondContact O-N 3.28Å; R49-N52 PolarHBondContact O-N 3.49Å; V50-N52 PolarHBondContact O-N 3.36Å; N52-Q55 PolarHBondContact O-N 3Å; N52-K56 WeakPolarHBondContact O-CB 3.3Å; N52-K56 VanDerWaalsContact O-CG 3.26Å; N52-K56 WeakPolarHBondContact O-CG 3.28Å; N52-K56 PolarHBondContact O-N 2.6Å; N52-Y153 PolarHBondContact ND2-OH 3.11Å
53	L	95.7	Very high	94	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.3	-40.1	176.6	-174.2	64.3	0	0	0	112	R49 V50 Y51 G58 F59 M62 I156 Y160 L171	R49-L53 WeakPolarHBondContact O-CB 3.11Å; R49-L53 PolarHBondContact O-N 2.96Å; V50-L53 PolarHBondContact O-N 2.94Å; Y51-L53 VanDerWaalsContact C-N 3.34Å; Y51-L53 PolarHBondContact O-N 2.75Å; L53-G58 PolarHBondContact O-N 2.9Å; L53-F59 HydrophobicContact CD1-CB 4.05Å; L53-M62 HydrophobicContact CD1-CE 3.65Å; L53-M62 HydrophobicContact CD1-SD 4.16Å; L53-I156 HydrophobicContact CB-CG2 4.48Å; L53-I156 HydrophobicContact CD2-CB 4.37Å; L53-I156 HydrophobicContact CD2-CG2 3.76Å; L53-Y160 HydrophobicContact CB-CE2 4.43Å; L53-Y160 HydrophobicContact CD2-CD2 3.74Å; L53-Y160 HydrophobicContact CD2-CE2 3.9Å; L53-Y160 HydrophobicContact CG-CE2 4.49Å; L53-L171 HydrophobicContact CG-CD2 4.41Å
54	H	95.5	Very high	94.3	Very high	17 Å²	17	37.8 Å²	37.8	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-62.8	-53.6	170.4	173	-83.1	0	0	0	111.3	V50 Y51 K56 N57 L171 W176	V50-H54 PolarHBondContact O-N 2.67Å; Y51-H54 WeakPolarHBondContact O-CB 3.48Å; Y51-H54 PolarHBondContact O-N 3.36Å; H54-K56 PolarHBondContact O-N 2.9Å; H54-K56 VanDerWaalsContact O-N 3.11Å; H54-N57 PolarHBondContact O-N 3.23Å; H54-L171 HydrophobicContact CB-CD1 4.34Å; H54-W176 HydrophobicContact CB-CE3 4.27Å; H54-W176 HydrophobicContact CB-CZ3 4.43Å; H54-W176 PolarHBondContact NE2-N 3.05Å
55	Q	95.1	Very high	94.5	Very high	62 Å²	62	39 Å²	39	29%	0.29	21%	0.211	S	C	.	.	H	α-helix	trans	-65.2	-15.6	-177.8	-61.7	-58.1	-41.5	0	0	114.6	Y51 N52 H344	Y51-Q55 HydrophobicContact CD1-CG 4.01Å; Y51-Q55 HydrophobicContact CD2-CG 4.2Å; Y51-Q55 HydrophobicContact CE1-CG 3.56Å; Y51-Q55 HydrophobicContact CE2-CG 3.76Å; Y51-Q55 VanDerWaalsContact CE2-NE2 3.33Å; Y51-Q55 HydrophobicContact CG-CG 4.3Å; Y51-Q55 VanDerWaalsContact CZ-CG 3.41Å; Y51-Q55 VanDerWaalsContact O-CG 3.32Å; Y51-Q55 WeakPolarHBondContact O-CG 3.23Å; Y51-Q55 PolarHBondContact O-N 3.32Å; N52-Q55 PolarHBondContact O-N 3Å; Q55-H344 PolarHBondContact NE2-ND1 3.04Å
56	K	94.4	Very high	94.6	Very high	73 Å²	73	39 Å²	39	32%	0.317	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	9.3	173.3	-69.7	-83.6	-172.3	157.9	0	113.1	N52 H54 G58 C61 M62	N52-K56 WeakPolarHBondContact O-CB 3.3Å; N52-K56 VanDerWaalsContact O-CG 3.26Å; N52-K56 WeakPolarHBondContact O-CG 3.28Å; N52-K56 PolarHBondContact O-N 2.6Å; H54-K56 PolarHBondContact O-N 2.9Å; H54-K56 VanDerWaalsContact O-N 3.11Å; K56-G58 VanDerWaalsContact C-N 3.32Å; K56-G58 PolarHBondContact O-N 3.47Å; K56-C61 WeakPolarHBondContact O-CB 3.47Å; K56-M62 HydrophobicContact CB-CB 3.74Å; K56-M62 HydrophobicContact CB-CG 4.04Å; K56-M62 HydrophobicContact CB-SD 4.44Å; K56-M62 HydrophobicContact CD-CG 4.39Å; K56-M62 HydrophobicContact CG-CB 4.25Å; K56-M62 HydrophobicContact CG-CG 4.01Å; K56-M62 HydrophobicContact CG-SD 4.39Å
57	N	93.3	Very high	94.7	Very high	88 Å²	88	41.8 Å²	41.8	47%	0.471	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	42	-178.7	-58	-10	0	0	0	112.9	H54 C61 P172	H54-N57 PolarHBondContact O-N 3.23Å; N57-C61 PolarHBondContact O-SG 3.35Å; N57-P172 HydrophobicContact CB-CB 4.19Å; N57-P172 HydrophobicContact CB-CG 4.25Å
58	G	92.7	Very high	94.8	Very high	3 Å²	3	47.2 Å²	47.2	3%	0.031	25%	0.248	C	C	.	.	S	Bend	trans	90.7	172.8	173.3	0	0	0	0	0	116.2	L53 K56 T60 C61 M62	L53-G58 PolarHBondContact O-N 2.9Å; K56-G58 VanDerWaalsContact C-N 3.32Å; K56-G58 PolarHBondContact O-N 3.47Å; G58-T60 PolarHBondContact O-N 3.4Å; G58-C61 PolarHBondContact O-N 2.69Å; G58-M62 WeakPolarHBondContact O-CB 3.48Å; G58-M62 PolarHBondContact O-N 2.75Å; G58-M62 VanDerWaalsContact O-N 3.13Å
59	F	94	Very high	94.7	Very high	15 Å²	15	47.8 Å²	47.8	7%	0.066	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-46	-164.3	-178.2	-94.6	0	0	0	113.6	L53 M62 L63 V150 W154 R157 M168	L53-F59 HydrophobicContact CD1-CB 4.05Å; F59-M62 HydrophobicContact CD2-CE 4.23Å; F59-M62 PolarHBondContact O-N 3.25Å; F59-L63 HydrophobicContact CE1-CD2 4.02Å; F59-L63 VanDerWaalsContact O-CB 3.22Å; F59-L63 WeakPolarHBondContact O-CB 3.38Å; F59-L63 PolarHBondContact O-N 3.34Å; F59-V150 HydrophobicContact CZ-CG1 4.28Å; F59-W154 HydrophobicContact CD1-CE3 4.44Å; F59-W154 AromaticContact CE1-CE3 3.79Å; F59-W154 HydrophobicContact CE1-CE3 3.79Å; F59-W154 HydrophobicContact CE1-CZ3 4Å; F59-W154 HydrophobicContact CE2-CB 4.43Å; F59-W154 HydrophobicContact CE2-CE3 4.3Å; F59-W154 AromaticContact CZ-CE3 3.71Å; F59-W154 HydrophobicContact CZ-CE3 3.71Å; F59-W154 HydrophobicContact CZ-CZ3 4.38Å; F59-R157 HydrophobicContact CD2-CB 4.3Å; F59-M168 HydrophobicContact CB-SD 4.17Å
60	T	93.9	Very high	94.7	Very high	104 Å²	104	47 Å²	47	64%	0.638	25%	0.248	S	C	*	.	H	α-helix	trans	-66.1	-41.2	-176.9	-46.8	0	0	0	0	112	G58 L63 L64	G58-T60 PolarHBondContact O-N 3.4Å; T60-L63 PolarHBondContact O-N 2.89Å; T60-L64 VanDerWaalsContact O-CB 3.27Å; T60-L64 WeakPolarHBondContact O-CB 3.19Å; T60-L64 PolarHBondContact O-N 3.35Å
61	C	94.2	Very high	94.7	Very high	74 Å²	74	50.7 Å²	50.7	50%	0.5	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-45.1	177.6	-59.7	0	0	0	0	111.3	K56 N57 G58 G65	K56-C61 WeakPolarHBondContact O-CB 3.47Å; N57-C61 PolarHBondContact O-SG 3.35Å; G58-C61 PolarHBondContact O-N 2.69Å; C61-G65 PolarHBondContact O-N 3.03Å
62	M	93.9	Very high	94.6	Very high	9 Å²	9	54.5 Å²	54.5	4%	0.044	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-47.7	175.2	-174.9	179.1	66.6	0	0	112.5	L53 K56 G58 F59 G65 E66 Y153	L53-M62 HydrophobicContact CD1-CE 3.65Å; L53-M62 HydrophobicContact CD1-SD 4.16Å; K56-M62 HydrophobicContact CB-CB 3.74Å; K56-M62 HydrophobicContact CB-CG 4.04Å; K56-M62 HydrophobicContact CB-SD 4.44Å; K56-M62 HydrophobicContact CD-CG 4.39Å; K56-M62 HydrophobicContact CG-CB 4.25Å; K56-M62 HydrophobicContact CG-CG 4.01Å; K56-M62 HydrophobicContact CG-SD 4.39Å; G58-M62 WeakPolarHBondContact O-CB 3.48Å; G58-M62 PolarHBondContact O-N 2.75Å; G58-M62 VanDerWaalsContact O-N 3.13Å; F59-M62 HydrophobicContact CD2-CE 4.23Å; F59-M62 PolarHBondContact O-N 3.25Å; M62-G65 PolarHBondContact O-N 3.4Å; M62-E66 PolarHBondContact O-N 2.92Å; M62-Y153 HydrophobicContact CE-CD1 3.51Å; M62-Y153 HydrophobicContact CE-CD2 3.57Å; M62-Y153 HydrophobicContact CE-CE1 4.03Å; M62-Y153 HydrophobicContact CE-CE2 4.12Å; M62-Y153 HydrophobicContact CE-CG 3.26Å; M62-Y153 HydrophobicContact SD-CD1 4.01Å; M62-Y153 HydrophobicContact SD-CD2 4.14Å; M62-Y153 HydrophobicContact SD-CE1 3.88Å; M62-Y153 HydrophobicContact SD-CE2 4.07Å; M62-Y153 HydrophobicContact SD-CG 4.14Å
63	L	95	Very high	94.4	Very high	46 Å²	46	52.7 Å²	52.7	24%	0.241	28%	0.28	C	S	.	.	H	α-helix	trans	-57.9	-49.1	178.6	177.4	69.5	0	0	0	111	F59 T60 G65 E66 I67 F146 V150	F59-L63 HydrophobicContact CE1-CD2 4.02Å; F59-L63 VanDerWaalsContact O-CB 3.22Å; F59-L63 WeakPolarHBondContact O-CB 3.38Å; F59-L63 PolarHBondContact O-N 3.34Å; T60-L63 PolarHBondContact O-N 2.89Å; L63-G65 VanDerWaalsContact C-N 3.33Å; L63-G65 PolarHBondContact O-N 2.86Å; L63-E66 PolarHBondContact O-N 3.33Å; L63-I67 HydrophobicContact CD1-CD1 4.14Å; L63-I67 HydrophobicContact CG-CD1 3.93Å; L63-I67 WeakPolarHBondContact O-CB 3.33Å; L63-I67 VanDerWaalsContact O-CG1 3.25Å; L63-I67 WeakPolarHBondContact O-CG1 3.37Å; L63-I67 PolarHBondContact O-N 2.94Å; L63-F146 HydrophobicContact CD1-CE2 3.91Å; L63-F146 HydrophobicContact CD1-CZ 3.69Å; L63-V150 HydrophobicContact CD1-CG1 4.41Å; L63-V150 HydrophobicContact CD1-CG2 3.57Å
64	L	95.9	Very high	94.3	Very high	90 Å²	90	57.7 Å²	57.7	47%	0.471	31%	0.306	S	S	.	.	H	α-helix	trans	-63.9	-38	179.2	-175.1	60.8	0	0	0	111.9	T60 I67 F68	T60-L64 VanDerWaalsContact O-CB 3.27Å; T60-L64 WeakPolarHBondContact O-CB 3.19Å; T60-L64 PolarHBondContact O-N 3.35Å; L64-I67 PolarHBondContact O-N 2.88Å; L64-F68 HydrophobicContact CD1-CD2 3.95Å; L64-F68 HydrophobicContact CD1-CE2 3.51Å; L64-F68 HydrophobicContact CD1-CZ 4.16Å; L64-F68 HydrophobicContact CD2-CE2 4.13Å; L64-F68 HydrophobicContact CG-CD2 3.85Å; L64-F68 HydrophobicContact CG-CE2 3.61Å; L64-F68 VanDerWaalsContact O-CD2 3.25Å; L64-F68 WeakPolarHBondContact O-CD2 3.34Å; L64-F68 PolarHBondContact O-N 3.17Å
65	G	94.5	Very high	94.3	Very high	27 Å²	27	62.5 Å²	62.5	28%	0.278	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-52.2	174.1	0	0	0	0	0	113	C61 M62 L63 I67 F68 E69	C61-G65 PolarHBondContact O-N 3.03Å; M62-G65 PolarHBondContact O-N 3.4Å; L63-G65 VanDerWaalsContact C-N 3.33Å; L63-G65 PolarHBondContact O-N 2.86Å; G65-I67 VanDerWaalsContact C-N 3.31Å; G65-I67 PolarHBondContact O-N 2.87Å; G65-F68 PolarHBondContact O-N 3.2Å; G65-E69 PolarHBondContact O-N 3.42Å
66	E	93.9	Very high	94.2	Very high	48 Å²	48	60 Å²	60	22%	0.224	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-35.6	178.4	-66	-73.4	158.7	0	0	112.2	M62 L63 E69 L70 R142 F146	M62-E66 PolarHBondContact O-N 2.92Å; L63-E66 PolarHBondContact O-N 3.33Å; E66-E69 PolarHBondContact O-N 3.02Å; E66-L70 PolarHBondContact O-N 3.36Å; E66-R142 IonicContact OE2-NH2 2.73Å; E66-F146 HydrophobicContact CB-CD2 3.69Å; E66-F146 HydrophobicContact CB-CE2 3.74Å
67	I	96	Very high	94.2	Very high	68 Å²	68	57.6 Å²	57.6	35%	0.349	31%	0.307	S	S	.	.	H	α-helix	trans	-61.5	-47.8	171.8	-71.5	168.2	0	0	0	110.6	L63 L64 G65 E69 L70 V71 F146	L63-I67 HydrophobicContact CD1-CD1 4.14Å; L63-I67 HydrophobicContact CG-CD1 3.93Å; L63-I67 WeakPolarHBondContact O-CB 3.33Å; L63-I67 VanDerWaalsContact O-CG1 3.25Å; L63-I67 WeakPolarHBondContact O-CG1 3.37Å; L63-I67 PolarHBondContact O-N 2.94Å; L64-I67 PolarHBondContact O-N 2.88Å; G65-I67 VanDerWaalsContact C-N 3.31Å; G65-I67 PolarHBondContact O-N 2.87Å; I67-E69 VanDerWaalsContact C-N 3.32Å; I67-E69 PolarHBondContact O-N 3.36Å; I67-L70 WeakPolarHBondContact O-CB 3.22Å; I67-L70 PolarHBondContact O-N 2.73Å; I67-L70 VanDerWaalsContact O-N 3.17Å; I67-V71 HydrophobicContact CG2-CG2 4.43Å; I67-V71 WeakPolarHBondContact O-CG2 3.36Å; I67-V71 PolarHBondContact O-N 3.07Å; I67-F146 HydrophobicContact CD1-CZ 4.14Å; I67-F146 HydrophobicContact CG1-CE1 4.41Å; I67-F146 HydrophobicContact CG1-CE2 3.98Å; I67-F146 HydrophobicContact CG1-CZ 3.54Å
68	F	96.3	Very high	94.2	Very high	115 Å²	115	55.1 Å²	55.1	50%	0.504	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-36	177.5	-81.8	-55	0	0	0	112.5	L64 G65 L70 V71 Q72	L64-F68 HydrophobicContact CD1-CD2 3.95Å; L64-F68 HydrophobicContact CD1-CE2 3.51Å; L64-F68 HydrophobicContact CD1-CZ 4.16Å; L64-F68 HydrophobicContact CD2-CE2 4.13Å; L64-F68 HydrophobicContact CG-CD2 3.85Å; L64-F68 HydrophobicContact CG-CE2 3.61Å; L64-F68 VanDerWaalsContact O-CD2 3.25Å; L64-F68 WeakPolarHBondContact O-CD2 3.34Å; L64-F68 PolarHBondContact O-N 3.17Å; G65-F68 PolarHBondContact O-N 3.2Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 PolarHBondContact O-N 2.7Å; F68-V71 PolarHBondContact O-N 2.99Å; F68-Q72 WeakPolarHBondContact O-CB 3.24Å; F68-Q72 VanDerWaalsContact O-CG 3.23Å; F68-Q72 WeakPolarHBondContact O-CG 3.33Å; F68-Q72 PolarHBondContact O-N 3.01Å
69	E	92.8	Very high	94.3	Very high	76 Å²	76	58.3 Å²	58.3	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-68.3	-29	174.3	-68.1	-171.1	-149.8	0	0	113.4	G65 E66 I67 L73 R142	G65-E69 PolarHBondContact O-N 3.42Å; E66-E69 PolarHBondContact O-N 3.02Å; I67-E69 VanDerWaalsContact C-N 3.32Å; I67-E69 PolarHBondContact O-N 3.36Å; E69-L73 PolarHBondContact O-N 2.87Å; E69-R142 VanDerWaalsContact CB-NH2 3.27Å; E69-R142 PolarHBondContact O-NH1 3.09Å; E69-R142 VanDerWaalsContact O-NH1 3.17Å; E69-R142 IonicContact OE2-CZ 3.42Å; E69-R142 IonicContact OE2-NH1 3.7Å; E69-R142 IonicContact OE2-NH2 2.64Å; E69-R142 PolarHBondContact OE2-NH2 3.01Å
70	L	94.8	Very high	94.2	Very high	10 Å²	10	59.2 Å²	59.2	5%	0.052	32%	0.322	C	S	.	.	H	α-helix	trans	-71.1	-40.3	170	-79.3	167.6	0	0	0	112.2	E66 I67 F68 L74 W139 R142 L143 F146	E66-L70 PolarHBondContact O-N 3.36Å; I67-L70 WeakPolarHBondContact O-CB 3.22Å; I67-L70 PolarHBondContact O-N 2.73Å; I67-L70 VanDerWaalsContact O-N 3.17Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 PolarHBondContact O-N 2.7Å; L70-L74 PolarHBondContact O-N 2.8Å; L70-W139 PolarHBondContact O-NE1 2.98Å; L70-R142 HydrophobicContact CD2-CB 4.01Å; L70-R142 HydrophobicContact CD2-CG 3.76Å; L70-L143 HydrophobicContact CD1-CD1 4.25Å; L70-F146 HydrophobicContact CD1-CB 3.9Å; L70-F146 HydrophobicContact CD1-CD1 3.8Å; L70-F146 HydrophobicContact CD1-CD2 4.11Å; L70-F146 HydrophobicContact CD1-CE1 4.35Å; L70-F146 HydrophobicContact CD1-CG 3.66Å
71	V	95.8	Very high	94.2	Very high	78 Å²	78	55.2 Å²	55.2	47%	0.473	30%	0.297	S	S	.	.	H	α-helix	trans	-69.1	-39.3	177.2	171.9	0	0	0	0	111.3	I67 F68 L73 L74 F75	I67-V71 HydrophobicContact CG2-CG2 4.43Å; I67-V71 WeakPolarHBondContact O-CG2 3.36Å; I67-V71 PolarHBondContact O-N 3.07Å; F68-V71 PolarHBondContact O-N 2.99Å; V71-L73 VanDerWaalsContact C-N 3.34Å; V71-L73 PolarHBondContact O-N 3.34Å; V71-L74 PolarHBondContact O-N 2.98Å; V71-F75 WeakPolarHBondContact O-CB 3.32Å; V71-F75 PolarHBondContact O-N 3.08Å
72	Q	92.8	Very high	94.2	Very high	94 Å²	94	54.9 Å²	54.9	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-59.2	-42.3	175.3	-78.2	170.4	15.5	0	0	112.2	F68 F75 V76	F68-Q72 WeakPolarHBondContact O-CB 3.24Å; F68-Q72 VanDerWaalsContact O-CG 3.23Å; F68-Q72 WeakPolarHBondContact O-CG 3.33Å; F68-Q72 PolarHBondContact O-N 3.01Å; Q72-F75 PolarHBondContact O-N 3.11Å; Q72-V76 WeakPolarHBondContact O-CB 3.19Å; Q72-V76 WeakPolarHBondContact O-CG2 3.38Å; Q72-V76 PolarHBondContact O-N 2.87Å
73	L	91.5	Very high	94.1	Very high	10 Å²	10	57 Å²	57	5%	0.052	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-45.8	175.8	174.3	58.4	0	0	0	111.6	E69 V71 V77 F138 W139 W303	E69-L73 PolarHBondContact O-N 2.87Å; V71-L73 VanDerWaalsContact C-N 3.34Å; V71-L73 PolarHBondContact O-N 3.34Å; L73-V77 HydrophobicContact CD1-CG2 4.28Å; L73-V77 WeakPolarHBondContact O-CG2 3.26Å; L73-V77 PolarHBondContact O-N 3.47Å; L73-F138 HydrophobicContact CD2-CD1 3.85Å; L73-F138 HydrophobicContact CD2-CE1 3.87Å; L73-W139 HydrophobicContact CD2-CB 4.18Å; L73-W139 HydrophobicContact CD2-CG 4.42Å; L73-W303 HydrophobicContact CD1-CE3 4.15Å; L73-W303 HydrophobicContact CD1-CH2 3.68Å; L73-W303 HydrophobicContact CD1-CZ2 4.43Å; L73-W303 HydrophobicContact CD1-CZ3 3.5Å; L73-W303 VanDerWaalsContact CD1-CZ3 3.5Å
74	L	93.9	Very high	94	Very high	105 Å²	105	58.2 Å²	58.2	55%	0.55	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-42.8	177	-178.7	61.8	0	0	0	111.9	L70 V71 G78	L70-L74 PolarHBondContact O-N 2.8Å; V71-L74 PolarHBondContact O-N 2.98Å; L74-G78 PolarHBondContact O-N 2.84Å
75	F	95.3	Very high	93.7	Very high	117 Å²	117	54.7 Å²	54.7	51%	0.513	30%	0.297	S	S	.	.	H	α-helix	trans	-63	-50.2	178.1	175.8	-99.6	0	0	0	112	V71 Q72 V77 G78 F79	V71-F75 WeakPolarHBondContact O-CB 3.32Å; V71-F75 PolarHBondContact O-N 3.08Å; Q72-F75 PolarHBondContact O-N 3.11Å; F75-V77 PolarHBondContact O-N 3.26Å; F75-G78 PolarHBondContact O-N 2.66Å; F75-F79 HydrophobicContact CE1-CD1 4.4Å; F75-F79 HydrophobicContact CE2-CB 4.23Å; F75-F79 HydrophobicContact CE2-CG 4.35Å; F75-F79 HydrophobicContact CZ-CB 4.26Å; F75-F79 HydrophobicContact CZ-CD1 4.04Å; F75-F79 HydrophobicContact CZ-CG 4.14Å; F75-F79 WeakPolarHBondContact O-CB 2.98Å; F75-F79 PolarHBondContact O-N 2.85Å
76	V	93.9	Very high	93.6	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.055	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-45.1	-179.3	167.8	0	0	0	0	111.2	Q72 T80 W303 L306 F310	Q72-V76 WeakPolarHBondContact O-CB 3.19Å; Q72-V76 WeakPolarHBondContact O-CG2 3.38Å; Q72-V76 PolarHBondContact O-N 2.87Å; V76-T80 VanDerWaalsContact O-CB 3.3Å; V76-T80 WeakPolarHBondContact O-CB 3.28Å; V76-T80 PolarHBondContact O-N 3.42Å; V76-T80 PolarHBondContact O-OG1 2.94Å; V76-W303 HydrophobicContact CB-CH2 4.21Å; V76-W303 HydrophobicContact CB-CZ3 3.9Å; V76-W303 HydrophobicContact CG1-CE3 4.22Å; V76-W303 HydrophobicContact CG1-CH2 4.17Å; V76-W303 HydrophobicContact CG1-CZ3 3.55Å; V76-L306 HydrophobicContact CG1-CB 4.07Å; V76-F310 HydrophobicContact CB-CD2 4.43Å; V76-F310 HydrophobicContact CG1-CD2 3.93Å; V76-F310 HydrophobicContact CG1-CE2 4.04Å; V76-F310 HydrophobicContact CG2-CD2 4.01Å
77	V	93.1	Very high	93.6	Very high	23 Å²	23	52.8 Å²	52.8	14%	0.139	28%	0.283	C	S	.	.	H	α-helix	trans	-68.7	-50.9	178.6	176	0	0	0	0	111.1	L73 F75 T80 V81 L132	L73-V77 HydrophobicContact CD1-CG2 4.28Å; L73-V77 WeakPolarHBondContact O-CG2 3.26Å; L73-V77 PolarHBondContact O-N 3.47Å; F75-V77 PolarHBondContact O-N 3.26Å; V77-T80 PolarHBondContact O-N 2.88Å; V77-V81 WeakPolarHBondContact O-CG2 3.28Å; V77-V81 PolarHBondContact O-N 3.25Å; V77-L132 HydrophobicContact CG1-CD2 4.08Å
78	G	93.3	Very high	93.3	Very high	36 Å²	36	50.9 Å²	50.9	37%	0.371	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-43.9	-177.1	0	0	0	0	0	113.3	L74 F75 V81 F82	L74-G78 PolarHBondContact O-N 2.84Å; F75-G78 PolarHBondContact O-N 2.66Å; G78-V81 PolarHBondContact O-N 2.86Å; G78-F82 WeakPolarHBondContact O-CB 3.45Å; G78-F82 PolarHBondContact O-N 2.84Å
79	F	94.9	Very high	93	Very high	71 Å²	71	50.1 Å²	50.1	31%	0.311	27%	0.268	S	S	.	.	H	α-helix	trans	-69	-36.1	178.4	-171.9	-125.9	0	0	0	112.1	F75 F82 L83 F310	F75-F79 HydrophobicContact CE1-CD1 4.4Å; F75-F79 HydrophobicContact CE2-CB 4.23Å; F75-F79 HydrophobicContact CE2-CG 4.35Å; F75-F79 HydrophobicContact CZ-CB 4.26Å; F75-F79 HydrophobicContact CZ-CD1 4.04Å; F75-F79 HydrophobicContact CZ-CG 4.14Å; F75-F79 WeakPolarHBondContact O-CB 2.98Å; F75-F79 PolarHBondContact O-N 2.85Å; F79-F82 HydrophobicContact CD2-CD1 4.16Å; F79-F82 HydrophobicContact CE2-CD1 4.23Å; F79-F82 PolarHBondContact O-N 2.87Å; F79-L83 HydrophobicContact CD1-CD1 4.05Å; F79-L83 HydrophobicContact CD2-CG 4.4Å; F79-L83 HydrophobicContact CE1-CD1 3.7Å; F79-L83 HydrophobicContact CE1-CG 4.36Å; F79-L83 HydrophobicContact CE2-CD1 4.34Å; F79-L83 HydrophobicContact CE2-CD2 4.17Å; F79-L83 HydrophobicContact CE2-CG 4.12Å; F79-L83 HydrophobicContact CZ-CD1 3.86Å; F79-L83 HydrophobicContact CZ-CD2 4.11Å; F79-L83 HydrophobicContact CZ-CG 4.09Å; F79-L83 WeakPolarHBondContact O-CB 3.42Å; F79-L83 WeakPolarHBondContact O-CG 3.27Å; F79-L83 PolarHBondContact O-N 3.02Å; F79-F310 AromaticContact CD1-CE1 3.72Å; F79-F310 HydrophobicContact CD1-CE1 3.72Å; F79-F310 AromaticContact CD1-CZ 3.91Å; F79-F310 HydrophobicContact CD1-CZ 3.91Å; F79-F310 AromaticContact CE1-CE1 3.89Å; F79-F310 HydrophobicContact CE1-CE1 3.89Å; F79-F310 HydrophobicContact CE1-CZ 4.45Å
80	T	93.5	Very high	92.8	Very high	33 Å²	33	50.6 Å²	50.6	20%	0.202	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-44.4	173.2	-56.5	0	0	0	0	111.5	V76 V77 L83 A84 L306	V76-T80 VanDerWaalsContact O-CB 3.3Å; V76-T80 WeakPolarHBondContact O-CB 3.28Å; V76-T80 PolarHBondContact O-N 3.42Å; V76-T80 PolarHBondContact O-OG1 2.94Å; V77-T80 PolarHBondContact O-N 2.88Å; T80-L83 PolarHBondContact O-N 2.89Å; T80-A84 VanDerWaalsContact O-CB 3.29Å; T80-A84 WeakPolarHBondContact O-CB 3.35Å; T80-A84 PolarHBondContact O-N 2.73Å; T80-L306 HydrophobicContact CG2-CD1 3.92Å; T80-L306 HydrophobicContact CG2-CD2 3.71Å; T80-L306 HydrophobicContact CG2-CG 4.49Å
81	V	93.1	Very high	92.4	Very high	20 Å²	20	50.3 Å²	50.3	12%	0.121	27%	0.272	C	S	.	.	H	α-helix	trans	-67	-38.5	177.8	170.6	0	0	0	0	111.7	V77 G78 A84 N85 I122 V128 L132	V77-V81 WeakPolarHBondContact O-CG2 3.28Å; V77-V81 PolarHBondContact O-N 3.25Å; G78-V81 PolarHBondContact O-N 2.86Å; V81-A84 PolarHBondContact O-N 3.08Å; V81-N85 PolarHBondContact O-N 2.85Å; V81-N85 VanDerWaalsContact O-N 3.11Å; V81-N85 PolarHBondContact O-ND2 3.35Å; V81-I122 HydrophobicContact CG1-CD1 3.95Å; V81-I122 HydrophobicContact CG1-CG1 4.22Å; V81-V128 HydrophobicContact CG1-CG1 3.85Å; V81-V128 HydrophobicContact CG2-CG1 4.15Å; V81-L132 HydrophobicContact CG1-CD1 4.43Å; V81-L132 HydrophobicContact CG2-CD2 4.07Å; V81-L132 HydrophobicContact CG2-CG 4.36Å
82	F	93.6	Very high	92	Very high	68 Å²	68	50 Å²	50	30%	0.298	27%	0.268	S	S	.	.	H	α-helix	trans	-59.3	-52.7	173	171.8	-95.7	0	0	0	111.8	G78 F79 A84 N85 C86 V87 I112	G78-F82 WeakPolarHBondContact O-CB 3.45Å; G78-F82 PolarHBondContact O-N 2.84Å; F79-F82 HydrophobicContact CD2-CD1 4.16Å; F79-F82 HydrophobicContact CE2-CD1 4.23Å; F79-F82 PolarHBondContact O-N 2.87Å; F82-A84 VanDerWaalsContact C-N 3.28Å; F82-A84 PolarHBondContact O-N 3.22Å; F82-N85 PolarHBondContact O-N 2.93Å; F82-C86 HydrophobicContact CD2-CB 3.57Å; F82-C86 HydrophobicContact CE2-CB 3.7Å; F82-C86 HydrophobicContact CG-CB 4.3Å; F82-C86 WeakPolarHBondContact O-CA 3.46Å; F82-C86 WeakPolarHBondContact O-CB 3.35Å; F82-C86 PolarHBondContact O-N 3.18Å; F82-V87 HydrophobicContact CD1-CG2 4.46Å; F82-V87 HydrophobicContact CE1-CG2 3.97Å; F82-V87 HydrophobicContact CZ-CG2 4.32Å; F82-I112 HydrophobicContact CE2-CG2 4.16Å; F82-I112 HydrophobicContact CZ-CD1 4.19Å; F82-I112 HydrophobicContact CZ-CG1 4.21Å; F82-I112 HydrophobicContact CZ-CG2 4.22Å
83	L	93.2	Very high	91.7	Very high	54 Å²	54	52 Å²	52	28%	0.283	28%	0.275	S	S	.	.	H	α-helix	trans	-59.2	-39.7	177.6	-71.2	175.2	0	0	0	112	F79 T80 V87 Y89	F79-L83 HydrophobicContact CD1-CD1 4.05Å; F79-L83 HydrophobicContact CD2-CG 4.4Å; F79-L83 HydrophobicContact CE1-CD1 3.7Å; F79-L83 HydrophobicContact CE1-CG 4.36Å; F79-L83 HydrophobicContact CE2-CD1 4.34Å; F79-L83 HydrophobicContact CE2-CD2 4.17Å; F79-L83 HydrophobicContact CE2-CG 4.12Å; F79-L83 HydrophobicContact CZ-CD1 3.86Å; F79-L83 HydrophobicContact CZ-CD2 4.11Å; F79-L83 HydrophobicContact CZ-CG 4.09Å; F79-L83 WeakPolarHBondContact O-CB 3.42Å; F79-L83 WeakPolarHBondContact O-CG 3.27Å; F79-L83 PolarHBondContact O-N 3.02Å; T80-L83 PolarHBondContact O-N 2.89Å; L83-V87 HydrophobicContact CD2-CG2 4.35Å; L83-Y89 WeakPolarHBondContact O-CE2 3.34Å; L83-Y89 PolarHBondContact O-OH 2.92Å
84	A	91.1	Very high	91	Very high	70 Å²	70	53.8 Å²	53.8	58%	0.579	29%	0.291	S	S	*	.	H	α-helix	trans	-78.6	-15.6	-176	0	0	0	0	0	115.4	T80 V81 F82	T80-A84 VanDerWaalsContact O-CB 3.29Å; T80-A84 WeakPolarHBondContact O-CB 3.35Å; T80-A84 PolarHBondContact O-N 2.73Å; V81-A84 PolarHBondContact O-N 3.08Å; F82-A84 VanDerWaalsContact C-N 3.28Å; F82-A84 PolarHBondContact O-N 3.22Å
85	N	91.3	Very high	90.3	Very high	17 Å²	17	54 Å²	54	9%	0.091	29%	0.293	C	S	.	.	H	α-helix	trans	-137.7	-18.2	-172.7	-53.9	-95.1	0	0	0	115.4	V81 F82 C118 I122 N125	V81-N85 PolarHBondContact O-N 2.85Å; V81-N85 VanDerWaalsContact O-N 3.11Å; V81-N85 PolarHBondContact O-ND2 3.35Å; F82-N85 PolarHBondContact O-N 2.93Å; N85-C118 PolarHBondContact O-SG 3.18Å; N85-C118 VanDerWaalsContact O-SG 3.35Å; N85-I122 HydrophobicContact CB-CD1 4.42Å; N85-I122 HydrophobicContact CB-CG1 3.73Å; N85-N125 PolarHBondContact OD1-ND2 3.45Å
86	C	92.5	Very high	89.3	Confident	10 Å²	10	53.5 Å²	53.5	7%	0.068	29%	0.291	C	S	.	.	S	Bend	trans	-107.5	-1.6	-177.7	-57.8	0	0	0	0	114.3	F82 L113 C118	F82-C86 HydrophobicContact CD2-CB 3.57Å; F82-C86 HydrophobicContact CE2-CB 3.7Å; F82-C86 HydrophobicContact CG-CB 4.3Å; F82-C86 WeakPolarHBondContact O-CA 3.46Å; F82-C86 WeakPolarHBondContact O-CB 3.35Å; F82-C86 PolarHBondContact O-N 3.18Å; C86-L113 PolarHBondContact O-N 3.22Å; C86-C118 WeakPolarHBondContact CA-SG 3.43Å; C86-C118 HydrophobicContact CB-CB 3.79Å; C86-C118 WeakPolarHBondContact CB-SG 3.43Å; C86-C118 PolarHBondContact N-SG 2.78Å; C86-C118 VanDerWaalsContact N-SG 3.42Å; C86-C118 WeakPolarHBondContact SG-CB 3.19Å; C86-C118 CovalentContact SG-SG 2.03Å; C86-C118 PolarHBondContact SG-SG 3.02Å
87	V	93	Very high	87.9	Confident	24 Å²	24	61.3 Å²	61.3	15%	0.145	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-109.8	120.6	-176.6	-179.2	0	0	0	0	110.4	F82 L83 Y89 L92 A111	F82-V87 HydrophobicContact CD1-CG2 4.46Å; F82-V87 HydrophobicContact CE1-CG2 3.97Å; F82-V87 HydrophobicContact CZ-CG2 4.32Å; L83-V87 HydrophobicContact CD2-CG2 4.35Å; V87-Y89 HydrophobicContact CB-CD2 4.46Å; V87-Y89 HydrophobicContact CB-CE2 4.09Å; V87-Y89 HydrophobicContact CG1-CD1 4.22Å; V87-Y89 HydrophobicContact CG1-CD2 4.31Å; V87-Y89 HydrophobicContact CG1-CE1 4.08Å; V87-Y89 HydrophobicContact CG1-CE2 4.18Å; V87-Y89 HydrophobicContact CG1-CG 4.35Å; V87-Y89 PolarHBondContact O-N 2.7Å; V87-L92 HydrophobicContact CG1-CD2 4.13Å; V87-A111 CarbonylContact C-O 3.6Å; V87-A111 WeakPolarHBondContact CA-O 3.46Å
88	D	90.2	Very high	86.5	Confident	28 Å²	28	63.1 Å²	63.1	15%	0.15	34%	0.335	C	S	.	.			trans	-80.6	94.8	169.5	-172.2	-30	0	0	0	109	D90 V91 L92 K96 A111 L113	D88-D90 VanDerWaalsContact C-N 3.26Å; D88-D90 PolarHBondContact O-N 2.87Å; D88-D90 WeakPolarHBondContact OD1-CB 3.29Å; D88-D90 PolarHBondContact OD1-N 3.3Å; D88-V91 HydrophobicContact CB-CB 4.24Å; D88-V91 HydrophobicContact CB-CG2 4.28Å; D88-V91 PolarHBondContact O-N 3.08Å; D88-V91 PolarHBondContact OD1-N 2.65Å; D88-L92 PolarHBondContact O-N 3.01Å; D88-K96 IonicContact OD2-NZ 3.3Å; D88-K96 PolarHBondContact OD2-NZ 3.45Å; D88-A111 PolarHBondContact N-O 3.35Å; D88-L113 HydrophobicContact CB-CD2 4.11Å; D88-L113 HydrophobicContact CB-CG 4.47Å
89	Y	89.9	Confident	84.8	Confident	99 Å²	99	68.8 Å²	68.8	39%	0.388	36%	0.357	S	S	.	.	H	α-helix	trans	-67.1	-23.1	179.1	-74.4	-75.6	0	0	0	113.5	L83 V87 L92 F93	L83-Y89 WeakPolarHBondContact O-CE2 3.34Å; L83-Y89 PolarHBondContact O-OH 2.92Å; V87-Y89 HydrophobicContact CB-CD2 4.46Å; V87-Y89 HydrophobicContact CB-CE2 4.09Å; V87-Y89 HydrophobicContact CG1-CD1 4.22Å; V87-Y89 HydrophobicContact CG1-CD2 4.31Å; V87-Y89 HydrophobicContact CG1-CE1 4.08Å; V87-Y89 HydrophobicContact CG1-CE2 4.18Å; V87-Y89 HydrophobicContact CG1-CG 4.35Å; V87-Y89 PolarHBondContact O-N 2.7Å; Y89-L92 HydrophobicContact CD1-CD2 4.12Å; Y89-L92 HydrophobicContact CE1-CD2 4.28Å; Y89-L92 PolarHBondContact O-N 2.86Å; Y89-F93 HydrophobicContact CD1-CD2 4.5Å; Y89-F93 AromaticContact CD1-CE2 3.67Å; Y89-F93 HydrophobicContact CD1-CE2 3.67Å; Y89-F93 AromaticContact CD1-CZ 3.73Å; Y89-F93 HydrophobicContact CD1-CZ 3.73Å; Y89-F93 HydrophobicContact CE1-CZ 4.36Å; Y89-F93 HydrophobicContact CG-CE2 4.17Å; Y89-F93 WeakPolarHBondContact O-CB 3.48Å; Y89-F93 WeakPolarHBondContact O-CD2 3.33Å; Y89-F93 WeakPolarHBondContact O-CG 3.3Å; Y89-F93 PolarHBondContact O-N 3.42Å
90	D	88	Confident	83	Confident	87 Å²	87	71 Å²	71	47%	0.465	37%	0.368	S	S	.	.	H	α-helix	trans	-75.2	-32.9	177.1	-74.9	-44	0	0	0	111.8	D88 A94 N95 K96	D88-D90 VanDerWaalsContact C-N 3.26Å; D88-D90 PolarHBondContact O-N 2.87Å; D88-D90 WeakPolarHBondContact OD1-CB 3.29Å; D88-D90 PolarHBondContact OD1-N 3.3Å; D90-A94 PolarHBondContact O-N 2.91Å; D90-N95 HydrophobicContact CB-CB 4.07Å; D90-N95 WeakPolarHBondContact O-CB 3.23Å; D90-N95 PolarHBondContact O-N 3.44Å; D90-N95 PolarHBondContact OD1-ND2 2.94Å; D90-K96 HydrophobicContact CB-CB 4.05Å; D90-K96 HydrophobicContact CB-CD 4.36Å; D90-K96 PolarHBondContact O-N 3.11Å
91	V	86.5	Confident	81.2	Confident	4 Å²	4	75.9 Å²	75.9	2%	0.024	40%	0.398	C	S	.	.	H	α-helix	trans	-70.3	-46.1	167.1	172.9	0	0	0	0	110.6	D88 F93 A94 K96 V98 V106 A111	D88-V91 HydrophobicContact CB-CB 4.24Å; D88-V91 HydrophobicContact CB-CG2 4.28Å; D88-V91 PolarHBondContact O-N 3.08Å; D88-V91 PolarHBondContact OD1-N 2.65Å; V91-F93 VanDerWaalsContact C-N 3.35Å; V91-F93 PolarHBondContact O-N 2.95Å; V91-A94 PolarHBondContact O-N 2.8Å; V91-A94 VanDerWaalsContact O-N 3.08Å; V91-K96 HydrophobicContact CG2-CB 4.44Å; V91-K96 HydrophobicContact CG2-CD 3.92Å; V91-K96 HydrophobicContact CG2-CG 4.17Å; V91-V98 HydrophobicContact CB-CG2 4.44Å; V91-V98 HydrophobicContact CG1-CG2 3.68Å; V91-V98 HydrophobicContact CG2-CG2 3.87Å; V91-V106 HydrophobicContact CG1-CG1 3.92Å; V91-A111 HydrophobicContact CG1-CB 4.21Å
92	L	87.1	Confident	79.1	Confident	72 Å²	72	80.6 Å²	80.6	38%	0.377	42%	0.422	S	S	.	.	H	α-helix	trans	-63	-36.7	-177.1	-171.9	62	0	0	0	113.6	V87 D88 Y89 A94 L108 A111	V87-L92 HydrophobicContact CG1-CD2 4.13Å; D88-L92 PolarHBondContact O-N 3.01Å; Y89-L92 HydrophobicContact CD1-CD2 4.12Å; Y89-L92 HydrophobicContact CE1-CD2 4.28Å; Y89-L92 PolarHBondContact O-N 2.86Å; L92-A94 VanDerWaalsContact C-N 3.34Å; L92-L108 HydrophobicContact CD1-CD1 4.38Å; L92-A111 HydrophobicContact CB-CB 3.92Å; L92-A111 HydrophobicContact CD1-CB 4.07Å
93	F	86.6	Confident	77.2	Confident	134 Å²	134	82.5 Å²	82.5	59%	0.588	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	7.6	176.3	-58.2	-41.5	0	0	0	113.5	Y89 V91 N95	Y89-F93 HydrophobicContact CD1-CD2 4.5Å; Y89-F93 AromaticContact CD1-CE2 3.67Å; Y89-F93 HydrophobicContact CD1-CE2 3.67Å; Y89-F93 AromaticContact CD1-CZ 3.73Å; Y89-F93 HydrophobicContact CD1-CZ 3.73Å; Y89-F93 HydrophobicContact CE1-CZ 4.36Å; Y89-F93 HydrophobicContact CG-CE2 4.17Å; Y89-F93 WeakPolarHBondContact O-CB 3.48Å; Y89-F93 WeakPolarHBondContact O-CD2 3.33Å; Y89-F93 WeakPolarHBondContact O-CG 3.3Å; Y89-F93 PolarHBondContact O-N 3.42Å; V91-F93 VanDerWaalsContact C-N 3.35Å; V91-F93 PolarHBondContact O-N 2.95Å; F93-N95 PolarHBondContact O-N 3.32Å
94	A	78.1	Confident	75.9	Confident	48 Å²	48	85.3 Å²	85.3	40%	0.397	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	21.8	-178.9	0	0	0	0	0	115.7	D90 V91 L92 K96	D90-A94 PolarHBondContact O-N 2.91Å; V91-A94 PolarHBondContact O-N 2.8Å; V91-A94 VanDerWaalsContact O-N 3.08Å; L92-A94 VanDerWaalsContact C-N 3.34Å; A94-K96 PolarHBondContact O-N 3.17Å
95	N	78.6	Confident	74.8	Confident	111 Å²	111	90.9 Å²	90.9	59%	0.594	48%	0.48	S	S	*	.	S	Bend	trans	-61.1	-26.8	165.7	-63.6	-22.7	0	0	0	111.4	D90 F93	D90-N95 HydrophobicContact CB-CB 4.07Å; D90-N95 WeakPolarHBondContact O-CB 3.23Å; D90-N95 PolarHBondContact O-N 3.44Å; D90-N95 PolarHBondContact OD1-ND2 2.94Å; F93-N95 PolarHBondContact O-N 3.32Å
96	K	73.5	Confident	74.1	Confident	106 Å²	106	93.7 Å²	93.7	46%	0.461	50%	0.497	S	S	.	.	S	Bend	trans	-131.4	103.7	-172.9	174.3	-179.5	160.8	-164.6	0	109.8	D88 D90 V91 A94 V98	D88-K96 IonicContact OD2-NZ 3.3Å; D88-K96 PolarHBondContact OD2-NZ 3.45Å; D90-K96 HydrophobicContact CB-CB 4.05Å; D90-K96 HydrophobicContact CB-CD 4.36Å; D90-K96 PolarHBondContact O-N 3.11Å; V91-K96 HydrophobicContact CG2-CB 4.44Å; V91-K96 HydrophobicContact CG2-CD 3.92Å; V91-K96 HydrophobicContact CG2-CG 4.17Å; A94-K96 PolarHBondContact O-N 3.17Å; K96-V98 PolarHBondContact O-N 3.46Å
97	F	64.6	Low	73.6	Confident	172 Å²	172	96.5 Å²	96.5	75%	0.754	51%	0.514	S	S	*	.			trans	-67.9	128.2	176.3	-62.8	-79.1	0	0	0	111.2
98	V	63.5	Low	73.1	Confident	61 Å²	61	101.4 Å²	101.4	37%	0.37	54%	0.539	S	S	.	.			trans	-88.5	119.3	170.9	-172.3	0	0	0	0	108.5	V91 K96 H100	V91-V98 HydrophobicContact CB-CG2 4.44Å; V91-V98 HydrophobicContact CG1-CG2 3.68Å; V91-V98 HydrophobicContact CG2-CG2 3.87Å; K96-V98 PolarHBondContact O-N 3.46Å; V98-H100 VanDerWaalsContact C-N 3.25Å; V98-H100 VanDerWaalsContact CG1-NE2 3.32Å; V98-H100 WeakPolarHBondContact CG1-NE2 3.19Å; V98-H100 PolarHBondContact O-N 2.96Å
99	N	58.8	Low	73	Confident	156 Å²	156	104.3 Å²	104.3	83%	0.834	56%	0.559	S	S	*	*			trans	-76.1	71	-177.9	-74.1	-14.4	0	0	0	112.1
100	H	57.1	Low	72.7	Confident	117 Å²	117	102.1 Å²	102.1	54%	0.542	55%	0.554	S	S	.	*			trans	-75.2	134.3	157.5	-65.6	-79.2	0	0	0	108.8	V98 D102	V98-H100 VanDerWaalsContact C-N 3.25Å; V98-H100 VanDerWaalsContact CG1-NE2 3.32Å; V98-H100 WeakPolarHBondContact CG1-NE2 3.19Å; V98-H100 PolarHBondContact O-N 2.96Å; H100-D102 PolarHBondContact O-N 3.03Å
101	T	54.2	Low	72.6	Confident	135 Å²	135	98.1 Å²	98.1	83%	0.828	53%	0.533	S	S	*	.	S	Bend	trans	-69.9	-16.1	-174.2	46.9	0	0	0	0	113.9
102	D	50.1	Low	72.9	Confident	119 Å²	119	101.3 Å²	101.3	64%	0.636	55%	0.549	S	S	*	.	S	Bend	trans	-137.2	123.6	-170.8	-60.2	-88.9	0	0	0	111.3	H100 S104	H100-D102 PolarHBondContact O-N 3.03Å; D102-S104 PolarHBondContact O-N 3.26Å
103	S	53.3	Low	73	Confident	109 Å²	109	99.7 Å²	99.7	76%	0.762	54%	0.541	S	S	*	.			trans	40.1	67.5	164.8	59.9	0	0	0	0	119.6	K105	S103-K105 PolarHBondContact O-N 2.69Å
104	S	66.4	Low	73.2	Confident	112 Å²	112	97.3 Å²	97.3	78%	0.783	54%	0.539	S	S	*	.				64.5	30	103.1	79	0	0	0	0	121.9	D102	D102-S104 PolarHBondContact O-N 3.26Å
105	K	67.4	Low	73.7	Confident	187 Å²	187	101.2 Å²	101.2	81%	0.813	55%	0.551	S	S	*	*			trans	-139.7	127.2	154.8	-68.2	-169.6	-179.8	-177.8	0	110.6	S103 T107	S103-K105 PolarHBondContact O-N 2.69Å; K105-T107 PolarHBondContact O-N 3.14Å
106	V	76.3	Confident	74.2	Confident	76 Å²	76	102.2 Å²	102.2	46%	0.461	56%	0.556	S	S	.	*			trans	-65.7	126.9	172.7	-179.1	0	0	0	0	108.7	V91 D110	V91-V106 HydrophobicContact CG1-CG1 3.92Å; V106-D110 HydrophobicContact CG1-CB 4.36Å
107	T	81.5	Confident	75.1	Confident	69 Å²	69	100.2 Å²	100.2	42%	0.423	55%	0.552	S	S	.	*			trans	-98.2	156.8	177.9	77.7	0	0	0	0	110.7	K105 P109 D110	K105-T107 PolarHBondContact O-N 3.14Å; T107-P109 VanDerWaalsContact C-N 3.35Å; T107-P109 WeakPolarHBondContact OG1-CD 3.34Å; T107-D110 WeakPolarHBondContact CA-OD2 3.22Å; T107-D110 VanDerWaalsContact CB-OD2 3.29Å; T107-D110 WeakPolarHBondContact CB-OD2 3.37Å; T107-D110 PolarHBondContact N-OD2 3.37Å; T107-D110 WeakPolarHBondContact O-CB 3.46Å; T107-D110 PolarHBondContact O-N 2.9Å; T107-D110 PolarHBondContact OG1-OD1 2.81Å; T107-D110 PolarHBondContact OG1-OD2 3.19Å
108	L	84.3	Confident	76.3	Confident	128 Å²	128	92.1 Å²	92.1	67%	0.67	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-58.4	-39	-178.3	-161.6	79	0	0	0	113.2	L92 D110 A111	L92-L108 HydrophobicContact CD1-CD1 4.38Å; L108-D110 VanDerWaalsContact C-N 3.3Å; L108-D110 PolarHBondContact O-N 2.91Å; L108-A111 PolarHBondContact O-N 3.39Å
109	P	86.5	Confident	77.7	Confident	88 Å²	88	92.6 Å²	92.6	57%	0.571	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-58.6	-31.9	172	-28.3	37.1	0	0	0	115.4	T107 A111 I112	T107-P109 VanDerWaalsContact C-N 3.35Å; T107-P109 WeakPolarHBondContact OG1-CD 3.34Å; P109-A111 PolarHBondContact O-N 2.84Å; P109-I112 PolarHBondContact O-N 2.89Å
110	D	83.8	Confident	79.3	Confident	54 Å²	54	87.2 Å²	87.2	29%	0.289	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-68.6	-23.5	-176.4	-51.1	-39.7	0	0	0	112.3	V106 T107 L108	V106-D110 HydrophobicContact CG1-CB 4.36Å; T107-D110 WeakPolarHBondContact CA-OD2 3.22Å; T107-D110 VanDerWaalsContact CB-OD2 3.29Å; T107-D110 WeakPolarHBondContact CB-OD2 3.37Å; T107-D110 PolarHBondContact N-OD2 3.37Å; T107-D110 WeakPolarHBondContact O-CB 3.46Å; T107-D110 PolarHBondContact O-N 2.9Å; T107-D110 PolarHBondContact OG1-OD1 2.81Å; T107-D110 PolarHBondContact OG1-OD2 3.19Å; L108-D110 VanDerWaalsContact C-N 3.3Å; L108-D110 PolarHBondContact O-N 2.91Å
111	A	86.9	Confident	80.9	Confident	2 Å²	2	85.8 Å²	85.8	2%	0.017	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-89.2	-1.7	173.1	0	0	0	0	0	113.6	V87 D88 V91 L92 L108 P109	V87-A111 CarbonylContact C-O 3.6Å; V87-A111 WeakPolarHBondContact CA-O 3.46Å; D88-A111 PolarHBondContact N-O 3.35Å; V91-A111 HydrophobicContact CG1-CB 4.21Å; L92-A111 HydrophobicContact CB-CB 3.92Å; L92-A111 HydrophobicContact CD1-CB 4.07Å; L108-A111 PolarHBondContact O-N 3.39Å; P109-A111 PolarHBondContact O-N 2.84Å
112	I	91.7	Very high	82.7	Confident	71 Å²	71	80.9 Å²	80.9	36%	0.364	46%	0.456	S	S	.	.	B	Isolated β-bridge	trans	-98.2	117.4	177.5	-61.7	172.1	0	0	0	108.7	F82 P109	F82-I112 HydrophobicContact CE2-CG2 4.16Å; F82-I112 HydrophobicContact CZ-CD1 4.19Å; F82-I112 HydrophobicContact CZ-CG1 4.21Å; F82-I112 HydrophobicContact CZ-CG2 4.22Å; P109-I112 PolarHBondContact O-N 2.89Å
113	L	89.7	Confident	84.6	Confident	38 Å²	38	84.3 Å²	84.3	20%	0.199	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-63.3	141.7	-179.9	-66.7	175.7	0	0	0	111.2	C86 D88 V117	C86-L113 PolarHBondContact O-N 3.22Å; D88-L113 HydrophobicContact CB-CD2 4.11Å; D88-L113 HydrophobicContact CB-CG 4.47Å; L113-V117 HydrophobicContact CD1-CG1 4.49Å
114	P	90.9	Very high	86.4	Confident	84 Å²	84	85.3 Å²	85.3	55%	0.545	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-52.5	142.8	172.7	-27.1	35	0	0	0	111.9	D116 V117 C118	P114-D116 PolarHBondContact O-N 3.49Å; P114-D116 VanDerWaalsContact O-N 3.09Å; P114-V117 HydrophobicContact CB-CG2 4.35Å; P114-V117 WeakPolarHBondContact O-CA 3.25Å; P114-V117 WeakPolarHBondContact O-CB 3.41Å; P114-V117 PolarHBondContact O-N 3.49Å; P114-C118 PolarHBondContact O-N 2.73Å
115	M	87.8	Confident	87.7	Confident	131 Å²	131	83 Å²	83	65%	0.645	44%	0.436	S	S	*	.	H	α-helix	trans	-54.4	-37	-171.7	-68.6	-61.4	-64.6	0	0	113.2	V117 N119	M115-V117 VanDerWaalsContact C-N 3.35Å; M115-N119 WeakPolarHBondContact O-CB 3.45Å; M115-N119 PolarHBondContact O-N 3.35Å; M115-N119 PolarHBondContact O-ND2 2.94Å
116	D	89.9	Confident	88.8	Confident	132 Å²	132	77.5 Å²	77.5	71%	0.706	43%	0.426	S	S	*	.	H	α-helix	trans	-65.7	-36.9	177.7	-55.1	-61.6	0	0	0	112.6	P114 A120	P114-D116 PolarHBondContact O-N 3.49Å; P114-D116 VanDerWaalsContact O-N 3.09Å; D116-A120 PolarHBondContact O-N 3.43Å
117	V	91.4	Very high	89.4	Confident	64 Å²	64	80.8 Å²	80.8	39%	0.388	43%	0.434	S	S	.	.	H	α-helix	trans	-74.4	-43.3	178.7	-178.2	0	0	0	0	110.8	L113 P114 M115 N119 A120 H121	L113-V117 HydrophobicContact CD1-CG1 4.49Å; P114-V117 HydrophobicContact CB-CG2 4.35Å; P114-V117 WeakPolarHBondContact O-CA 3.25Å; P114-V117 WeakPolarHBondContact O-CB 3.41Å; P114-V117 PolarHBondContact O-N 3.49Å; M115-V117 VanDerWaalsContact C-N 3.35Å; V117-N119 VanDerWaalsContact C-N 3.34Å; V117-N119 PolarHBondContact O-N 3.32Å; V117-A120 WeakPolarHBondContact O-CB 3.48Å; V117-A120 PolarHBondContact O-N 2.88Å; V117-H121 PolarHBondContact O-CD2 2.97Å; V117-H121 VanDerWaalsContact O-CD2 3.3Å; V117-H121 PolarHBondContact O-N 3.2Å
118	C	91.7	Very high	89.8	Confident	2 Å²	2	78.2 Å²	78.2	1%	0.014	42%	0.418	C	S	.	.	H	α-helix	trans	-65.4	-38.7	173.5	-171.4	0	0	0	0	111.8	N85 C86 P114 A120 H121 I122	N85-C118 PolarHBondContact O-SG 3.18Å; N85-C118 VanDerWaalsContact O-SG 3.35Å; C86-C118 WeakPolarHBondContact CA-SG 3.43Å; C86-C118 HydrophobicContact CB-CB 3.79Å; C86-C118 WeakPolarHBondContact CB-SG 3.43Å; C86-C118 PolarHBondContact N-SG 2.78Å; C86-C118 VanDerWaalsContact N-SG 3.42Å; C86-C118 WeakPolarHBondContact SG-CB 3.19Å; C86-C118 CovalentContact SG-SG 2.03Å; C86-C118 PolarHBondContact SG-SG 3.02Å; P114-C118 PolarHBondContact O-N 2.73Å; C118-A120 VanDerWaalsContact C-N 3.27Å; C118-A120 PolarHBondContact O-N 2.92Å; C118-H121 PolarHBondContact O-N 3.41Å; C118-I122 WeakPolarHBondContact O-CB 3.39Å; C118-I122 WeakPolarHBondContact O-CG1 3.5Å; C118-I122 PolarHBondContact O-N 3.14Å
119	N	91.3	Very high	90.1	Very high	71 Å²	71	75.1 Å²	75.1	38%	0.38	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-33.2	173.4	-80.9	-43.2	0	0	0	112.5	M115 V117 R123	M115-N119 WeakPolarHBondContact O-CB 3.45Å; M115-N119 PolarHBondContact O-N 3.35Å; M115-N119 PolarHBondContact O-ND2 2.94Å; V117-N119 VanDerWaalsContact C-N 3.34Å; V117-N119 PolarHBondContact O-N 3.32Å; N119-R123 WeakPolarHBondContact O-CB 3.36Å; N119-R123 WeakPolarHBondContact O-CD 3.42Å; N119-R123 WeakPolarHBondContact O-CG 3.39Å; N119-R123 PolarHBondContact O-N 2.87Å
120	A	92.2	Very high	90.3	Very high	42 Å²	42	76.8 Å²	76.8	35%	0.347	40%	0.4	S	S	.	.	H	α-helix	trans	-66.3	-53.8	171.1	0	0	0	0	0	111.1	D116 V117 C118 I122 R123 D124	D116-A120 PolarHBondContact O-N 3.43Å; V117-A120 WeakPolarHBondContact O-CB 3.48Å; V117-A120 PolarHBondContact O-N 2.88Å; C118-A120 VanDerWaalsContact C-N 3.27Å; C118-A120 PolarHBondContact O-N 2.92Å; A120-I122 VanDerWaalsContact C-N 3.3Å; A120-I122 PolarHBondContact O-N 2.89Å; A120-R123 CarbonylContact O-C 3.6Å; A120-R123 WeakPolarHBondContact O-CA 3.14Å; A120-R123 WeakPolarHBondContact O-CB 3.47Å; A120-R123 PolarHBondContact O-N 2.67Å; A120-D124 PolarHBondContact O-N 3.04Å
121	H	90.9	Very high	90.5	Very high	88 Å²	88	76.6 Å²	76.6	41%	0.407	40%	0.401	S	S	.	.	H	α-helix	trans	-56.8	-39.8	178.8	-73.1	-55.5	0	0	0	113.6	V117 C118 R123 D124 N125	V117-H121 PolarHBondContact O-CD2 2.97Å; V117-H121 VanDerWaalsContact O-CD2 3.3Å; V117-H121 PolarHBondContact O-N 3.2Å; C118-H121 PolarHBondContact O-N 3.41Å; H121-R123 VanDerWaalsContact C-N 3.3Å; H121-R123 PolarHBondContact O-N 2.84Å; H121-D124 PolarHBondContact O-N 3.29Å; H121-N125 VanDerWaalsContact O-CB 3.23Å; H121-N125 WeakPolarHBondContact O-CB 3.28Å; H121-N125 PolarHBondContact O-N 2.79Å
122	I	92.1	Very high	90.7	Very high	32 Å²	32	79.5 Å²	79.5	16%	0.164	42%	0.416	C	S	.	.	H	α-helix	trans	-66.4	-31.4	175	-68.4	169.7	0	0	0	111.8	V81 N85 C118 A120 V128 I129 L132	V81-I122 HydrophobicContact CG1-CD1 3.95Å; V81-I122 HydrophobicContact CG1-CG1 4.22Å; N85-I122 HydrophobicContact CB-CD1 4.42Å; N85-I122 HydrophobicContact CB-CG1 3.73Å; C118-I122 WeakPolarHBondContact O-CB 3.39Å; C118-I122 WeakPolarHBondContact O-CG1 3.5Å; C118-I122 PolarHBondContact O-N 3.14Å; A120-I122 VanDerWaalsContact C-N 3.3Å; A120-I122 PolarHBondContact O-N 2.89Å; I122-V128 HydrophobicContact CG2-CG1 4.27Å; I122-I129 VanDerWaalsContact O-CG1 3.28Å; I122-I129 WeakPolarHBondContact O-CG1 3.26Å; I122-L132 HydrophobicContact CG2-CD1 4.1Å
123	R	90.6	Very high	90.8	Very high	190 Å²	190	81 Å²	81	72%	0.717	42%	0.423	S	S	*	.	H	α-helix	trans	-80	-32.2	177.2	-75.5	172.1	-177.6	-156.7	2	113.5	N119 A120 H121 I129	N119-R123 WeakPolarHBondContact O-CB 3.36Å; N119-R123 WeakPolarHBondContact O-CD 3.42Å; N119-R123 WeakPolarHBondContact O-CG 3.39Å; N119-R123 PolarHBondContact O-N 2.87Å; A120-R123 CarbonylContact O-C 3.6Å; A120-R123 WeakPolarHBondContact O-CA 3.14Å; A120-R123 WeakPolarHBondContact O-CB 3.47Å; A120-R123 PolarHBondContact O-N 2.67Å; H121-R123 VanDerWaalsContact C-N 3.3Å; H121-R123 PolarHBondContact O-N 2.84Å; R123-I129 WeakPolarHBondContact O-CD1 3.49Å
124	D	92	Very high	90.9	Very high	131 Å²	131	82 Å²	82	70%	0.701	43%	0.428	S	S	*	.	H	α-helix	trans	-76.3	-30.9	176.5	-62.3	-28.7	0	0	0	111.1	A120 H121 A126	A120-D124 PolarHBondContact O-N 3.04Å; H121-D124 PolarHBondContact O-N 3.29Å; D124-A126 PolarHBondContact O-N 3.17Å
125	N	92.6	Very high	91	Very high	62 Å²	62	79.3 Å²	79.3	33%	0.332	41%	0.412	S	S	.	.			trans	-81.9	80.2	179.1	-166.9	-20.1	0	0	0	112.5	N85 H121 F127 V128 I129	N85-N125 PolarHBondContact OD1-ND2 3.45Å; H121-N125 VanDerWaalsContact O-CB 3.23Å; H121-N125 WeakPolarHBondContact O-CB 3.28Å; H121-N125 PolarHBondContact O-N 2.79Å; N125-F127 PolarHBondContact O-N 2.88Å; N125-F127 PolarHBondContact OD1-N 3.2Å; N125-V128 HydrophobicContact CB-CB 4.14Å; N125-V128 HydrophobicContact CB-CG2 4.21Å; N125-V128 VanDerWaalsContact CG-CG2 3.5Å; N125-V128 VanDerWaalsContact ND2-CG2 3.3Å; N125-V128 WeakPolarHBondContact ND2-CG2 3.19Å; N125-V128 PolarHBondContact O-N 3.24Å; N125-V128 PolarHBondContact OD1-N 2.82Å; N125-I129 PolarHBondContact O-N 2.99Å; N125-I129 VanDerWaalsContact O-N 3.16Å
126	A	90.5	Very high	91.3	Very high	73 Å²	73	74.8 Å²	74.8	60%	0.603	40%	0.399	S	S	*	.	H	α-helix	trans	-52.7	-28.5	179.5	0	0	0	0	0	114.9	D124 F130	D124-A126 PolarHBondContact O-N 3.17Å; A126-F130 WeakPolarHBondContact O-CB 3.33Å; A126-F130 PolarHBondContact O-N 2.78Å
127	F	88.8	Confident	91.6	Very high	144 Å²	144	73.1 Å²	73.1	63%	0.632	39%	0.393	S	S	*	.	H	α-helix	trans	-69.6	-42.3	174.9	175.9	-99.3	0	0	0	112	N125 I129 F130 V131	N125-F127 PolarHBondContact O-N 2.88Å; N125-F127 PolarHBondContact OD1-N 3.2Å; F127-I129 VanDerWaalsContact C-N 3.35Å; F127-F130 PolarHBondContact O-N 3.42Å; F127-V131 HydrophobicContact CD1-CG2 4.48Å; F127-V131 HydrophobicContact CE1-CG2 4.05Å; F127-V131 HydrophobicContact CE2-CG2 4.31Å; F127-V131 HydrophobicContact CZ-CG2 3.95Å; F127-V131 WeakPolarHBondContact O-CG2 3.36Å; F127-V131 PolarHBondContact O-N 2.68Å
128	V	89.8	Confident	91.7	Very high	16 Å²	16	75.5 Å²	75.5	10%	0.097	40%	0.399	C	S	.	.	H	α-helix	trans	-63.6	-41	174.8	168.8	0	0	0	0	110.8	V81 I122 N125 F130 V131 L132	V81-V128 HydrophobicContact CG1-CG1 3.85Å; V81-V128 HydrophobicContact CG2-CG1 4.15Å; I122-V128 HydrophobicContact CG2-CG1 4.27Å; N125-V128 HydrophobicContact CB-CB 4.14Å; N125-V128 HydrophobicContact CB-CG2 4.21Å; N125-V128 VanDerWaalsContact CG-CG2 3.5Å; N125-V128 VanDerWaalsContact ND2-CG2 3.3Å; N125-V128 WeakPolarHBondContact ND2-CG2 3.19Å; N125-V128 PolarHBondContact O-N 3.24Å; N125-V128 PolarHBondContact OD1-N 2.82Å; V128-F130 PolarHBondContact O-N 2.95Å; V128-V131 PolarHBondContact O-N 3.13Å; V128-L132 HydrophobicContact CG1-CD1 3.91Å; V128-L132 HydrophobicContact CG1-CG 4.36Å; V128-L132 WeakPolarHBondContact O-CB 3.2Å; V128-L132 VanDerWaalsContact O-CG 3.32Å; V128-L132 WeakPolarHBondContact O-CG 3.38Å; V128-L132 PolarHBondContact O-N 3.18Å
129	I	91.4	Very high	91.9	Very high	63 Å²	63	79.2 Å²	79.2	32%	0.323	41%	0.412	S	S	.	.	H	α-helix	trans	-58.9	-47.6	173.3	-58.1	177.8	0	0	0	111	I122 R123 N125 F127 V131 L132 I133	I122-I129 VanDerWaalsContact O-CG1 3.28Å; I122-I129 WeakPolarHBondContact O-CG1 3.26Å; R123-I129 WeakPolarHBondContact O-CD1 3.49Å; N125-I129 PolarHBondContact O-N 2.99Å; N125-I129 VanDerWaalsContact O-N 3.16Å; F127-I129 VanDerWaalsContact C-N 3.35Å; I129-V131 PolarHBondContact O-N 2.78Å; I129-L132 PolarHBondContact O-N 3.35Å; I129-I133 HydrophobicContact CG2-CD1 3.78Å; I129-I133 HydrophobicContact CG2-CG1 4.31Å; I129-I133 WeakPolarHBondContact O-CG1 3.36Å; I129-I133 PolarHBondContact O-N 2.81Å
130	F	90.2	Very high	92.1	Very high	123 Å²	123	80.3 Å²	80.3	54%	0.539	42%	0.418	S	S	.	.	H	α-helix	trans	-60.1	-43.4	-179.9	177.8	-104.5	0	0	0	112.3	A126 F127 V128 I133 I134	A126-F130 WeakPolarHBondContact O-CB 3.33Å; A126-F130 PolarHBondContact O-N 2.78Å; F127-F130 PolarHBondContact O-N 3.42Å; V128-F130 PolarHBondContact O-N 2.95Å; F130-I133 PolarHBondContact O-N 3.41Å; F130-I134 HydrophobicContact CD1-CD1 4.09Å; F130-I134 HydrophobicContact CE1-CD1 3.54Å; F130-I134 HydrophobicContact CE2-CD1 4.01Å; F130-I134 HydrophobicContact CZ-CD1 3.5Å; F130-I134 PolarHBondContact O-N 2.91Å; F130-I134 VanDerWaalsContact O-N 3.13Å
131	V	88.4	Confident	92.3	Very high	50 Å²	50	83.9 Å²	83.9	30%	0.303	43%	0.427	S	S	.	.	H	α-helix	trans	-63.3	-46.4	174	173.4	0	0	0	0	111.1	F127 V128 I129 I133 I134 S135	F127-V131 HydrophobicContact CD1-CG2 4.48Å; F127-V131 HydrophobicContact CE1-CG2 4.05Å; F127-V131 HydrophobicContact CE2-CG2 4.31Å; F127-V131 HydrophobicContact CZ-CG2 3.95Å; F127-V131 WeakPolarHBondContact O-CG2 3.36Å; F127-V131 PolarHBondContact O-N 2.68Å; V128-V131 PolarHBondContact O-N 3.13Å; I129-V131 PolarHBondContact O-N 2.78Å; V131-I133 VanDerWaalsContact C-N 3.32Å; V131-I133 PolarHBondContact O-N 2.67Å; V131-I134 PolarHBondContact O-N 3.42Å; V131-S135 WeakPolarHBondContact O-CB 3.47Å; V131-S135 PolarHBondContact O-N 3.3Å; V131-S135 PolarHBondContact O-OG 2.86Å
132	L	91.8	Very high	92.5	Very high	62 Å²	62	82.5 Å²	82.5	33%	0.325	42%	0.418	S	S	.	.	H	α-helix	trans	-59.6	-39.3	177.4	-77.5	171.5	0	0	0	112.7	V77 V81 I122 V128 I129 G136	V77-L132 HydrophobicContact CG1-CD2 4.08Å; V81-L132 HydrophobicContact CG1-CD1 4.43Å; V81-L132 HydrophobicContact CG2-CD2 4.07Å; V81-L132 HydrophobicContact CG2-CG 4.36Å; I122-L132 HydrophobicContact CG2-CD1 4.1Å; V128-L132 HydrophobicContact CG1-CD1 3.91Å; V128-L132 HydrophobicContact CG1-CG 4.36Å; V128-L132 WeakPolarHBondContact O-CB 3.2Å; V128-L132 VanDerWaalsContact O-CG 3.32Å; V128-L132 WeakPolarHBondContact O-CG 3.38Å; V128-L132 PolarHBondContact O-N 3.18Å; I129-L132 PolarHBondContact O-N 3.35Å; L132-G136 PolarHBondContact O-N 3.11Å
133	I	93.4	Very high	92.7	Very high	102 Å²	102	83.1 Å²	83.1	52%	0.523	42%	0.421	S	S	.	.	H	α-helix	trans	-63.8	-48.2	175.6	-70.8	169	0	0	0	110.6	I129 F130 V131 G136 V137	I129-I133 HydrophobicContact CG2-CD1 3.78Å; I129-I133 HydrophobicContact CG2-CG1 4.31Å; I129-I133 WeakPolarHBondContact O-CG1 3.36Å; I129-I133 PolarHBondContact O-N 2.81Å; F130-I133 PolarHBondContact O-N 3.41Å; V131-I133 VanDerWaalsContact C-N 3.32Å; V131-I133 PolarHBondContact O-N 2.67Å; I133-G136 PolarHBondContact O-N 2.83Å; I133-V137 WeakPolarHBondContact O-CG2 3.35Å; I133-V137 PolarHBondContact O-N 3.11Å
134	I	91.4	Very high	93	Very high	60 Å²	60	78.3 Å²	78.3	31%	0.308	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-46.7	179.3	-69.8	174.7	0	0	0	111	F130 V131 G136 V137 F138 V299	F130-I134 HydrophobicContact CD1-CD1 4.09Å; F130-I134 HydrophobicContact CE1-CD1 3.54Å; F130-I134 HydrophobicContact CE2-CD1 4.01Å; F130-I134 HydrophobicContact CZ-CD1 3.5Å; F130-I134 PolarHBondContact O-N 2.91Å; F130-I134 VanDerWaalsContact O-N 3.13Å; V131-I134 PolarHBondContact O-N 3.42Å; I134-G136 VanDerWaalsContact C-N 3.33Å; I134-G136 PolarHBondContact O-N 3.39Å; I134-V137 PolarHBondContact O-N 2.75Å; I134-F138 WeakPolarHBondContact O-CB 3.36Å; I134-F138 PolarHBondContact O-N 2.91Å; I134-V299 HydrophobicContact CG2-CG1 4.19Å
135	S	92.2	Very high	93.1	Very high	27 Å²	27	78 Å²	78	19%	0.189	41%	0.405	C	S	.	.	H	α-helix	trans	-62.1	-39	175.9	-67.9	0	0	0	0	112.2	V131 F138 W139	V131-S135 WeakPolarHBondContact O-CB 3.47Å; V131-S135 PolarHBondContact O-N 3.3Å; V131-S135 PolarHBondContact O-OG 2.86Å; S135-F138 PolarHBondContact O-N 2.97Å; S135-W139 VanDerWaalsContact O-CB 3.22Å; S135-W139 WeakPolarHBondContact O-CB 3.39Å; S135-W139 PolarHBondContact O-N 2.67Å
136	G	94.7	Very high	93.3	Very high	37 Å²	37	76.2 Å²	76.2	38%	0.381	40%	0.395	S	S	.	.	H	α-helix	trans	-65.6	-45.3	176.9	0	0	0	0	0	113	L132 I133 I134 W139 L140	L132-G136 PolarHBondContact O-N 3.11Å; I133-G136 PolarHBondContact O-N 2.83Å; I134-G136 VanDerWaalsContact C-N 3.33Å; I134-G136 PolarHBondContact O-N 3.39Å; G136-W139 PolarHBondContact O-N 2.88Å; G136-L140 VanDerWaalsContact O-CB 3.31Å; G136-L140 WeakPolarHBondContact O-CB 3.3Å; G136-L140 PolarHBondContact O-N 3.02Å
137	V	95.3	Very high	93.5	Very high	96 Å²	96	77.1 Å²	77.1	58%	0.582	39%	0.389	S	S	*	.	H	α-helix	trans	-63.4	-43.1	174.9	171.5	0	0	0	0	111.1	I133 I134 L140 H141	I133-V137 WeakPolarHBondContact O-CG2 3.35Å; I133-V137 PolarHBondContact O-N 3.11Å; I134-V137 PolarHBondContact O-N 2.75Å; V137-L140 PolarHBondContact O-N 3.13Å; V137-H141 WeakPolarHBondContact O-CB 3.21Å; V137-H141 PolarHBondContact O-N 3.05Å
138	F	93.8	Very high	93.9	Very high	115 Å²	115	76.5 Å²	76.5	50%	0.504	38%	0.384	S	S	.	.	H	α-helix	trans	-64.8	-42.7	176.9	179.3	-107.4	0	0	0	112.5	L73 I134 S135 H141 R142	L73-F138 HydrophobicContact CD2-CD1 3.85Å; L73-F138 HydrophobicContact CD2-CE1 3.87Å; I134-F138 WeakPolarHBondContact O-CB 3.36Å; I134-F138 PolarHBondContact O-N 2.91Å; S135-F138 PolarHBondContact O-N 2.97Å; F138-H141 PolarHBondContact O-N 3.09Å; F138-R142 WeakPolarHBondContact O-CB 3.03Å; F138-R142 PolarHBondContact O-N 2.88Å
139	W	95.9	Very high	94.1	Very high	79 Å²	79	77.6 Å²	77.6	30%	0.299	39%	0.389	S	S	.	.	H	α-helix	trans	-64.4	-43.1	175.7	-177.1	94.6	0	0	0	111.6	L70 L73 S135 G136 R142 L143	L70-W139 PolarHBondContact O-NE1 2.98Å; L73-W139 HydrophobicContact CD2-CB 4.18Å; L73-W139 HydrophobicContact CD2-CG 4.42Å; S135-W139 VanDerWaalsContact O-CB 3.22Å; S135-W139 WeakPolarHBondContact O-CB 3.39Å; S135-W139 PolarHBondContact O-N 2.67Å; G136-W139 PolarHBondContact O-N 2.88Å; W139-R142 CarbonylContact O-C 3.55Å; W139-R142 PolarHBondContact O-N 3.02Å; W139-L143 HydrophobicContact CH2-CD2 3.81Å; W139-L143 HydrophobicContact CZ3-CB 4.48Å; W139-L143 HydrophobicContact CZ3-CD2 3.76Å; W139-L143 WeakPolarHBondContact O-CB 3.45Å; W139-L143 PolarHBondContact O-N 2.94Å
140	L	96.5	Very high	94.2	Very high	95 Å²	95	76.6 Å²	76.6	50%	0.497	39%	0.386	S	S	.	.	H	α-helix	trans	-63.3	-44.9	176.6	179.1	60.7	0	0	0	111.8	G136 V137 R142 L143 V144	G136-L140 VanDerWaalsContact O-CB 3.31Å; G136-L140 WeakPolarHBondContact O-CB 3.3Å; G136-L140 PolarHBondContact O-N 3.02Å; V137-L140 PolarHBondContact O-N 3.13Å; L140-R142 VanDerWaalsContact C-N 3.31Å; L140-R142 PolarHBondContact O-N 3.02Å; L140-L143 WeakPolarHBondContact O-CB 3.42Å; L140-L143 PolarHBondContact O-N 2.69Å; L140-V144 HydrophobicContact CD1-CG2 4.44Å; L140-V144 WeakPolarHBondContact O-CG2 3.48Å; L140-V144 PolarHBondContact O-N 3.11Å
141	H	95.6	Very high	94.4	Very high	117 Å²	117	75 Å²	75	54%	0.542	39%	0.389	S	S	.	.	H	α-helix	trans	-58.7	-42.3	172.4	163.5	-105.4	0	0	0	111.6	V137 F138 V144 K145	V137-H141 WeakPolarHBondContact O-CB 3.21Å; V137-H141 PolarHBondContact O-N 3.05Å; F138-H141 PolarHBondContact O-N 3.09Å; H141-V144 PolarHBondContact O-N 3.27Å; H141-K145 WeakPolarHBondContact O-CB 3.25Å; H141-K145 PolarHBondContact O-N 2.78Å
142	R	95.5	Very high	94.6	Very high	59 Å²	59	73.3 Å²	73.3	22%	0.223	38%	0.379	C	S	.	.	H	α-helix	trans	-64.9	-39.3	175.9	-164.8	-177	172.9	174.3	8.8	111.9	E66 E69 L70 F138 W139 L140 K145 F146	E66-R142 IonicContact OE2-NH2 2.73Å; E69-R142 VanDerWaalsContact CB-NH2 3.27Å; E69-R142 PolarHBondContact O-NH1 3.09Å; E69-R142 VanDerWaalsContact O-NH1 3.17Å; E69-R142 IonicContact OE2-CZ 3.42Å; E69-R142 IonicContact OE2-NH1 3.7Å; E69-R142 IonicContact OE2-NH2 2.64Å; E69-R142 PolarHBondContact OE2-NH2 3.01Å; L70-R142 HydrophobicContact CD2-CB 4.01Å; L70-R142 HydrophobicContact CD2-CG 3.76Å; F138-R142 WeakPolarHBondContact O-CB 3.03Å; F138-R142 PolarHBondContact O-N 2.88Å; W139-R142 CarbonylContact O-C 3.55Å; W139-R142 PolarHBondContact O-N 3.02Å; L140-R142 VanDerWaalsContact C-N 3.31Å; L140-R142 PolarHBondContact O-N 3.02Å; R142-K145 PolarHBondContact O-N 2.96Å; R142-F146 WeakPolarHBondContact O-CB 3.29Å; R142-F146 PolarHBondContact O-N 3.15Å
143	L	96.4	Very high	94.7	Very high	44 Å²	44	71.8 Å²	71.8	23%	0.23	37%	0.369	C	S	.	.	H	α-helix	trans	-63.6	-46.8	175.5	-179.9	68.5	0	0	0	111.7	L70 W139 L140 K145 F146 L147	L70-L143 HydrophobicContact CD1-CD1 4.25Å; W139-L143 HydrophobicContact CH2-CD2 3.81Å; W139-L143 HydrophobicContact CZ3-CB 4.48Å; W139-L143 HydrophobicContact CZ3-CD2 3.76Å; W139-L143 WeakPolarHBondContact O-CB 3.45Å; W139-L143 PolarHBondContact O-N 2.94Å; L140-L143 WeakPolarHBondContact O-CB 3.42Å; L140-L143 PolarHBondContact O-N 2.69Å; L143-K145 VanDerWaalsContact C-N 3.34Å; L143-K145 PolarHBondContact O-N 3.43Å; L143-F146 HydrophobicContact CD1-CD1 4.17Å; L143-F146 WeakPolarHBondContact O-CB 3.4Å; L143-F146 PolarHBondContact O-N 2.98Å; L143-F146 VanDerWaalsContact O-N 3.16Å; L143-L147 HydrophobicContact CD1-CG 4.48Å; L143-L147 HydrophobicContact CG-CD1 4.21Å; L143-L147 WeakPolarHBondContact O-CG 3.38Å; L143-L147 PolarHBondContact O-N 3.45Å
144	V	97	Very high	94.8	Very high	89 Å²	89	73.6 Å²	73.6	54%	0.539	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-44	176.7	171.9	0	0	0	0	110.9	L140 H141 F146 L147 Y148	L140-V144 HydrophobicContact CD1-CG2 4.44Å; L140-V144 WeakPolarHBondContact O-CG2 3.48Å; L140-V144 PolarHBondContact O-N 3.11Å; H141-V144 PolarHBondContact O-N 3.27Å; V144-F146 VanDerWaalsContact C-N 3.34Å; V144-F146 PolarHBondContact O-N 2.9Å; V144-L147 PolarHBondContact O-N 2.86Å; V144-Y148 PolarHBondContact O-N 2.9Å
145	K	94.8	Very high	94.9	Very high	124 Å²	124	74.6 Å²	74.6	54%	0.539	37%	0.373	S	S	.	.	H	α-helix	trans	-62.7	-38.9	174.4	-177.8	173.1	178.9	175.1	0	112.5	H141 R142 L143 N149	H141-K145 WeakPolarHBondContact O-CB 3.25Å; H141-K145 PolarHBondContact O-N 2.78Å; R142-K145 PolarHBondContact O-N 2.96Å; L143-K145 VanDerWaalsContact C-N 3.34Å; L143-K145 PolarHBondContact O-N 3.43Å; K145-N149 WeakPolarHBondContact O-CB 3.05Å; K145-N149 VanDerWaalsContact O-CG 3.3Å; K145-N149 PolarHBondContact O-N 2.95Å
146	F	95.4	Very high	94.9	Very high	25 Å²	25	73.4 Å²	73.4	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-62.9	-49.4	174.4	163	-99.4	0	0	0	111.5	L63 E66 I67 L70 R142 L143 V144 Y148 N149 V150	L63-F146 HydrophobicContact CD1-CE2 3.91Å; L63-F146 HydrophobicContact CD1-CZ 3.69Å; E66-F146 HydrophobicContact CB-CD2 3.69Å; E66-F146 HydrophobicContact CB-CE2 3.74Å; I67-F146 HydrophobicContact CD1-CZ 4.14Å; I67-F146 HydrophobicContact CG1-CE1 4.41Å; I67-F146 HydrophobicContact CG1-CE2 3.98Å; I67-F146 HydrophobicContact CG1-CZ 3.54Å; L70-F146 HydrophobicContact CD1-CB 3.9Å; L70-F146 HydrophobicContact CD1-CD1 3.8Å; L70-F146 HydrophobicContact CD1-CD2 4.11Å; L70-F146 HydrophobicContact CD1-CE1 4.35Å; L70-F146 HydrophobicContact CD1-CG 3.66Å; R142-F146 WeakPolarHBondContact O-CB 3.29Å; R142-F146 PolarHBondContact O-N 3.15Å; L143-F146 HydrophobicContact CD1-CD1 4.17Å; L143-F146 WeakPolarHBondContact O-CB 3.4Å; L143-F146 PolarHBondContact O-N 2.98Å; L143-F146 VanDerWaalsContact O-N 3.16Å; V144-F146 VanDerWaalsContact C-N 3.34Å; V144-F146 PolarHBondContact O-N 2.9Å; F146-Y148 PolarHBondContact O-N 3.25Å; F146-N149 CarbonylContact O-C 3.59Å; F146-N149 WeakPolarHBondContact O-CB 2.93Å; F146-N149 PolarHBondContact O-N 2.95Å; F146-N149 VanDerWaalsContact O-N 3.14Å; F146-V150 HydrophobicContact CD1-CG2 4.47Å; F146-V150 HydrophobicContact CD2-CG2 4.06Å; F146-V150 HydrophobicContact CE1-CG2 4.1Å; F146-V150 HydrophobicContact CE2-CG2 3.65Å; F146-V150 HydrophobicContact CG-CG2 4.46Å; F146-V150 HydrophobicContact CZ-CG2 3.67Å; F146-V150 WeakPolarHBondContact O-CG2 3.46Å; F146-V150 PolarHBondContact O-N 2.97Å
147	L	96.2	Very high	94.9	Very high	93 Å²	93	74.9 Å²	74.9	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-59.7	-45.6	178.9	-68.3	171.1	0	0	0	111.8	L143 V144 N149 V150 C151	L143-L147 HydrophobicContact CD1-CG 4.48Å; L143-L147 HydrophobicContact CG-CD1 4.21Å; L143-L147 WeakPolarHBondContact O-CG 3.38Å; L143-L147 PolarHBondContact O-N 3.45Å; V144-L147 PolarHBondContact O-N 2.86Å; L147-N149 PolarHBondContact O-N 3.38Å; L147-V150 PolarHBondContact O-N 3.34Å; L147-C151 PolarHBondContact O-N 2.91Å; L147-C151 VanDerWaalsContact O-N 3.14Å; L147-C151 PolarHBondContact O-SG 2.77Å
148	Y	95.5	Very high	94.8	Very high	131 Å²	131	71.7 Å²	71.7	51%	0.514	34%	0.34	S	S	.	.	H	α-helix	trans	-58.5	-46.7	172.9	170.8	-99.6	0	0	0	112.1	R49 V144 F146 V150 C151 C152	R49-Y148 PolarHBondContact NH2-OH 2.95Å; V144-Y148 PolarHBondContact O-N 2.9Å; F146-Y148 PolarHBondContact O-N 3.25Å; Y148-V150 VanDerWaalsContact C-N 3.33Å; Y148-V150 PolarHBondContact O-N 3.33Å; Y148-C151 PolarHBondContact O-N 3.43Å; Y148-C152 VanDerWaalsContact CZ-SG 3.56Å; Y148-C152 PolarHBondContact O-N 3.08Å; Y148-C152 VanDerWaalsContact O-N 3.1Å
149	N	93.8	Very high	94.8	Very high	39 Å²	39	66.2 Å²	66.2	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-41	175.9	-82.5	-12.7	0	0	0	112	K145 F146 L147 C151 C152 Y153	K145-N149 WeakPolarHBondContact O-CB 3.05Å; K145-N149 VanDerWaalsContact O-CG 3.3Å; K145-N149 PolarHBondContact O-N 2.95Å; F146-N149 CarbonylContact O-C 3.59Å; F146-N149 WeakPolarHBondContact O-CB 2.93Å; F146-N149 PolarHBondContact O-N 2.95Å; F146-N149 VanDerWaalsContact O-N 3.14Å; L147-N149 PolarHBondContact O-N 3.38Å; N149-C151 VanDerWaalsContact C-N 3.35Å; N149-C151 PolarHBondContact O-N 3.2Å; N149-C152 PolarHBondContact O-N 3.35Å; N149-Y153 HydrophobicContact CB-CD2 4.17Å; N149-Y153 HydrophobicContact CB-CE2 4.29Å; N149-Y153 WeakPolarHBondContact O-CB 3.46Å; N149-Y153 WeakPolarHBondContact O-CD2 3.23Å; N149-Y153 PolarHBondContact O-N 3.47Å
150	V	94.8	Very high	94.6	Very high	42 Å²	42	62.5 Å²	62.5	26%	0.255	30%	0.302	S	S	.	.	H	α-helix	trans	-60.2	-43.8	178.1	167.8	0	0	0	0	111.1	F59 L63 F146 L147 Y148 Y153 W154	F59-V150 HydrophobicContact CZ-CG1 4.28Å; L63-V150 HydrophobicContact CD1-CG1 4.41Å; L63-V150 HydrophobicContact CD1-CG2 3.57Å; F146-V150 HydrophobicContact CD1-CG2 4.47Å; F146-V150 HydrophobicContact CD2-CG2 4.06Å; F146-V150 HydrophobicContact CE1-CG2 4.1Å; F146-V150 HydrophobicContact CE2-CG2 3.65Å; F146-V150 HydrophobicContact CG-CG2 4.46Å; F146-V150 HydrophobicContact CZ-CG2 3.67Å; F146-V150 WeakPolarHBondContact O-CG2 3.46Å; F146-V150 PolarHBondContact O-N 2.97Å; L147-V150 PolarHBondContact O-N 3.34Å; Y148-V150 VanDerWaalsContact C-N 3.33Å; Y148-V150 PolarHBondContact O-N 3.33Å; V150-Y153 PolarHBondContact O-N 3.21Å; V150-W154 WeakPolarHBondContact O-CB 3.36Å; V150-W154 PolarHBondContact O-N 3.45Å
151	C	94.3	Very high	94.5	Very high	90 Å²	90	61 Å²	61	61%	0.608	29%	0.294	S	S	*	.	H	α-helix	trans	-59.4	-50.3	173.8	-65.1	0	0	0	0	111.9	L147 Y148 N149 Y153 W154 E155	L147-C151 PolarHBondContact O-N 2.91Å; L147-C151 VanDerWaalsContact O-N 3.14Å; L147-C151 PolarHBondContact O-SG 2.77Å; Y148-C151 PolarHBondContact O-N 3.43Å; N149-C151 VanDerWaalsContact C-N 3.35Å; N149-C151 PolarHBondContact O-N 3.2Å; C151-Y153 PolarHBondContact O-N 3Å; C151-W154 WeakPolarHBondContact O-CB 3.06Å; C151-W154 PolarHBondContact O-N 3.5Å; C151-E155 PolarHBondContact O-N 2.81Å
152	C	92.6	Very high	94.3	Very high	14 Å²	14	60.3 Å²	60.3	10%	0.095	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-36	179.1	-66.6	0	0	0	0	113.4	R49 Y148 N149 W154 E155 I156	R49-C152 PolarHBondContact NH2-SG 2.77Å; R49-C152 VanDerWaalsContact NH2-SG 3.37Å; Y148-C152 VanDerWaalsContact CZ-SG 3.56Å; Y148-C152 PolarHBondContact O-N 3.08Å; Y148-C152 VanDerWaalsContact O-N 3.1Å; N149-C152 PolarHBondContact O-N 3.35Å; C152-W154 VanDerWaalsContact C-N 3.33Å; C152-E155 WeakPolarHBondContact O-CB 3.16Å; C152-E155 PolarHBondContact O-N 2.96Å; C152-I156 WeakPolarHBondContact O-CG1 3.43Å; C152-I156 PolarHBondContact O-N 3.37Å; C152-I156 VanDerWaalsContact O-N 3.15Å
153	Y	94.7	Very high	94	Very high	29 Å²	29	57.6 Å²	57.6	11%	0.114	28%	0.284	C	S	.	.	H	α-helix	trans	-75.9	-21.6	176.6	-79.7	-66.4	0	0	0	113.1	R49 N52 M62 N149 V150 C151 E155 I156 R157	R49-Y153 HydrophobicContact CB-CD1 4.25Å; R49-Y153 HydrophobicContact CB-CE1 3.63Å; R49-Y153 HydrophobicContact CG-CE1 3.85Å; R49-Y153 WeakPolarHBondContact O-CE1 3.37Å; N52-Y153 PolarHBondContact ND2-OH 3.11Å; M62-Y153 HydrophobicContact CE-CD1 3.51Å; M62-Y153 HydrophobicContact CE-CD2 3.57Å; M62-Y153 HydrophobicContact CE-CE1 4.03Å; M62-Y153 HydrophobicContact CE-CE2 4.12Å; M62-Y153 HydrophobicContact CE-CG 3.26Å; M62-Y153 HydrophobicContact SD-CD1 4.01Å; M62-Y153 HydrophobicContact SD-CD2 4.14Å; M62-Y153 HydrophobicContact SD-CE1 3.88Å; M62-Y153 HydrophobicContact SD-CE2 4.07Å; M62-Y153 HydrophobicContact SD-CG 4.14Å; N149-Y153 HydrophobicContact CB-CD2 4.17Å; N149-Y153 HydrophobicContact CB-CE2 4.29Å; N149-Y153 WeakPolarHBondContact O-CB 3.46Å; N149-Y153 WeakPolarHBondContact O-CD2 3.23Å; N149-Y153 PolarHBondContact O-N 3.47Å; V150-Y153 PolarHBondContact O-N 3.21Å; C151-Y153 PolarHBondContact O-N 3Å; Y153-E155 VanDerWaalsContact C-N 3.35Å; Y153-I156 PolarHBondContact O-N 3.3Å; Y153-R157 WeakPolarHBondContact O-CB 3.48Å; Y153-R157 PolarHBondContact O-N 3.36Å
154	W	94.3	Very high	93.7	Very high	140 Å²	140	55.6 Å²	55.6	53%	0.53	27%	0.274	S	S	.	.	H	α-helix	trans	-67.4	-38.1	169.3	-172.4	-98.3	0	0	0	111.7	F59 V150 C151 C152 R157 S158	F59-W154 HydrophobicContact CD1-CE3 4.44Å; F59-W154 AromaticContact CE1-CE3 3.79Å; F59-W154 HydrophobicContact CE1-CE3 3.79Å; F59-W154 HydrophobicContact CE1-CZ3 4Å; F59-W154 HydrophobicContact CE2-CB 4.43Å; F59-W154 HydrophobicContact CE2-CE3 4.3Å; F59-W154 AromaticContact CZ-CE3 3.71Å; F59-W154 HydrophobicContact CZ-CE3 3.71Å; F59-W154 HydrophobicContact CZ-CZ3 4.38Å; V150-W154 WeakPolarHBondContact O-CB 3.36Å; V150-W154 PolarHBondContact O-N 3.45Å; C151-W154 WeakPolarHBondContact O-CB 3.06Å; C151-W154 PolarHBondContact O-N 3.5Å; C152-W154 VanDerWaalsContact C-N 3.33Å; W154-R157 VanDerWaalsContact CZ2-NH1 3.32Å; W154-R157 WeakPolarHBondContact O-CB 3.48Å; W154-R157 PolarHBondContact O-N 3.36Å; W154-S158 PolarHBondContact O-N 2.84Å
155	E	92.9	Very high	93.4	Very high	81 Å²	81	57.5 Å²	57.5	38%	0.379	28%	0.275	S	S	.	.	H	α-helix	trans	-62.3	-48.5	170.6	177.3	175.9	-137	0	0	111.5	W37 C151 C152 Y153 R157 S158 F159	W37-E155 HydrophobicContact CH2-CG 3.7Å; W37-E155 VanDerWaalsContact CH2-O 3.31Å; W37-E155 WeakPolarHBondContact CH2-O 3.34Å; W37-E155 HydrophobicContact CZ3-CG 3.53Å; C151-E155 PolarHBondContact O-N 2.81Å; C152-E155 WeakPolarHBondContact O-CB 3.16Å; C152-E155 PolarHBondContact O-N 2.96Å; Y153-E155 VanDerWaalsContact C-N 3.35Å; E155-R157 VanDerWaalsContact C-N 3.3Å; E155-R157 PolarHBondContact O-N 3.19Å; E155-S158 WeakPolarHBondContact O-CA 3.23Å; E155-S158 WeakPolarHBondContact O-CB 3.47Å; E155-S158 PolarHBondContact O-N 3Å; E155-F159 PolarHBondContact O-N 3.45Å
156	I	93.8	Very high	93.3	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.015	25%	0.25	C	S	.	.	H	α-helix	trans	-61.4	-37.3	174.5	-57	-57.2	0	0	0	112	F46 R49 V50 L53 C152 Y153 S158 F159 Y160	F46-I156 HydrophobicContact CD2-CD1 3.35Å; F46-I156 HydrophobicContact CE2-CD1 3.44Å; F46-I156 VanDerWaalsContact CE2-CD1 3.44Å; F46-I156 HydrophobicContact CG-CD1 4.36Å; F46-I156 HydrophobicContact CZ-CD1 4.5Å; R49-I156 HydrophobicContact CB-CD1 4.35Å; R49-I156 HydrophobicContact CB-CG1 3.91Å; V50-I156 HydrophobicContact CB-CG2 4.48Å; V50-I156 HydrophobicContact CG2-CD1 4.25Å; V50-I156 HydrophobicContact CG2-CG2 3.85Å; L53-I156 HydrophobicContact CB-CG2 4.48Å; L53-I156 HydrophobicContact CD2-CB 4.37Å; L53-I156 HydrophobicContact CD2-CG2 3.76Å; C152-I156 WeakPolarHBondContact O-CG1 3.43Å; C152-I156 PolarHBondContact O-N 3.37Å; C152-I156 VanDerWaalsContact O-N 3.15Å; Y153-I156 PolarHBondContact O-N 3.3Å; I156-S158 VanDerWaalsContact C-N 3.29Å; I156-S158 PolarHBondContact O-N 3.04Å; I156-F159 WeakPolarHBondContact O-CB 3.03Å; I156-F159 PolarHBondContact O-N 3.42Å; I156-Y160 HydrophobicContact CG2-CD2 4.05Å; I156-Y160 HydrophobicContact CG2-CE2 4.06Å; I156-Y160 WeakPolarHBondContact O-CD2 3.38Å; I156-Y160 PolarHBondContact O-N 3.1Å
157	R	94.6	Very high	93.1	Very high	68 Å²	68	52.2 Å²	52.2	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-59.9	-39.1	171.3	167.9	178.1	176.6	-79.1	-8.1	111.7	F59 Y153 W154 E155 Y160 I161 M168	F59-R157 HydrophobicContact CD2-CB 4.3Å; Y153-R157 WeakPolarHBondContact O-CB 3.48Å; Y153-R157 PolarHBondContact O-N 3.36Å; W154-R157 VanDerWaalsContact CZ2-NH1 3.32Å; W154-R157 WeakPolarHBondContact O-CB 3.48Å; W154-R157 PolarHBondContact O-N 3.36Å; E155-R157 VanDerWaalsContact C-N 3.3Å; E155-R157 PolarHBondContact O-N 3.19Å; R157-Y160 PolarHBondContact O-N 3.25Å; R157-I161 HydrophobicContact CG-CD1 3.92Å; R157-I161 WeakPolarHBondContact O-CG1 3.32Å; R157-I161 PolarHBondContact O-N 3.13Å; R157-M168 HydrophobicContact CB-CE 4.5Å; R157-M168 HydrophobicContact CB-SD 4.45Å; R157-M168 HydrophobicContact CG-CE 4.14Å; R157-M168 HydrophobicContact CG-CG 4.33Å; R157-M168 HydrophobicContact CG-SD 3.87Å
158	S	92.9	Very high	92.9	Very high	29 Å²	29	49.9 Å²	49.9	20%	0.203	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-41.3	174.2	-165.3	0	0	0	0	111.6	W154 E155 I156 I161 N162	W154-S158 PolarHBondContact O-N 2.84Å; E155-S158 WeakPolarHBondContact O-CA 3.23Å; E155-S158 WeakPolarHBondContact O-CB 3.47Å; E155-S158 PolarHBondContact O-N 3Å; I156-S158 VanDerWaalsContact C-N 3.29Å; I156-S158 PolarHBondContact O-N 3.04Å; S158-I161 PolarHBondContact O-N 3.49Å; S158-N162 VanDerWaalsContact O-CB 3.25Å; S158-N162 WeakPolarHBondContact O-CB 3.44Å; S158-N162 PolarHBondContact O-N 3.43Å; S158-N162 PolarHBondContact OG-ND2 3.49Å; S158-N162 VanDerWaalsContact OG-ND2 3.09Å
159	F	92.5	Very high	92.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-44.6	174	174.9	-104.9	0	0	0	112.4	W37 F46 V50 E155 I156 I161 A163 L164 I192	W37-F159 HydrophobicContact CD2-CB 4.33Å; W37-F159 AromaticContact CD2-CD2 3.85Å; W37-F159 HydrophobicContact CD2-CD2 3.85Å; W37-F159 HydrophobicContact CE3-CB 4.41Å; W37-F159 HydrophobicContact CE3-CD2 4.34Å; W37-F159 AromaticContact CG-CD2 3.89Å; W37-F159 HydrophobicContact CG-CD2 3.89Å; W37-F159 HydrophobicContact CG-CE2 4.46Å; W37-F159 HydrophobicContact CH2-CB 4Å; W37-F159 HydrophobicContact CZ2-CB 3.88Å; W37-F159 HydrophobicContact CZ3-CB 4.26Å; F46-F159 HydrophobicContact CE1-CE1 4.28Å; F46-F159 HydrophobicContact CE1-CZ 4.32Å; F46-F159 HydrophobicContact CE2-CD1 4.43Å; F46-F159 HydrophobicContact CE2-CG 4.33Å; F46-F159 AromaticContact CZ-CD1 3.77Å; F46-F159 HydrophobicContact CZ-CD1 3.77Å; F46-F159 HydrophobicContact CZ-CD2 4Å; F46-F159 AromaticContact CZ-CE1 3.74Å; F46-F159 HydrophobicContact CZ-CE1 3.74Å; F46-F159 AromaticContact CZ-CE2 3.99Å; F46-F159 HydrophobicContact CZ-CE2 3.99Å; F46-F159 AromaticContact CZ-CG 3.91Å; F46-F159 HydrophobicContact CZ-CG 3.91Å; F46-F159 AromaticContact CZ-CZ 3.86Å; F46-F159 HydrophobicContact CZ-CZ 3.86Å; V50-F159 HydrophobicContact CG2-CD1 4.29Å; V50-F159 HydrophobicContact CG2-CE1 4.34Å; E155-F159 PolarHBondContact O-N 3.45Å; I156-F159 WeakPolarHBondContact O-CB 3.03Å; I156-F159 PolarHBondContact O-N 3.42Å; F159-I161 PolarHBondContact O-N 3.49Å; F159-A163 HydrophobicContact CD2-CB 3.66Å; F159-A163 HydrophobicContact CE2-CB 3.73Å; F159-A163 HydrophobicContact CG-CB 4.46Å; F159-A163 WeakPolarHBondContact O-CA 3.13Å; F159-A163 WeakPolarHBondContact O-CB 3.4Å; F159-A163 PolarHBondContact O-N 2.86Å; F159-L164 HydrophobicContact CD1-CD1 3.89Å; F159-L164 HydrophobicContact CD1-CG 4.39Å; F159-L164 HydrophobicContact CE1-CD1 3.52Å; F159-L164 HydrophobicContact CE1-CG 3.88Å; F159-L164 HydrophobicContact CZ-CD1 4.33Å; F159-L164 HydrophobicContact CZ-CG 4.22Å; F159-L164 PolarHBondContact O-N 3.02Å; F159-L164 VanDerWaalsContact O-N 3.1Å; F159-I192 HydrophobicContact CE2-CD1 3.7Å; F159-I192 HydrophobicContact CZ-CD1 3.8Å
160	Y	93.6	Very high	92.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-43.8	176.5	-92.8	-84.2	0	0	0	113.7	V50 L53 I156 R157 L164 K165 M166 M168 L171 V179	V50-Y160 HydrophobicContact CB-CE2 4.48Å; V50-Y160 HydrophobicContact CG1-CE2 3.93Å; V50-Y160 WeakPolarHBondContact CG1-OH 3.25Å; V50-Y160 PolarHBondContact O-OH 2.98Å; L53-Y160 HydrophobicContact CB-CE2 4.43Å; L53-Y160 HydrophobicContact CD2-CD2 3.74Å; L53-Y160 HydrophobicContact CD2-CE2 3.9Å; L53-Y160 HydrophobicContact CG-CE2 4.49Å; I156-Y160 HydrophobicContact CG2-CD2 4.05Å; I156-Y160 HydrophobicContact CG2-CE2 4.06Å; I156-Y160 WeakPolarHBondContact O-CD2 3.38Å; I156-Y160 PolarHBondContact O-N 3.1Å; R157-Y160 PolarHBondContact O-N 3.25Å; Y160-L164 HydrophobicContact CD1-CB 4.46Å; Y160-L164 HydrophobicContact CD1-CD1 3.49Å; Y160-L164 VanDerWaalsContact CD1-CD1 3.49Å; Y160-L164 HydrophobicContact CD2-CD1 4.33Å; Y160-L164 HydrophobicContact CE1-CD1 3.59Å; Y160-L164 HydrophobicContact CE2-CD1 4.43Å; Y160-L164 HydrophobicContact CG-CD1 3.89Å; Y160-L164 WeakPolarHBondContact O-CB 3.31Å; Y160-K165 PolarHBondContact O-N 2.89Å; Y160-M166 HydrophobicContact CD1-SD 4.32Å; Y160-M166 HydrophobicContact CE1-SD 4.4Å; Y160-M166 PolarHBondContact O-N 3.28Å; Y160-M166 VanDerWaalsContact O-N 3.16Å; Y160-M168 VanDerWaalsContact CB-CE 3.44Å; Y160-M168 HydrophobicContact CG-CE 4.04Å; Y160-L171 HydrophobicContact CD1-CD1 4.01Å; Y160-L171 HydrophobicContact CD1-CD2 4.49Å; Y160-L171 HydrophobicContact CE1-CD1 3.48Å; Y160-L171 VanDerWaalsContact CE1-CD1 3.48Å; Y160-L171 HydrophobicContact CE1-CD2 4.4Å; Y160-V179 HydrophobicContact CE1-CG1 4Å; Y160-V179 HydrophobicContact CE1-CG2 4.33Å; Y160-V179 WeakPolarHBondContact OH-CG1 3.5Å
161	I	92.9	Very high	92.3	Very high	63 Å²	63	48.5 Å²	48.5	32%	0.323	25%	0.248	S	C	.	.	H	α-helix	trans	-75	-46.8	-177.2	-63.7	167.1	0	0	0	110.7	R157 S158 F159 M168	R157-I161 HydrophobicContact CG-CD1 3.92Å; R157-I161 WeakPolarHBondContact O-CG1 3.32Å; R157-I161 PolarHBondContact O-N 3.13Å; S158-I161 PolarHBondContact O-N 3.49Å; F159-I161 PolarHBondContact O-N 3.49Å; I161-M168 HydrophobicContact CD1-CG 4.1Å; I161-M168 HydrophobicContact CG1-CE 4.29Å; I161-M168 HydrophobicContact CG1-CG 4.36Å
162	N	91.3	Very high	92.2	Very high	103 Å²	103	46.7 Å²	46.7	55%	0.551	24%	0.235	S	C	*	.	H	α-helix	trans	-90.5	-36.7	-168.1	-60.6	-16.4	0	0	0	113.6	S158	S158-N162 VanDerWaalsContact O-CB 3.25Å; S158-N162 WeakPolarHBondContact O-CB 3.44Å; S158-N162 PolarHBondContact O-N 3.43Å; S158-N162 PolarHBondContact OG-ND2 3.49Å; S158-N162 VanDerWaalsContact OG-ND2 3.09Å
163	A	89.8	Confident	92.2	Very high	2 Å²	2	52.9 Å²	52.9	2%	0.017	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-58	-179.8	0	0	0	0	0	111.3	F159 K165 I186	F159-A163 HydrophobicContact CD2-CB 3.66Å; F159-A163 HydrophobicContact CE2-CB 3.73Å; F159-A163 HydrophobicContact CG-CB 4.46Å; F159-A163 WeakPolarHBondContact O-CA 3.13Å; F159-A163 WeakPolarHBondContact O-CB 3.4Å; F159-A163 PolarHBondContact O-N 2.86Å; A163-K165 PolarHBondContact O-N 3.34Å; A163-I186 HydrophobicContact CB-CG2 4.47Å; A163-I186 WeakPolarHBondContact O-CD1 3.37Å
164	L	90.4	Very high	92	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.01	26%	0.258	C	S	.	.	S	Bend	trans	-67.8	-14.1	-178.6	-70.8	165.2	0	0	0	114	F159 Y160 M166 R182 I183 I186	F159-L164 HydrophobicContact CD1-CD1 3.89Å; F159-L164 HydrophobicContact CD1-CG 4.39Å; F159-L164 HydrophobicContact CE1-CD1 3.52Å; F159-L164 HydrophobicContact CE1-CG 3.88Å; F159-L164 HydrophobicContact CZ-CD1 4.33Å; F159-L164 HydrophobicContact CZ-CG 4.22Å; F159-L164 PolarHBondContact O-N 3.02Å; F159-L164 VanDerWaalsContact O-N 3.1Å; Y160-L164 HydrophobicContact CD1-CB 4.46Å; Y160-L164 HydrophobicContact CD1-CD1 3.49Å; Y160-L164 VanDerWaalsContact CD1-CD1 3.49Å; Y160-L164 HydrophobicContact CD2-CD1 4.33Å; Y160-L164 HydrophobicContact CE1-CD1 3.59Å; Y160-L164 HydrophobicContact CE2-CD1 4.43Å; Y160-L164 HydrophobicContact CG-CD1 3.89Å; Y160-L164 WeakPolarHBondContact O-CB 3.31Å; L164-M166 VanDerWaalsContact C-N 3.27Å; L164-M166 HydrophobicContact CB-CG 4.19Å; L164-M166 HydrophobicContact CB-SD 4.27Å; L164-M166 WeakPolarHBondContact O-CG 3.44Å; L164-M166 PolarHBondContact O-N 2.97Å; L164-R182 HydrophobicContact CD2-CB 3.57Å; L164-R182 PolarHBondContact O-NH1 3Å; L164-I183 HydrophobicContact CD1-CG1 4.4Å; L164-I183 HydrophobicContact CD2-CG1 3.74Å; L164-I186 HydrophobicContact CB-CD1 4.43Å; L164-I186 HydrophobicContact CD2-CD1 3.74Å; L164-I186 HydrophobicContact CG-CD1 4.24Å
165	K	91.4	Very high	91.9	Very high	129 Å²	129	47.2 Å²	47.2	56%	0.561	24%	0.243	S	C	*	.			trans	53.7	46.5	179.8	-59.7	148.3	-169.9	159	0	110.4	Y160 A163 R182 E189	Y160-K165 PolarHBondContact O-N 2.89Å; A163-K165 PolarHBondContact O-N 3.34Å; K165-R182 PolarHBondContact O-NH1 3.43Å; K165-E189 IonicContact NZ-OE2 3.93Å; K165-E189 PolarHBondContact NZ-OE2 2.98Å
166	M	91.2	Very high	91.9	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.02	23%	0.226	C	C	.	.			trans	-122.6	132.9	178.1	-63.2	179.1	83.6	0	0	110	Y160 L164 A174 V179 R182	Y160-M166 HydrophobicContact CD1-SD 4.32Å; Y160-M166 HydrophobicContact CE1-SD 4.4Å; Y160-M166 PolarHBondContact O-N 3.28Å; Y160-M166 VanDerWaalsContact O-N 3.16Å; L164-M166 VanDerWaalsContact C-N 3.27Å; L164-M166 HydrophobicContact CB-CG 4.19Å; L164-M166 HydrophobicContact CB-SD 4.27Å; L164-M166 WeakPolarHBondContact O-CG 3.44Å; L164-M166 PolarHBondContact O-N 2.97Å; M166-A174 HydrophobicContact CE-CB 3.42Å; M166-A174 VanDerWaalsContact CE-CB 3.42Å; M166-V179 HydrophobicContact CE-CG2 3.94Å; M166-V179 HydrophobicContact SD-CG2 4.05Å; M166-R182 VanDerWaalsContact CG-NH1 3.29Å
167	S	91.7	Very high	91.8	Very high	34 Å²	34	46.1 Å²	46.1	24%	0.238	24%	0.237	C	C	.	.			trans	-76.4	150.8	173.2	85	0	0	0	0	111.6	S169 E170 L171	S167-S169 PolarHBondContact O-N 2.87Å; S167-S169 VanDerWaalsContact O-N 3.1Å; S167-S169 PolarHBondContact OG-N 3.17Å; S167-S169 PolarHBondContact OG-OG 2.85Å; S167-E170 WeakPolarHBondContact CB-OE1 3.35Å; S167-E170 PolarHBondContact N-OE2 2.96Å; S167-E170 PolarHBondContact O-N 3.46Å; S167-E170 PolarHBondContact OG-N 2.82Å; S167-E170 VanDerWaalsContact OG-N 3.17Å; S167-E170 PolarHBondContact OG-OE1 2.88Å; S167-L171 PolarHBondContact O-N 3.34Å
168	M	91.4	Very high	91.6	Very high	44 Å²	44	46.5 Å²	46.5	22%	0.217	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.9	173.8	-70	-76.5	113.2	0	0	112.8	F59 R157 Y160 I161 L171	F59-M168 HydrophobicContact CB-SD 4.17Å; R157-M168 HydrophobicContact CB-CE 4.5Å; R157-M168 HydrophobicContact CB-SD 4.45Å; R157-M168 HydrophobicContact CG-CE 4.14Å; R157-M168 HydrophobicContact CG-CG 4.33Å; R157-M168 HydrophobicContact CG-SD 3.87Å; Y160-M168 VanDerWaalsContact CB-CE 3.44Å; Y160-M168 HydrophobicContact CG-CE 4.04Å; I161-M168 HydrophobicContact CD1-CG 4.1Å; I161-M168 HydrophobicContact CG1-CE 4.29Å; I161-M168 HydrophobicContact CG1-CG 4.36Å; M168-L171 HydrophobicContact CE-CD2 4.23Å
169	S	90.4	Very high	91.7	Very high	89 Å²	89	45.1 Å²	45.1	62%	0.622	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-26.4	174.2	25.4	0	0	0	0	114	S167 Y173	S167-S169 PolarHBondContact O-N 2.87Å; S167-S169 VanDerWaalsContact O-N 3.1Å; S167-S169 PolarHBondContact OG-N 3.17Å; S167-S169 PolarHBondContact OG-OG 2.85Å; S169-Y173 WeakPolarHBondContact O-CD2 3.32Å; S169-Y173 WeakPolarHBondContact O-CE2 3.3Å
170	E	91.4	Very high	91.7	Very high	92 Å²	92	45.2 Å²	45.2	43%	0.43	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-31.8	173	-74.6	131.4	-129.2	0	0	112.3	S167 P172 Y173 A174	S167-E170 WeakPolarHBondContact CB-OE1 3.35Å; S167-E170 PolarHBondContact N-OE2 2.96Å; S167-E170 PolarHBondContact O-N 3.46Å; S167-E170 PolarHBondContact OG-N 2.82Å; S167-E170 VanDerWaalsContact OG-N 3.17Å; S167-E170 PolarHBondContact OG-OE1 2.88Å; E170-P172 VanDerWaalsContact C-N 3.32Å; E170-P172 VanDerWaalsContact O-N 3.13Å; E170-Y173 PolarHBondContact O-N 2.79Å; E170-A174 PolarHBondContact O-N 3.07Å; E170-A174 VanDerWaalsContact O-N 3.1Å
171	L	91.1	Very high	91.6	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-33.4	-172	-172.2	61.8	0	0	0	115.9	L53 H54 Y160 S167 M168 Y173 V179	L53-L171 HydrophobicContact CG-CD2 4.41Å; H54-L171 HydrophobicContact CB-CD1 4.34Å; Y160-L171 HydrophobicContact CD1-CD1 4.01Å; Y160-L171 HydrophobicContact CD1-CD2 4.49Å; Y160-L171 HydrophobicContact CE1-CD1 3.48Å; Y160-L171 VanDerWaalsContact CE1-CD1 3.48Å; Y160-L171 HydrophobicContact CE1-CD2 4.4Å; S167-L171 PolarHBondContact O-N 3.34Å; M168-L171 HydrophobicContact CE-CD2 4.23Å; L171-Y173 VanDerWaalsContact C-N 3.27Å; L171-Y173 PolarHBondContact O-N 3.44Å; L171-V179 HydrophobicContact CD1-CG2 4.4Å
172	P	92.3	Very high	91.5	Very high	53 Å²	53	48 Å²	48	34%	0.344	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-12.2	174.5	-19.1	34.1	0	0	0	115.3	N57 E170	N57-P172 HydrophobicContact CB-CB 4.19Å; N57-P172 HydrophobicContact CB-CG 4.25Å; E170-P172 VanDerWaalsContact C-N 3.32Å; E170-P172 VanDerWaalsContact O-N 3.13Å
173	Y	90.9	Very high	91.5	Very high	143 Å²	143	43 Å²	43	56%	0.561	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-28.5	-176.8	-53.2	-77.4	0	0	0	112.6	S169 E170 L171 Q691	S169-Y173 WeakPolarHBondContact O-CD2 3.32Å; S169-Y173 WeakPolarHBondContact O-CE2 3.3Å; E170-Y173 PolarHBondContact O-N 2.79Å; L171-Y173 VanDerWaalsContact C-N 3.27Å; L171-Y173 PolarHBondContact O-N 3.44Å; Y173-Q691 PolarHBondContact O-NE2 3.38Å
174	A	90.6	Very high	91.5	Very high	15 Å²	15	44.4 Å²	44.4	12%	0.124	23%	0.231	C	C	.	.	S	Bend	trans	-59.7	152.3	168.2	0	0	0	0	0	111.2	M166 E170	M166-A174 HydrophobicContact CE-CB 3.42Å; M166-A174 VanDerWaalsContact CE-CB 3.42Å; E170-A174 PolarHBondContact O-N 3.07Å; E170-A174 VanDerWaalsContact O-N 3.1Å
175	T	91.9	Very high	91.4	Very high	35 Å²	35	50.6 Å²	50.6	22%	0.215	26%	0.26	C	S	.	.			trans	-100.9	157.4	174.3	69.2	0	0	0	0	111.2	Q177 E178 V179 S694	T175-Q177 PolarHBondContact O-N 3.32Å; T175-E178 WeakPolarHBondContact O-CB 3.42Å; T175-E178 PolarHBondContact O-N 2.86Å; T175-V179 PolarHBondContact O-N 2.92Å; T175-V179 VanDerWaalsContact O-N 3.16Å; T175-S694 VanDerWaalsContact CG2-OG 3.31Å; T175-S694 WeakPolarHBondContact CG2-OG 3.45Å; T175-S694 PolarHBondContact OG1-OG 3.44Å
176	W	93.6	Very high	91.2	Very high	5 Å²	5	44.8 Å²	44.8	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-58.3	-34.5	-179.7	175.6	-102.9	0	0	0	112.3	V50 Y51 H54 E178 V179 Q180 I204 I208 L342 H344	V50-W176 HydrophobicContact CG1-CH2 4.29Å; V50-W176 HydrophobicContact CG1-CZ3 4.34Å; Y51-W176 AromaticContact CD2-CD2 3.85Å; Y51-W176 HydrophobicContact CD2-CD2 3.85Å; Y51-W176 AromaticContact CD2-CE2 3.95Å; Y51-W176 AromaticContact CD2-CE3 3.83Å; Y51-W176 HydrophobicContact CD2-CE3 3.83Å; Y51-W176 AromaticContact CD2-CH2 4Å; Y51-W176 HydrophobicContact CD2-CH2 4Å; Y51-W176 HydrophobicContact CD2-CZ2 4.02Å; Y51-W176 AromaticContact CD2-CZ3 3.91Å; Y51-W176 HydrophobicContact CD2-CZ3 3.91Å; Y51-W176 HydrophobicContact CE2-CD2 4.29Å; Y51-W176 HydrophobicContact CG-CH2 4.46Å; Y51-W176 HydrophobicContact CG-CZ3 4.46Å; H54-W176 HydrophobicContact CB-CE3 4.27Å; H54-W176 HydrophobicContact CB-CZ3 4.43Å; H54-W176 PolarHBondContact NE2-N 3.05Å; W176-E178 PolarHBondContact O-N 3.33Å; W176-V179 HydrophobicContact CE3-CB 4.31Å; W176-V179 HydrophobicContact CE3-CG1 4.17Å; W176-V179 HydrophobicContact CZ3-CB 4.49Å; W176-V179 HydrophobicContact CZ3-CG1 3.86Å; W176-V179 PolarHBondContact O-N 3.23Å; W176-Q180 VanDerWaalsContact O-CB 3.25Å; W176-Q180 WeakPolarHBondContact O-CB 3.44Å; W176-Q180 PolarHBondContact O-N 3.33Å; W176-I204 HydrophobicContact CZ2-CG2 4.25Å; W176-I208 HydrophobicContact CH2-CD1 4.14Å; W176-I208 HydrophobicContact CZ2-CD1 3.74Å; W176-L342 HydrophobicContact CG-CD1 4.34Å; W176-L342 VanDerWaalsContact NE1-CD1 3.33Å; W176-H344 AromaticContact CG-CE1 3.94Å
177	Q	91.6	Very high	90.8	Very high	57 Å²	57	44.7 Å²	44.7	27%	0.266	23%	0.234	S	C	.	.	H	α-helix	trans	-63.7	-38	176.4	-70.8	-65.5	-25.8	0	0	112.4	T175 Q180 A181 Y205 N560	T175-Q177 PolarHBondContact O-N 3.32Å; Q177-Q180 PolarHBondContact O-N 3.14Å; Q177-A181 WeakPolarHBondContact O-CB 3.16Å; Q177-A181 PolarHBondContact O-N 3.35Å; Q177-Y205 PolarHBondContact NE2-OH 3.14Å; Q177-N560 PolarHBondContact NE2-OD1 3.23Å; Q177-N560 PolarHBondContact OE1-OD1 3.31Å
178	E	91.6	Very high	90.3	Very high	75 Å²	75	48.9 Å²	48.9	35%	0.35	25%	0.249	S	C	.	.	H	α-helix	trans	-66.4	-46.3	173.9	-165.6	-156.6	151	0	0	111.4	T175 W176 Q180 A181 R182	T175-E178 WeakPolarHBondContact O-CB 3.42Å; T175-E178 PolarHBondContact O-N 2.86Å; W176-E178 PolarHBondContact O-N 3.33Å; E178-Q180 VanDerWaalsContact C-N 3.29Å; E178-Q180 PolarHBondContact O-N 3.4Å; E178-A181 PolarHBondContact O-N 3.34Å; E178-R182 WeakPolarHBondContact O-CG 3.39Å; E178-R182 PolarHBondContact O-N 3.15Å; E178-R182 IonicContact OE1-CZ 2.72Å; E178-R182 VanDerWaalsContact OE1-CZ 3.23Å; E178-R182 IonicContact OE1-NE 3.94Å; E178-R182 PolarHBondContact OE1-NE 3.23Å; E178-R182 IonicContact OE1-NH2 3.23Å; E178-R182 PolarHBondContact OE1-NH2 3.36Å
179	V	93.5	Very high	89.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-43.6	176.1	172.7	0	0	0	0	110.7	Y160 M166 L171 T175 W176 R182 I183	Y160-V179 HydrophobicContact CE1-CG1 4Å; Y160-V179 HydrophobicContact CE1-CG2 4.33Å; Y160-V179 WeakPolarHBondContact OH-CG1 3.5Å; M166-V179 HydrophobicContact CE-CG2 3.94Å; M166-V179 HydrophobicContact SD-CG2 4.05Å; L171-V179 HydrophobicContact CD1-CG2 4.4Å; T175-V179 PolarHBondContact O-N 2.92Å; T175-V179 VanDerWaalsContact O-N 3.16Å; W176-V179 HydrophobicContact CE3-CB 4.31Å; W176-V179 HydrophobicContact CE3-CG1 4.17Å; W176-V179 HydrophobicContact CZ3-CB 4.49Å; W176-V179 HydrophobicContact CZ3-CG1 3.86Å; W176-V179 PolarHBondContact O-N 3.23Å; V179-R182 PolarHBondContact O-N 2.86Å; V179-I183 HydrophobicContact CG1-CD1 3.95Å; V179-I183 VanDerWaalsContact O-CG1 3.27Å; V179-I183 WeakPolarHBondContact O-CG1 3.2Å; V179-I183 PolarHBondContact O-N 3.42Å
180	Q	93.2	Very high	88.7	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.009	25%	0.247	C	C	.	.	H	α-helix	trans	-66.4	-42.3	179.3	-179.2	162.6	-9.6	0	0	112.5	W176 Q177 E178 I183 I184 E201 I204 Y205	W176-Q180 VanDerWaalsContact O-CB 3.25Å; W176-Q180 WeakPolarHBondContact O-CB 3.44Å; W176-Q180 PolarHBondContact O-N 3.33Å; Q177-Q180 PolarHBondContact O-N 3.14Å; E178-Q180 VanDerWaalsContact C-N 3.29Å; E178-Q180 PolarHBondContact O-N 3.4Å; Q180-I183 WeakPolarHBondContact O-CB 3.41Å; Q180-I183 PolarHBondContact O-N 3.17Å; Q180-I184 HydrophobicContact CG-CD1 4.15Å; Q180-I184 WeakPolarHBondContact O-CG1 3.2Å; Q180-I184 PolarHBondContact O-N 3.45Å; Q180-E201 VanDerWaalsContact NE2-CA 3.28Å; Q180-E201 PolarHBondContact NE2-O 2.96Å; Q180-I204 HydrophobicContact CG-CD1 3.96Å; Q180-Y205 VanDerWaalsContact OE1-CE2 3.29Å
181	A	91	Very high	88	Confident	54 Å²	54	50.9 Å²	50.9	45%	0.446	25%	0.247	S	C	.	.	H	α-helix	trans	-59.9	-46.7	174.6	0	0	0	0	0	111.7	Q177 E178 I183 I184 E185	Q177-A181 WeakPolarHBondContact O-CB 3.16Å; Q177-A181 PolarHBondContact O-N 3.35Å; E178-A181 PolarHBondContact O-N 3.34Å; A181-I183 VanDerWaalsContact C-N 3.34Å; A181-I183 PolarHBondContact O-N 3.5Å; A181-I184 PolarHBondContact O-N 2.99Å; A181-E185 PolarHBondContact O-N 3.44Å
182	R	91.6	Very high	87.2	Confident	67 Å²	67	50.9 Å²	50.9	25%	0.253	25%	0.247	S	C	.	.	H	α-helix	trans	-60.8	-39	175.6	-67.2	175.4	-179.9	-125.1	9.6	112.3	L164 K165 M166 E178 V179 I184 E185 I186	L164-R182 HydrophobicContact CD2-CB 3.57Å; L164-R182 PolarHBondContact O-NH1 3Å; K165-R182 PolarHBondContact O-NH1 3.43Å; M166-R182 VanDerWaalsContact CG-NH1 3.29Å; E178-R182 WeakPolarHBondContact O-CG 3.39Å; E178-R182 PolarHBondContact O-N 3.15Å; E178-R182 IonicContact OE1-CZ 2.72Å; E178-R182 VanDerWaalsContact OE1-CZ 3.23Å; E178-R182 IonicContact OE1-NE 3.94Å; E178-R182 PolarHBondContact OE1-NE 3.23Å; E178-R182 IonicContact OE1-NH2 3.23Å; E178-R182 PolarHBondContact OE1-NH2 3.36Å; V179-R182 PolarHBondContact O-N 2.86Å; R182-I184 PolarHBondContact O-N 3.36Å; R182-E185 PolarHBondContact O-N 3.12Å; R182-I186 WeakPolarHBondContact O-CB 3.39Å; R182-I186 WeakPolarHBondContact O-CD1 3.49Å; R182-I186 WeakPolarHBondContact O-CG1 3.37Å; R182-I186 PolarHBondContact O-N 3.48Å
183	I	91.6	Very high	86.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-43.5	174.8	-72.4	166.7	0	0	0	111.4	F47 V50 L164 V179 Q180 A181 I186 Q187 L199 I204	F47-I183 HydrophobicContact CE1-CG2 3.8Å; V50-I183 HydrophobicContact CG1-CD1 3.87Å; L164-I183 HydrophobicContact CD1-CG1 4.4Å; L164-I183 HydrophobicContact CD2-CG1 3.74Å; V179-I183 HydrophobicContact CG1-CD1 3.95Å; V179-I183 VanDerWaalsContact O-CG1 3.27Å; V179-I183 WeakPolarHBondContact O-CG1 3.2Å; V179-I183 PolarHBondContact O-N 3.42Å; Q180-I183 WeakPolarHBondContact O-CB 3.41Å; Q180-I183 PolarHBondContact O-N 3.17Å; A181-I183 VanDerWaalsContact C-N 3.34Å; A181-I183 PolarHBondContact O-N 3.5Å; I183-I186 PolarHBondContact O-N 3.39Å; I183-Q187 PolarHBondContact O-N 3.45Å; I183-L199 HydrophobicContact CG2-CD2 4.35Å; I183-I204 HydrophobicContact CG2-CD1 3.89Å
184	I	89.9	Confident	85.4	Confident	31 Å²	31	46 Å²	46	16%	0.159	23%	0.227	C	C	.	.	H	α-helix	trans	-68.8	-36.4	-179.7	-68.8	168.1	0	0	0	111.4	Q180 A181 R182 E201 I204	Q180-I184 HydrophobicContact CG-CD1 4.15Å; Q180-I184 WeakPolarHBondContact O-CG1 3.2Å; Q180-I184 PolarHBondContact O-N 3.45Å; A181-I184 PolarHBondContact O-N 2.99Å; R182-I184 PolarHBondContact O-N 3.36Å; I184-E201 HydrophobicContact CD1-CB 4.49Å; I184-E201 HydrophobicContact CD1-CG 3.83Å; I184-I204 HydrophobicContact CD1-CD1 4.13Å; I184-I204 HydrophobicContact CG1-CD1 3.79Å
185	E	88.1	Confident	84.1	Confident	131 Å²	131	51.9 Å²	51.9	61%	0.612	25%	0.252	S	S	*	.	H	α-helix	trans	-64.6	-49.6	172.5	-173.6	169.8	-140.5	0	0	111.5	A181 R182 Q187 K188	A181-E185 PolarHBondContact O-N 3.44Å; R182-E185 PolarHBondContact O-N 3.12Å; E185-Q187 VanDerWaalsContact C-N 3.31Å; E185-Q187 PolarHBondContact O-N 3.37Å; E185-K188 VanDerWaalsContact O-CB 3.3Å; E185-K188 WeakPolarHBondContact O-CB 3.48Å; E185-K188 WeakPolarHBondContact O-CG 3.43Å; E185-K188 PolarHBondContact O-N 3.38Å
186	I	86.1	Confident	83.2	Confident	7 Å²	7	53.1 Å²	53.1	4%	0.036	25%	0.254	C	S	.	.	H	α-helix	trans	-66.7	-26.5	-177.5	-78	160.2	0	0	0	113.7	A163 L164 R182 I183 K188 E189 H190 I192	A163-I186 HydrophobicContact CB-CG2 4.47Å; A163-I186 WeakPolarHBondContact O-CD1 3.37Å; L164-I186 HydrophobicContact CB-CD1 4.43Å; L164-I186 HydrophobicContact CD2-CD1 3.74Å; L164-I186 HydrophobicContact CG-CD1 4.24Å; R182-I186 WeakPolarHBondContact O-CB 3.39Å; R182-I186 WeakPolarHBondContact O-CD1 3.49Å; R182-I186 WeakPolarHBondContact O-CG1 3.37Å; R182-I186 PolarHBondContact O-N 3.48Å; I183-I186 PolarHBondContact O-N 3.39Å; I186-K188 PolarHBondContact O-N 3.02Å; I186-K188 VanDerWaalsContact O-N 3.13Å; I186-E189 PolarHBondContact O-N 3.45Å; I186-H190 HydrophobicContact CG2-CB 4.24Å; I186-H190 PolarHBondContact O-N 3.45Å; I186-I192 HydrophobicContact CG2-CD1 4.23Å
187	Q	83.7	Confident	81.9	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-54.3	-30.8	171	170.5	62.6	14.3	0	0	111.9	I183 E185 Q191 C193 K196 L199	I183-Q187 PolarHBondContact O-N 3.45Å; E185-Q187 VanDerWaalsContact C-N 3.31Å; E185-Q187 PolarHBondContact O-N 3.37Å; Q187-Q191 PolarHBondContact O-N 2.87Å; Q187-Q191 VanDerWaalsContact O-N 3.11Å; Q187-C193 PolarHBondContact NE2-O 3.5Å; Q187-K196 PolarHBondContact NE2-O 3.36Å; Q187-L199 HydrophobicContact CB-CB 4.32Å; Q187-L199 HydrophobicContact CG-CB 3.88Å
188	K	79.8	Confident	81.2	Confident	123 Å²	123	64.4 Å²	64.4	54%	0.535	31%	0.305	S	S	.	.	H	α-helix	trans	-74.1	-30	178.4	-50.9	-173.3	-171.5	-151.5	0	112.8	E185 I186 E198	E185-K188 VanDerWaalsContact O-CB 3.3Å; E185-K188 WeakPolarHBondContact O-CB 3.48Å; E185-K188 WeakPolarHBondContact O-CG 3.43Å; E185-K188 PolarHBondContact O-N 3.38Å; I186-K188 PolarHBondContact O-N 3.02Å; I186-K188 VanDerWaalsContact O-N 3.13Å; K188-E198 WeakPolarHBondContact CE-OE1 3.4Å; K188-E198 IonicContact NZ-OE1 2.68Å; K188-E198 PolarHBondContact NZ-OE1 3.02Å
189	E	79	Confident	80.9	Confident	122 Å²	122	61.2 Å²	61.2	57%	0.57	29%	0.29	S	S	*	.	H	α-helix	trans	-84.5	-42	177.1	-59.3	-168	141	0	0	112.2	K165 I186	K165-E189 IonicContact NZ-OE2 3.93Å; K165-E189 PolarHBondContact NZ-OE2 2.98Å; I186-E189 PolarHBondContact O-N 3.45Å
190	H	70.4	Confident	80.7	Confident	50 Å²	50	63.3 Å²	63.3	23%	0.231	30%	0.303	C	S	.	.	H	α-helix	trans	-116.6	-5.8	-162.5	-80.3	-71.8	0	0	0	116.2	S35 I186 I192	S35-H190 WeakPolarHBondContact CB-ND1 3.47Å; S35-H190 PolarHBondContact OG-ND1 3.37Å; I186-H190 HydrophobicContact CG2-CB 4.24Å; I186-H190 PolarHBondContact O-N 3.45Å; H190-I192 HydrophobicContact CB-CG1 4.47Å; H190-I192 PolarHBondContact O-N 3.09Å
191	Q	75.4	Confident	80.6	Confident	94 Å²	94	64.5 Å²	64.5	44%	0.439	31%	0.308	S	S	.	.			trans	43.1	56.7	177.8	-63	-167.5	12.9	0	0	114.4	Q187 C193	Q187-Q191 PolarHBondContact O-N 2.87Å; Q187-Q191 VanDerWaalsContact O-N 3.11Å; Q191-C193 VanDerWaalsContact C-N 3.26Å; Q191-C193 PolarHBondContact O-N 3.07Å
192	I	75.7	Confident	80.7	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.015	29%	0.292	C	S	.	.	S	Bend	trans	-60.7	-40.9	179	-48.8	176	0	0	0	109.9	I40 L43 F46 F159 I186 H190	I40-I192 HydrophobicContact CD1-CG2 3.61Å; I40-I192 HydrophobicContact CG1-CG2 3.96Å; L43-I192 HydrophobicContact CD2-CG2 3.84Å; F46-I192 HydrophobicContact CE1-CG2 4.29Å; F159-I192 HydrophobicContact CE2-CD1 3.7Å; F159-I192 HydrophobicContact CZ-CD1 3.8Å; I186-I192 HydrophobicContact CG2-CD1 4.23Å; H190-I192 HydrophobicContact CB-CG1 4.47Å; H190-I192 PolarHBondContact O-N 3.09Å
193	C	75.6	Confident	80.7	Confident	6 Å²	6	60 Å²	60	4%	0.041	28%	0.282	C	S	.	.			trans	-98.9	121.8	167.5	-177.6	0	0	0	0	110.7	L43 Q187 Q191	L43-C193 HydrophobicContact CD1-CB 3.95Å; Q187-C193 PolarHBondContact NE2-O 3.5Å; Q191-C193 VanDerWaalsContact C-N 3.26Å; Q191-C193 PolarHBondContact O-N 3.07Å
194	I	68.6	Low	80.8	Confident	86 Å²	86	60 Å²	60	44%	0.441	28%	0.282	S	S	.	.	S	Bend	trans	-72.2	-45.9	173	-67.7	-173.5	0	0	0	111.4	H39 K196	H39-I194 HydrophobicContact CB-CD1 3.84Å; H39-I194 HydrophobicContact CB-CG1 4.2Å; H39-I194 VanDerWaalsContact CD2-CD1 3.41Å; H39-I194 WeakPolarHBondContact CD2-CD1 3.46Å; I194-K196 PolarHBondContact O-N 3.18Å
195	H	64.3	Low	81.1	Confident	140 Å²	140	58.5 Å²	58.5	65%	0.648	27%	0.274	S	S	*	.	S	Bend	trans	-68	-8.8	-165.8	-62.2	172.4	0	0	0	114.6
196	K	73.1	Confident	81.5	Confident	60 Å²	60	52.4 Å²	52.4	26%	0.261	25%	0.246	S	C	.	.			trans	-146.8	116.2	-177.1	-154.9	-176.3	178.5	178.6	0	110.2	Q187 I194 E198 D203	Q187-K196 PolarHBondContact NE2-O 3.36Å; I194-K196 PolarHBondContact O-N 3.18Å; K196-E198 VanDerWaalsContact C-N 3.26Å; K196-E198 VanDerWaalsContact CD-O 3.27Å; K196-E198 WeakPolarHBondContact CD-O 3.2Å; K196-E198 WeakPolarHBondContact CE-O 3.36Å; K196-E198 VanDerWaalsContact CG-O 3.28Å; K196-E198 WeakPolarHBondContact CG-O 3.49Å; K196-E198 PolarHBondContact O-N 3.46Å; K196-D203 WeakPolarHBondContact CD-OD2 3.39Å; K196-D203 WeakPolarHBondContact CE-OD2 3.41Å; K196-D203 IonicContact NZ-OD1 2.7Å; K196-D203 PolarHBondContact NZ-OD1 3.15Å; K196-D203 IonicContact NZ-OD2 3.65Å; K196-D203 PolarHBondContact NZ-OD2 3.06Å
197	K	65.9	Low	81.8	Confident	183 Å²	183	52.1 Å²	52.1	80%	0.796	24%	0.244	S	C	*	.	S	Bend	trans	-62	-31.9	-176.8	-67.2	-174.8	178	-178.6	0	113.3
198	E	77.9	Confident	82.4	Confident	117 Å²	117	52.4 Å²	52.4	55%	0.547	25%	0.245	S	C	.	.	S	Bend	trans	-126.8	127.4	174	-62.6	-168.3	124.2	0	0	109.6	K188 K196	K188-E198 WeakPolarHBondContact CE-OE1 3.4Å; K188-E198 IonicContact NZ-OE1 2.68Å; K188-E198 PolarHBondContact NZ-OE1 3.02Å; K196-E198 VanDerWaalsContact C-N 3.26Å; K196-E198 VanDerWaalsContact CD-O 3.27Å; K196-E198 WeakPolarHBondContact CD-O 3.2Å; K196-E198 WeakPolarHBondContact CE-O 3.36Å; K196-E198 VanDerWaalsContact CG-O 3.28Å; K196-E198 WeakPolarHBondContact CG-O 3.49Å; K196-E198 PolarHBondContact O-N 3.46Å
199	L	85	Confident	83.3	Confident	7 Å²	7	46.6 Å²	46.6	4%	0.037	22%	0.22	C	C	.	.			trans	-91.5	130.7	177.4	-173.7	73.4	0	0	0	108.3	F47 I183 Q187 D203 I204	F47-L199 HydrophobicContact CE1-CD2 4.42Å; F47-L199 HydrophobicContact CE2-CD2 4.4Å; F47-L199 HydrophobicContact CZ-CD2 3.75Å; I183-L199 HydrophobicContact CG2-CD2 4.35Å; Q187-L199 HydrophobicContact CB-CB 4.32Å; Q187-L199 HydrophobicContact CG-CB 3.88Å; L199-D203 HydrophobicContact CD1-CB 3.51Å; L199-D203 HydrophobicContact CG-CB 4.19Å; L199-I204 HydrophobicContact CD2-CD1 3.87Å; L199-I204 HydrophobicContact CD2-CG1 3.61Å; L199-I204 HydrophobicContact CG-CD1 4.37Å; L199-I204 HydrophobicContact CG-CG1 4Å
200	T	89.1	Confident	84	Confident	45 Å²	45	41 Å²	41	28%	0.276	19%	0.194	S	C	.	.			trans	-91	166.6	176.9	68.4	0	0	0	0	111.3	L202 D203 I204	T200-L202 VanDerWaalsContact C-N 3.29Å; T200-L202 PolarHBondContact O-N 3.49Å; T200-L202 PolarHBondContact OG1-N 3.42Å; T200-D203 PolarHBondContact N-OD2 3.32Å; T200-D203 PolarHBondContact O-N 3.1Å; T200-D203 PolarHBondContact OG1-N 3.44Å; T200-D203 PolarHBondContact OG1-OD1 3.38Å; T200-D203 PolarHBondContact OG1-OD2 3.14Å; T200-I204 PolarHBondContact O-N 3.45Å
201	E	91.4	Very high	85.2	Confident	27 Å²	27	39.7 Å²	39.7	13%	0.126	19%	0.188	C	C	.	.	H	α-helix	trans	-55.7	-48.5	170.7	-56.5	79.9	179	0	0	110.5	Q180 I184 D203 I204 Y205 W563	Q180-E201 VanDerWaalsContact NE2-CA 3.28Å; Q180-E201 PolarHBondContact NE2-O 2.96Å; I184-E201 HydrophobicContact CD1-CB 4.49Å; I184-E201 HydrophobicContact CD1-CG 3.83Å; E201-D203 VanDerWaalsContact C-N 3.32Å; E201-D203 PolarHBondContact O-N 3.27Å; E201-I204 WeakPolarHBondContact O-CB 3.44Å; E201-I204 PolarHBondContact O-N 2.95Å; E201-I204 VanDerWaalsContact O-N 3.12Å; E201-Y205 WeakPolarHBondContact O-CD2 3.39Å; E201-Y205 PolarHBondContact O-N 3.41Å; E201-Y205 VanDerWaalsContact O-N 3.14Å; E201-W563 HydrophobicContact CB-CB 4.41Å; E201-W563 HydrophobicContact CG-CB 4.36Å; E201-W563 PolarHBondContact OE1-N 3.36Å; E201-W563 WeakPolarHBondContact OE2-CA 3.41Å
202	L	92.8	Very high	86.2	Confident	19 Å²	19	37.9 Å²	37.9	10%	0.099	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-36.9	-178.1	-174.6	62.6	0	0	0	112.7	T200 I204 Y205 H206 M520 F556 W563	T200-L202 VanDerWaalsContact C-N 3.29Å; T200-L202 PolarHBondContact O-N 3.49Å; T200-L202 PolarHBondContact OG1-N 3.42Å; L202-I204 VanDerWaalsContact C-N 3.31Å; L202-I204 PolarHBondContact O-N 3.3Å; L202-Y205 PolarHBondContact O-N 3.47Å; L202-H206 WeakPolarHBondContact O-CB 3.43Å; L202-H206 PolarHBondContact O-N 3.28Å; L202-M520 HydrophobicContact CD1-CE 3.89Å; L202-F556 HydrophobicContact CB-CE1 4.21Å; L202-F556 HydrophobicContact CB-CZ 4.1Å; L202-F556 HydrophobicContact CD1-CE1 3.98Å; L202-F556 HydrophobicContact CD1-CE2 4.24Å; L202-F556 HydrophobicContact CD1-CZ 3.79Å; L202-W563 HydrophobicContact CD2-CZ2 3.98Å
203	D	92.2	Very high	87.2	Confident	7 Å²	7	37.9 Å²	37.9	4%	0.037	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-43.6	175.5	-60.2	-34	0	0	0	111.2	K196 L199 T200 E201 H206 R207 V511	K196-D203 WeakPolarHBondContact CD-OD2 3.39Å; K196-D203 WeakPolarHBondContact CE-OD2 3.41Å; K196-D203 IonicContact NZ-OD1 2.7Å; K196-D203 PolarHBondContact NZ-OD1 3.15Å; K196-D203 IonicContact NZ-OD2 3.65Å; K196-D203 PolarHBondContact NZ-OD2 3.06Å; L199-D203 HydrophobicContact CD1-CB 3.51Å; L199-D203 HydrophobicContact CG-CB 4.19Å; T200-D203 PolarHBondContact N-OD2 3.32Å; T200-D203 PolarHBondContact O-N 3.1Å; T200-D203 PolarHBondContact OG1-N 3.44Å; T200-D203 PolarHBondContact OG1-OD1 3.38Å; T200-D203 PolarHBondContact OG1-OD2 3.14Å; E201-D203 VanDerWaalsContact C-N 3.32Å; E201-D203 PolarHBondContact O-N 3.27Å; D203-H206 PolarHBondContact O-N 3.48Å; D203-R207 WeakPolarHBondContact O-CG 3.46Å; D203-R207 PolarHBondContact O-N 2.97Å; D203-R207 VanDerWaalsContact O-N 3.15Å; D203-V511 HydrophobicContact CB-CG2 3.96Å
204	I	93.8	Very high	88.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.1	-45.9	180	-63.6	168.1	0	0	0	110.1	W176 Q180 I183 I184 L199 T200 E201 L202 R207 I208	W176-I204 HydrophobicContact CZ2-CG2 4.25Å; Q180-I204 HydrophobicContact CG-CD1 3.96Å; I183-I204 HydrophobicContact CG2-CD1 3.89Å; I184-I204 HydrophobicContact CD1-CD1 4.13Å; I184-I204 HydrophobicContact CG1-CD1 3.79Å; L199-I204 HydrophobicContact CD2-CD1 3.87Å; L199-I204 HydrophobicContact CD2-CG1 3.61Å; L199-I204 HydrophobicContact CG-CD1 4.37Å; L199-I204 HydrophobicContact CG-CG1 4Å; T200-I204 PolarHBondContact O-N 3.45Å; E201-I204 WeakPolarHBondContact O-CB 3.44Å; E201-I204 PolarHBondContact O-N 2.95Å; E201-I204 VanDerWaalsContact O-N 3.12Å; L202-I204 VanDerWaalsContact C-N 3.31Å; L202-I204 PolarHBondContact O-N 3.3Å; I204-R207 PolarHBondContact O-N 2.98Å; I204-I208 HydrophobicContact CG2-CD1 3.68Å; I204-I208 WeakPolarHBondContact O-CG1 3.41Å; I204-I208 PolarHBondContact O-N 3.47Å
205	Y	95.7	Very high	89.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-43.6	176.1	-85.1	-103.4	0	0	0	111.9	Q177 Q180 E201 L202 R207 I208 L209 N340 L342 E345 F556 N560	Q177-Y205 PolarHBondContact NE2-OH 3.14Å; Q180-Y205 VanDerWaalsContact OE1-CE2 3.29Å; E201-Y205 WeakPolarHBondContact O-CD2 3.39Å; E201-Y205 PolarHBondContact O-N 3.41Å; E201-Y205 VanDerWaalsContact O-N 3.14Å; L202-Y205 PolarHBondContact O-N 3.47Å; Y205-R207 VanDerWaalsContact C-N 3.32Å; Y205-R207 PolarHBondContact O-N 3.3Å; Y205-I208 PolarHBondContact O-N 2.95Å; Y205-L209 HydrophobicContact CD1-CD1 3.85Å; Y205-L209 WeakPolarHBondContact O-CB 3.33Å; Y205-L209 WeakPolarHBondContact O-CG 3.42Å; Y205-L209 PolarHBondContact O-N 3.25Å; Y205-N340 HydrophobicContact CD1-CB 4.42Å; Y205-N340 WeakPolarHBondContact CD1-O 3.2Å; Y205-N340 WeakPolarHBondContact CE1-O 3.31Å; Y205-L342 HydrophobicContact CD1-CD1 4.07Å; Y205-L342 HydrophobicContact CD1-CD2 4.34Å; Y205-L342 HydrophobicContact CD1-CG 3.8Å; Y205-L342 HydrophobicContact CE1-CB 4.42Å; Y205-L342 HydrophobicContact CE1-CD1 3.45Å; Y205-L342 VanDerWaalsContact CE1-CD1 3.45Å; Y205-L342 HydrophobicContact CE1-CD2 4.43Å; Y205-L342 HydrophobicContact CE1-CG 3.44Å; Y205-L342 VanDerWaalsContact CE1-CG 3.44Å; Y205-L342 HydrophobicContact CE2-CD1 4.32Å; Y205-E345 WeakPolarHBondContact CE1-OE1 3.19Å; Y205-E345 PolarHBondContact OH-OE1 3.03Å; Y205-F556 HydrophobicContact CD1-CD2 4.49Å; Y205-F556 AromaticContact CD1-CE2 3.8Å; Y205-F556 HydrophobicContact CD1-CE2 3.8Å; Y205-F556 AromaticContact CD2-CE2 3.72Å; Y205-F556 HydrophobicContact CD2-CE2 3.72Å; Y205-F556 HydrophobicContact CD2-CZ 4.03Å; Y205-F556 AromaticContact CE1-CE2 3.99Å; Y205-F556 HydrophobicContact CE1-CE2 3.99Å; Y205-F556 AromaticContact CE2-CE2 3.93Å; Y205-F556 HydrophobicContact CE2-CE2 3.93Å; Y205-F556 HydrophobicContact CE2-CZ 4.33Å; Y205-F556 AromaticContact CG-CE2 3.64Å; Y205-F556 HydrophobicContact CG-CE2 3.64Å; Y205-F556 HydrophobicContact CG-CZ 4.27Å; Y205-N560 WeakPolarHBondContact CE2-OD1 3.31Å; Y205-N560 PolarHBondContact OH-ND2 3.25Å; Y205-N560 PolarHBondContact OH-OD1 3.18Å
206	H	95.2	Very high	91.1	Very high	3 Å²	3	27 Å²	27	1%	0.014	13%	0.126	C	C	.	.	H	α-helix	trans	-57.5	-41.8	176.1	-77	170.9	0	0	0	112.3	L202 D203 R210 N340 V511 T514 A518 Q519	L202-H206 WeakPolarHBondContact O-CB 3.43Å; L202-H206 PolarHBondContact O-N 3.28Å; D203-H206 PolarHBondContact O-N 3.48Å; H206-R210 VanDerWaalsContact O-CA 3.32Å; H206-R210 WeakPolarHBondContact O-CA 3.47Å; H206-R210 WeakPolarHBondContact O-CB 3.14Å; H206-R210 PolarHBondContact O-N 3.3Å; H206-N340 PolarHBondContact CD2-OD1 3.02Å; H206-V511 HydrophobicContact CB-CG1 3.91Å; H206-T514 HydrophobicContact CB-CG2 4.37Å; H206-A518 PolarHBondContact NE2-O 3.25Å; H206-Q519 PolarHBondContact CE1-NE2 2.81Å; H206-Q519 PolarHBondContact CE1-OE1 3.35Å
207	R	94.3	Very high	92.2	Very high	1 Å²	1	24.2 Å²	24.2	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-70.4	-39.3	178.3	-67.7	-174.9	-173.1	-75	4.2	114	D44 F47 Q48 D203 I204 Y205 L209 G510 V511	D44-R207 VanDerWaalsContact OD1-CG 3.26Å; D44-R207 WeakPolarHBondContact OD1-CG 3.33Å; D44-R207 IonicContact OD1-CZ 3.86Å; D44-R207 IonicContact OD1-NH1 3.4Å; D44-R207 PolarHBondContact OD1-NH1 2.73Å; F47-R207 HydrophobicContact CD2-CB 4.28Å; F47-R207 VanDerWaalsContact CD2-CD 3.42Å; Q48-R207 PolarHBondContact NE2-O 3.09Å; D203-R207 WeakPolarHBondContact O-CG 3.46Å; D203-R207 PolarHBondContact O-N 2.97Å; D203-R207 VanDerWaalsContact O-N 3.15Å; I204-R207 PolarHBondContact O-N 2.98Å; Y205-R207 VanDerWaalsContact C-N 3.32Å; Y205-R207 PolarHBondContact O-N 3.3Å; R207-L209 VanDerWaalsContact C-N 3.33Å; R207-G510 PolarHBondContact NH2-O 2.9Å; R207-V511 HydrophobicContact CG-CG1 4.26Å
208	I	96.1	Very high	93.7	Very high	7 Å²	7	15.5 Å²	15.5	4%	0.036	8%	0.075	C	C	.	.	H	α-helix	trans	-72.4	-30	177.7	-64	166.8	0	0	0	111.2	F47 Y51 W176 I204 Y205 L342	F47-I208 HydrophobicContact CB-CD1 4.31Å; F47-I208 HydrophobicContact CB-CG1 3.84Å; Y51-I208 HydrophobicContact CD1-CG2 4.22Å; Y51-I208 HydrophobicContact CG-CD1 4.41Å; Y51-I208 HydrophobicContact CG-CG2 4.23Å; W176-I208 HydrophobicContact CH2-CD1 4.14Å; W176-I208 HydrophobicContact CZ2-CD1 3.74Å; I204-I208 HydrophobicContact CG2-CD1 3.68Å; I204-I208 WeakPolarHBondContact O-CG1 3.41Å; I204-I208 PolarHBondContact O-N 3.47Å; Y205-I208 PolarHBondContact O-N 2.95Å; I208-L342 HydrophobicContact CB-CD2 4.3Å; I208-L342 HydrophobicContact CD1-CD2 4.44Å; I208-L342 HydrophobicContact CG2-CD2 3.63Å
209	L	96.8	Very high	94.5	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.005	5%	0.051	C	C	.	.	H	α-helix	trans	-114.7	-0.4	-168.2	-59.3	174.8	0	0	0	115.2	Y205 R207 F211 K212 N213 E341 L342	Y205-L209 HydrophobicContact CD1-CD1 3.85Å; Y205-L209 WeakPolarHBondContact O-CB 3.33Å; Y205-L209 WeakPolarHBondContact O-CG 3.42Å; Y205-L209 PolarHBondContact O-N 3.25Å; R207-L209 VanDerWaalsContact C-N 3.33Å; L209-F211 PolarHBondContact O-N 2.68Å; L209-F211 VanDerWaalsContact O-N 3.17Å; L209-K212 HydrophobicContact CD2-CB 4.46Å; L209-K212 HydrophobicContact CD2-CD 3.72Å; L209-K212 CarbonylContact O-C 3.6Å; L209-K212 WeakPolarHBondContact O-CA 3.42Å; L209-K212 WeakPolarHBondContact O-CB 3.49Å; L209-K212 PolarHBondContact O-N 3.46Å; L209-N213 PolarHBondContact O-N 3.46Å; L209-E341 VanDerWaalsContact CD1-O 3.31Å; L209-E341 WeakPolarHBondContact CD1-O 3.47Å; L209-L342 HydrophobicContact CD1-CD2 4.09Å; L209-L342 HydrophobicContact CD1-CG 4.39Å; L209-L342 HydrophobicContact CD2-CD2 4.05Å; L209-L342 HydrophobicContact CG-CD2 4.11Å
210	R	95.8	Very high	94.9	Very high	4 Å²	4	10.4 Å²	10.4	2%	0.015	5%	0.052	C	C	.	.	H	α-helix	trans	-37.2	-62.6	-174.5	-166.4	-176.3	-58.3	-95.5	2.8	113.7	D44 H206 N213 Y214 E262 W263 V511 D513	D44-R210 VanDerWaalsContact CG-NH2 3.31Å; D44-R210 IonicContact OD1-NH2 2.73Å; D44-R210 PolarHBondContact OD1-NH2 2.87Å; D44-R210 IonicContact OD2-CZ 2.67Å; D44-R210 IonicContact OD2-NE 2.6Å; D44-R210 PolarHBondContact OD2-NE 3.19Å; D44-R210 IonicContact OD2-NH2 2.98Å; D44-R210 PolarHBondContact OD2-NH2 3.43Å; H206-R210 VanDerWaalsContact O-CA 3.32Å; H206-R210 WeakPolarHBondContact O-CA 3.47Å; H206-R210 WeakPolarHBondContact O-CB 3.14Å; H206-R210 PolarHBondContact O-N 3.3Å; R210-N213 PolarHBondContact O-N 3.14Å; R210-Y214 HydrophobicContact CG-CE2 4.29Å; R210-Y214 WeakPolarHBondContact O-CD2 3.38Å; R210-Y214 PolarHBondContact O-N 3.1Å; R210-E262 WeakPolarHBondContact CD-O 3.36Å; R210-W263 PolarHBondContact NH1-O 2.93Å; R210-V511 PolarHBondContact NH1-O 2.95Å; R210-V511 VanDerWaalsContact NH1-O 3.08Å; R210-V511 PolarHBondContact NH2-O 3.48Å; R210-D513 PolarHBondContact NH1-O 3.4Å
211	F	95.6	Very high	95.1	Very high	23 Å²	23	9.9 Å²	9.9	10%	0.101	5%	0.046	C	C	.	.	H	α-helix	trans	-70.8	-32.5	-179.5	-55.4	-40.9	0	0	0	113.5	L209 Y214 M215 F252 F259 E262	L209-F211 PolarHBondContact O-N 2.68Å; L209-F211 VanDerWaalsContact O-N 3.17Å; F211-Y214 PolarHBondContact O-N 2.78Å; F211-M215 WeakPolarHBondContact O-CG 3.47Å; F211-M215 PolarHBondContact O-N 3.22Å; F211-F252 HydrophobicContact CB-CD1 4.24Å; F211-F252 HydrophobicContact CB-CD2 3.76Å; F211-F252 HydrophobicContact CB-CE1 4.33Å; F211-F252 HydrophobicContact CB-CE2 3.87Å; F211-F252 HydrophobicContact CB-CG 3.96Å; F211-F252 HydrophobicContact CB-CZ 4.17Å; F211-F252 HydrophobicContact CD1-CB 3.86Å; F211-F252 AromaticContact CD1-CD1 3.22Å; F211-F252 HydrophobicContact CD1-CD1 3.22Å; F211-F252 HydrophobicContact CD1-CD2 4.17Å; F211-F252 AromaticContact CD1-CE1 3.76Å; F211-F252 HydrophobicContact CD1-CE1 3.76Å; F211-F252 AromaticContact CD1-CG 3.46Å; F211-F252 HydrophobicContact CD1-CG 3.46Å; F211-F252 VanDerWaalsContact CD1-CG 3.46Å; F211-F252 HydrophobicContact CD1-CZ 4.44Å; F211-F252 HydrophobicContact CD2-CB 4.16Å; F211-F252 HydrophobicContact CD2-CG 4.31Å; F211-F252 HydrophobicContact CE1-CB 3.93Å; F211-F252 AromaticContact CE1-CD1 3.72Å; F211-F252 HydrophobicContact CE1-CD1 3.72Å; F211-F252 AromaticContact CE1-CG 3.99Å; F211-F252 HydrophobicContact CE1-CG 3.99Å; F211-F252 HydrophobicContact CE2-CB 4.22Å; F211-F252 HydrophobicContact CG-CB 3.98Å; F211-F252 AromaticContact CG-CD1 3.88Å; F211-F252 HydrophobicContact CG-CD1 3.88Å; F211-F252 AromaticContact CG-CD2 3.96Å; F211-F252 HydrophobicContact CG-CD2 3.96Å; F211-F252 HydrophobicContact CG-CE1 4.38Å; F211-F252 HydrophobicContact CG-CE2 4.47Å; F211-F252 AromaticContact CG-CG 3.65Å; F211-F252 HydrophobicContact CG-CG 3.65Å; F211-F252 HydrophobicContact CZ-CB 4.1Å; F211-F259 HydrophobicContact CE1-CD1 4.05Å; F211-F259 HydrophobicContact CE1-CD2 4.23Å; F211-F259 HydrophobicContact CE1-CE1 4.12Å; F211-F259 HydrophobicContact CE1-CE2 4.3Å; F211-F259 HydrophobicContact CE1-CG 4.14Å; F211-F259 HydrophobicContact CE1-CZ 4.25Å; F211-E262 HydrophobicContact CZ-CB 4.46Å; F211-E262 WeakPolarHBondContact CZ-O 3.48Å
212	K	96	Very high	95.2	Very high	56 Å²	56	11.2 Å²	11.2	24%	0.243	6%	0.059	C	C	.	.	H	α-helix	trans	-66.1	-39.1	175.9	-65.3	178.2	-175.8	172.9	0	111.5	L209 M215 V216 D343	L209-K212 HydrophobicContact CD2-CB 4.46Å; L209-K212 HydrophobicContact CD2-CD 3.72Å; L209-K212 CarbonylContact O-C 3.6Å; L209-K212 WeakPolarHBondContact O-CA 3.42Å; L209-K212 WeakPolarHBondContact O-CB 3.49Å; L209-K212 PolarHBondContact O-N 3.46Å; K212-M215 PolarHBondContact O-N 3.27Å; K212-V216 WeakPolarHBondContact O-CG2 3.48Å; K212-V216 PolarHBondContact O-N 2.98Å; K212-D343 IonicContact NZ-OD1 3.39Å; K212-D343 PolarHBondContact NZ-OD1 2.89Å; K212-D343 VanDerWaalsContact NZ-OD1 3.08Å; K212-D343 IonicContact NZ-OD2 3.25Å; K212-D343 PolarHBondContact NZ-OD2 3.1Å
213	N	97	Very high	95.2	Very high	3 Å²	3	11 Å²	11	2%	0.016	6%	0.058	C	C	.	.	H	α-helix	trans	-63.2	-40.9	175.1	-78	-24.6	0	0	0	111.9	L209 R210 V216 A217 N340 C515 A518	L209-N213 PolarHBondContact O-N 3.46Å; R210-N213 PolarHBondContact O-N 3.14Å; N213-V216 PolarHBondContact O-N 2.9Å; N213-A217 PolarHBondContact O-N 2.96Å; N213-N340 PolarHBondContact ND2-OD1 3.35Å; N213-N340 PolarHBondContact OD1-N 3.38Å; N213-C515 HydrophobicContact CB-CB 4.13Å; N213-A518 HydrophobicContact CB-CB 3.88Å; N213-A518 VanDerWaalsContact ND2-CB 3.35Å; N213-A518 WeakPolarHBondContact ND2-CB 3.45Å
214	Y	96.9	Very high	95.3	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-62	-44	170.3	-74.4	-70.2	0	0	0	111.9	R210 F211 V216 A217 M218 F252 F259 F500 F501 T505 T514 C515	R210-Y214 HydrophobicContact CG-CE2 4.29Å; R210-Y214 WeakPolarHBondContact O-CD2 3.38Å; R210-Y214 PolarHBondContact O-N 3.1Å; F211-Y214 PolarHBondContact O-N 2.78Å; Y214-V216 PolarHBondContact O-N 3.5Å; Y214-A217 PolarHBondContact O-N 2.87Å; Y214-M218 WeakPolarHBondContact O-CG 3.49Å; Y214-M218 PolarHBondContact O-N 2.98Å; Y214-F252 HydrophobicContact CD2-CE1 4.18Å; Y214-F252 HydrophobicContact CG-CE1 4.31Å; Y214-F259 HydrophobicContact CD2-CZ 4.34Å; Y214-F259 HydrophobicContact CE2-CE1 4.47Å; Y214-F259 HydrophobicContact CE2-CE2 4.46Å; Y214-F259 AromaticContact CE2-CZ 3.64Å; Y214-F259 HydrophobicContact CE2-CZ 3.64Å; Y214-F500 HydrophobicContact CD1-CE1 4.11Å; Y214-F500 HydrophobicContact CD1-CZ 4.42Å; Y214-F501 HydrophobicContact CD1-CD1 4.15Å; Y214-F501 AromaticContact CD1-CE1 3.58Å; Y214-F501 HydrophobicContact CD1-CE1 3.58Å; Y214-F501 HydrophobicContact CD1-CZ 4.34Å; Y214-F501 HydrophobicContact CD2-CE1 4.41Å; Y214-F501 AromaticContact CE1-CD1 3.96Å; Y214-F501 HydrophobicContact CE1-CD1 3.96Å; Y214-F501 AromaticContact CE1-CE1 3.78Å; Y214-F501 HydrophobicContact CE1-CE1 3.78Å; Y214-F501 AromaticContact CG-CE1 3.92Å; Y214-F501 HydrophobicContact CG-CE1 3.92Å; Y214-F501 HydrophobicContact CG-CZ 4.48Å; Y214-T505 PolarHBondContact OH-OG1 3.37Å; Y214-T514 PolarHBondContact OH-O 3.37Å; Y214-C515 HydrophobicContact CD1-CB 3.66Å; Y214-C515 HydrophobicContact CD2-CB 4.24Å; Y214-C515 HydrophobicContact CE1-CB 3.7Å; Y214-C515 HydrophobicContact CE2-CB 4.26Å; Y214-C515 HydrophobicContact CG-CB 3.95Å; Y214-C515 PolarHBondContact OH-N 2.91Å
215	M	96.8	Very high	95.2	Very high	3 Å²	3	11.8 Å²	11.8	2%	0.015	6%	0.063	C	C	.	.	H	α-helix	trans	-62.2	-39.7	176.7	-68.7	-61.3	-66.3	0	0	112.8	F211 K212 M218 V219 L224 Y239 F247 E248 F252	F211-M215 WeakPolarHBondContact O-CG 3.47Å; F211-M215 PolarHBondContact O-N 3.22Å; K212-M215 PolarHBondContact O-N 3.27Å; M215-M218 HydrophobicContact CG-CE 4.47Å; M215-M218 HydrophobicContact SD-CE 3.54Å; M215-M218 VanDerWaalsContact SD-CE 3.54Å; M215-V219 WeakPolarHBondContact O-CG2 3.42Å; M215-V219 PolarHBondContact O-N 3.12Å; M215-V219 VanDerWaalsContact O-N 3.12Å; M215-L224 HydrophobicContact CE-CD1 3.72Å; M215-L224 HydrophobicContact SD-CD1 4.43Å; M215-Y239 WeakPolarHBondContact CE-OH 3.47Å; M215-F247 HydrophobicContact CE-CB 3.89Å; M215-F247 HydrophobicContact CE-CD2 4.05Å; M215-F247 HydrophobicContact CE-CG 4.49Å; M215-F247 HydrophobicContact SD-CB 4.41Å; M215-E248 HydrophobicContact CG-CG 4.46Å; M215-E248 HydrophobicContact SD-CG 4.44Å; M215-F252 HydrophobicContact CG-CE2 3.95Å; M215-F252 HydrophobicContact CG-CZ 4.38Å; M215-F252 HydrophobicContact SD-CE2 3.9Å; M215-F252 HydrophobicContact SD-CZ 4.34Å
216	V	96.8	Very high	95.1	Very high	2 Å²	2	12.1 Å²	12.1	1%	0.012	7%	0.065	C	C	.	.	H	α-helix	trans	-63.8	-44.8	174.9	172.9	0	0	0	0	111.1	K212 N213 Y214 V219 N220 R337 F339	K212-V216 WeakPolarHBondContact O-CG2 3.48Å; K212-V216 PolarHBondContact O-N 2.98Å; N213-V216 PolarHBondContact O-N 2.9Å; Y214-V216 PolarHBondContact O-N 3.5Å; V216-V219 PolarHBondContact O-N 3.39Å; V216-N220 WeakPolarHBondContact O-CB 3.32Å; V216-N220 PolarHBondContact O-N 3.47Å; V216-R337 HydrophobicContact CG2-CB 4.22Å; V216-R337 HydrophobicContact CG2-CG 4.3Å; V216-F339 HydrophobicContact CB-CD1 4.4Å; V216-F339 HydrophobicContact CB-CE1 4.05Å; V216-F339 HydrophobicContact CG1-CD1 4.1Å; V216-F339 HydrophobicContact CG1-CE1 3.69Å; V216-F339 HydrophobicContact CG1-CZ 4.15Å
217	A	95.9	Very high	94.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.7	-45.8	177.8	0	0	0	0	0	112.3	N213 Y214 V219 N220 K221 F339 F500 F517	N213-A217 PolarHBondContact O-N 2.96Å; Y214-A217 PolarHBondContact O-N 2.87Å; A217-V219 VanDerWaalsContact C-N 3.28Å; A217-V219 PolarHBondContact O-N 3.06Å; A217-N220 PolarHBondContact O-N 3.18Å; A217-K221 PolarHBondContact O-N 3.03Å; A217-F339 HydrophobicContact CB-CE1 3.93Å; A217-F339 HydrophobicContact CB-CZ 4.21Å; A217-F500 HydrophobicContact CB-CE2 4.13Å; A217-F500 HydrophobicContact CB-CZ 3.83Å; A217-F517 HydrophobicContact CB-CD2 3.78Å; A217-F517 HydrophobicContact CB-CE2 4.32Å; A217-F517 HydrophobicContact CB-CG 4.48Å
218	M	95.8	Very high	94.8	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.1	-26.7	178.8	-68.2	-173.1	-69.1	0	0	113.4	Y214 M215 S222 L223 L224 F251 F252 F500 F501	Y214-M218 WeakPolarHBondContact O-CG 3.49Å; Y214-M218 PolarHBondContact O-N 2.98Å; M215-M218 HydrophobicContact CG-CE 4.47Å; M215-M218 HydrophobicContact SD-CE 3.54Å; M215-M218 VanDerWaalsContact SD-CE 3.54Å; M218-S222 PolarHBondContact O-N 3.36Å; M218-L223 HydrophobicContact CB-CB 4.34Å; M218-L223 HydrophobicContact CG-CD1 4.22Å; M218-L223 PolarHBondContact O-N 3.38Å; M218-L224 HydrophobicContact CB-CD1 4.17Å; M218-L224 HydrophobicContact CB-CD2 4.44Å; M218-L224 HydrophobicContact CB-CG 3.97Å; M218-L224 PolarHBondContact O-N 3.28Å; M218-L224 HydrophobicContact SD-CD2 4.44Å; M218-F251 HydrophobicContact CE-CD2 3.89Å; M218-F251 HydrophobicContact CE-CE2 4.23Å; M218-F251 HydrophobicContact SD-CD2 4.41Å; M218-F251 HydrophobicContact SD-CE2 4.39Å; M218-F252 HydrophobicContact CE-CZ 4.13Å; M218-F500 HydrophobicContact CG-CD1 3.95Å; M218-F500 HydrophobicContact CG-CE1 3.41Å; M218-F500 VanDerWaalsContact CG-CE1 3.41Å; M218-F500 HydrophobicContact CG-CE2 4.37Å; M218-F500 HydrophobicContact CG-CZ 3.66Å; M218-F500 HydrophobicContact SD-CD1 4.34Å; M218-F500 HydrophobicContact SD-CE1 4.04Å; M218-F501 HydrophobicContact CE-CZ 4.28Å; M218-F501 HydrophobicContact SD-CE2 3.89Å; M218-F501 HydrophobicContact SD-CZ 4.13Å
219	V	94.9	Very high	94.5	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-76.2	-45.6	171	171.5	0	0	0	0	111.4	M215 V216 A217 S222 L224 Y331 C334	M215-V219 WeakPolarHBondContact O-CG2 3.42Å; M215-V219 PolarHBondContact O-N 3.12Å; M215-V219 VanDerWaalsContact O-N 3.12Å; V216-V219 PolarHBondContact O-N 3.39Å; A217-V219 VanDerWaalsContact C-N 3.28Å; A217-V219 PolarHBondContact O-N 3.06Å; V219-S222 PolarHBondContact O-N 2.98Å; V219-S222 VanDerWaalsContact O-N 3.1Å; V219-L224 HydrophobicContact CG2-CD1 3.95Å; V219-Y331 HydrophobicContact CG1-CD2 4.38Å; V219-Y331 HydrophobicContact CG1-CE2 4.06Å; V219-C334 HydrophobicContact CG1-CB 4.39Å; V219-C334 HydrophobicContact CG2-CB 4.23Å
220	N	93.8	Very high	94.1	Very high	11 Å²	11	33.4 Å²	33.4	6%	0.059	15%	0.151	C	C	.	.	H	α-helix	trans	-60.2	-48.1	177.8	177.3	-110	0	0	0	111.4	V216 A217 S222 E545 K548	V216-N220 WeakPolarHBondContact O-CB 3.32Å; V216-N220 PolarHBondContact O-N 3.47Å; A217-N220 PolarHBondContact O-N 3.18Å; N220-S222 PolarHBondContact O-N 3.46Å; N220-S222 VanDerWaalsContact O-N 3.14Å; N220-E545 PolarHBondContact ND2-O 2.59Å; N220-E545 PolarHBondContact OD1-N 3.42Å; N220-E545 VanDerWaalsContact OD1-N 3.1Å; N220-K548 HydrophobicContact CB-CD 4.23Å
221	K	93.4	Very high	93.5	Very high	33 Å²	33	39.8 Å²	39.8	14%	0.143	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	7.8	174.3	-74.5	-71.8	179.9	-176.2	0	115	A217 L223 I540 Y541 Q543 E545	A217-K221 PolarHBondContact O-N 3.03Å; K221-L223 HydrophobicContact CB-CD1 4.3Å; K221-L223 HydrophobicContact CB-CG 4.1Å; K221-L223 PolarHBondContact O-N 3.45Å; K221-L223 VanDerWaalsContact O-N 3.09Å; K221-I540 PolarHBondContact NZ-O 3.27Å; K221-Y541 VanDerWaalsContact CE-O 3.3Å; K221-Y541 WeakPolarHBondContact CE-O 3.4Å; K221-Y541 PolarHBondContact NZ-O 3Å; K221-Q543 WeakPolarHBondContact CE-O 3.46Å; K221-Q543 PolarHBondContact NZ-O 3.46Å; K221-E545 WeakPolarHBondContact CE-OE1 3.33Å; K221-E545 IonicContact NZ-OE1 3.04Å; K221-E545 PolarHBondContact NZ-OE1 3.23Å
222	S	93.3	Very high	93	Very high	56 Å²	56	45.4 Å²	45.4	39%	0.392	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	32.8	176.7	-60.6	0	0	0	0	114.7	M218 V219 N220 K493	M218-S222 PolarHBondContact O-N 3.36Å; V219-S222 PolarHBondContact O-N 2.98Å; V219-S222 VanDerWaalsContact O-N 3.1Å; N220-S222 PolarHBondContact O-N 3.46Å; N220-S222 VanDerWaalsContact O-N 3.14Å; S222-K493 PolarHBondContact O-NZ 3.34Å; S222-K493 VanDerWaalsContact O-NZ 3.15Å
223	L	93.5	Very high	92.2	Very high	15 Å²	15	49.1 Å²	49.1	8%	0.079	25%	0.251	C	S	.	.			trans	-77.4	-34.4	177.4	-64.1	175.6	0	0	0	111.3	M218 K221 K493 E496 F500	M218-L223 HydrophobicContact CB-CB 4.34Å; M218-L223 HydrophobicContact CG-CD1 4.22Å; M218-L223 PolarHBondContact O-N 3.38Å; K221-L223 HydrophobicContact CB-CD1 4.3Å; K221-L223 HydrophobicContact CB-CG 4.1Å; K221-L223 PolarHBondContact O-N 3.45Å; K221-L223 VanDerWaalsContact O-N 3.09Å; L223-K493 WeakPolarHBondContact O-CD 3.46Å; L223-E496 HydrophobicContact CD2-CB 4.12Å; L223-F500 HydrophobicContact CD1-CB 3.62Å; L223-F500 HydrophobicContact CD1-CD1 4.11Å; L223-F500 HydrophobicContact CD1-CD2 3.33Å; L223-F500 HydrophobicContact CD1-CE2 4Å; L223-F500 HydrophobicContact CD1-CG 3.41Å; L223-F500 VanDerWaalsContact CD1-CG 3.41Å
224	L	94.3	Very high	91.7	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.026	27%	0.266	C	S	.	.	S	Bend	trans	-80.5	128.9	176.5	-57.7	178.6	0	0	0	110.8	M215 M218 V219 V226 F247 F251 L490	M215-L224 HydrophobicContact CE-CD1 3.72Å; M215-L224 HydrophobicContact SD-CD1 4.43Å; M218-L224 HydrophobicContact CB-CD1 4.17Å; M218-L224 HydrophobicContact CB-CD2 4.44Å; M218-L224 HydrophobicContact CB-CG 3.97Å; M218-L224 PolarHBondContact O-N 3.28Å; M218-L224 HydrophobicContact SD-CD2 4.44Å; V219-L224 HydrophobicContact CG2-CD1 3.95Å; L224-V226 VanDerWaalsContact C-N 3.33Å; L224-V226 HydrophobicContact CB-CG1 4.16Å; L224-V226 PolarHBondContact O-N 2.94Å; L224-F247 HydrophobicContact CB-CE2 4.02Å; L224-F247 HydrophobicContact CB-CZ 4.4Å; L224-F247 HydrophobicContact CD1-CD2 3.78Å; L224-F247 HydrophobicContact CD1-CE2 3.95Å; L224-F247 HydrophobicContact CD2-CD2 4.14Å; L224-F247 HydrophobicContact CD2-CE2 4.19Å; L224-F247 HydrophobicContact CD2-CG 4.36Å; L224-F247 HydrophobicContact CD2-CZ 4.46Å; L224-F247 HydrophobicContact CG-CD2 4.4Å; L224-F247 HydrophobicContact CG-CE2 4.27Å; L224-F251 HydrophobicContact CD2-CE2 3.81Å; L224-F251 HydrophobicContact CD2-CZ 4.19Å; L224-L490 HydrophobicContact CD2-CD1 4.29Å
225	P	92.3	Very high	91.3	Very high	18 Å²	18	54.7 Å²	54.7	12%	0.117	29%	0.288	C	S	.	.			trans	-74.9	85.5	177.9	31.4	-34.4	0	0	0	110.1	F228 I485 C489 L490	P225-F228 HydrophobicContact CB-CZ 4.34Å; P225-F228 WeakPolarHBondContact O-CE2 3.14Å; P225-F228 WeakPolarHBondContact O-CZ 3.49Å; P225-I485 HydrophobicContact CG-CG2 4.03Å; P225-C489 HydrophobicContact CB-CB 3.83Å; P225-C489 HydrophobicContact CG-CB 3.97Å; P225-L490 HydrophobicContact CG-CB 4.11Å; P225-L490 HydrophobicContact CG-CD1 4.06Å
226	V	92.3	Very high	90.9	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.042	30%	0.298	C	S	.	.			trans	-113.5	-15.9	178.2	-60.5	0	0	0	0	113.6	L224 V237 F238 Y239 F247 Y331	L224-V226 VanDerWaalsContact C-N 3.33Å; L224-V226 HydrophobicContact CB-CG1 4.16Å; L224-V226 PolarHBondContact O-N 2.94Å; V226-V237 HydrophobicContact CB-CG1 4.49Å; V226-V237 CarbonylContact O-C 3.57Å; V226-V237 VanDerWaalsContact O-CA 3.29Å; V226-V237 WeakPolarHBondContact O-CA 3.44Å; V226-V237 WeakPolarHBondContact O-CG1 3.22Å; V226-F238 PolarHBondContact O-N 3.17Å; V226-Y239 HydrophobicContact CG1-CD2 3.69Å; V226-Y239 HydrophobicContact CG1-CE2 4.43Å; V226-Y239 HydrophobicContact CG1-CG 4.04Å; V226-F247 HydrophobicContact CG1-CE2 4.39Å; V226-Y331 HydrophobicContact CG2-CD2 4.13Å; V226-Y331 HydrophobicContact CG2-CE2 4.12Å
227	R	91.6	Very high	90.8	Very high	140 Å²	140	56.9 Å²	56.9	53%	0.528	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.5	177.2	-56.1	-172	-176.9	160.2	3.1	109.9	V237 Y331	R227-V237 HydrophobicContact CG-CG2 4.29Å; R227-Y331 PolarHBondContact NH2-OH 3.48Å
228	F	91.1	Very high	90.8	Very high	51 Å²	51	58.1 Å²	58.1	22%	0.224	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	133.8	-176.1	-60.5	-80.5	0	0	0	111.4	P225 S236 F238 I485	P225-F228 HydrophobicContact CB-CZ 4.34Å; P225-F228 WeakPolarHBondContact O-CE2 3.14Å; P225-F228 WeakPolarHBondContact O-CZ 3.49Å; F228-S236 PolarHBondContact N-O 2.77Å; F228-S236 PolarHBondContact O-N 3.25Å; F228-F238 HydrophobicContact CD2-CB 4.08Å; F228-F238 HydrophobicContact CE2-CB 4.1Å; F228-I485 HydrophobicContact CE1-CG1 4.35Å; F228-I485 HydrophobicContact CE2-CD1 3.69Å; F228-I485 HydrophobicContact CE2-CG1 4.28Å; F228-I485 HydrophobicContact CZ-CD1 3.61Å; F228-I485 HydrophobicContact CZ-CG1 3.69Å; F228-I485 HydrophobicContact CZ-CG2 4.09Å
229	R	89.8	Confident	90.8	Very high	193 Å²	193	58.4 Å²	58.4	73%	0.728	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	105.4	173.5	-174	164.4	-69.2	174.2	-1.8	110.1	D235	R229-D235 VanDerWaalsContact CB-OD1 3.29Å; R229-D235 WeakPolarHBondContact CB-OD1 3.09Å; R229-D235 WeakPolarHBondContact CG-OD1 3.12Å; R229-D235 IonicContact CZ-OD1 2.69Å; R229-D235 IonicContact CZ-OD2 3.68Å; R229-D235 IonicContact NE-OD1 3.84Å; R229-D235 PolarHBondContact NE-OD1 3.42Å; R229-D235 IonicContact NE-OD2 2.7Å; R229-D235 IonicContact NH2-OD1 2.69Å; R229-D235 PolarHBondContact NH2-OD1 3.49Å; R229-D235 IonicContact NH2-OD2 3.85Å; R229-D235 PolarHBondContact NH2-OD2 2.87Å
230	L	88.2	Confident	90.9	Very high	75 Å²	75	58.1 Å²	58.1	39%	0.393	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.7	178	-64.8	179.4	0	0	0	110.3	V232 L233 G234	L230-V232 PolarHBondContact O-N 3.13Å; L230-L233 HydrophobicContact CB-CB 4.02Å; L230-L233 HydrophobicContact CD1-CB 4.15Å; L230-L233 HydrophobicContact CD1-CD1 3.87Å; L230-L233 PolarHBondContact O-N 2.89Å; L230-G234 PolarHBondContact N-O 3.39Å; L230-G234 PolarHBondContact O-N 2.92Å
231	P	84.2	Confident	91	Very high	137 Å²	137	65.6 Å²	65.6	89%	0.89	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21	-173.3	-28.3	35.7	0	0	0	116.6
232	V	84	Confident	91	Very high	142 Å²	142	65.2 Å²	65.2	86%	0.861	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-32	-178.4	-176.8	0	0	0	0	112.5	L230	L230-V232 PolarHBondContact O-N 3.13Å
233	L	79.3	Confident	91.2	Very high	133 Å²	133	62.5 Å²	62.5	70%	0.696	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-3.8	-174.5	-72.5	154.2	0	0	0	113.4	L230	L230-L233 HydrophobicContact CB-CB 4.02Å; L230-L233 HydrophobicContact CD1-CB 4.15Å; L230-L233 HydrophobicContact CD1-CD1 3.87Å; L230-L233 PolarHBondContact O-N 2.89Å
234	G	87.3	Confident	91.3	Very high	33 Å²	33	64.1 Å²	64.1	34%	0.34	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	69.4	-149	-178.3	0	0	0	0	0	112.8	L230 S236	L230-G234 PolarHBondContact N-O 3.39Å; L230-G234 PolarHBondContact O-N 2.92Å; G234-S236 PolarHBondContact O-N 3.28Å; G234-S236 VanDerWaalsContact O-N 3.14Å
235	D	88.1	Confident	91.4	Very high	88 Å²	88	69.9 Å²	69.9	47%	0.471	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	99.9	179.8	-71.4	-24.2	0	0	0	110.7	R229 Q463	R229-D235 VanDerWaalsContact CB-OD1 3.29Å; R229-D235 WeakPolarHBondContact CB-OD1 3.09Å; R229-D235 WeakPolarHBondContact CG-OD1 3.12Å; R229-D235 IonicContact CZ-OD1 2.69Å; R229-D235 IonicContact CZ-OD2 3.68Å; R229-D235 IonicContact NE-OD1 3.84Å; R229-D235 PolarHBondContact NE-OD1 3.42Å; R229-D235 IonicContact NE-OD2 2.7Å; R229-D235 IonicContact NH2-OD1 2.69Å; R229-D235 PolarHBondContact NH2-OD1 3.49Å; R229-D235 IonicContact NH2-OD2 3.85Å; R229-D235 PolarHBondContact NH2-OD2 2.87Å; D235-Q463 PolarHBondContact O-NE2 2.93Å
236	S	89.4	Confident	91.6	Very high	32 Å²	32	69.3 Å²	69.3	22%	0.224	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	153.5	-179	-59.6	0	0	0	0	111.1	F228 G234	F228-S236 PolarHBondContact N-O 2.77Å; F228-S236 PolarHBondContact O-N 3.25Å; G234-S236 PolarHBondContact O-N 3.28Å; G234-S236 VanDerWaalsContact O-N 3.14Å
237	V	94.3	Very high	91.8	Very high	18 Å²	18	69 Å²	69	11%	0.109	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.4	175.9	-176.7	0	0	0	0	109	V226 R227 Y331 Q463	V226-V237 HydrophobicContact CB-CG1 4.49Å; V226-V237 CarbonylContact O-C 3.57Å; V226-V237 VanDerWaalsContact O-CA 3.29Å; V226-V237 WeakPolarHBondContact O-CA 3.44Å; V226-V237 WeakPolarHBondContact O-CG1 3.22Å; R227-V237 HydrophobicContact CG-CG2 4.29Å; V237-Y331 HydrophobicContact CG1-CD1 3.9Å; V237-Y331 HydrophobicContact CG1-CD2 3.82Å; V237-Y331 HydrophobicContact CG1-CE1 4.41Å; V237-Y331 HydrophobicContact CG1-CE2 4.34Å; V237-Y331 HydrophobicContact CG1-CG 3.58Å; V237-Q463 HydrophobicContact CB-CB 4.48Å; V237-Q463 HydrophobicContact CG2-CB 3.97Å; V237-Q463 VanDerWaalsContact CG2-CD 3.48Å; V237-Q463 HydrophobicContact CG2-CG 3.84Å
238	F	95.4	Very high	92	Very high	26 Å²	26	63.3 Å²	63.3	11%	0.114	32%	0.324	C	S	.	.			trans	-123	105.9	179.5	-167.8	-91.3	0	0	0	110	V226 F228 T240 L243 E474 V481 I485	V226-F238 PolarHBondContact O-N 3.17Å; F228-F238 HydrophobicContact CD2-CB 4.08Å; F228-F238 HydrophobicContact CE2-CB 4.1Å; F238-T240 HydrophobicContact CD1-CG2 4.4Å; F238-T240 HydrophobicContact CE1-CG2 3.73Å; F238-T240 HydrophobicContact CE2-CG2 4Å; F238-T240 HydrophobicContact CZ-CG2 3.5Å; F238-L243 HydrophobicContact CD1-CD2 4.37Å; F238-E474 HydrophobicContact CD2-CG 4.35Å; F238-E474 HydrophobicContact CE2-CB 4.23Å; F238-E474 HydrophobicContact CE2-CG 4.26Å; F238-V481 HydrophobicContact CD1-CG1 3.84Å; F238-V481 HydrophobicContact CE1-CB 3.82Å; F238-V481 HydrophobicContact CE1-CG1 3.55Å; F238-V481 HydrophobicContact CE2-CB 4.48Å; F238-V481 HydrophobicContact CE2-CG1 4.36Å; F238-V481 HydrophobicContact CG-CG1 4.36Å; F238-V481 HydrophobicContact CZ-CB 3.75Å; F238-V481 HydrophobicContact CZ-CG1 3.84Å; F238-V481 HydrophobicContact CZ-CG2 4.27Å; F238-I485 HydrophobicContact CD1-CD1 3.57Å; F238-I485 HydrophobicContact CE1-CD1 4.17Å; F238-I485 HydrophobicContact CG-CD1 4.42Å
239	Y	96.4	Very high	92.2	Very high	7 Å²	7	63.1 Å²	63.1	3%	0.027	33%	0.325	C	S	.	.			trans	-148.6	89.2	179.3	-175.5	-123.4	0	0	0	110.5	M215 V226 L243 K244 F247 L330 C334	M215-Y239 WeakPolarHBondContact CE-OH 3.47Å; V226-Y239 HydrophobicContact CG1-CD2 3.69Å; V226-Y239 HydrophobicContact CG1-CE2 4.43Å; V226-Y239 HydrophobicContact CG1-CG 4.04Å; Y239-L243 HydrophobicContact CD2-CD2 4.39Å; Y239-K244 HydrophobicContact CE2-CB 3.92Å; Y239-F247 HydrophobicContact CD2-CE2 4.13Å; Y239-F247 AromaticContact CE2-CD2 3.87Å; Y239-F247 HydrophobicContact CE2-CD2 3.87Å; Y239-F247 AromaticContact CE2-CE2 3.84Å; Y239-F247 HydrophobicContact CE2-CE2 3.84Å; Y239-L330 HydrophobicContact CD1-CB 4.24Å; Y239-L330 HydrophobicContact CD1-CD2 4.2Å; Y239-L330 HydrophobicContact CD1-CG 3.88Å; Y239-L330 HydrophobicContact CE1-CD2 4.21Å; Y239-L330 HydrophobicContact CE1-CG 3.85Å; Y239-L330 WeakPolarHBondContact O-CB 3.48Å; Y239-C334 HydrophobicContact CE1-CB 4.37Å
240	T	96.4	Very high	92.5	Very high	1 Å²	1	54 Å²	54	1%	0.006	29%	0.29	C	S	.	.			trans	-92.1	166.9	-177.1	59.6	0	0	0	0	112.1	F238 G242 L243 K244 L330 E474 S478	F238-T240 HydrophobicContact CD1-CG2 4.4Å; F238-T240 HydrophobicContact CE1-CG2 3.73Å; F238-T240 HydrophobicContact CE2-CG2 4Å; F238-T240 HydrophobicContact CZ-CG2 3.5Å; T240-G242 PolarHBondContact O-N 2.93Å; T240-L243 PolarHBondContact O-N 2.9Å; T240-L243 WeakPolarHBondContact OG1-CB 3.42Å; T240-L243 PolarHBondContact OG1-N 2.99Å; T240-L243 VanDerWaalsContact OG1-N 3.13Å; T240-K244 WeakPolarHBondContact O-CB 3.41Å; T240-K244 PolarHBondContact O-N 3.45Å; T240-L330 VanDerWaalsContact C-CD2 3.45Å; T240-E474 HydrophobicContact CG2-CB 4.1Å; T240-E474 WeakPolarHBondContact CG2-O 3.49Å; T240-S478 VanDerWaalsContact CB-OG 3.31Å; T240-S478 WeakPolarHBondContact CB-OG 3.32Å; T240-S478 PolarHBondContact OG1-OG 3.18Å
241	R	95.7	Very high	92.9	Very high	168 Å²	168	50.4 Å²	50.4	63%	0.634	27%	0.272	S	S	*	.	H	α-helix	trans	-57.2	-39.9	171.2	-68.5	167	-173.3	-159.3	5.3	111.4	K244 Y245 L330 E475	R241-K244 PolarHBondContact O-N 2.93Å; R241-Y245 WeakPolarHBondContact O-CB 3.39Å; R241-Y245 PolarHBondContact O-N 2.88Å; R241-L330 HydrophobicContact CG-CD2 4.24Å; R241-E475 WeakPolarHBondContact CB-OE1 3.39Å; R241-E475 WeakPolarHBondContact CG-OE1 3.39Å; R241-E475 PolarHBondContact N-OE1 3.48Å; R241-E475 PolarHBondContact N-OE2 3.27Å
242	G	95	Very high	93.4	Very high	24 Å²	24	44.2 Å²	44.2	25%	0.247	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-42.8	177	0	0	0	0	0	113.5	T240 N246	T240-G242 PolarHBondContact O-N 2.93Å; G242-N246 PolarHBondContact O-N 2.88Å; G242-N246 PolarHBondContact O-ND2 3.03Å
243	L	96.1	Very high	93.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.3	-42.8	176	-175.8	61.4	0	0	0	111.5	F238 Y239 T240 N246 F247 T482 I485 L486	F238-L243 HydrophobicContact CD1-CD2 4.37Å; Y239-L243 HydrophobicContact CD2-CD2 4.39Å; T240-L243 PolarHBondContact O-N 2.9Å; T240-L243 WeakPolarHBondContact OG1-CB 3.42Å; T240-L243 PolarHBondContact OG1-N 2.99Å; T240-L243 VanDerWaalsContact OG1-N 3.13Å; L243-N246 PolarHBondContact O-N 3.48Å; L243-F247 HydrophobicContact CD1-CD1 4.37Å; L243-F247 HydrophobicContact CD1-CE1 3.62Å; L243-F247 HydrophobicContact CD1-CE2 4.3Å; L243-F247 HydrophobicContact CD1-CZ 3.6Å; L243-F247 HydrophobicContact CD2-CE2 4.19Å; L243-F247 HydrophobicContact CD2-CZ 3.92Å; L243-F247 HydrophobicContact CG-CD2 4.46Å; L243-F247 HydrophobicContact CG-CE1 4.06Å; L243-F247 HydrophobicContact CG-CE2 3.8Å; L243-F247 HydrophobicContact CG-CZ 3.58Å; L243-F247 WeakPolarHBondContact O-CG 3.33Å; L243-F247 PolarHBondContact O-N 3.36Å; L243-T482 HydrophobicContact CD1-CG2 4.02Å; L243-I485 HydrophobicContact CD1-CB 4.37Å; L243-I485 HydrophobicContact CD1-CG2 3.99Å; L243-I485 HydrophobicContact CD2-CD1 3.97Å; L243-I485 HydrophobicContact CD2-CG2 4.25Å; L243-L486 HydrophobicContact CD1-CD2 4.24Å
244	K	96.8	Very high	94.2	Very high	48 Å²	48	37.9 Å²	37.9	21%	0.209	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-48.4	174.4	177.4	174.9	-178.8	-78	0	112.1	Y239 T240 R241 N246 F247 E248 L330	Y239-K244 HydrophobicContact CE2-CB 3.92Å; T240-K244 WeakPolarHBondContact O-CB 3.41Å; T240-K244 PolarHBondContact O-N 3.45Å; R241-K244 PolarHBondContact O-N 2.93Å; K244-N246 VanDerWaalsContact C-N 3.27Å; K244-N246 PolarHBondContact O-N 3.33Å; K244-F247 PolarHBondContact O-N 2.89Å; K244-F247 VanDerWaalsContact O-N 3.11Å; K244-E248 WeakPolarHBondContact CE-OE1 3.48Å; K244-E248 IonicContact NZ-OE1 3.69Å; K244-E248 PolarHBondContact NZ-OE1 2.92Å; K244-E248 IonicContact NZ-OE2 3.42Å; K244-E248 PolarHBondContact NZ-OE2 3.23Å; K244-E248 PolarHBondContact O-N 3.06Å; K244-L330 HydrophobicContact CB-CD2 4.15Å; K244-L330 HydrophobicContact CD-CD1 4.39Å; K244-L330 HydrophobicContact CD-CD2 4.22Å
245	Y	96.3	Very high	94.1	Very high	126 Å²	126	42.7 Å²	42.7	49%	0.494	22%	0.221	S	C	.	.	H	α-helix	trans	-58.2	-41.3	178.2	174.2	-98.4	0	0	0	111.5	R241 E248 L249 W253	R241-Y245 WeakPolarHBondContact O-CB 3.39Å; R241-Y245 PolarHBondContact O-N 2.88Å; Y245-E248 PolarHBondContact O-N 3.24Å; Y245-L249 HydrophobicContact CE1-CD2 4.19Å; Y245-L249 VanDerWaalsContact O-CB 3.3Å; Y245-L249 WeakPolarHBondContact O-CB 3.42Å; Y245-L249 PolarHBondContact O-N 2.66Å; Y245-W253 AromaticContact CD2-CZ3 3.85Å; Y245-W253 HydrophobicContact CD2-CZ3 3.85Å; Y245-W253 HydrophobicContact CE2-CE3 4.35Å; Y245-W253 AromaticContact CE2-CZ3 3.75Å; Y245-W253 HydrophobicContact CE2-CZ3 3.75Å
246	N	96.9	Very high	93.9	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-39.1	174.9	-86.3	-75.4	0	0	0	113	G242 L243 K244 L249 I250 I289 N293 T482 L486	G242-N246 PolarHBondContact O-N 2.88Å; G242-N246 PolarHBondContact O-ND2 3.03Å; L243-N246 PolarHBondContact O-N 3.48Å; K244-N246 VanDerWaalsContact C-N 3.27Å; K244-N246 PolarHBondContact O-N 3.33Å; N246-L249 PolarHBondContact O-N 3.1Å; N246-I250 WeakPolarHBondContact O-CB 3.34Å; N246-I250 VanDerWaalsContact O-CD1 3.32Å; N246-I250 WeakPolarHBondContact O-CD1 3.2Å; N246-I250 WeakPolarHBondContact O-CG1 3.38Å; N246-I250 PolarHBondContact O-N 3.13Å; N246-I289 WeakPolarHBondContact OD1-CG2 3.44Å; N246-N293 PolarHBondContact ND2-OD1 2.95Å; N246-N293 PolarHBondContact OD1-ND2 3.17Å; N246-N293 PolarHBondContact OD1-OD1 3.06Å; N246-T482 HydrophobicContact CB-CG2 4.43Å; N246-L486 HydrophobicContact CB-CD1 3.97Å; N246-L486 HydrophobicContact CB-CD2 4.4Å
247	F	96.3	Very high	94.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-44.3	172.8	-64.3	-22.9	0	0	0	111.9	M215 L224 V226 Y239 L243 K244 L249 I250 F251 L486 L490	M215-F247 HydrophobicContact CE-CB 3.89Å; M215-F247 HydrophobicContact CE-CD2 4.05Å; M215-F247 HydrophobicContact CE-CG 4.49Å; M215-F247 HydrophobicContact SD-CB 4.41Å; L224-F247 HydrophobicContact CB-CE2 4.02Å; L224-F247 HydrophobicContact CB-CZ 4.4Å; L224-F247 HydrophobicContact CD1-CD2 3.78Å; L224-F247 HydrophobicContact CD1-CE2 3.95Å; L224-F247 HydrophobicContact CD2-CD2 4.14Å; L224-F247 HydrophobicContact CD2-CE2 4.19Å; L224-F247 HydrophobicContact CD2-CG 4.36Å; L224-F247 HydrophobicContact CD2-CZ 4.46Å; L224-F247 HydrophobicContact CG-CD2 4.4Å; L224-F247 HydrophobicContact CG-CE2 4.27Å; V226-F247 HydrophobicContact CG1-CE2 4.39Å; Y239-F247 HydrophobicContact CD2-CE2 4.13Å; Y239-F247 AromaticContact CE2-CD2 3.87Å; Y239-F247 HydrophobicContact CE2-CD2 3.87Å; Y239-F247 AromaticContact CE2-CE2 3.84Å; Y239-F247 HydrophobicContact CE2-CE2 3.84Å; L243-F247 HydrophobicContact CD1-CD1 4.37Å; L243-F247 HydrophobicContact CD1-CE1 3.62Å; L243-F247 HydrophobicContact CD1-CE2 4.3Å; L243-F247 HydrophobicContact CD1-CZ 3.6Å; L243-F247 HydrophobicContact CD2-CE2 4.19Å; L243-F247 HydrophobicContact CD2-CZ 3.92Å; L243-F247 HydrophobicContact CG-CD2 4.46Å; L243-F247 HydrophobicContact CG-CE1 4.06Å; L243-F247 HydrophobicContact CG-CE2 3.8Å; L243-F247 HydrophobicContact CG-CZ 3.58Å; L243-F247 WeakPolarHBondContact O-CG 3.33Å; L243-F247 PolarHBondContact O-N 3.36Å; K244-F247 PolarHBondContact O-N 2.89Å; K244-F247 VanDerWaalsContact O-N 3.11Å; F247-L249 VanDerWaalsContact C-N 3.35Å; F247-L249 PolarHBondContact O-N 2.71Å; F247-I250 PolarHBondContact O-N 2.63Å; F247-F251 HydrophobicContact CB-CD2 4.17Å; F247-F251 HydrophobicContact CB-CE2 3.86Å; F247-F251 HydrophobicContact CD1-CE2 4.44Å; F247-F251 HydrophobicContact CG-CE2 4.29Å; F247-F251 WeakPolarHBondContact O-CD2 3.32Å; F247-F251 WeakPolarHBondContact O-CG 3.01Å; F247-F251 PolarHBondContact O-N 3.49Å; F247-L486 HydrophobicContact CD1-CD2 4.2Å; F247-L486 HydrophobicContact CE1-CD2 3.98Å; F247-L490 HydrophobicContact CD1-CD1 4.42Å; F247-L490 HydrophobicContact CD1-CD2 3.95Å; F247-L490 HydrophobicContact CE1-CD1 3.91Å; F247-L490 HydrophobicContact CE1-CD2 3.87Å; F247-L490 HydrophobicContact CE1-CG 4.37Å
248	E	95.7	Very high	94.1	Very high	20 Å²	20	38.3 Å²	38.3	9%	0.093	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-38.3	177.9	-69.4	174.6	141.7	0	0	112	M215 K244 Y245 F252 W253	M215-E248 HydrophobicContact CG-CG 4.46Å; M215-E248 HydrophobicContact SD-CG 4.44Å; K244-E248 WeakPolarHBondContact CE-OE1 3.48Å; K244-E248 IonicContact NZ-OE1 3.69Å; K244-E248 PolarHBondContact NZ-OE1 2.92Å; K244-E248 IonicContact NZ-OE2 3.42Å; K244-E248 PolarHBondContact NZ-OE2 3.23Å; K244-E248 PolarHBondContact O-N 3.06Å; Y245-E248 PolarHBondContact O-N 3.24Å; E248-F252 HydrophobicContact CB-CD2 4.24Å; E248-F252 HydrophobicContact CG-CD2 4.28Å; E248-F252 HydrophobicContact CG-CE2 4.36Å; E248-F252 PolarHBondContact O-N 2.91Å; E248-W253 HydrophobicContact CB-CD2 4.46Å; E248-W253 HydrophobicContact CB-CE3 4.04Å; E248-W253 HydrophobicContact CB-CH2 3.67Å; E248-W253 HydrophobicContact CB-CZ2 4.12Å; E248-W253 HydrophobicContact CB-CZ3 3.62Å; E248-W253 HydrophobicContact CG-CH2 4.45Å; E248-W253 PolarHBondContact O-N 3.32Å
249	L	95.8	Very high	94	Very high	48 Å²	48	37.3 Å²	37.3	25%	0.251	20%	0.199	S	C	.	.	H	α-helix	trans	-65.5	-38.2	171.8	-179.8	61.8	0	0	0	112.9	Y245 N246 F247 W253 R285	Y245-L249 HydrophobicContact CE1-CD2 4.19Å; Y245-L249 VanDerWaalsContact O-CB 3.3Å; Y245-L249 WeakPolarHBondContact O-CB 3.42Å; Y245-L249 PolarHBondContact O-N 2.66Å; N246-L249 PolarHBondContact O-N 3.1Å; F247-L249 VanDerWaalsContact C-N 3.35Å; F247-L249 PolarHBondContact O-N 2.71Å; L249-W253 HydrophobicContact CB-CE3 4.43Å; L249-W253 HydrophobicContact CD1-CB 4.29Å; L249-R285 PolarHBondContact O-NH2 2.83Å
250	I	95.8	Very high	93.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-71.1	-46.3	177.6	-70.6	160.5	0	0	0	110.4	N246 F247 L282 R285 I286 I289 L486 L490	N246-I250 WeakPolarHBondContact O-CB 3.34Å; N246-I250 VanDerWaalsContact O-CD1 3.32Å; N246-I250 WeakPolarHBondContact O-CD1 3.2Å; N246-I250 WeakPolarHBondContact O-CG1 3.38Å; N246-I250 PolarHBondContact O-N 3.13Å; F247-I250 PolarHBondContact O-N 2.63Å; I250-L282 HydrophobicContact CG2-CD1 3.95Å; I250-R285 PolarHBondContact O-NH1 3.08Å; I250-I286 HydrophobicContact CD1-CG1 4.32Å; I250-I286 HydrophobicContact CG2-CD1 4.48Å; I250-I286 HydrophobicContact CG2-CG1 3.82Å; I250-I289 HydrophobicContact CD1-CG2 4.25Å; I250-I289 HydrophobicContact CG1-CB 4.47Å; I250-I289 HydrophobicContact CG1-CD1 3.68Å; I250-I289 HydrophobicContact CG1-CG2 4.15Å; I250-L486 HydrophobicContact CD1-CD2 3.68Å; I250-L490 HydrophobicContact CD1-CD2 3.86Å
251	F	95.3	Very high	93.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-87.1	-38.4	-170.6	-55.5	-50	0	0	0	114.2	M218 L224 F247 L258 L490 I497 F501	M218-F251 HydrophobicContact CE-CD2 3.89Å; M218-F251 HydrophobicContact CE-CE2 4.23Å; M218-F251 HydrophobicContact SD-CD2 4.41Å; M218-F251 HydrophobicContact SD-CE2 4.39Å; L224-F251 HydrophobicContact CD2-CE2 3.81Å; L224-F251 HydrophobicContact CD2-CZ 4.19Å; F247-F251 HydrophobicContact CB-CD2 4.17Å; F247-F251 HydrophobicContact CB-CE2 3.86Å; F247-F251 HydrophobicContact CD1-CE2 4.44Å; F247-F251 HydrophobicContact CG-CE2 4.29Å; F247-F251 WeakPolarHBondContact O-CD2 3.32Å; F247-F251 WeakPolarHBondContact O-CG 3.01Å; F247-F251 PolarHBondContact O-N 3.49Å; F251-L258 HydrophobicContact CD1-CD1 4.2Å; F251-L258 PolarHBondContact O-N 3.04Å; F251-L490 HydrophobicContact CZ-CD1 4.3Å; F251-L490 HydrophobicContact CZ-CD2 4.27Å; F251-I497 HydrophobicContact CD1-CG2 4.21Å; F251-I497 HydrophobicContact CE1-CD1 4.16Å; F251-I497 HydrophobicContact CE1-CG2 3.76Å; F251-I497 HydrophobicContact CZ-CD1 4.03Å; F251-I497 HydrophobicContact CZ-CG2 4.39Å; F251-F501 HydrophobicContact CB-CE2 4.42Å; F251-F501 HydrophobicContact CB-CZ 4.26Å; F251-F501 HydrophobicContact CD1-CE2 4.29Å; F251-F501 HydrophobicContact CG-CE2 4.35Å
252	F	94.7	Very high	92.8	Very high	8 Å²	8	42.8 Å²	42.8	4%	0.035	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-40	-166.1	-46.4	-58.8	0	0	0	113.8	F211 Y214 M215 M218 E248 S257 F259 F501	F211-F252 HydrophobicContact CB-CD1 4.24Å; F211-F252 HydrophobicContact CB-CD2 3.76Å; F211-F252 HydrophobicContact CB-CE1 4.33Å; F211-F252 HydrophobicContact CB-CE2 3.87Å; F211-F252 HydrophobicContact CB-CG 3.96Å; F211-F252 HydrophobicContact CB-CZ 4.17Å; F211-F252 HydrophobicContact CD1-CB 3.86Å; F211-F252 AromaticContact CD1-CD1 3.22Å; F211-F252 HydrophobicContact CD1-CD1 3.22Å; F211-F252 HydrophobicContact CD1-CD2 4.17Å; F211-F252 AromaticContact CD1-CE1 3.76Å; F211-F252 HydrophobicContact CD1-CE1 3.76Å; F211-F252 AromaticContact CD1-CG 3.46Å; F211-F252 HydrophobicContact CD1-CG 3.46Å; F211-F252 VanDerWaalsContact CD1-CG 3.46Å; F211-F252 HydrophobicContact CD1-CZ 4.44Å; F211-F252 HydrophobicContact CD2-CB 4.16Å; F211-F252 HydrophobicContact CD2-CG 4.31Å; F211-F252 HydrophobicContact CE1-CB 3.93Å; F211-F252 AromaticContact CE1-CD1 3.72Å; F211-F252 HydrophobicContact CE1-CD1 3.72Å; F211-F252 AromaticContact CE1-CG 3.99Å; F211-F252 HydrophobicContact CE1-CG 3.99Å; F211-F252 HydrophobicContact CE2-CB 4.22Å; F211-F252 HydrophobicContact CG-CB 3.98Å; F211-F252 AromaticContact CG-CD1 3.88Å; F211-F252 HydrophobicContact CG-CD1 3.88Å; F211-F252 AromaticContact CG-CD2 3.96Å; F211-F252 HydrophobicContact CG-CD2 3.96Å; F211-F252 HydrophobicContact CG-CE1 4.38Å; F211-F252 HydrophobicContact CG-CE2 4.47Å; F211-F252 AromaticContact CG-CG 3.65Å; F211-F252 HydrophobicContact CG-CG 3.65Å; F211-F252 HydrophobicContact CZ-CB 4.1Å; Y214-F252 HydrophobicContact CD2-CE1 4.18Å; Y214-F252 HydrophobicContact CG-CE1 4.31Å; M215-F252 HydrophobicContact CG-CE2 3.95Å; M215-F252 HydrophobicContact CG-CZ 4.38Å; M215-F252 HydrophobicContact SD-CE2 3.9Å; M215-F252 HydrophobicContact SD-CZ 4.34Å; M218-F252 HydrophobicContact CE-CZ 4.13Å; E248-F252 HydrophobicContact CB-CD2 4.24Å; E248-F252 HydrophobicContact CG-CD2 4.28Å; E248-F252 HydrophobicContact CG-CE2 4.36Å; E248-F252 PolarHBondContact O-N 2.91Å; F252-S257 VanDerWaalsContact O-CB 3.22Å; F252-S257 WeakPolarHBondContact O-CB 3.38Å; F252-S257 PolarHBondContact O-OG 3.09Å; F252-F259 AromaticContact CD1-CD2 3.92Å; F252-F259 HydrophobicContact CD1-CD2 3.92Å; F252-F259 AromaticContact CD1-CE2 3.77Å; F252-F259 HydrophobicContact CD1-CE2 3.77Å; F252-F259 HydrophobicContact CE1-CE2 4.06Å; F252-F501 HydrophobicContact CE1-CE1 4.1Å; F252-F501 AromaticContact CE1-CZ 3.85Å; F252-F501 HydrophobicContact CE1-CZ 3.85Å; F252-F501 HydrophobicContact CZ-CZ 4.31Å
253	W	92.1	Very high	92.4	Very high	99 Å²	99	45.7 Å²	45.7	38%	0.375	24%	0.239	S	C	.	.	S	Bend	trans	-100.6	149.1	-169.1	-53.4	-35.3	0	0	0	115.5	Y245 E248 L249 R285	Y245-W253 AromaticContact CD2-CZ3 3.85Å; Y245-W253 HydrophobicContact CD2-CZ3 3.85Å; Y245-W253 HydrophobicContact CE2-CE3 4.35Å; Y245-W253 AromaticContact CE2-CZ3 3.75Å; Y245-W253 HydrophobicContact CE2-CZ3 3.75Å; E248-W253 HydrophobicContact CB-CD2 4.46Å; E248-W253 HydrophobicContact CB-CE3 4.04Å; E248-W253 HydrophobicContact CB-CH2 3.67Å; E248-W253 HydrophobicContact CB-CZ2 4.12Å; E248-W253 HydrophobicContact CB-CZ3 3.62Å; E248-W253 HydrophobicContact CG-CH2 4.45Å; E248-W253 PolarHBondContact O-N 3.32Å; L249-W253 HydrophobicContact CB-CE3 4.43Å; L249-W253 HydrophobicContact CD1-CB 4.29Å; W253-R285 PolarHBondContact O-NH2 3.23Å
254	G	88.8	Confident	92.3	Very high	43 Å²	43	46.9 Å²	46.9	44%	0.443	25%	0.247	S	C	.	.	S	Bend	trans	82.9	161.9	177.8	0	0	0	0	0	114	G256 S257	G254-G256 PolarHBondContact O-N 3.05Å; G254-G256 VanDerWaalsContact O-N 3.08Å; G254-S257 WeakPolarHBondContact O-CB 3.46Å; G254-S257 PolarHBondContact O-N 3.48Å; G254-S257 PolarHBondContact O-OG 3.48Å
255	P	85.6	Confident	92.1	Very high	133 Å²	133	44.6 Å²	44.6	86%	0.864	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-26.7	-166.4	23.6	-34.8	0	0	0	114.3	K266	P255-K266 PolarHBondContact O-NZ 2.97Å
256	G	83.9	Confident	92	Very high	37 Å²	37	40.5 Å²	40.5	38%	0.381	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	8.5	176.8	0	0	0	0	0	115.6	G254 R285	G254-G256 PolarHBondContact O-N 3.05Å; G254-G256 VanDerWaalsContact O-N 3.08Å; G256-R285 VanDerWaalsContact C-CZ 3.41Å; G256-R285 VanDerWaalsContact C-NH1 3.31Å; G256-R285 WeakPolarHBondContact O-CD 3.25Å; G256-R285 VanDerWaalsContact O-CZ 3.23Å; G256-R285 PolarHBondContact O-NE 2.87Å; G256-R285 PolarHBondContact O-NH1 3.16Å
257	S	92.8	Very high	91.8	Very high	6 Å²	6	44.7 Å²	44.7	4%	0.042	24%	0.241	C	C	.	.	S	Bend	trans	-70	170.7	177.4	78.4	0	0	0	0	112.3	F252 G254 F259 K266	F252-S257 VanDerWaalsContact O-CB 3.22Å; F252-S257 WeakPolarHBondContact O-CB 3.38Å; F252-S257 PolarHBondContact O-OG 3.09Å; G254-S257 WeakPolarHBondContact O-CB 3.46Å; G254-S257 PolarHBondContact O-N 3.48Å; G254-S257 PolarHBondContact O-OG 3.48Å; S257-F259 VanDerWaalsContact C-N 3.25Å; S257-F259 PolarHBondContact OG-N 3.43Å; S257-F259 PolarHBondContact OG-O 3.22Å; S257-F259 VanDerWaalsContact OG-O 3.11Å; S257-K266 PolarHBondContact O-NZ 3.48Å
258	L	93.7	Very high	91.5	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.016	26%	0.256	C	S	.	.	S	Bend	trans	-74.2	-23.2	178.1	-69.2	79.2	0	0	0	111.5	F251 L265 K266 Y269 L282 I498 F501	F251-L258 HydrophobicContact CD1-CD1 4.2Å; F251-L258 PolarHBondContact O-N 3.04Å; L258-L265 HydrophobicContact CB-CD1 3.8Å; L258-K266 PolarHBondContact O-N 3.38Å; L258-Y269 HydrophobicContact CB-CD2 4.3Å; L258-Y269 HydrophobicContact CB-CE2 4.29Å; L258-Y269 HydrophobicContact CD2-CD1 4.23Å; L258-Y269 HydrophobicContact CD2-CE1 4.37Å; L258-Y269 HydrophobicContact CG-CD1 4.41Å; L258-Y269 HydrophobicContact CG-CE1 4.16Å; L258-Y269 HydrophobicContact CG-CE2 4.46Å; L258-L282 HydrophobicContact CD1-CD1 4.29Å; L258-I498 HydrophobicContact CD2-CD1 3.97Å; L258-F501 HydrophobicContact CD2-CB 3.99Å; L258-F501 HydrophobicContact CD2-CD1 4.45Å; L258-F501 HydrophobicContact CD2-CD2 3.51Å; L258-F501 HydrophobicContact CD2-CE2 4.08Å; L258-F501 HydrophobicContact CD2-CG 3.73Å
259	F	93.4	Very high	91.4	Very high	5 Å²	5	47.6 Å²	47.6	2%	0.022	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	144.5	176.2	-75.3	-100.7	0	0	0	110.3	F211 Y214 F252 S257 S264 L265 K266 F501 D513	F211-F259 HydrophobicContact CE1-CD1 4.05Å; F211-F259 HydrophobicContact CE1-CD2 4.23Å; F211-F259 HydrophobicContact CE1-CE1 4.12Å; F211-F259 HydrophobicContact CE1-CE2 4.3Å; F211-F259 HydrophobicContact CE1-CG 4.14Å; F211-F259 HydrophobicContact CE1-CZ 4.25Å; Y214-F259 HydrophobicContact CD2-CZ 4.34Å; Y214-F259 HydrophobicContact CE2-CE1 4.47Å; Y214-F259 HydrophobicContact CE2-CE2 4.46Å; Y214-F259 AromaticContact CE2-CZ 3.64Å; Y214-F259 HydrophobicContact CE2-CZ 3.64Å; F252-F259 AromaticContact CD1-CD2 3.92Å; F252-F259 HydrophobicContact CD1-CD2 3.92Å; F252-F259 AromaticContact CD1-CE2 3.77Å; F252-F259 HydrophobicContact CD1-CE2 3.77Å; F252-F259 HydrophobicContact CE1-CE2 4.06Å; S257-F259 VanDerWaalsContact C-N 3.25Å; S257-F259 PolarHBondContact OG-N 3.43Å; S257-F259 PolarHBondContact OG-O 3.22Å; S257-F259 VanDerWaalsContact OG-O 3.11Å; F259-S264 CarbonylContact C-O 3.6Å; F259-S264 WeakPolarHBondContact CA-O 3.37Å; F259-S264 VanDerWaalsContact CD1-C 3.5Å; F259-S264 WeakPolarHBondContact CD1-O 3.42Å; F259-L265 HydrophobicContact CD2-CD1 4.19Å; F259-L265 HydrophobicContact CE2-CD1 3.9Å; F259-L265 HydrophobicContact CZ-CD1 4.15Å; F259-K266 VanDerWaalsContact O-CE 3.24Å; F259-K266 WeakPolarHBondContact O-CE 3.34Å; F259-F501 HydrophobicContact CE2-CE1 4.04Å; F259-D513 HydrophobicContact CE1-CB 4.5Å
260	E	88.5	Confident	91.1	Very high	119 Å²	119	48.1 Å²	48.1	56%	0.556	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	-48.3	177.3	-157.7	166.8	153.7	0	0	109.9	S264 K266	E260-S264 PolarHBondContact N-O 2.88Å; E260-K266 HydrophobicContact CB-CG 3.53Å; E260-K266 HydrophobicContact CG-CG 3.9Å
261	N	87.7	Confident	90.8	Very high	97 Å²	97	56.3 Å²	56.3	52%	0.519	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	163.3	170.6	-63.8	-70	0	0	0	107.5	W263 S264	N261-W263 PolarHBondContact O-N 3.23Å; N261-S264 PolarHBondContact O-N 3.3Å
262	E	87.4	Confident	90.3	Very high	75 Å²	75	58.4 Å²	58.4	35%	0.35	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-23.4	-174.3	-65.8	-175.3	176.4	0	0	114.2	N42 R210 F211	N42-E262 VanDerWaalsContact ND2-CD 3.33Å; N42-E262 PolarHBondContact ND2-OE2 3.13Å; R210-E262 WeakPolarHBondContact CD-O 3.36Å; F211-E262 HydrophobicContact CZ-CB 4.46Å; F211-E262 WeakPolarHBondContact CZ-O 3.48Å
263	W	88.1	Confident	89.9	Confident	85 Å²	85	61.6 Å²	61.6	32%	0.322	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-4.3	179.9	56.8	29	0	0	0	116.9	E41 R210 N261 D513	E41-W263 WeakPolarHBondContact O-CH2 3.31Å; E41-W263 VanDerWaalsContact O-CZ3 3.26Å; E41-W263 WeakPolarHBondContact O-CZ3 3.39Å; R210-W263 PolarHBondContact NH1-O 2.93Å; N261-W263 PolarHBondContact O-N 3.23Å; W263-D513 PolarHBondContact O-N 3.43Å
264	S	92.4	Very high	89.8	Confident	25 Å²	25	61.2 Å²	61.2	18%	0.175	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	138.3	-172.8	-171.2	0	0	0	0	114.8	F259 E260 N261 D513	F259-S264 CarbonylContact C-O 3.6Å; F259-S264 WeakPolarHBondContact CA-O 3.37Å; F259-S264 VanDerWaalsContact CD1-C 3.5Å; F259-S264 WeakPolarHBondContact CD1-O 3.42Å; E260-S264 PolarHBondContact N-O 2.88Å; N261-S264 PolarHBondContact O-N 3.3Å; S264-D513 WeakPolarHBondContact CA-OD2 3.48Å; S264-D513 WeakPolarHBondContact CB-OD2 3.37Å; S264-D513 PolarHBondContact OG-OD2 2.87Å
265	L	93.9	Very high	90	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.5	178.5	-169.3	77.3	0	0	0	109.8	L258 F259 Q267 K270 F501 T505 D513	L258-L265 HydrophobicContact CB-CD1 3.8Å; F259-L265 HydrophobicContact CD2-CD1 4.19Å; F259-L265 HydrophobicContact CE2-CD1 3.9Å; F259-L265 HydrophobicContact CZ-CD1 4.15Å; L265-Q267 PolarHBondContact O-N 2.87Å; L265-K270 HydrophobicContact CD2-CG 4.31Å; L265-F501 HydrophobicContact CD1-CD1 4.28Å; L265-T505 HydrophobicContact CD2-CG2 4.19Å; L265-D513 HydrophobicContact CB-CB 4.3Å; L265-D513 PolarHBondContact N-OD2 3.44Å
266	K	93.7	Very high	90.4	Very high	39 Å²	39	63 Å²	63	17%	0.17	33%	0.331	C	S	.	.			trans	-54.5	134.6	179.8	-69.9	165.5	175.8	163.4	0	110.4	P255 S257 L258 F259 E260 E268 Y269	P255-K266 PolarHBondContact O-NZ 2.97Å; S257-K266 PolarHBondContact O-NZ 3.48Å; L258-K266 PolarHBondContact O-N 3.38Å; F259-K266 VanDerWaalsContact O-CE 3.24Å; F259-K266 WeakPolarHBondContact O-CE 3.34Å; E260-K266 HydrophobicContact CB-CG 3.53Å; E260-K266 HydrophobicContact CG-CG 3.9Å; K266-E268 HydrophobicContact CB-CG 4.14Å; K266-E268 PolarHBondContact O-N 3.44Å; K266-Y269 HydrophobicContact CB-CD2 3.81Å; K266-Y269 HydrophobicContact CB-CE2 3.88Å; K266-Y269 HydrophobicContact CD-CE2 4.16Å; K266-Y269 PolarHBondContact O-N 2.96Å
267	Q	91.8	Very high	90.9	Very high	95 Å²	95	65.1 Å²	65.1	44%	0.444	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-17.8	-172.1	-67.6	-69.9	-19.4	0	0	114.3	L265	L265-Q267 PolarHBondContact O-N 2.87Å
268	E	91.8	Very high	91	Very high	66 Å²	66	65 Å²	65	31%	0.308	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-39.6	171.5	63.8	-178.9	-172.9	0	0	113	K266 K270 R271 L278 R281	K266-E268 HydrophobicContact CB-CG 4.14Å; K266-E268 PolarHBondContact O-N 3.44Å; E268-K270 VanDerWaalsContact C-N 3.35Å; E268-K270 PolarHBondContact O-N 3.46Å; E268-R271 PolarHBondContact O-N 3.41Å; E268-L278 HydrophobicContact CB-CD1 4.37Å; E268-L278 HydrophobicContact CB-CD2 4.18Å; E268-L278 VanDerWaalsContact CD-CD2 3.48Å; E268-L278 HydrophobicContact CG-CD1 4.46Å; E268-L278 HydrophobicContact CG-CD2 3.84Å; E268-L278 WeakPolarHBondContact O-CD1 3.48Å; E268-R281 IonicContact OE1-NH1 3.36Å; E268-R281 IonicContact OE2-CZ 3.6Å; E268-R281 IonicContact OE2-NH1 2.95Å; E268-R281 PolarHBondContact OE2-NH1 3.32Å
269	Y	91.6	Very high	91.1	Very high	15 Å²	15	65 Å²	65	6%	0.059	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-23.9	-178.6	-59.1	-78.3	0	0	0	113.1	L258 K266 R271 L278 I498 R502	L258-Y269 HydrophobicContact CB-CD2 4.3Å; L258-Y269 HydrophobicContact CB-CE2 4.29Å; L258-Y269 HydrophobicContact CD2-CD1 4.23Å; L258-Y269 HydrophobicContact CD2-CE1 4.37Å; L258-Y269 HydrophobicContact CG-CD1 4.41Å; L258-Y269 HydrophobicContact CG-CE1 4.16Å; L258-Y269 HydrophobicContact CG-CE2 4.46Å; K266-Y269 HydrophobicContact CB-CD2 3.81Å; K266-Y269 HydrophobicContact CB-CE2 3.88Å; K266-Y269 HydrophobicContact CD-CE2 4.16Å; K266-Y269 PolarHBondContact O-N 2.96Å; Y269-R271 PolarHBondContact O-N 2.82Å; Y269-L278 HydrophobicContact CD1-CB 4.37Å; Y269-L278 HydrophobicContact CD1-CD1 3.9Å; Y269-L278 HydrophobicContact CD1-CG 4.5Å; Y269-L278 HydrophobicContact CE1-CB 3.96Å; Y269-L278 HydrophobicContact CE1-CD1 4.11Å; Y269-L278 HydrophobicContact CE1-CD2 3.95Å; Y269-L278 HydrophobicContact CE1-CG 4.22Å; Y269-L278 HydrophobicContact CG-CD1 4.48Å; Y269-I498 HydrophobicContact CD1-CD1 3.78Å; Y269-I498 HydrophobicContact CE1-CD1 3.64Å; Y269-R502 VanDerWaalsContact O-CB 3.29Å; Y269-R502 WeakPolarHBondContact O-CB 3.12Å; Y269-R502 VanDerWaalsContact O-CG 3.27Å; Y269-R502 WeakPolarHBondContact O-CG 3.42Å
270	K	91.3	Very high	91.2	Very high	59 Å²	59	69.9 Å²	69.9	26%	0.257	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.8	173.1	-66.6	-175.8	174.6	175.8	0	112.5	L265 E268 E507 D513	L265-K270 HydrophobicContact CD2-CG 4.31Å; E268-K270 VanDerWaalsContact C-N 3.35Å; E268-K270 PolarHBondContact O-N 3.46Å; K270-E507 IonicContact NZ-OE2 3.87Å; K270-E507 PolarHBondContact NZ-OE2 3.08Å; K270-D513 WeakPolarHBondContact CE-OD1 3.38Å; K270-D513 IonicContact NZ-OD1 3.91Å; K270-D513 PolarHBondContact NZ-OD1 3.44Å; K270-D513 IonicContact NZ-OD2 2.68Å; K270-D513 PolarHBondContact NZ-OD2 2.87Å
271	R	89.6	Confident	91.5	Very high	173 Å²	173	69.2 Å²	69.2	65%	0.653	35%	0.349	S	S	*	.			trans	-101.3	134.1	-175.7	-63.5	177.3	-176	-173.5	1	111.9	E268 Y269 G273	E268-R271 PolarHBondContact O-N 3.41Å; Y269-R271 PolarHBondContact O-N 2.82Å; R271-G273 PolarHBondContact O-N 3.21Å
272	G	84.1	Confident	91.9	Very high	44 Å²	44	65 Å²	65	45%	0.454	33%	0.327	S	S	.	.	S	Bend	trans	-72.7	-25.6	-176.7	0	0	0	0	0	115.9	N274	G272-N274 PolarHBondContact O-N 2.8Å
273	G	86.8	Confident	92.3	Very high	74 Å²	74	61.8 Å²	61.8	76%	0.763	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-48.4	-167.2	0	0	0	0	0	115.1	R271 R275	R271-G273 PolarHBondContact O-N 3.21Å; G273-R275 VanDerWaalsContact C-N 3.33Å; G273-R275 PolarHBondContact O-N 2.95Å
274	N	88.9	Confident	92.7	Very high	92 Å²	92	60.4 Å²	60.4	49%	0.492	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	18.1	-171.9	-66.2	54.8	0	0	0	113.4	G272 L276 E277 L278	G272-N274 PolarHBondContact O-N 2.8Å; N274-L276 PolarHBondContact O-N 2.85Å; N274-E277 HydrophobicContact CB-CB 4.46Å; N274-E277 PolarHBondContact ND2-OE2 3.23Å; N274-E277 WeakPolarHBondContact O-CB 3.47Å; N274-E277 PolarHBondContact O-N 3.33Å; N274-L278 HydrophobicContact CB-CG 4.37Å; N274-L278 WeakPolarHBondContact O-CG 3.37Å; N274-L278 PolarHBondContact O-N 3.18Å
275	R	92.9	Very high	92.9	Very high	105 Å²	105	61.6 Å²	61.6	40%	0.396	32%	0.316	S	S	.	.	H	α-helix	trans	-55.6	-32.7	-168.8	70.6	170.8	-176.6	140.5	-0.1	115.2	G273 A279 L495 I498 D499	G273-R275 VanDerWaalsContact C-N 3.33Å; G273-R275 PolarHBondContact O-N 2.95Å; R275-A279 VanDerWaalsContact O-CB 3.3Å; R275-A279 WeakPolarHBondContact O-CB 3.31Å; R275-A279 PolarHBondContact O-N 3.43Å; R275-L495 HydrophobicContact CG-CD1 4.38Å; R275-I498 HydrophobicContact CB-CG2 4.48Å; R275-D499 WeakPolarHBondContact CD-OD1 3.31Å; R275-D499 IonicContact CZ-OD2 3.83Å; R275-D499 IonicContact NH1-OD1 2.68Å; R275-D499 IonicContact NH1-OD2 3.35Å; R275-D499 PolarHBondContact NH1-OD2 3.5Å
276	L	94.4	Very high	93	Very high	107 Å²	107	61.5 Å²	61.5	56%	0.56	32%	0.316	S	S	*	.	H	α-helix	trans	-71.4	-47	177	-64.9	177.1	0	0	0	111.4	N274 L278 A279 D280 L495	N274-L276 PolarHBondContact O-N 2.85Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 2.87Å; L276-A279 WeakPolarHBondContact O-CB 3.47Å; L276-A279 PolarHBondContact O-N 2.9Å; L276-A279 VanDerWaalsContact O-N 3.11Å; L276-D280 PolarHBondContact O-N 2.92Å; L276-L495 HydrophobicContact CD2-CD1 4.13Å; L276-L495 HydrophobicContact CD2-CD2 4.12Å
277	E	94.3	Very high	93.2	Very high	83 Å²	83	61.7 Å²	61.7	39%	0.388	32%	0.319	S	S	.	.	H	α-helix	trans	-58.9	-43.8	176.2	-167	-160.3	164	0	0	111.3	N274 A279 D280 R281	N274-E277 HydrophobicContact CB-CB 4.46Å; N274-E277 PolarHBondContact ND2-OE2 3.23Å; N274-E277 WeakPolarHBondContact O-CB 3.47Å; N274-E277 PolarHBondContact O-N 3.33Å; E277-A279 VanDerWaalsContact C-N 3.35Å; E277-A279 PolarHBondContact O-N 3.3Å; E277-D280 PolarHBondContact O-N 3.45Å; E277-R281 VanDerWaalsContact O-CG 3.3Å; E277-R281 WeakPolarHBondContact O-CG 3.42Å; E277-R281 PolarHBondContact O-N 3.44Å; E277-R281 IonicContact OE1-CZ 3.21Å; E277-R281 IonicContact OE1-NE 3.89Å; E277-R281 PolarHBondContact OE1-NE 2.95Å; E277-R281 IonicContact OE1-NH2 2.72Å; E277-R281 PolarHBondContact OE1-NH2 2.9Å; E277-R281 IonicContact OE2-NH2 2.77Å
278	L	94.6	Very high	93.4	Very high	3 Å²	3	65.6 Å²	65.6	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-37.6	175.7	-64	177.5	0	0	0	112.2	E268 Y269 N274 L276 L282 I498	E268-L278 HydrophobicContact CB-CD1 4.37Å; E268-L278 HydrophobicContact CB-CD2 4.18Å; E268-L278 VanDerWaalsContact CD-CD2 3.48Å; E268-L278 HydrophobicContact CG-CD1 4.46Å; E268-L278 HydrophobicContact CG-CD2 3.84Å; E268-L278 WeakPolarHBondContact O-CD1 3.48Å; Y269-L278 HydrophobicContact CD1-CB 4.37Å; Y269-L278 HydrophobicContact CD1-CD1 3.9Å; Y269-L278 HydrophobicContact CD1-CG 4.5Å; Y269-L278 HydrophobicContact CE1-CB 3.96Å; Y269-L278 HydrophobicContact CE1-CD1 4.11Å; Y269-L278 HydrophobicContact CE1-CD2 3.95Å; Y269-L278 HydrophobicContact CE1-CG 4.22Å; Y269-L278 HydrophobicContact CG-CD1 4.48Å; N274-L278 HydrophobicContact CB-CG 4.37Å; N274-L278 WeakPolarHBondContact O-CG 3.37Å; N274-L278 PolarHBondContact O-N 3.18Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 2.87Å; L278-L282 WeakPolarHBondContact O-CB 3.36Å; L278-L282 PolarHBondContact O-N 3.15Å; L278-I498 HydrophobicContact CB-CG1 4.48Å; L278-I498 HydrophobicContact CB-CG2 4.2Å
279	A	95.6	Very high	93.6	Very high	4 Å²	4	63.7 Å²	63.7	3%	0.033	32%	0.321	C	S	.	.	H	α-helix	trans	-68	-34.2	174.9	0	0	0	0	0	112.8	R275 L276 E277 A283 S494 L495 I498	R275-A279 VanDerWaalsContact O-CB 3.3Å; R275-A279 WeakPolarHBondContact O-CB 3.31Å; R275-A279 PolarHBondContact O-N 3.43Å; L276-A279 WeakPolarHBondContact O-CB 3.47Å; L276-A279 PolarHBondContact O-N 2.9Å; L276-A279 VanDerWaalsContact O-N 3.11Å; E277-A279 VanDerWaalsContact C-N 3.35Å; E277-A279 PolarHBondContact O-N 3.3Å; A279-A283 VanDerWaalsContact O-CB 3.23Å; A279-A283 WeakPolarHBondContact O-CB 3.39Å; A279-A283 PolarHBondContact O-N 3.39Å; A279-S494 VanDerWaalsContact O-CB 3.25Å; A279-S494 WeakPolarHBondContact O-CB 3.34Å; A279-S494 PolarHBondContact O-OG 3Å; A279-L495 HydrophobicContact CB-CB 4.01Å; A279-L495 HydrophobicContact CB-CD1 3.99Å; A279-I498 HydrophobicContact CB-CG1 4.21Å
280	D	95.7	Very high	93.9	Very high	106 Å²	106	63 Å²	63	57%	0.567	32%	0.318	S	S	*	.	H	α-helix	trans	-74.7	-38.8	174.9	-80.1	-35.9	0	0	0	112.6	L276 E277 A283 S284	L276-D280 PolarHBondContact O-N 2.92Å; E277-D280 PolarHBondContact O-N 3.45Å; D280-A283 PolarHBondContact O-N 3.47Å; D280-S284 VanDerWaalsContact O-CB 3.3Å; D280-S284 WeakPolarHBondContact O-CB 3.5Å; D280-S284 PolarHBondContact O-N 3.01Å; D280-S284 PolarHBondContact O-OG 3.49Å
281	R	95.1	Very high	94.2	Very high	106 Å²	106	63.5 Å²	63.5	40%	0.4	32%	0.323	S	S	.	.	H	α-helix	trans	-58.4	-47.8	169.3	-70.6	176.2	-170.6	-175.5	6.4	110.6	E268 E277 S284 R285	E268-R281 IonicContact OE1-NH1 3.36Å; E268-R281 IonicContact OE2-CZ 3.6Å; E268-R281 IonicContact OE2-NH1 2.95Å; E268-R281 PolarHBondContact OE2-NH1 3.32Å; E277-R281 VanDerWaalsContact O-CG 3.3Å; E277-R281 WeakPolarHBondContact O-CG 3.42Å; E277-R281 PolarHBondContact O-N 3.44Å; E277-R281 IonicContact OE1-CZ 3.21Å; E277-R281 IonicContact OE1-NE 3.89Å; E277-R281 PolarHBondContact OE1-NE 2.95Å; E277-R281 IonicContact OE1-NH2 2.72Å; E277-R281 PolarHBondContact OE1-NH2 2.9Å; E277-R281 IonicContact OE2-NH2 2.77Å; R281-S284 PolarHBondContact O-N 3.45Å; R281-R285 PolarHBondContact O-N 2.91Å
282	L	95.9	Very high	94.5	Very high	9 Å²	9	57.3 Å²	57.3	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-45.8	176.3	178.6	59.5	0	0	0	111.8	I250 L258 L278 S284 R285 I286 I497 I498	I250-L282 HydrophobicContact CG2-CD1 3.95Å; L258-L282 HydrophobicContact CD1-CD1 4.29Å; L278-L282 WeakPolarHBondContact O-CB 3.36Å; L278-L282 PolarHBondContact O-N 3.15Å; L282-S284 VanDerWaalsContact C-N 3.27Å; L282-S284 PolarHBondContact O-N 2.99Å; L282-R285 PolarHBondContact O-N 2.94Å; L282-I286 HydrophobicContact CD1-CD1 4.05Å; L282-I286 HydrophobicContact CD1-CG1 4.18Å; L282-I286 HydrophobicContact CG-CD1 3.84Å; L282-I286 HydrophobicContact CG-CG1 4.44Å; L282-I286 VanDerWaalsContact O-CG1 3.28Å; L282-I286 WeakPolarHBondContact O-CG1 3.32Å; L282-I286 PolarHBondContact O-N 3.26Å; L282-I497 HydrophobicContact CD2-CB 4.3Å; L282-I497 HydrophobicContact CD2-CG2 3.99Å; L282-I498 HydrophobicContact CB-CD1 4.26Å; L282-I498 HydrophobicContact CD2-CD1 3.59Å; L282-I498 HydrophobicContact CD2-CG1 4Å
283	A	96.6	Very high	95.1	Very high	7 Å²	7	56.5 Å²	56.5	6%	0.058	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-37.2	176.8	0	0	0	0	0	112.5	A279 D280 L287 R491	A279-A283 VanDerWaalsContact O-CB 3.23Å; A279-A283 WeakPolarHBondContact O-CB 3.39Å; A279-A283 PolarHBondContact O-N 3.39Å; D280-A283 PolarHBondContact O-N 3.47Å; A283-L287 WeakPolarHBondContact O-CB 3.27Å; A283-L287 PolarHBondContact O-N 2.84Å; A283-R491 HydrophobicContact CB-CG 3.85Å
284	S	96	Very high	95.6	Very high	56 Å²	56	57.6 Å²	57.6	39%	0.392	28%	0.282	S	S	.	.	H	α-helix	trans	-69.4	-40.4	176.2	-58.8	0	0	0	0	111.9	D280 R281 L282 L287 W288	D280-S284 VanDerWaalsContact O-CB 3.3Å; D280-S284 WeakPolarHBondContact O-CB 3.5Å; D280-S284 PolarHBondContact O-N 3.01Å; D280-S284 PolarHBondContact O-OG 3.49Å; R281-S284 PolarHBondContact O-N 3.45Å; L282-S284 VanDerWaalsContact C-N 3.27Å; L282-S284 PolarHBondContact O-N 2.99Å; S284-L287 WeakPolarHBondContact O-CB 3.5Å; S284-L287 PolarHBondContact O-N 3.44Å; S284-W288 PolarHBondContact O-N 3.41Å; S284-W288 VanDerWaalsContact O-N 3.07Å
285	R	95.5	Very high	95.9	Very high	49 Å²	49	60 Å²	60	19%	0.185	29%	0.294	C	S	.	.	H	α-helix	trans	-68.6	-38.2	175.1	-177.8	156.6	168.1	-90.2	-13.3	112.6	L249 I250 W253 G256 R281 L282 L287 W288 I289	L249-R285 PolarHBondContact O-NH2 2.83Å; I250-R285 PolarHBondContact O-NH1 3.08Å; W253-R285 PolarHBondContact O-NH2 3.23Å; G256-R285 VanDerWaalsContact C-CZ 3.41Å; G256-R285 VanDerWaalsContact C-NH1 3.31Å; G256-R285 WeakPolarHBondContact O-CD 3.25Å; G256-R285 VanDerWaalsContact O-CZ 3.23Å; G256-R285 PolarHBondContact O-NE 2.87Å; G256-R285 PolarHBondContact O-NH1 3.16Å; R281-R285 PolarHBondContact O-N 2.91Å; L282-R285 PolarHBondContact O-N 2.94Å; R285-L287 VanDerWaalsContact C-N 3.32Å; R285-L287 PolarHBondContact O-N 3.45Å; R285-W288 PolarHBondContact O-N 2.87Å; R285-I289 HydrophobicContact CG-CD1 3.87Å; R285-I289 WeakPolarHBondContact O-CB 3.36Å; R285-I289 WeakPolarHBondContact O-CG1 3.35Å; R285-I289 PolarHBondContact O-N 3.18Å
286	I	97	Very high	96	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.9	-42.9	171.2	-68.7	164.1	0	0	0	110.7	I250 L282 G290 L486 L490 R491	I250-I286 HydrophobicContact CD1-CG1 4.32Å; I250-I286 HydrophobicContact CG2-CD1 4.48Å; I250-I286 HydrophobicContact CG2-CG1 3.82Å; L282-I286 HydrophobicContact CD1-CD1 4.05Å; L282-I286 HydrophobicContact CD1-CG1 4.18Å; L282-I286 HydrophobicContact CG-CD1 3.84Å; L282-I286 HydrophobicContact CG-CG1 4.44Å; L282-I286 VanDerWaalsContact O-CG1 3.28Å; L282-I286 WeakPolarHBondContact O-CG1 3.32Å; L282-I286 PolarHBondContact O-N 3.26Å; I286-G290 PolarHBondContact O-N 2.8Å; I286-L486 HydrophobicContact CG2-CB 4.46Å; I286-L486 VanDerWaalsContact CG2-O 3.22Å; I286-L486 WeakPolarHBondContact CG2-O 3.41Å; I286-L490 HydrophobicContact CD1-CD2 3.98Å; I286-L490 HydrophobicContact CD1-CG 4.1Å; I286-L490 HydrophobicContact CG1-CD2 4.1Å; I286-L490 HydrophobicContact CG2-CB 4.35Å; I286-L490 HydrophobicContact CG2-CD2 4.09Å; I286-L490 HydrophobicContact CG2-CG 4.48Å; I286-R491 HydrophobicContact CG2-CB 4.05Å
287	L	97.1	Very high	96	Very high	42 Å²	42	55 Å²	55	22%	0.22	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-50.2	177.3	178.6	63.8	0	0	0	111.8	A283 S284 R285 I289 G290 I291 I487	A283-L287 WeakPolarHBondContact O-CB 3.27Å; A283-L287 PolarHBondContact O-N 2.84Å; S284-L287 WeakPolarHBondContact O-CB 3.5Å; S284-L287 PolarHBondContact O-N 3.44Å; R285-L287 VanDerWaalsContact C-N 3.32Å; R285-L287 PolarHBondContact O-N 3.45Å; L287-I289 PolarHBondContact O-N 3.47Å; L287-G290 PolarHBondContact O-N 2.95Å; L287-I291 HydrophobicContact CD1-CD1 4.02Å; L287-I291 HydrophobicContact CD1-CG1 4.38Å; L287-I291 HydrophobicContact CG-CD1 3.92Å; L287-I291 WeakPolarHBondContact O-CG1 3.33Å; L287-I291 PolarHBondContact O-N 3.37Å; L287-I487 HydrophobicContact CD1-CG1 4.37Å; L287-I487 HydrophobicContact CD1-CG2 4.07Å
288	W	96.5	Very high	96	Very high	178 Å²	178	55 Å²	55	67%	0.674	28%	0.284	S	S	*	.	H	α-helix	trans	-64	-40.1	179.7	-76.6	115.9	0	0	0	113.1	S284 R285 G290 I291 A292	S284-W288 PolarHBondContact O-N 3.41Å; S284-W288 VanDerWaalsContact O-N 3.07Å; R285-W288 PolarHBondContact O-N 2.87Å; W288-G290 VanDerWaalsContact C-N 3.35Å; W288-I291 HydrophobicContact CE3-CD1 4.26Å; W288-I291 HydrophobicContact CZ3-CD1 4.46Å; W288-I291 PolarHBondContact O-N 2.96Å; W288-A292 WeakPolarHBondContact O-CB 3.41Å; W288-A292 PolarHBondContact O-N 3.39Å
289	I	96.9	Very high	95.8	Very high	25 Å²	25	57.8 Å²	57.8	13%	0.128	30%	0.301	C	S	.	.	H	α-helix	trans	-66.1	-38.7	174.5	-69.2	168.7	0	0	0	110.6	N246 I250 R285 L287 A292 N293 L486	N246-I289 WeakPolarHBondContact OD1-CG2 3.44Å; I250-I289 HydrophobicContact CD1-CG2 4.25Å; I250-I289 HydrophobicContact CG1-CB 4.47Å; I250-I289 HydrophobicContact CG1-CD1 3.68Å; I250-I289 HydrophobicContact CG1-CG2 4.15Å; R285-I289 HydrophobicContact CG-CD1 3.87Å; R285-I289 WeakPolarHBondContact O-CB 3.36Å; R285-I289 WeakPolarHBondContact O-CG1 3.35Å; R285-I289 PolarHBondContact O-N 3.18Å; L287-I289 PolarHBondContact O-N 3.47Å; I289-A292 PolarHBondContact O-N 3.44Å; I289-N293 PolarHBondContact O-N 3.21Å; I289-N293 PolarHBondContact O-ND2 3.1Å; I289-L486 HydrophobicContact CG2-CD1 4.42Å
290	G	97.1	Very high	95.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.9	-43.9	172.7	0	0	0	0	0	113.2	I286 L287 W288 N293 L294 P483	I286-G290 PolarHBondContact O-N 2.8Å; L287-G290 PolarHBondContact O-N 2.95Å; W288-G290 VanDerWaalsContact C-N 3.35Å; G290-N293 PolarHBondContact O-N 2.87Å; G290-L294 PolarHBondContact O-N 3.16Å; G290-P483 WeakPolarHBondContact O-CB 3.44Å
291	I	97.6	Very high	95.6	Very high	70 Å²	70	57.7 Å²	57.7	36%	0.359	30%	0.299	S	S	.	.	H	α-helix	trans	-64.5	-41.1	175.6	-68.4	165.6	0	0	0	111	L287 W288 N293 L294 L295 I487	L287-I291 HydrophobicContact CD1-CD1 4.02Å; L287-I291 HydrophobicContact CD1-CG1 4.38Å; L287-I291 HydrophobicContact CG-CD1 3.92Å; L287-I291 WeakPolarHBondContact O-CG1 3.33Å; L287-I291 PolarHBondContact O-N 3.37Å; W288-I291 HydrophobicContact CE3-CD1 4.26Å; W288-I291 HydrophobicContact CZ3-CD1 4.46Å; W288-I291 PolarHBondContact O-N 2.96Å; I291-N293 PolarHBondContact O-N 3.48Å; I291-L294 WeakPolarHBondContact O-CB 3.4Å; I291-L294 PolarHBondContact O-N 2.93Å; I291-L295 PolarHBondContact O-N 3.38Å; I291-I487 HydrophobicContact CG1-CD1 4.46Å
292	A	96.5	Very high	95.4	Very high	44 Å²	44	56.2 Å²	56.2	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-63.1	-40.9	175.6	0	0	0	0	0	112.2	W288 I289 L294 L295 L296	W288-A292 WeakPolarHBondContact O-CB 3.41Å; W288-A292 PolarHBondContact O-N 3.39Å; I289-A292 PolarHBondContact O-N 3.44Å; A292-L294 VanDerWaalsContact C-N 3.34Å; A292-L295 PolarHBondContact O-N 3.18Å; A292-L296 WeakPolarHBondContact O-CB 3.15Å; A292-L296 VanDerWaalsContact O-CG 3.31Å; A292-L296 WeakPolarHBondContact O-CG 3.39Å; A292-L296 PolarHBondContact O-N 3.02Å
293	N	96.8	Very high	95.2	Very high	26 Å²	26	59.5 Å²	59.5	14%	0.139	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-39	173	-81.6	-99.8	0	0	0	111.8	N246 I289 G290 I291 L296 C297 P483	N246-N293 PolarHBondContact ND2-OD1 2.95Å; N246-N293 PolarHBondContact OD1-ND2 3.17Å; N246-N293 PolarHBondContact OD1-OD1 3.06Å; I289-N293 PolarHBondContact O-N 3.21Å; I289-N293 PolarHBondContact O-ND2 3.1Å; G290-N293 PolarHBondContact O-N 2.87Å; I291-N293 PolarHBondContact O-N 3.48Å; N293-L296 PolarHBondContact O-N 3.43Å; N293-C297 WeakPolarHBondContact O-CB 3.38Å; N293-C297 PolarHBondContact O-N 3.28Å; N293-P483 HydrophobicContact CB-CB 4.05Å
294	L	96.8	Very high	95.1	Very high	98 Å²	98	61.3 Å²	61.3	51%	0.513	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-39.6	177	-173.9	62.8	0	0	0	112.1	G290 I291 A292 C297 P483	G290-L294 PolarHBondContact O-N 3.16Å; I291-L294 WeakPolarHBondContact O-CB 3.4Å; I291-L294 PolarHBondContact O-N 2.93Å; A292-L294 VanDerWaalsContact C-N 3.34Å; L294-C297 VanDerWaalsContact O-CB 3.22Å; L294-C297 WeakPolarHBondContact O-CB 3.41Å; L294-C297 PolarHBondContact O-N 3.36Å; L294-P483 HydrophobicContact CB-CB 3.97Å; L294-P483 HydrophobicContact CB-CG 4.41Å; L294-P483 HydrophobicContact CD1-CB 4.46Å; L294-P483 HydrophobicContact CD1-CG 4.23Å
295	L	95.7	Very high	95	Very high	141 Å²	141	62.8 Å²	62.8	74%	0.738	32%	0.323	S	S	*	.	H	α-helix	trans	-68.7	-37.8	176	-176.9	63.1	0	0	0	112.4	I291 A292	I291-L295 PolarHBondContact O-N 3.38Å; A292-L295 PolarHBondContact O-N 3.18Å
296	L	94	Very high	94.9	Very high	92 Å²	92	62.4 Å²	62.4	48%	0.482	33%	0.325	S	S	.	.	H	α-helix	trans	-81.4	-14.6	178.1	-66.6	171.3	0	0	0	113.6	A292 N293 V299 I300	A292-L296 WeakPolarHBondContact O-CB 3.15Å; A292-L296 VanDerWaalsContact O-CG 3.31Å; A292-L296 WeakPolarHBondContact O-CG 3.39Å; A292-L296 PolarHBondContact O-N 3.02Å; N293-L296 PolarHBondContact O-N 3.43Å; L296-V299 PolarHBondContact O-N 3.09Å; L296-I300 HydrophobicContact CB-CD1 3.73Å; L296-I300 HydrophobicContact CB-CG1 4.24Å; L296-I300 WeakPolarHBondContact O-CG1 3.44Å; L296-I300 PolarHBondContact O-N 3.16Å
297	C	95.6	Very high	94.6	Very high	17 Å²	17	66.6 Å²	66.6	12%	0.115	34%	0.341	C	S	.	.	H	α-helix	trans	-42.7	-52.3	-178.7	-179.1	0	0	0	0	114.6	N293 L294 V299 I300 L301 P479	N293-C297 WeakPolarHBondContact O-CB 3.38Å; N293-C297 PolarHBondContact O-N 3.28Å; L294-C297 VanDerWaalsContact O-CB 3.22Å; L294-C297 WeakPolarHBondContact O-CB 3.41Å; L294-C297 PolarHBondContact O-N 3.36Å; C297-V299 PolarHBondContact O-N 2.97Å; C297-I300 PolarHBondContact O-N 2.72Å; C297-L301 WeakPolarHBondContact O-CB 3.25Å; C297-L301 PolarHBondContact O-N 2.97Å; C297-P479 PolarHBondContact SG-O 3Å
298	P	92.6	Very high	94.3	Very high	81 Å²	81	65.5 Å²	65.5	53%	0.526	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-39.7	-179	23.1	-34	0	0	0	113.1	L301 V302	P298-L301 PolarHBondContact O-N 3.31Å; P298-V302 WeakPolarHBondContact O-CG2 3.45Å; P298-V302 PolarHBondContact O-N 3.32Å
299	V	90.9	Very high	94.1	Very high	63 Å²	63	62.5 Å²	62.5	38%	0.382	33%	0.33	S	S	.	.	H	α-helix	trans	-68.1	-45	179.5	-178.1	0	0	0	0	110.6	I134 L296 C297 L301 V302 W303	I134-V299 HydrophobicContact CG2-CG1 4.19Å; L296-V299 PolarHBondContact O-N 3.09Å; C297-V299 PolarHBondContact O-N 2.97Å; V299-L301 VanDerWaalsContact C-N 3.35Å; V299-V302 PolarHBondContact O-N 3.44Å; V299-W303 PolarHBondContact O-N 2.63Å; V299-W303 VanDerWaalsContact O-N 3.09Å
300	I	92.9	Very high	93.9	Very high	59 Å²	59	64.1 Å²	64.1	30%	0.303	34%	0.336	S	S	.	.	H	α-helix	trans	-66.5	-38.9	178.6	-58.1	169	0	0	0	110.4	L296 C297 W303 Q304 P479	L296-I300 HydrophobicContact CB-CD1 3.73Å; L296-I300 HydrophobicContact CB-CG1 4.24Å; L296-I300 WeakPolarHBondContact O-CG1 3.44Å; L296-I300 PolarHBondContact O-N 3.16Å; C297-I300 PolarHBondContact O-N 2.72Å; I300-W303 PolarHBondContact O-N 2.74Å; I300-Q304 HydrophobicContact CG2-CG 4.41Å; I300-Q304 WeakPolarHBondContact O-CG 3.35Å; I300-Q304 PolarHBondContact O-N 3.3Å; I300-P479 HydrophobicContact CB-CB 4.13Å; I300-P479 HydrophobicContact CB-CG 4.35Å; I300-P479 HydrophobicContact CG2-CB 3.95Å; I300-P479 HydrophobicContact CG2-CG 3.73Å
301	L	94.3	Very high	93.4	Very high	49 Å²	49	66 Å²	66	26%	0.257	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-44.8	178.1	-177.5	61.9	0	0	0	112	C297 P298 V299 W303 Q304 I305 L476 P479 V480	C297-L301 WeakPolarHBondContact O-CB 3.25Å; C297-L301 PolarHBondContact O-N 2.97Å; P298-L301 PolarHBondContact O-N 3.31Å; V299-L301 VanDerWaalsContact C-N 3.35Å; L301-W303 VanDerWaalsContact C-N 3.33Å; L301-W303 PolarHBondContact O-N 2.84Å; L301-Q304 PolarHBondContact O-N 2.85Å; L301-I305 HydrophobicContact CD1-CD1 4.29Å; L301-I305 HydrophobicContact CD1-CG1 4.44Å; L301-I305 HydrophobicContact CG-CD1 4Å; L301-I305 VanDerWaalsContact O-CG1 3.29Å; L301-I305 WeakPolarHBondContact O-CG1 3.37Å; L301-I305 PolarHBondContact O-N 2.63Å; L301-L476 HydrophobicContact CD1-CD1 4.13Å; L301-L476 WeakPolarHBondContact CD1-O 3.44Å; L301-P479 HydrophobicContact CB-CB 4.37Å; L301-P479 HydrophobicContact CB-CG 4.44Å; L301-P479 HydrophobicContact CD1-CG 4.47Å; L301-V480 HydrophobicContact CD2-CG2 4.25Å
302	V	91.9	Very high	93	Very high	74 Å²	74	65.1 Å²	65.1	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-59.2	-44.5	173.8	169.2	0	0	0	0	110.9	P298 V299 Q304 I305 L306	P298-V302 WeakPolarHBondContact O-CG2 3.45Å; P298-V302 PolarHBondContact O-N 3.32Å; V299-V302 PolarHBondContact O-N 3.44Å; V302-Q304 PolarHBondContact O-N 2.84Å; V302-I305 PolarHBondContact O-N 3.13Å; V302-L306 HydrophobicContact CG1-CD1 3.84Å; V302-L306 HydrophobicContact CG1-CG 4.42Å; V302-L306 VanDerWaalsContact O-CG 3.31Å; V302-L306 WeakPolarHBondContact O-CG 3.14Å; V302-L306 PolarHBondContact O-N 2.73Å
303	W	91.7	Very high	92.5	Very high	79 Å²	79	65.9 Å²	65.9	30%	0.299	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-45.6	174.6	171.7	-101.4	0	0	0	112.6	L73 V76 V299 I300 L301 L306 Y307	L73-W303 HydrophobicContact CD1-CE3 4.15Å; L73-W303 HydrophobicContact CD1-CH2 3.68Å; L73-W303 HydrophobicContact CD1-CZ2 4.43Å; L73-W303 HydrophobicContact CD1-CZ3 3.5Å; L73-W303 VanDerWaalsContact CD1-CZ3 3.5Å; V76-W303 HydrophobicContact CB-CH2 4.21Å; V76-W303 HydrophobicContact CB-CZ3 3.9Å; V76-W303 HydrophobicContact CG1-CE3 4.22Å; V76-W303 HydrophobicContact CG1-CH2 4.17Å; V76-W303 HydrophobicContact CG1-CZ3 3.55Å; V299-W303 PolarHBondContact O-N 2.63Å; V299-W303 VanDerWaalsContact O-N 3.09Å; I300-W303 PolarHBondContact O-N 2.74Å; L301-W303 VanDerWaalsContact C-N 3.33Å; L301-W303 PolarHBondContact O-N 2.84Å; W303-L306 PolarHBondContact O-N 3.28Å; W303-Y307 HydrophobicContact CH2-CD2 4.35Å; W303-Y307 AromaticContact CZ2-CD2 3.9Å; W303-Y307 HydrophobicContact CZ2-CD2 3.9Å; W303-Y307 HydrophobicContact CZ2-CG 4.3Å; W303-Y307 VanDerWaalsContact O-CB 3.24Å; W303-Y307 WeakPolarHBondContact O-CB 3.49Å; W303-Y307 PolarHBondContact O-N 3.03Å
304	Q	93.6	Very high	92	Very high	45 Å²	45	69.2 Å²	69.2	21%	0.21	36%	0.356	C	S	.	.	H	α-helix	trans	-64.4	-40.3	178.6	-69.4	-69	8.5	0	0	112.4	I300 L301 V302 A308 L476 P479	I300-Q304 HydrophobicContact CG2-CG 4.41Å; I300-Q304 WeakPolarHBondContact O-CG 3.35Å; I300-Q304 PolarHBondContact O-N 3.3Å; L301-Q304 PolarHBondContact O-N 2.85Å; V302-Q304 PolarHBondContact O-N 2.84Å; Q304-A308 WeakPolarHBondContact O-CB 3.44Å; Q304-A308 PolarHBondContact O-N 2.89Å; Q304-L476 HydrophobicContact CB-CD1 4.19Å; Q304-P479 HydrophobicContact CG-CG 4.09Å
305	I	94.1	Very high	91.5	Very high	87 Å²	87	66.3 Å²	66.3	45%	0.446	34%	0.341	S	S	.	.	H	α-helix	trans	-60.2	-51.9	175.5	-69.2	164.6	0	0	0	110.3	L301 V302 A308 F309 L476	L301-I305 HydrophobicContact CD1-CD1 4.29Å; L301-I305 HydrophobicContact CD1-CG1 4.44Å; L301-I305 HydrophobicContact CG-CD1 4Å; L301-I305 VanDerWaalsContact O-CG1 3.29Å; L301-I305 WeakPolarHBondContact O-CG1 3.37Å; L301-I305 PolarHBondContact O-N 2.63Å; V302-I305 PolarHBondContact O-N 3.13Å; I305-A308 PolarHBondContact O-N 3Å; I305-F309 VanDerWaalsContact O-CB 3.32Å; I305-F309 WeakPolarHBondContact O-CB 3.38Å; I305-F309 PolarHBondContact O-N 3.05Å; I305-L476 HydrophobicContact CG1-CD1 3.65Å
306	L	92.7	Very high	90.9	Very high	41 Å²	41	63.3 Å²	63.3	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-47	-178.6	-67	171.5	0	0	0	111.6	V76 T80 V302 W303 A308 F309 F310	V76-L306 HydrophobicContact CG1-CB 4.07Å; T80-L306 HydrophobicContact CG2-CD1 3.92Å; T80-L306 HydrophobicContact CG2-CD2 3.71Å; T80-L306 HydrophobicContact CG2-CG 4.49Å; V302-L306 HydrophobicContact CG1-CD1 3.84Å; V302-L306 HydrophobicContact CG1-CG 4.42Å; V302-L306 VanDerWaalsContact O-CG 3.31Å; V302-L306 WeakPolarHBondContact O-CG 3.14Å; V302-L306 PolarHBondContact O-N 2.73Å; W303-L306 PolarHBondContact O-N 3.28Å; L306-A308 PolarHBondContact O-N 2.96Å; L306-F309 PolarHBondContact O-N 2.73Å; L306-F310 HydrophobicContact CB-CD2 4.48Å; L306-F310 HydrophobicContact CB-CE2 4.32Å; L306-F310 HydrophobicContact CD2-CE2 4.36Å; L306-F310 WeakPolarHBondContact O-CD2 3.41Å; L306-F310 PolarHBondContact O-N 2.81Å
307	Y	90.8	Very high	90.2	Very high	88 Å²	88	67.4 Å²	67.4	35%	0.345	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-42.5	179	-177	-99.3	0	0	0	112.1	W303 S311	W303-Y307 HydrophobicContact CH2-CD2 4.35Å; W303-Y307 AromaticContact CZ2-CD2 3.9Å; W303-Y307 HydrophobicContact CZ2-CD2 3.9Å; W303-Y307 HydrophobicContact CZ2-CG 4.3Å; W303-Y307 VanDerWaalsContact O-CB 3.24Å; W303-Y307 WeakPolarHBondContact O-CB 3.49Å; W303-Y307 PolarHBondContact O-N 3.03Å; Y307-S311 WeakPolarHBondContact O-CB 3.29Å; Y307-S311 PolarHBondContact O-N 3.32Å; Y307-S311 PolarHBondContact O-OG 3.29Å
308	A	91.7	Very high	89.8	Confident	19 Å²	19	74.7 Å²	74.7	16%	0.157	36%	0.364	C	S	.	.	H	α-helix	trans	-65	-41.4	175.2	0	0	0	0	0	111.9	Q304 I305 L306 S311 Y312	Q304-A308 WeakPolarHBondContact O-CB 3.44Å; Q304-A308 PolarHBondContact O-N 2.89Å; I305-A308 PolarHBondContact O-N 3Å; L306-A308 PolarHBondContact O-N 2.96Å; A308-S311 PolarHBondContact O-N 3.29Å; A308-Y312 HydrophobicContact CB-CD2 4.07Å; A308-Y312 HydrophobicContact CB-CE2 4.41Å; A308-Y312 WeakPolarHBondContact O-CB 3.5Å; A308-Y312 WeakPolarHBondContact O-CD2 3.13Å; A308-Y312 PolarHBondContact O-N 3.33Å
309	F	92.7	Very high	89.5	Confident	114 Å²	114	75.6 Å²	75.6	50%	0.5	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-52.6	176.6	177.3	-101.3	0	0	0	111.8	I305 L306 S311 T313	I305-F309 VanDerWaalsContact O-CB 3.32Å; I305-F309 WeakPolarHBondContact O-CB 3.38Å; I305-F309 PolarHBondContact O-N 3.05Å; L306-F309 PolarHBondContact O-N 2.73Å; F309-S311 VanDerWaalsContact C-N 3.33Å; F309-S311 PolarHBondContact O-N 3.19Å; F309-T313 VanDerWaalsContact CD2-OG1 3.27Å; F309-T313 WeakPolarHBondContact CD2-OG1 3.29Å; F309-T313 HydrophobicContact CE2-CG2 4.25Å; F309-T313 WeakPolarHBondContact O-CB 3.44Å; F309-T313 PolarHBondContact O-N 2.76Å; F309-T313 VanDerWaalsContact O-N 3.15Å; F309-T313 PolarHBondContact O-OG1 3.43Å
310	F	91.2	Very high	89.1	Confident	59 Å²	59	73.4 Å²	73.4	26%	0.259	35%	0.349	S	S	.	.	H	α-helix	trans	-68.2	-29.6	179.6	-66.2	-59.4	0	0	0	113.2	V76 F79 L306	V76-F310 HydrophobicContact CB-CD2 4.43Å; V76-F310 HydrophobicContact CG1-CD2 3.93Å; V76-F310 HydrophobicContact CG1-CE2 4.04Å; V76-F310 HydrophobicContact CG2-CD2 4.01Å; F79-F310 AromaticContact CD1-CE1 3.72Å; F79-F310 HydrophobicContact CD1-CE1 3.72Å; F79-F310 AromaticContact CD1-CZ 3.91Å; F79-F310 HydrophobicContact CD1-CZ 3.91Å; F79-F310 AromaticContact CE1-CE1 3.89Å; F79-F310 HydrophobicContact CE1-CE1 3.89Å; F79-F310 HydrophobicContact CE1-CZ 4.45Å; L306-F310 HydrophobicContact CB-CD2 4.48Å; L306-F310 HydrophobicContact CB-CE2 4.32Å; L306-F310 HydrophobicContact CD2-CE2 4.36Å; L306-F310 WeakPolarHBondContact O-CD2 3.41Å; L306-F310 PolarHBondContact O-N 2.81Å
311	S	88.6	Confident	88.6	Confident	39 Å²	39	71.8 Å²	71.8	27%	0.273	35%	0.346	S	S	.	.	H	α-helix	trans	-85.8	-27.3	-178	-55.9	0	0	0	0	114.7	Y307 A308 F309	Y307-S311 WeakPolarHBondContact O-CB 3.29Å; Y307-S311 PolarHBondContact O-N 3.32Å; Y307-S311 PolarHBondContact O-OG 3.29Å; A308-S311 PolarHBondContact O-N 3.29Å; F309-S311 VanDerWaalsContact C-N 3.33Å; F309-S311 PolarHBondContact O-N 3.19Å
312	Y	87.7	Confident	88.2	Confident	53 Å²	53	70.2 Å²	70.2	21%	0.208	34%	0.339	C	S	.	.	H	α-helix	trans	-118.5	-16.2	-171	-59.1	-58.8	0	0	0	115.4	A308 E314 I315 I316 I472	A308-Y312 HydrophobicContact CB-CD2 4.07Å; A308-Y312 HydrophobicContact CB-CE2 4.41Å; A308-Y312 WeakPolarHBondContact O-CB 3.5Å; A308-Y312 WeakPolarHBondContact O-CD2 3.13Å; A308-Y312 PolarHBondContact O-N 3.33Å; Y312-E314 PolarHBondContact O-N 3.08Å; Y312-I315 HydrophobicContact CD1-CD1 4.19Å; Y312-I315 PolarHBondContact O-N 2.99Å; Y312-I315 VanDerWaalsContact O-N 3.17Å; Y312-I316 VanDerWaalsContact O-CG1 3.3Å; Y312-I316 WeakPolarHBondContact O-CG1 3.48Å; Y312-I316 PolarHBondContact O-N 2.99Å; Y312-I472 HydrophobicContact CD1-CD1 3.87Å; Y312-I472 HydrophobicContact CD2-CD1 3.82Å; Y312-I472 HydrophobicContact CD2-CG1 4.17Å; Y312-I472 HydrophobicContact CD2-CG2 4.03Å; Y312-I472 HydrophobicContact CE1-CD1 3.81Å; Y312-I472 HydrophobicContact CE1-CG1 4.36Å; Y312-I472 HydrophobicContact CE2-CB 4.49Å; Y312-I472 HydrophobicContact CE2-CD1 3.74Å; Y312-I472 HydrophobicContact CE2-CG1 3.68Å; Y312-I472 HydrophobicContact CE2-CG2 4Å; Y312-I472 HydrophobicContact CG-CD1 3.9Å
313	T	86.5	Confident	87.9	Confident	59 Å²	59	68.2 Å²	68.2	36%	0.362	33%	0.326	S	S	.	.	H	α-helix	trans	-64.2	-36.7	-179.2	-62.6	0	0	0	0	113	F309 I316 K317	F309-T313 VanDerWaalsContact CD2-OG1 3.27Å; F309-T313 WeakPolarHBondContact CD2-OG1 3.29Å; F309-T313 HydrophobicContact CE2-CG2 4.25Å; F309-T313 WeakPolarHBondContact O-CB 3.44Å; F309-T313 PolarHBondContact O-N 2.76Å; F309-T313 VanDerWaalsContact O-N 3.15Å; F309-T313 PolarHBondContact O-OG1 3.43Å; T313-I316 PolarHBondContact O-N 3.48Å; T313-K317 PolarHBondContact O-N 3.37Å; T313-K317 VanDerWaalsContact O-N 3.12Å
314	E	86.6	Confident	87.6	Confident	96 Å²	96	66.1 Å²	66.1	45%	0.449	33%	0.329	S	S	.	.	H	α-helix	trans	-60.4	-46.9	172.4	-173.8	-81.7	160.1	0	0	111.1	Y312 I316 K317 R318	Y312-E314 PolarHBondContact O-N 3.08Å; E314-I316 PolarHBondContact O-N 3.43Å; E314-K317 PolarHBondContact O-N 2.68Å; E314-K317 VanDerWaalsContact O-N 3.16Å; E314-R318 WeakPolarHBondContact O-CB 3.3Å; E314-R318 PolarHBondContact O-N 2.79Å; E314-R318 WeakPolarHBondContact OE1-CD 3.36Å; E314-R318 IonicContact OE1-CZ 3.75Å; E314-R318 IonicContact OE1-NE 3.44Å; E314-R318 IonicContact OE1-NH1 3.68Å; E314-R318 PolarHBondContact OE1-NH1 3.4Å; E314-R318 IonicContact OE2-NH1 2.69Å; E314-R318 PolarHBondContact OE2-NH1 3.49Å
315	I	86	Confident	87.4	Confident	38 Å²	38	65.8 Å²	65.8	20%	0.195	33%	0.334	C	S	.	.	H	α-helix	trans	-64.9	-39.7	-179	-63.1	176.8	0	0	0	111	Y312 K317 E319 S322	Y312-I315 HydrophobicContact CD1-CD1 4.19Å; Y312-I315 PolarHBondContact O-N 2.99Å; Y312-I315 VanDerWaalsContact O-N 3.17Å; I315-K317 VanDerWaalsContact C-N 3.33Å; I315-K317 PolarHBondContact O-N 2.79Å; I315-E319 CarbonylContact O-C 3.18Å; I315-E319 PolarHBondContact O-N 3.43Å; I315-S322 WeakPolarHBondContact CG2-OG 3.43Å
316	I	82.9	Confident	87.4	Confident	78 Å²	78	62.8 Å²	62.8	40%	0.4	32%	0.317	S	S	.	.	H	α-helix	trans	-60.9	-42	174.3	-70.9	162.9	0	0	0	111	Y312 T313 E314 L323	Y312-I316 VanDerWaalsContact O-CG1 3.3Å; Y312-I316 WeakPolarHBondContact O-CG1 3.48Å; Y312-I316 PolarHBondContact O-N 2.99Å; T313-I316 PolarHBondContact O-N 3.48Å; E314-I316 PolarHBondContact O-N 3.43Å; I316-L323 HydrophobicContact CD1-CD1 4.22Å; I316-L323 HydrophobicContact CG1-CD1 3.55Å
317	K	80.4	Confident	87.5	Confident	178 Å²	178	62.6 Å²	62.6	77%	0.774	32%	0.318	S	S	*	.	H	α-helix	trans	-73.5	-41	179.7	-173.8	178.9	178.9	-178.6	0	112.5	T313 E314 I315	T313-K317 PolarHBondContact O-N 3.37Å; T313-K317 VanDerWaalsContact O-N 3.12Å; E314-K317 PolarHBondContact O-N 2.68Å; E314-K317 VanDerWaalsContact O-N 3.16Å; I315-K317 VanDerWaalsContact C-N 3.33Å; I315-K317 PolarHBondContact O-N 2.79Å
318	R	86.4	Confident	87.8	Confident	169 Å²	169	59.8 Å²	59.8	64%	0.638	31%	0.307	S	S	*	.	H	α-helix	trans	-84.8	-41.9	-173.1	-161.6	-174.9	78.6	-146.3	9.5	113.4	E314	E314-R318 WeakPolarHBondContact O-CB 3.3Å; E314-R318 PolarHBondContact O-N 2.79Å; E314-R318 WeakPolarHBondContact OE1-CD 3.36Å; E314-R318 IonicContact OE1-CZ 3.75Å; E314-R318 IonicContact OE1-NE 3.44Å; E314-R318 IonicContact OE1-NH1 3.68Å; E314-R318 PolarHBondContact OE1-NH1 3.4Å; E314-R318 IonicContact OE2-NH1 2.69Å; E314-R318 PolarHBondContact OE2-NH1 3.49Å
319	E	86.3	Confident	88	Confident	101 Å²	101	58.9 Å²	58.9	47%	0.472	30%	0.3	S	S	.	.			trans	-151	71.7	-172.2	-163.6	-166.5	148.6	0	0	111.3	I315 G321 S322	I315-E319 CarbonylContact O-C 3.18Å; I315-E319 PolarHBondContact O-N 3.43Å; E319-G321 PolarHBondContact O-N 3.48Å; E319-G321 VanDerWaalsContact O-N 3.15Å; E319-S322 VanDerWaalsContact O-CB 3.27Å; E319-S322 WeakPolarHBondContact O-CB 3.49Å; E319-S322 PolarHBondContact O-N 3.31Å; E319-S322 PolarHBondContact O-OG 3.35Å
320	P	82.6	Confident	88.2	Confident	17 Å²	17	55.2 Å²	55.2	11%	0.11	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.4	-176.3	23.3	-33.2	0	0	0	113.2	S322 L323 T415 V416	P320-S322 PolarHBondContact O-N 3.37Å; P320-L323 PolarHBondContact O-N 2.98Å; P320-L323 VanDerWaalsContact O-N 3.11Å; P320-T415 HydrophobicContact CG-CG2 3.73Å; P320-V416 HydrophobicContact CB-CG2 3.8Å; P320-V416 HydrophobicContact CG-CG2 4.02Å
321	G	82.2	Confident	88.4	Confident	25 Å²	25	52.9 Å²	52.9	26%	0.258	28%	0.275	S	S	.	.	H	α-helix	trans	-58.8	-26.6	172.7	0	0	0	0	0	113.7	E319 L323 G324 A325	E319-G321 PolarHBondContact O-N 3.48Å; E319-G321 VanDerWaalsContact O-N 3.15Å; G321-L323 PolarHBondContact O-N 3.48Å; G321-G324 CarbonylContact O-C 3.56Å; G321-G324 WeakPolarHBondContact O-CA 3.43Å; G321-G324 PolarHBondContact O-N 3.34Å; G321-A325 PolarHBondContact O-N 3.44Å; G321-A325 VanDerWaalsContact O-N 3.15Å
322	S	86.3	Confident	88.7	Confident	16 Å²	16	51 Å²	51	11%	0.112	26%	0.262	C	S	.	.	H	α-helix	trans	-67.5	-15.4	177.1	75.6	0	0	0	0	113.9	I315 E319 P320 A325 K468	I315-S322 WeakPolarHBondContact CG2-OG 3.43Å; E319-S322 VanDerWaalsContact O-CB 3.27Å; E319-S322 WeakPolarHBondContact O-CB 3.49Å; E319-S322 PolarHBondContact O-N 3.31Å; E319-S322 PolarHBondContact O-OG 3.35Å; P320-S322 PolarHBondContact O-N 3.37Å; S322-A325 WeakPolarHBondContact O-CB 3.23Å; S322-K468 WeakPolarHBondContact O-CD 3.47Å
323	L	85.3	Confident	89.1	Confident	31 Å²	31	53 Å²	53	16%	0.162	27%	0.269	C	S	.	.	H	α-helix	trans	-85.7	-25.1	169.7	-64.9	-171.9	0	0	0	112.9	I316 P320 G321 A325 K468 A469 I472	I316-L323 HydrophobicContact CD1-CD1 4.22Å; I316-L323 HydrophobicContact CG1-CD1 3.55Å; P320-L323 PolarHBondContact O-N 2.98Å; P320-L323 VanDerWaalsContact O-N 3.11Å; G321-L323 PolarHBondContact O-N 3.48Å; L323-A325 VanDerWaalsContact C-N 3.26Å; L323-K468 HydrophobicContact CD2-CD 4.03Å; L323-K468 HydrophobicContact CD2-CG 4.34Å; L323-A469 HydrophobicContact CB-CB 4.36Å; L323-A469 PolarHBondContact O-N 3.49Å; L323-A469 VanDerWaalsContact O-N 3.12Å; L323-I472 HydrophobicContact CD2-CD1 3.79Å
324	G	86.2	Confident	89.5	Confident	36 Å²	36	50.8 Å²	50.8	37%	0.371	26%	0.256	S	S	.	.	H	α-helix	trans	-75.6	-12.3	167.7	0	0	0	0	0	113.4	G321 Y467	G321-G324 CarbonylContact O-C 3.56Å; G321-G324 WeakPolarHBondContact O-CA 3.43Å; G321-G324 PolarHBondContact O-N 3.34Å; G324-Y467 WeakPolarHBondContact O-CD1 3.4Å; G324-Y467 VanDerWaalsContact O-CE1 3.28Å; G324-Y467 WeakPolarHBondContact O-CE1 3.33Å
325	A	89.3	Confident	89.9	Confident	37 Å²	37	46.7 Å²	46.7	31%	0.306	24%	0.236	S	C	.	.	S	Bend	trans	-61.9	152.1	166	0	0	0	0	0	111.3	G321 S322 L323 K468	G321-A325 PolarHBondContact O-N 3.44Å; G321-A325 VanDerWaalsContact O-N 3.15Å; S322-A325 WeakPolarHBondContact O-CB 3.23Å; L323-A325 VanDerWaalsContact C-N 3.26Å; A325-K468 WeakPolarHBondContact O-CB 3.31Å; A325-K468 PolarHBondContact O-N 3.01Å
326	R	93.2	Very high	90.4	Very high	25 Å²	25	44.9 Å²	44.9	9%	0.094	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	159.6	178.9	-72.1	177.4	173.7	-96.8	2	111.6	Y354 M361 S462 F465 Q466 Y467	R326-Y354 WeakPolarHBondContact O-CE2 3.42Å; R326-Y354 PolarHBondContact O-OH 3.18Å; R326-M361 VanDerWaalsContact CZ-CE 3.48Å; R326-S462 PolarHBondContact NH1-OG 3.38Å; R326-F465 HydrophobicContact CB-CD1 3.75Å; R326-F465 HydrophobicContact CB-CD2 4.49Å; R326-F465 HydrophobicContact CB-CE1 3.39Å; R326-F465 HydrophobicContact CB-CE2 4.18Å; R326-F465 HydrophobicContact CB-CG 4.29Å; R326-F465 HydrophobicContact CB-CZ 3.63Å; R326-F465 HydrophobicContact CG-CD1 4.36Å; R326-F465 HydrophobicContact CG-CE1 4.24Å; R326-F465 PolarHBondContact NH1-O 3.11Å; R326-Q466 CarbonylContact C-O 3.58Å; R326-Q466 WeakPolarHBondContact CA-O 3.39Å; R326-Q466 WeakPolarHBondContact CB-O 3.48Å; R326-Y467 HydrophobicContact CG-CD1 3.74Å; R326-Y467 HydrophobicContact CG-CE1 3.95Å; R326-Y467 HydrophobicContact CG-CG 4.32Å; R326-Y467 PolarHBondContact NH2-OH 3.21Å; R326-Y467 VanDerWaalsContact NH2-OH 3.08Å
327	C	95.1	Very high	91.1	Very high	36 Å²	36	42.2 Å²	42.2	24%	0.243	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	154.5	176.5	57.6	0	0	0	0	110.8	S329 F465 Q466	C327-S329 PolarHBondContact O-N 3.47Å; C327-F465 CarbonylContact O-C 3.57Å; C327-F465 WeakPolarHBondContact O-CA 3.22Å; C327-Q466 PolarHBondContact N-O 2.9Å; C327-Q466 PolarHBondContact O-N 3.4Å; C327-Q466 VanDerWaalsContact O-N 3.08Å
328	W	96.8	Very high	91.9	Very high	29 Å²	29	33.8 Å²	33.8	11%	0.11	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	119.5	172.7	-62	110.3	0	0	0	109.9	R333 L336 L350 A357 I441 F461 L464 F465	W328-R333 HydrophobicContact CB-CG 4.26Å; W328-L336 HydrophobicContact CE3-CD1 4.06Å; W328-L336 HydrophobicContact CZ3-CD1 3.88Å; W328-L350 HydrophobicContact CB-CD1 4.36Å; W328-L350 HydrophobicContact CD2-CD2 3.83Å; W328-L350 HydrophobicContact CE3-CD2 4.14Å; W328-L350 HydrophobicContact CG-CB 4.27Å; W328-L350 HydrophobicContact CG-CD1 4.29Å; W328-L350 HydrophobicContact CG-CD2 4.14Å; W328-L350 HydrophobicContact CG-CG 4.47Å; W328-L350 HydrophobicContact CZ2-CD2 4.31Å; W328-L350 PolarHBondContact NE1-O 3.33Å; W328-A357 HydrophobicContact CH2-CB 3.81Å; W328-A357 HydrophobicContact CZ2-CB 3.89Å; W328-I441 HydrophobicContact CH2-CG2 3.78Å; W328-I441 HydrophobicContact CZ2-CG2 4.28Å; W328-I441 HydrophobicContact CZ3-CG2 4.41Å; W328-F461 HydrophobicContact CH2-CZ 4.18Å; W328-F461 HydrophobicContact CZ3-CZ 4.25Å; W328-L464 WeakPolarHBondContact CA-O 3.27Å; W328-F465 AromaticContact CD2-CD2 3.64Å; W328-F465 HydrophobicContact CD2-CD2 3.64Å; W328-F465 HydrophobicContact CD2-CE2 4.14Å; W328-F465 AromaticContact CE2-CD2 3.93Å; W328-F465 HydrophobicContact CE3-CB 4.16Å; W328-F465 AromaticContact CE3-CD2 3.72Å; W328-F465 HydrophobicContact CE3-CD2 3.72Å; W328-F465 HydrophobicContact CE3-CG 4.34Å; W328-F465 HydrophobicContact CG-CD2 4.13Å; W328-F465 HydrophobicContact CG-CE2 4.41Å; W328-F465 HydrophobicContact CH2-CD2 4.36Å; W328-F465 HydrophobicContact CZ2-CD2 4.3Å; W328-F465 HydrophobicContact CZ2-CE2 4.46Å; W328-F465 HydrophobicContact CZ3-CB 4.14Å; W328-F465 HydrophobicContact CZ3-CD2 4.08Å; W328-F465 HydrophobicContact CZ3-CG 4.38Å
329	S	96.4	Very high	92.4	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.007	15%	0.145	C	C	.	.			trans	-64.8	155.8	-177.8	68.5	0	0	0	0	111.3	C327 Y331 G332 R333 Q463 L464	C327-S329 PolarHBondContact O-N 3.47Å; S329-Y331 PolarHBondContact O-N 2.98Å; S329-G332 PolarHBondContact O-N 2.84Å; S329-G332 VanDerWaalsContact O-N 3.11Å; S329-G332 PolarHBondContact OG-N 2.83Å; S329-R333 WeakPolarHBondContact O-CG 3.46Å; S329-R333 PolarHBondContact O-N 2.97Å; S329-Q463 WeakPolarHBondContact CB-O 3.25Å; S329-Q463 PolarHBondContact OG-O 2.99Å; S329-L464 PolarHBondContact N-O 3.44Å; S329-L464 PolarHBondContact OG-O 3.04Å
330	L	96	Very high	92.9	Very high	36 Å²	36	20.9 Å²	20.9	19%	0.188	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-30.7	175.1	-175.1	64.5	0	0	0	111.2	Y239 T240 R241 K244 R333 C334	Y239-L330 HydrophobicContact CD1-CB 4.24Å; Y239-L330 HydrophobicContact CD1-CD2 4.2Å; Y239-L330 HydrophobicContact CD1-CG 3.88Å; Y239-L330 HydrophobicContact CE1-CD2 4.21Å; Y239-L330 HydrophobicContact CE1-CG 3.85Å; Y239-L330 WeakPolarHBondContact O-CB 3.48Å; T240-L330 VanDerWaalsContact C-CD2 3.45Å; R241-L330 HydrophobicContact CG-CD2 4.24Å; K244-L330 HydrophobicContact CB-CD2 4.15Å; K244-L330 HydrophobicContact CD-CD1 4.39Å; K244-L330 HydrophobicContact CD-CD2 4.22Å; L330-R333 PolarHBondContact O-N 3.45Å; L330-C334 PolarHBondContact O-N 3.08Å
331	Y	95.8	Very high	93.5	Very high	11 Å²	11	20.1 Å²	20.1	4%	0.043	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-50.1	170.5	169.6	-105	0	0	0	111.2	V219 V226 R227 V237 S329 R333 C334 Y335 L464	V219-Y331 HydrophobicContact CG1-CD2 4.38Å; V219-Y331 HydrophobicContact CG1-CE2 4.06Å; V226-Y331 HydrophobicContact CG2-CD2 4.13Å; V226-Y331 HydrophobicContact CG2-CE2 4.12Å; R227-Y331 PolarHBondContact NH2-OH 3.48Å; V237-Y331 HydrophobicContact CG1-CD1 3.9Å; V237-Y331 HydrophobicContact CG1-CD2 3.82Å; V237-Y331 HydrophobicContact CG1-CE1 4.41Å; V237-Y331 HydrophobicContact CG1-CE2 4.34Å; V237-Y331 HydrophobicContact CG1-CG 3.58Å; S329-Y331 PolarHBondContact O-N 2.98Å; Y331-R333 VanDerWaalsContact C-N 3.26Å; Y331-R333 PolarHBondContact O-N 3.39Å; Y331-C334 CarbonylContact O-C 3.54Å; Y331-C334 PolarHBondContact O-N 2.85Å; Y331-Y335 WeakPolarHBondContact O-CB 3.35Å; Y331-Y335 PolarHBondContact O-N 3.42Å; Y331-L464 HydrophobicContact CD1-CD2 3.9Å; Y331-L464 HydrophobicContact CE1-CD2 3.66Å
332	G	94.9	Very high	94.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-57.4	-37.4	175.7	0	0	0	0	0	112.8	S329 C334 Y335 L336	S329-G332 PolarHBondContact O-N 2.84Å; S329-G332 VanDerWaalsContact O-N 3.11Å; S329-G332 PolarHBondContact OG-N 2.83Å; G332-C334 VanDerWaalsContact C-N 3.27Å; G332-C334 PolarHBondContact O-N 3.41Å; G332-Y335 PolarHBondContact O-N 3.02Å; G332-L336 VanDerWaalsContact O-CB 3.3Å; G332-L336 WeakPolarHBondContact O-CB 3.46Å; G332-L336 WeakPolarHBondContact O-CG 3.45Å; G332-L336 PolarHBondContact O-N 3.36Å
333	R	96.2	Very high	94.7	Very high	94 Å²	94	20.7 Å²	20.7	36%	0.355	11%	0.113	S	C	.	.	H	α-helix	trans	-70.4	-14.3	174.8	-67.4	-176.7	72.5	158.8	6.6	114.8	W328 S329 L330 Y331 L346 L350	W328-R333 HydrophobicContact CB-CG 4.26Å; S329-R333 WeakPolarHBondContact O-CG 3.46Å; S329-R333 PolarHBondContact O-N 2.97Å; L330-R333 PolarHBondContact O-N 3.45Å; Y331-R333 VanDerWaalsContact C-N 3.26Å; Y331-R333 PolarHBondContact O-N 3.39Å; R333-L346 WeakPolarHBondContact O-CD2 3.24Å; R333-L350 HydrophobicContact CG-CD1 3.89Å
334	C	95	Very high	95.1	Very high	12 Å²	12	22 Å²	22	8%	0.081	12%	0.118	C	C	.	.	H	α-helix	trans	-98.3	-33.6	167.8	-75.8	0	0	0	0	112.1	V219 Y239 L330 Y331 G332	V219-C334 HydrophobicContact CG1-CB 4.39Å; V219-C334 HydrophobicContact CG2-CB 4.23Å; Y239-C334 HydrophobicContact CE1-CB 4.37Å; L330-C334 PolarHBondContact O-N 3.08Å; Y331-C334 CarbonylContact O-C 3.54Å; Y331-C334 PolarHBondContact O-N 2.85Å; G332-C334 VanDerWaalsContact C-N 3.27Å; G332-C334 PolarHBondContact O-N 3.41Å
335	Y	95.1	Very high	95.5	Very high	11 Å²	11	21.3 Å²	21.3	4%	0.043	11%	0.105	C	C	.	.	H	α-helix	trans	-71	-48	179.5	-177.4	-106.2	0	0	0	112.2	Y331 G332 R337 L464 D546 K548	Y331-Y335 WeakPolarHBondContact O-CB 3.35Å; Y331-Y335 PolarHBondContact O-N 3.42Å; G332-Y335 PolarHBondContact O-N 3.02Å; Y335-R337 VanDerWaalsContact C-N 3.25Å; Y335-R337 PolarHBondContact O-N 2.91Å; Y335-L464 HydrophobicContact CD1-CD1 4.19Å; Y335-L464 HydrophobicContact CD1-CD2 3.6Å; Y335-L464 HydrophobicContact CE1-CD1 4.38Å; Y335-L464 HydrophobicContact CE1-CD2 4.38Å; Y335-L464 HydrophobicContact CG-CD2 4.16Å; Y335-D546 WeakPolarHBondContact CE2-OD2 3.22Å; Y335-D546 VanDerWaalsContact CZ-OD2 3.24Å; Y335-D546 PolarHBondContact OH-OD2 2.86Å; Y335-K548 VanDerWaalsContact O-CE 3.23Å; Y335-K548 WeakPolarHBondContact O-CE 3.19Å; Y335-K548 PolarHBondContact O-NZ 3.09Å
336	L	96.1	Very high	95.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-82	3.3	-177.2	-58	174.8	0	0	0	114.4	W328 G332 R349 L350 I441 L464	W328-L336 HydrophobicContact CE3-CD1 4.06Å; W328-L336 HydrophobicContact CZ3-CD1 3.88Å; G332-L336 VanDerWaalsContact O-CB 3.3Å; G332-L336 WeakPolarHBondContact O-CB 3.46Å; G332-L336 WeakPolarHBondContact O-CG 3.45Å; G332-L336 PolarHBondContact O-N 3.36Å; L336-R349 PolarHBondContact O-NH1 2.77Å; L336-R349 VanDerWaalsContact O-NH1 3.09Å; L336-R349 PolarHBondContact O-NH2 2.69Å; L336-L350 HydrophobicContact CB-CD2 4.47Å; L336-L350 HydrophobicContact CD1-CD2 3.81Å; L336-I441 HydrophobicContact CD1-CB 4.16Å; L336-I441 HydrophobicContact CD1-CD1 4.36Å; L336-I441 HydrophobicContact CD1-CG2 4.26Å; L336-I441 HydrophobicContact CD2-CB 4.21Å; L336-I441 HydrophobicContact CD2-CD1 3.95Å; L336-I441 HydrophobicContact CD2-CG1 4.33Å; L336-L464 HydrophobicContact CD2-CD1 4.19Å
337	R	97.2	Very high	95.9	Very high	22 Å²	22	22.4 Å²	22.4	8%	0.083	11%	0.106	C	C	.	.	P	Polyproline II helix	trans	-88.9	133.4	-179	-166.4	-177.5	-174.4	136.6	0.6	111.2	V216 Y335 E341 D343 L346 K548	V216-R337 HydrophobicContact CG2-CB 4.22Å; V216-R337 HydrophobicContact CG2-CG 4.3Å; Y335-R337 VanDerWaalsContact C-N 3.25Å; Y335-R337 PolarHBondContact O-N 2.91Å; R337-E341 VanDerWaalsContact CA-OE2 3.32Å; R337-E341 WeakPolarHBondContact CA-OE2 3.38Å; R337-E341 HydrophobicContact CG-CB 4.29Å; R337-E341 HydrophobicContact CG-CG 4.4Å; R337-E341 WeakPolarHBondContact CG-OE2 3.18Å; R337-E341 VanDerWaalsContact CZ-O 3.3Å; R337-E341 PolarHBondContact NE-O 3.09Å; R337-E341 VanDerWaalsContact NE-O 3.15Å; R337-E341 PolarHBondContact NH2-O 3.29Å; R337-D343 IonicContact CZ-OD1 2.86Å; R337-D343 IonicContact NH1-OD1 2.81Å; R337-D343 PolarHBondContact NH1-OD1 3.15Å; R337-D343 IonicContact NH2-OD1 3.87Å; R337-D343 PolarHBondContact NH2-OD1 2.72Å; R337-L346 HydrophobicContact CB-CD1 4.15Å; R337-L346 HydrophobicContact CB-CD2 4.15Å; R337-L346 HydrophobicContact CG-CD1 4.33Å; R337-L346 HydrophobicContact CG-CD2 3.97Å; R337-K548 PolarHBondContact O-NZ 3.23Å
338	H	96.7	Very high	95.8	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.	P	Polyproline II helix	trans	-73.2	165.7	170.5	-50.1	98.9	0	0	0	111.2	E341 R349 H442 Y443 S552 H555	H338-E341 HydrophobicContact CB-CB 3.97Å; H338-E341 IonicContact CG-OE2 2.78Å; H338-E341 PolarHBondContact N-OE2 3.15Å; H338-E341 VanDerWaalsContact ND1-CD 3.31Å; H338-E341 IonicContact ND1-OE1 2.68Å; H338-E341 PolarHBondContact ND1-OE1 2.95Å; H338-E341 IonicContact ND1-OE2 3.18Å; H338-E341 PolarHBondContact ND1-OE2 3.37Å; H338-R349 PolarHBondContact CE1-NE 2.72Å; H338-R349 PolarHBondContact CE1-NH1 2.97Å; H338-R349 VanDerWaalsContact CE1-NH1 3.34Å; H338-R349 PolarHBondContact CE1-NH2 3.01Å; H338-R349 PolarHBondContact ND1-NH1 3.49Å; H338-H442 AromaticContact CE1-CE1 3.77Å; H338-H442 AromaticContact CE1-ND1 3.18Å; H338-H442 PolarHBondContact CE1-ND1 3.5Å; H338-H442 AromaticContact NE2-CE1 3.91Å; H338-H442 AromaticContact NE2-CG 3.93Å; H338-H442 AromaticContact NE2-ND1 2.98Å; H338-H442 PolarHBondContact NE2-ND1 3.42Å; H338-Y443 AromaticContact CD2-CE2 3.64Å; H338-Y443 AromaticContact CD2-CZ 3.74Å; H338-Y443 PolarHBondContact CD2-OH 3.26Å; H338-Y443 AromaticContact NE2-CE2 4Å; H338-S552 WeakPolarHBondContact CA-OG 3.36Å; H338-S552 WeakPolarHBondContact CB-OG 3.5Å; H338-H555 AromaticContact CE1-CD2 3.21Å; H338-H555 PolarHBondContact CE1-CD2 2.63Å; H338-H555 AromaticContact CE1-CG 3.38Å; H338-H555 AromaticContact CE1-ND1 3.98Å; H338-H555 AromaticContact CE1-NE2 3.72Å; H338-H555 AromaticContact CG-CG 3.99Å; H338-H555 AromaticContact ND1-CD2 3.67Å; H338-H555 AromaticContact ND1-CE1 3.89Å; H338-H555 AromaticContact ND1-CG 3.53Å; H338-H555 AromaticContact ND1-ND1 3.68Å; H338-H555 AromaticContact ND1-NE2 3.86Å; H338-H555 AromaticContact NE2-CD2 3.9Å; H338-H555 AromaticContact NE2-CG 3.82Å
339	F	96.8	Very high	95.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	144.4	159.9	-61.4	-66.5	0	0	0	110	V216 A217 E341 F517 A518 K548 S552	V216-F339 HydrophobicContact CB-CD1 4.4Å; V216-F339 HydrophobicContact CB-CE1 4.05Å; V216-F339 HydrophobicContact CG1-CD1 4.1Å; V216-F339 HydrophobicContact CG1-CE1 3.69Å; V216-F339 HydrophobicContact CG1-CZ 4.15Å; A217-F339 HydrophobicContact CB-CE1 3.93Å; A217-F339 HydrophobicContact CB-CZ 4.21Å; F339-E341 PolarHBondContact O-N 3.27Å; F339-F517 HydrophobicContact CD1-CB 4.26Å; F339-F517 HydrophobicContact CD2-CB 4.16Å; F339-F517 HydrophobicContact CE1-CB 3.8Å; F339-F517 HydrophobicContact CE2-CB 3.68Å; F339-F517 HydrophobicContact CE2-CG 4.42Å; F339-F517 HydrophobicContact CG-CB 4.44Å; F339-F517 HydrophobicContact CZ-CB 3.49Å; F339-F517 VanDerWaalsContact CZ-CB 3.49Å; F339-F517 HydrophobicContact CZ-CG 4.09Å; F339-A518 HydrophobicContact CB-CB 4.4Å; F339-K548 HydrophobicContact CE2-CB 3.99Å; F339-K548 HydrophobicContact CE2-CD 4.29Å; F339-S552 PolarHBondContact N-OG 3.48Å
340	N	96.8	Very high	95.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	29.7	-178.5	-51.2	-40.7	0	0	0	115.2	Y205 H206 N213 A518 M520 F556	Y205-N340 HydrophobicContact CD1-CB 4.42Å; Y205-N340 WeakPolarHBondContact CD1-O 3.2Å; Y205-N340 WeakPolarHBondContact CE1-O 3.31Å; H206-N340 PolarHBondContact CD2-OD1 3.02Å; N213-N340 PolarHBondContact ND2-OD1 3.35Å; N213-N340 PolarHBondContact OD1-N 3.38Å; N340-A518 PolarHBondContact ND2-O 3.1Å; N340-M520 HydrophobicContact CB-SD 4.47Å; N340-M520 WeakPolarHBondContact ND2-CE 3.08Å; N340-M520 PolarHBondContact ND2-SD 3.04Å; N340-M520 VanDerWaalsContact ND2-SD 3.44Å; N340-F556 HydrophobicContact CB-CD2 3.78Å; N340-F556 HydrophobicContact CB-CE2 3.98Å
341	E	96.6	Very high	95.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.			trans	-97.3	132	170.3	171.1	174.6	-144.5	0	0	110.6	L209 R337 H338 F339 E345 L346 R349 H555	L209-E341 VanDerWaalsContact CD1-O 3.31Å; L209-E341 WeakPolarHBondContact CD1-O 3.47Å; R337-E341 VanDerWaalsContact CA-OE2 3.32Å; R337-E341 WeakPolarHBondContact CA-OE2 3.38Å; R337-E341 HydrophobicContact CG-CB 4.29Å; R337-E341 HydrophobicContact CG-CG 4.4Å; R337-E341 WeakPolarHBondContact CG-OE2 3.18Å; R337-E341 VanDerWaalsContact CZ-O 3.3Å; R337-E341 PolarHBondContact NE-O 3.09Å; R337-E341 VanDerWaalsContact NE-O 3.15Å; R337-E341 PolarHBondContact NH2-O 3.29Å; H338-E341 HydrophobicContact CB-CB 3.97Å; H338-E341 IonicContact CG-OE2 2.78Å; H338-E341 PolarHBondContact N-OE2 3.15Å; H338-E341 VanDerWaalsContact ND1-CD 3.31Å; H338-E341 IonicContact ND1-OE1 2.68Å; H338-E341 PolarHBondContact ND1-OE1 2.95Å; H338-E341 IonicContact ND1-OE2 3.18Å; H338-E341 PolarHBondContact ND1-OE2 3.37Å; F339-E341 PolarHBondContact O-N 3.27Å; E341-E345 VanDerWaalsContact CA-OE2 3.31Å; E341-E345 WeakPolarHBondContact CA-OE2 3.44Å; E341-E345 HydrophobicContact CG-CB 3.92Å; E341-L346 HydrophobicContact CG-CB 4.03Å; E341-L346 WeakPolarHBondContact OE1-CA 3.36Å; E341-L346 PolarHBondContact OE1-N 2.89Å; E341-R349 VanDerWaalsContact CD-NH1 3.26Å; E341-R349 WeakPolarHBondContact OE1-CD 3.33Å; E341-R349 IonicContact OE1-CZ 3.76Å; E341-R349 IonicContact OE1-NE 2.87Å; E341-R349 IonicContact OE1-NH1 2.68Å; E341-R349 PolarHBondContact OE1-NH1 3.29Å; E341-R349 IonicContact OE2-NH1 3.97Å; E341-R349 PolarHBondContact OE2-NH1 3.33Å; E341-H555 IonicContact OE1-CE1 2.67Å; E341-H555 IonicContact OE1-NE2 2.71Å
342	L	96.9	Very high	95.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.			trans	-78.3	161.3	176.7	-69.8	166	0	0	0	111.9	Y51 W176 Y205 I208 L209 H344 E345 L346	Y51-L342 HydrophobicContact CD2-CD1 4.38Å; Y51-L342 HydrophobicContact CD2-CD2 4.14Å; Y51-L342 HydrophobicContact CE2-CB 4.13Å; Y51-L342 HydrophobicContact CE2-CD1 3.88Å; Y51-L342 HydrophobicContact CE2-CD2 3.77Å; Y51-L342 HydrophobicContact CE2-CG 4.14Å; W176-L342 HydrophobicContact CG-CD1 4.34Å; W176-L342 VanDerWaalsContact NE1-CD1 3.33Å; Y205-L342 HydrophobicContact CD1-CD1 4.07Å; Y205-L342 HydrophobicContact CD1-CD2 4.34Å; Y205-L342 HydrophobicContact CD1-CG 3.8Å; Y205-L342 HydrophobicContact CE1-CB 4.42Å; Y205-L342 HydrophobicContact CE1-CD1 3.45Å; Y205-L342 VanDerWaalsContact CE1-CD1 3.45Å; Y205-L342 HydrophobicContact CE1-CD2 4.43Å; Y205-L342 HydrophobicContact CE1-CG 3.44Å; Y205-L342 VanDerWaalsContact CE1-CG 3.44Å; Y205-L342 HydrophobicContact CE2-CD1 4.32Å; I208-L342 HydrophobicContact CB-CD2 4.3Å; I208-L342 HydrophobicContact CD1-CD2 4.44Å; I208-L342 HydrophobicContact CG2-CD2 3.63Å; L209-L342 HydrophobicContact CD1-CD2 4.09Å; L209-L342 HydrophobicContact CD1-CG 4.39Å; L209-L342 HydrophobicContact CD2-CD2 4.05Å; L209-L342 HydrophobicContact CG-CD2 4.11Å; L342-H344 PolarHBondContact O-N 3.22Å; L342-E345 HydrophobicContact CB-CG 4.26Å; L342-E345 PolarHBondContact N-OE2 3.38Å; L342-E345 PolarHBondContact O-N 3.41Å; L342-L346 PolarHBondContact O-N 3.27Å
343	D	95.9	Very high	95.3	Very high	54 Å²	54	26.1 Å²	26.1	29%	0.289	13%	0.132	S	C	.	.	H	α-helix	trans	-65	-26.8	-173	-65.4	-19.7	0	0	0	113.2	Y51 K212 R337 M347	Y51-D343 PolarHBondContact OH-N 2.79Å; K212-D343 IonicContact NZ-OD1 3.39Å; K212-D343 PolarHBondContact NZ-OD1 2.89Å; K212-D343 VanDerWaalsContact NZ-OD1 3.08Å; K212-D343 IonicContact NZ-OD2 3.25Å; K212-D343 PolarHBondContact NZ-OD2 3.1Å; R337-D343 IonicContact CZ-OD1 2.86Å; R337-D343 IonicContact NH1-OD1 2.81Å; R337-D343 PolarHBondContact NH1-OD1 3.15Å; R337-D343 IonicContact NH2-OD1 3.87Å; R337-D343 PolarHBondContact NH2-OD1 2.72Å; D343-M347 WeakPolarHBondContact O-CB 3.42Å; D343-M347 PolarHBondContact O-N 3.19Å
344	H	94.5	Very high	95.3	Very high	59 Å²	59	26 Å²	26	27%	0.273	13%	0.131	S	C	.	.	H	α-helix	trans	-84.1	-36.2	-179.2	72.5	-80.9	0	0	0	113	Y51 Q55 W176 L342 M347 S348	Y51-H344 AromaticContact CE2-CE1 3.95Å; Y51-H344 AromaticContact CE2-ND1 3.62Å; Y51-H344 AromaticContact CZ-ND1 3.75Å; Y51-H344 PolarHBondContact OH-N 2.6Å; Y51-H344 PolarHBondContact OH-ND1 3.47Å; Q55-H344 PolarHBondContact NE2-ND1 3.04Å; W176-H344 AromaticContact CG-CE1 3.94Å; L342-H344 PolarHBondContact O-N 3.22Å; H344-M347 PolarHBondContact O-N 2.86Å; H344-S348 WeakPolarHBondContact O-CB 3.44Å; H344-S348 PolarHBondContact O-N 3.36Å
345	E	94.8	Very high	95.2	Very high	20 Å²	20	32.9 Å²	32.9	9%	0.093	16%	0.16	C	C	.	.	H	α-helix	trans	-57.3	-52.2	170.7	-65.2	162.7	-169.3	0	0	110.4	Y205 E341 L342 M347 S348 R349 H555	Y205-E345 WeakPolarHBondContact CE1-OE1 3.19Å; Y205-E345 PolarHBondContact OH-OE1 3.03Å; E341-E345 VanDerWaalsContact CA-OE2 3.31Å; E341-E345 WeakPolarHBondContact CA-OE2 3.44Å; E341-E345 HydrophobicContact CG-CB 3.92Å; L342-E345 HydrophobicContact CB-CG 4.26Å; L342-E345 PolarHBondContact N-OE2 3.38Å; L342-E345 PolarHBondContact O-N 3.41Å; E345-M347 VanDerWaalsContact C-N 3.32Å; E345-M347 PolarHBondContact O-N 3.3Å; E345-S348 WeakPolarHBondContact O-CB 3.32Å; E345-S348 PolarHBondContact O-N 3.16Å; E345-S348 VanDerWaalsContact O-N 3.14Å; E345-R349 PolarHBondContact O-N 2.95Å; E345-H555 IonicContact OE2-CE1 2.75Å
346	L	96	Very high	95.2	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-57.3	-44.5	174.7	178.2	65.5	0	0	0	111.7	R333 R337 E341 L342 S348 R349 L350	R333-L346 WeakPolarHBondContact O-CD2 3.24Å; R337-L346 HydrophobicContact CB-CD1 4.15Å; R337-L346 HydrophobicContact CB-CD2 4.15Å; R337-L346 HydrophobicContact CG-CD1 4.33Å; R337-L346 HydrophobicContact CG-CD2 3.97Å; E341-L346 HydrophobicContact CG-CB 4.03Å; E341-L346 WeakPolarHBondContact OE1-CA 3.36Å; E341-L346 PolarHBondContact OE1-N 2.89Å; L342-L346 PolarHBondContact O-N 3.27Å; L346-S348 VanDerWaalsContact C-N 3.32Å; L346-S348 PolarHBondContact O-N 3.17Å; L346-R349 PolarHBondContact O-N 3.29Å; L346-L350 HydrophobicContact CD1-CD1 3.9Å; L346-L350 HydrophobicContact CD1-CG 4.1Å; L346-L350 HydrophobicContact CG-CD1 3.88Å; L346-L350 HydrophobicContact CG-CG 4.4Å; L346-L350 WeakPolarHBondContact O-CB 3.34Å; L346-L350 VanDerWaalsContact O-CG 3.24Å; L346-L350 WeakPolarHBondContact O-CG 3.38Å; L346-L350 PolarHBondContact O-N 3Å
347	M	95	Very high	95.1	Very high	84 Å²	84	32.9 Å²	32.9	41%	0.414	16%	0.163	S	C	.	.	H	α-helix	trans	-67.2	-33.9	179.8	-166.2	66	-162.2	0	0	112	D343 H344 E345 S351	D343-M347 WeakPolarHBondContact O-CB 3.42Å; D343-M347 PolarHBondContact O-N 3.19Å; H344-M347 PolarHBondContact O-N 2.86Å; E345-M347 VanDerWaalsContact C-N 3.32Å; E345-M347 PolarHBondContact O-N 3.3Å; M347-S351 VanDerWaalsContact O-CB 3.23Å; M347-S351 WeakPolarHBondContact O-CB 3.49Å; M347-S351 PolarHBondContact O-N 3.16Å; M347-S351 PolarHBondContact O-OG 3.04Å
348	S	92.7	Very high	95	Very high	48 Å²	48	33.5 Å²	33.5	34%	0.336	17%	0.17	S	C	.	.	H	α-helix	trans	-62.9	-52.3	174.5	-176.5	0	0	0	0	111.2	H344 E345 L346 L350 S351 K352	H344-S348 WeakPolarHBondContact O-CB 3.44Å; H344-S348 PolarHBondContact O-N 3.36Å; E345-S348 WeakPolarHBondContact O-CB 3.32Å; E345-S348 PolarHBondContact O-N 3.16Å; E345-S348 VanDerWaalsContact O-N 3.14Å; L346-S348 VanDerWaalsContact C-N 3.32Å; L346-S348 PolarHBondContact O-N 3.17Å; S348-L350 PolarHBondContact O-N 3.49Å; S348-S351 PolarHBondContact O-N 3.03Å; S348-K352 WeakPolarHBondContact O-CG 3.36Å; S348-K352 PolarHBondContact O-N 3.38Å
349	R	94.2	Very high	94.8	Very high	12 Å²	12	39.4 Å²	39.4	5%	0.045	20%	0.196	C	C	.	.	H	α-helix	trans	-54.9	-51.4	174.5	-78.3	172.3	57.3	-126.3	3.2	112.5	L336 H338 E341 E345 L346 S351 K352 G353 H440 I441 H442	L336-R349 PolarHBondContact O-NH1 2.77Å; L336-R349 VanDerWaalsContact O-NH1 3.09Å; L336-R349 PolarHBondContact O-NH2 2.69Å; H338-R349 PolarHBondContact CE1-NE 2.72Å; H338-R349 PolarHBondContact CE1-NH1 2.97Å; H338-R349 VanDerWaalsContact CE1-NH1 3.34Å; H338-R349 PolarHBondContact CE1-NH2 3.01Å; H338-R349 PolarHBondContact ND1-NH1 3.49Å; E341-R349 VanDerWaalsContact CD-NH1 3.26Å; E341-R349 WeakPolarHBondContact OE1-CD 3.33Å; E341-R349 IonicContact OE1-CZ 3.76Å; E341-R349 IonicContact OE1-NE 2.87Å; E341-R349 IonicContact OE1-NH1 2.68Å; E341-R349 PolarHBondContact OE1-NH1 3.29Å; E341-R349 IonicContact OE2-NH1 3.97Å; E341-R349 PolarHBondContact OE2-NH1 3.33Å; E345-R349 PolarHBondContact O-N 2.95Å; L346-R349 PolarHBondContact O-N 3.29Å; R349-S351 VanDerWaalsContact C-N 3.29Å; R349-S351 PolarHBondContact O-N 3.03Å; R349-K352 PolarHBondContact O-N 3.4Å; R349-G353 PolarHBondContact O-N 2.87Å; R349-H440 PolarHBondContact NE-O 2.95Å; R349-I441 PolarHBondContact NH2-O 2.88Å; R349-H442 PolarHBondContact NE-CE1 2.95Å; R349-H442 PolarHBondContact NE-ND1 3.35Å
350	L	95.1	Very high	94.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65	-31.1	179.7	-68.8	179.3	0	0	0	112.7	W328 R333 L336 L346 S348 Y354 I441	W328-L350 HydrophobicContact CB-CD1 4.36Å; W328-L350 HydrophobicContact CD2-CD2 3.83Å; W328-L350 HydrophobicContact CE3-CD2 4.14Å; W328-L350 HydrophobicContact CG-CB 4.27Å; W328-L350 HydrophobicContact CG-CD1 4.29Å; W328-L350 HydrophobicContact CG-CD2 4.14Å; W328-L350 HydrophobicContact CG-CG 4.47Å; W328-L350 HydrophobicContact CZ2-CD2 4.31Å; W328-L350 PolarHBondContact NE1-O 3.33Å; R333-L350 HydrophobicContact CG-CD1 3.89Å; L336-L350 HydrophobicContact CB-CD2 4.47Å; L336-L350 HydrophobicContact CD1-CD2 3.81Å; L346-L350 HydrophobicContact CD1-CD1 3.9Å; L346-L350 HydrophobicContact CD1-CG 4.1Å; L346-L350 HydrophobicContact CG-CD1 3.88Å; L346-L350 HydrophobicContact CG-CG 4.4Å; L346-L350 WeakPolarHBondContact O-CB 3.34Å; L346-L350 VanDerWaalsContact O-CG 3.24Å; L346-L350 WeakPolarHBondContact O-CG 3.38Å; L346-L350 PolarHBondContact O-N 3Å; S348-L350 PolarHBondContact O-N 3.49Å; L350-Y354 WeakPolarHBondContact O-CB 3.18Å; L350-Y354 PolarHBondContact O-N 2.98Å; L350-Y354 VanDerWaalsContact O-N 3.12Å; L350-I441 HydrophobicContact CD2-CG2 4.46Å
351	S	94.5	Very high	94.5	Very high	65 Å²	65	39.7 Å²	39.7	46%	0.455	20%	0.197	S	C	.	.	H	α-helix	trans	-71.9	-42.4	175.4	-59.7	0	0	0	0	111.8	M347 S348 R349 Y354	M347-S351 VanDerWaalsContact O-CB 3.23Å; M347-S351 WeakPolarHBondContact O-CB 3.49Å; M347-S351 PolarHBondContact O-N 3.16Å; M347-S351 PolarHBondContact O-OG 3.04Å; S348-S351 PolarHBondContact O-N 3.03Å; R349-S351 VanDerWaalsContact C-N 3.29Å; R349-S351 PolarHBondContact O-N 3.03Å; S351-Y354 WeakPolarHBondContact O-CB 3.31Å; S351-Y354 PolarHBondContact O-N 2.92Å
352	K	92.4	Very high	94.3	Very high	67 Å²	67	42.9 Å²	42.9	29%	0.291	21%	0.214	S	C	.	.	H	α-helix	trans	-58.9	-47.3	173.3	-70.7	169.8	174.5	177.4	0	111.1	S348 R349 Y354 S702	S348-K352 WeakPolarHBondContact O-CG 3.36Å; S348-K352 PolarHBondContact O-N 3.38Å; R349-K352 PolarHBondContact O-N 3.4Å; K352-Y354 VanDerWaalsContact C-N 3.33Å; K352-Y354 PolarHBondContact O-N 2.7Å; K352-S702 PolarHBondContact NZ-OG 3.26Å
353	G	93.2	Very high	94	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.4	-23.1	177.4	0	0	0	0	0	115.8	R349 K355 A356 A357	R349-G353 PolarHBondContact O-N 2.87Å; G353-K355 PolarHBondContact O-N 3.46Å; G353-A356 PolarHBondContact O-N 3.42Å; G353-A357 PolarHBondContact O-N 3.19Å
354	Y	95.5	Very high	93.6	Very high	90 Å²	90	42.6 Å²	42.6	35%	0.353	21%	0.213	S	C	.	.	H	α-helix	trans	-56.4	-43.6	-170.3	-179.4	-94	0	0	0	114.1	R326 L350 S351 K352 A356 A357 S358 F465	R326-Y354 WeakPolarHBondContact O-CE2 3.42Å; R326-Y354 PolarHBondContact O-OH 3.18Å; L350-Y354 WeakPolarHBondContact O-CB 3.18Å; L350-Y354 PolarHBondContact O-N 2.98Å; L350-Y354 VanDerWaalsContact O-N 3.12Å; S351-Y354 WeakPolarHBondContact O-CB 3.31Å; S351-Y354 PolarHBondContact O-N 2.92Å; K352-Y354 VanDerWaalsContact C-N 3.33Å; K352-Y354 PolarHBondContact O-N 2.7Å; Y354-A356 VanDerWaalsContact C-N 3.34Å; Y354-A356 PolarHBondContact O-N 2.85Å; Y354-A357 PolarHBondContact O-N 2.96Å; Y354-S358 WeakPolarHBondContact O-CB 3.38Å; Y354-S358 PolarHBondContact O-N 3.01Å; Y354-F465 AromaticContact CD2-CE2 3.6Å; Y354-F465 HydrophobicContact CD2-CE2 3.6Å; Y354-F465 AromaticContact CD2-CZ 3.76Å; Y354-F465 HydrophobicContact CD2-CZ 3.76Å; Y354-F465 AromaticContact CE2-CE2 3.68Å; Y354-F465 HydrophobicContact CE2-CE2 3.68Å; Y354-F465 AromaticContact CE2-CZ 3.63Å; Y354-F465 HydrophobicContact CE2-CZ 3.63Å
355	K	93.9	Very high	93	Very high	158 Å²	158	42.2 Å²	42.2	69%	0.687	21%	0.212	S	C	*	.	H	α-helix	trans	-68.7	-33.3	-176.4	-167	172.4	-176.4	175.7	0	112.2	G353 K359	G353-K355 PolarHBondContact O-N 3.46Å; K355-K359 WeakPolarHBondContact O-CG 3.31Å; K355-K359 PolarHBondContact O-N 3.31Å
356	A	93.8	Very high	92.7	Very high	11 Å²	11	43.7 Å²	43.7	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-74.8	-44	174.3	0	0	0	0	0	111.3	G353 Y354 S358 K359 Y360 V436 I437	G353-A356 PolarHBondContact O-N 3.42Å; Y354-A356 VanDerWaalsContact C-N 3.34Å; Y354-A356 PolarHBondContact O-N 2.85Å; A356-S358 VanDerWaalsContact C-N 3.33Å; A356-S358 PolarHBondContact O-N 3.42Å; A356-K359 PolarHBondContact O-N 3.37Å; A356-Y360 WeakPolarHBondContact O-CB 3.48Å; A356-Y360 PolarHBondContact O-N 3.42Å; A356-V436 HydrophobicContact CB-CG1 3.95Å; A356-I437 HydrophobicContact CB-CG1 3.66Å
357	A	95.5	Very high	92.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.1	-41.9	175.6	0	0	0	0	0	113	W328 G353 Y354 Y360 M361 I437 F461 F465	W328-A357 HydrophobicContact CH2-CB 3.81Å; W328-A357 HydrophobicContact CZ2-CB 3.89Å; G353-A357 PolarHBondContact O-N 3.19Å; Y354-A357 PolarHBondContact O-N 2.96Å; A357-Y360 PolarHBondContact O-N 2.95Å; A357-M361 PolarHBondContact O-N 2.87Å; A357-M361 VanDerWaalsContact O-N 3.09Å; A357-I437 HydrophobicContact CB-CD1 4.35Å; A357-I437 HydrophobicContact CB-CG1 4.4Å; A357-F461 HydrophobicContact CB-CE1 4.04Å; A357-F461 HydrophobicContact CB-CZ 3.78Å; A357-F465 HydrophobicContact CB-CD1 3.98Å; A357-F465 HydrophobicContact CB-CD2 4.45Å; A357-F465 HydrophobicContact CB-CE1 3.84Å; A357-F465 HydrophobicContact CB-CE2 4.35Å; A357-F465 HydrophobicContact CB-CG 4.29Å; A357-F465 HydrophobicContact CB-CZ 4.05Å
358	S	94.1	Very high	92.2	Very high	35 Å²	35	50.6 Å²	50.6	25%	0.245	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-47.9	174.8	-174.3	0	0	0	0	112.2	Y354 A356 Y360 M361 N362	Y354-S358 WeakPolarHBondContact O-CB 3.38Å; Y354-S358 PolarHBondContact O-N 3.01Å; A356-S358 VanDerWaalsContact C-N 3.33Å; A356-S358 PolarHBondContact O-N 3.42Å; S358-Y360 PolarHBondContact O-N 2.98Å; S358-M361 PolarHBondContact O-N 3.14Å; S358-N362 PolarHBondContact O-N 3.32Å; S358-N362 PolarHBondContact O-ND2 2.8Å; S358-N362 PolarHBondContact O-OD1 3.13Å
359	K	92.8	Very high	92.1	Very high	123 Å²	123	51.7 Å²	51.7	54%	0.535	27%	0.27	S	S	.	.	H	α-helix	trans	-57.9	-47.8	174.3	-78.2	-175	172	-167.6	0	112.2	K355 A356 M361 N362 C363 L433	K355-K359 WeakPolarHBondContact O-CG 3.31Å; K355-K359 PolarHBondContact O-N 3.31Å; A356-K359 PolarHBondContact O-N 3.37Å; K359-M361 PolarHBondContact O-N 2.91Å; K359-N362 PolarHBondContact O-N 3.23Å; K359-C363 PolarHBondContact O-N 3.11Å; K359-C363 PolarHBondContact O-SG 3.1Å; K359-C363 VanDerWaalsContact O-SG 3.35Å; K359-L433 HydrophobicContact CB-CD1 4.12Å; K359-L433 HydrophobicContact CB-CD2 3.94Å; K359-L433 HydrophobicContact CD-CD2 4.18Å
360	Y	94.3	Very high	91.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.5	-48.6	179.5	174.6	-98.6	0	0	0	111.6	A356 A357 S358 N362 C363 F364 P430 L433 L434 I437 A452 F461	A356-Y360 WeakPolarHBondContact O-CB 3.48Å; A356-Y360 PolarHBondContact O-N 3.42Å; A357-Y360 PolarHBondContact O-N 2.95Å; S358-Y360 PolarHBondContact O-N 2.98Å; Y360-N362 VanDerWaalsContact C-N 3.34Å; Y360-N362 PolarHBondContact O-N 3.37Å; Y360-C363 WeakPolarHBondContact O-CB 3.26Å; Y360-C363 PolarHBondContact O-N 2.95Å; Y360-F364 HydrophobicContact CD1-CE2 4.43Å; Y360-F364 HydrophobicContact CD2-CE2 4.01Å; Y360-F364 HydrophobicContact CE1-CE2 4.03Å; Y360-F364 AromaticContact CE2-CE2 3.55Å; Y360-F364 HydrophobicContact CE2-CE2 3.55Å; Y360-F364 HydrophobicContact CE2-CZ 4.05Å; Y360-F364 HydrophobicContact CG-CE2 4.4Å; Y360-F364 AromaticContact CZ-CE2 3.53Å; Y360-F364 WeakPolarHBondContact O-CD2 3.37Å; Y360-F364 WeakPolarHBondContact O-CE2 3.26Å; Y360-P430 HydrophobicContact CD2-CB 4.15Å; Y360-P430 HydrophobicContact CE2-CB 3.85Å; Y360-L433 HydrophobicContact CD2-CB 4.32Å; Y360-L434 HydrophobicContact CD2-CB 4.49Å; Y360-L434 HydrophobicContact CE2-CB 4.37Å; Y360-I437 HydrophobicContact CD1-CD1 4.4Å; Y360-I437 HydrophobicContact CG-CD1 3.96Å; Y360-A452 HydrophobicContact CE2-CB 4.34Å; Y360-A452 WeakPolarHBondContact CE2-O 3.4Å; Y360-A452 PolarHBondContact OH-O 2.67Å; Y360-F461 HydrophobicContact CD1-CD1 4.07Å; Y360-F461 HydrophobicContact CD1-CE1 4.23Å; Y360-F461 HydrophobicContact CD1-CG 4.4Å; Y360-F461 HydrophobicContact CE1-CB 4.31Å; Y360-F461 HydrophobicContact CE1-CD1 4.2Å; Y360-F461 HydrophobicContact CE1-CG 4.15Å
361	M	93.8	Very high	91.9	Very high	7 Å²	7	55.7 Å²	55.7	3%	0.034	30%	0.296	C	S	.	.	H	α-helix	trans	-70.5	-28.6	-179.5	-66.1	-56	-85.9	0	0	113.7	R326 A357 S358 K359 C363 F364 R458 F461 F465	R326-M361 VanDerWaalsContact CZ-CE 3.48Å; A357-M361 PolarHBondContact O-N 2.87Å; A357-M361 VanDerWaalsContact O-N 3.09Å; S358-M361 PolarHBondContact O-N 3.14Å; K359-M361 PolarHBondContact O-N 2.91Å; M361-C363 VanDerWaalsContact C-N 3.28Å; M361-C363 PolarHBondContact O-N 2.79Å; M361-F364 PolarHBondContact O-N 3.1Å; M361-R458 HydrophobicContact CE-CG 3.79Å; M361-R458 WeakPolarHBondContact CE-O 3.23Å; M361-R458 HydrophobicContact SD-CG 4.03Å; M361-F461 HydrophobicContact CE-CD1 4.3Å; M361-F461 HydrophobicContact CG-CD1 3.82Å; M361-F461 HydrophobicContact CG-CE1 3.95Å; M361-F461 HydrophobicContact SD-CB 4.46Å; M361-F461 HydrophobicContact SD-CD1 3.51Å; M361-F461 VanDerWaalsContact SD-CD1 3.51Å; M361-F461 HydrophobicContact SD-CE1 4.23Å; M361-F461 HydrophobicContact SD-CG 4.36Å; M361-F465 HydrophobicContact CG-CD1 4.07Å
362	N	90.7	Very high	92	Very high	66 Å²	66	56.3 Å²	56.3	35%	0.353	30%	0.296	S	S	.	.	H	α-helix	trans	-68.9	-25.9	174.6	-68	-11.6	0	0	0	112.3	S358 K359 Y360 F364 L365 M426	S358-N362 PolarHBondContact O-N 3.32Å; S358-N362 PolarHBondContact O-ND2 2.8Å; S358-N362 PolarHBondContact O-OD1 3.13Å; K359-N362 PolarHBondContact O-N 3.23Å; Y360-N362 VanDerWaalsContact C-N 3.34Å; Y360-N362 PolarHBondContact O-N 3.37Å; N362-F364 PolarHBondContact O-N 3.44Å; N362-F364 VanDerWaalsContact O-N 3.13Å; N362-L365 WeakPolarHBondContact O-CD1 3.44Å; N362-L365 WeakPolarHBondContact O-CG 3.37Å; N362-M426 HydrophobicContact CB-SD 3.83Å; N362-M426 VanDerWaalsContact O-CE 3.29Å; N362-M426 WeakPolarHBondContact O-CE 3.29Å
363	C	90.5	Very high	92	Very high	17 Å²	17	53.3 Å²	53.3	12%	0.115	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.2	172.1	-63.5	0	0	0	0	114	K359 Y360 M361 F428	K359-C363 PolarHBondContact O-N 3.11Å; K359-C363 PolarHBondContact O-SG 3.1Å; K359-C363 VanDerWaalsContact O-SG 3.35Å; Y360-C363 WeakPolarHBondContact O-CB 3.26Å; Y360-C363 PolarHBondContact O-N 2.95Å; M361-C363 VanDerWaalsContact C-N 3.28Å; M361-C363 PolarHBondContact O-N 2.79Å; C363-F428 HydrophobicContact CB-CD2 3.82Å; C363-F428 HydrophobicContact CB-CE2 3.98Å
364	F	88.6	Confident	92.1	Very high	32 Å²	32	58.6 Å²	58.6	14%	0.14	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	33.5	-174.8	-57.1	-79.7	0	0	0	114.4	Y360 M361 N362 F428 P430 A452 R458	Y360-F364 HydrophobicContact CD1-CE2 4.43Å; Y360-F364 HydrophobicContact CD2-CE2 4.01Å; Y360-F364 HydrophobicContact CE1-CE2 4.03Å; Y360-F364 AromaticContact CE2-CE2 3.55Å; Y360-F364 HydrophobicContact CE2-CE2 3.55Å; Y360-F364 HydrophobicContact CE2-CZ 4.05Å; Y360-F364 HydrophobicContact CG-CE2 4.4Å; Y360-F364 AromaticContact CZ-CE2 3.53Å; Y360-F364 WeakPolarHBondContact O-CD2 3.37Å; Y360-F364 WeakPolarHBondContact O-CE2 3.26Å; M361-F364 PolarHBondContact O-N 3.1Å; N362-F364 PolarHBondContact O-N 3.44Å; N362-F364 VanDerWaalsContact O-N 3.13Å; F364-F428 HydrophobicContact CE1-CE2 4.28Å; F364-F428 HydrophobicContact CE1-CZ 4.31Å; F364-P430 HydrophobicContact CE2-CB 4.25Å; F364-P430 HydrophobicContact CZ-CB 3.77Å; F364-P430 HydrophobicContact CZ-CG 4.39Å; F364-A452 VanDerWaalsContact CZ-O 3.26Å; F364-A452 WeakPolarHBondContact CZ-O 3.22Å; F364-R458 HydrophobicContact CB-CG 3.91Å; F364-R458 HydrophobicContact CD2-CG 4.15Å; F364-R458 HydrophobicContact CG-CB 4.43Å; F364-R458 HydrophobicContact CG-CG 4.04Å; F364-R458 PolarHBondContact O-NH1 2.85Å
365	L	82.4	Confident	92.1	Very high	51 Å²	51	58.1 Å²	58.1	27%	0.267	31%	0.311	S	S	.	.			trans	-63.5	140.6	172.6	-76.8	161.8	0	0	0	111.7	N362 P367 P422	N362-L365 WeakPolarHBondContact O-CD1 3.44Å; N362-L365 WeakPolarHBondContact O-CG 3.37Å; L365-P367 WeakPolarHBondContact O-CD 3.36Å; L365-P422 HydrophobicContact CD1-CB 3.68Å; L365-P422 HydrophobicContact CD1-CG 4.22Å
366	S	86.9	Confident	92.3	Very high	50 Å²	50	53.3 Å²	53.3	35%	0.35	29%	0.294	S	S	.	.			trans	-70.3	125.7	-178.3	171.7	0	0	0	0	111.3	L368 L369 T370	S366-L368 VanDerWaalsContact C-N 3.3Å; S366-L368 PolarHBondContact O-N 3.43Å; S366-L368 PolarHBondContact OG-N 3.28Å; S366-L369 PolarHBondContact O-N 2.92Å; S366-L369 PolarHBondContact OG-N 3.36Å; S366-T370 PolarHBondContact O-N 3.15Å; S366-T370 PolarHBondContact O-OG1 2.92Å
367	P	89.1	Confident	92.4	Very high	101 Å²	101	53.4 Å²	53.4	66%	0.656	30%	0.295	S	S	*	.	H	α-helix	trans	-60.4	-39.5	175	-24.9	35	0	0	0	112.3	L365 T370 V371	L365-P367 WeakPolarHBondContact O-CD 3.36Å; P367-T370 WeakPolarHBondContact O-CB 3.32Å; P367-T370 PolarHBondContact O-N 2.9Å; P367-V371 WeakPolarHBondContact O-CG2 3.32Å; P367-V371 PolarHBondContact O-N 3.27Å
368	L	92	Very high	92.4	Very high	130 Å²	130	60.1 Å²	60.1	68%	0.681	33%	0.325	S	S	*	.	H	α-helix	trans	-62.1	-47.8	177.6	-179.9	63.7	0	0	0	111.3	S366 T370 V371 V372	S366-L368 VanDerWaalsContact C-N 3.3Å; S366-L368 PolarHBondContact O-N 3.43Å; S366-L368 PolarHBondContact OG-N 3.28Å; L368-T370 VanDerWaalsContact C-N 3.29Å; L368-T370 PolarHBondContact O-N 3.15Å; L368-V371 PolarHBondContact O-N 3.35Å; L368-V372 WeakPolarHBondContact O-CG2 3.39Å; L368-V372 PolarHBondContact O-N 3.12Å
369	L	90	Very high	92.6	Very high	70 Å²	70	64.3 Å²	64.3	37%	0.366	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-39.9	176.8	-176.6	62	0	0	0	111.2	S366 V371 V372 A373 F420	S366-L369 PolarHBondContact O-N 2.92Å; S366-L369 PolarHBondContact OG-N 3.36Å; L369-V371 PolarHBondContact O-N 3.5Å; L369-V372 PolarHBondContact O-N 2.91Å; L369-A373 WeakPolarHBondContact O-CB 3.28Å; L369-A373 PolarHBondContact O-N 2.67Å; L369-F420 HydrophobicContact CD2-CB 4.37Å; L369-F420 HydrophobicContact CD2-CD1 3.89Å; L369-F420 HydrophobicContact CD2-CE1 4.41Å; L369-F420 HydrophobicContact CD2-CG 4.17Å; L369-F420 HydrophobicContact CG-CB 4.26Å; L369-F420 HydrophobicContact CG-CG 4.35Å
370	T	91.7	Very high	92.8	Very high	14 Å²	14	58.8 Å²	58.8	9%	0.086	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-40.5	176.8	-58.9	0	0	0	0	112.1	S366 P367 L368 K374 P422	S366-T370 PolarHBondContact O-N 3.15Å; S366-T370 PolarHBondContact O-OG1 2.92Å; P367-T370 WeakPolarHBondContact O-CB 3.32Å; P367-T370 PolarHBondContact O-N 2.9Å; L368-T370 VanDerWaalsContact C-N 3.29Å; L368-T370 PolarHBondContact O-N 3.15Å; T370-K374 HydrophobicContact CG2-CD 4.16Å; T370-K374 WeakPolarHBondContact O-CB 3.39Å; T370-K374 VanDerWaalsContact O-CG 3.25Å; T370-K374 WeakPolarHBondContact O-CG 3.44Å; T370-K374 PolarHBondContact O-N 2.41Å; T370-K374 VanDerWaalsContact O-N 3.09Å; T370-P422 HydrophobicContact CG2-CG 4.16Å
371	V	94.9	Very high	92.9	Very high	83 Å²	83	59.9 Å²	59.9	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-69.2	-44.7	176.9	170.8	0	0	0	0	111.1	P367 L368 L369 K374 N375	P367-V371 WeakPolarHBondContact O-CG2 3.32Å; P367-V371 PolarHBondContact O-N 3.27Å; L368-V371 PolarHBondContact O-N 3.35Å; L369-V371 PolarHBondContact O-N 3.5Å; V371-K374 PolarHBondContact O-N 3.22Å; V371-N375 PolarHBondContact O-N 3.04Å; V371-N375 PolarHBondContact O-ND2 3.4Å
372	V	95.5	Very high	93.1	Very high	78 Å²	78	62 Å²	62	47%	0.473	34%	0.343	S	S	.	.	H	α-helix	trans	-60.8	-50.5	176	172.9	0	0	0	0	110.5	L368 L369 K374 N375 V376	L368-V372 WeakPolarHBondContact O-CG2 3.39Å; L368-V372 PolarHBondContact O-N 3.12Å; L369-V372 PolarHBondContact O-N 2.91Å; V372-K374 VanDerWaalsContact C-N 3.35Å; V372-K374 PolarHBondContact O-N 3.49Å; V372-N375 PolarHBondContact O-N 2.6Å; V372-V376 HydrophobicContact CG1-CG2 4.13Å; V372-V376 WeakPolarHBondContact O-CG2 3.41Å; V372-V376 PolarHBondContact O-N 2.73Å
373	A	93.8	Very high	93.3	Very high	4 Å²	4	63.9 Å²	63.9	3%	0.033	35%	0.352	C	S	.	.	H	α-helix	trans	-59.8	-40.4	-179	0	0	0	0	0	113	L369 A377 C417 F420 I421	L369-A373 WeakPolarHBondContact O-CB 3.28Å; L369-A373 PolarHBondContact O-N 2.67Å; A373-A377 WeakPolarHBondContact O-CB 3.16Å; A373-A377 PolarHBondContact O-N 3.28Å; A373-C417 HydrophobicContact CB-CB 4.44Å; A373-F420 HydrophobicContact CB-CB 3.88Å; A373-I421 HydrophobicContact CB-CG1 4.13Å
374	K	94.5	Very high	93.6	Very high	111 Å²	111	64.2 Å²	64.2	48%	0.483	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-45.6	175	-77.8	172	-178.5	176.2	0	112.4	T370 V371 V372 F378 I421	T370-K374 HydrophobicContact CG2-CD 4.16Å; T370-K374 WeakPolarHBondContact O-CB 3.39Å; T370-K374 VanDerWaalsContact O-CG 3.25Å; T370-K374 WeakPolarHBondContact O-CG 3.44Å; T370-K374 PolarHBondContact O-N 2.41Å; T370-K374 VanDerWaalsContact O-N 3.09Å; V371-K374 PolarHBondContact O-N 3.22Å; V372-K374 VanDerWaalsContact C-N 3.35Å; V372-K374 PolarHBondContact O-N 3.49Å; K374-F378 WeakPolarHBondContact O-CB 3.4Å; K374-F378 PolarHBondContact O-N 2.84Å; K374-I421 HydrophobicContact CG-CD1 3.78Å; K374-I421 HydrophobicContact CG-CG1 4.02Å
375	N	96.5	Very high	94	Very high	80 Å²	80	65.4 Å²	65.4	43%	0.428	37%	0.369	S	S	.	.	H	α-helix	trans	-69.6	-44.9	-179.5	-73.8	-68.3	0	0	0	111.9	V371 V372 A377 F378 F379	V371-N375 PolarHBondContact O-N 3.04Å; V371-N375 PolarHBondContact O-ND2 3.4Å; V372-N375 PolarHBondContact O-N 2.6Å; N375-A377 PolarHBondContact O-N 2.85Å; N375-F378 WeakPolarHBondContact O-CB 3.44Å; N375-F378 PolarHBondContact O-N 3.11Å; N375-F378 VanDerWaalsContact O-N 3.15Å; N375-F379 HydrophobicContact CB-CE2 4.32Å; N375-F379 WeakPolarHBondContact O-CD2 3.26Å; N375-F379 PolarHBondContact O-N 2.84Å
376	V	96.3	Very high	94.6	Very high	56 Å²	56	67.3 Å²	67.3	34%	0.339	38%	0.382	S	S	.	.	H	α-helix	trans	-64.2	-40.9	177.4	178.7	0	0	0	0	111.1	V372 F378 F379 A380 C417	V372-V376 HydrophobicContact CG1-CG2 4.13Å; V372-V376 WeakPolarHBondContact O-CG2 3.41Å; V372-V376 PolarHBondContact O-N 2.73Å; V376-F378 VanDerWaalsContact C-N 3.29Å; V376-F378 PolarHBondContact O-N 2.77Å; V376-F379 PolarHBondContact O-N 3.43Å; V376-A380 VanDerWaalsContact O-CB 3.26Å; V376-A380 WeakPolarHBondContact O-CB 3.32Å; V376-A380 PolarHBondContact O-N 3.5Å; V376-C417 VanDerWaalsContact CG1-SG 3.55Å
377	A	95.9	Very high	95	Very high	14 Å²	14	66.5 Å²	66.5	12%	0.116	37%	0.374	C	S	.	.	H	α-helix	trans	-62.9	-33	173.5	0	0	0	0	0	113.2	A373 N375 G381 C417	A373-A377 WeakPolarHBondContact O-CB 3.16Å; A373-A377 PolarHBondContact O-N 3.28Å; N375-A377 PolarHBondContact O-N 2.85Å; A377-G381 WeakPolarHBondContact O-CA 3.22Å; A377-G381 PolarHBondContact O-N 2.78Å; A377-C417 HydrophobicContact CB-CB 3.81Å
378	F	97.1	Very high	95.3	Very high	140 Å²	140	65.2 Å²	65.2	61%	0.614	36%	0.361	S	S	*	.	H	α-helix	trans	-68.7	-52.8	175.1	176.9	-100.4	0	0	0	111.4	K374 N375 V376 G381 S382	K374-F378 WeakPolarHBondContact O-CB 3.4Å; K374-F378 PolarHBondContact O-N 2.84Å; N375-F378 WeakPolarHBondContact O-CB 3.44Å; N375-F378 PolarHBondContact O-N 3.11Å; N375-F378 VanDerWaalsContact O-N 3.15Å; V376-F378 VanDerWaalsContact C-N 3.29Å; V376-F378 PolarHBondContact O-N 2.77Å; F378-G381 PolarHBondContact O-N 3.3Å; F378-S382 PolarHBondContact O-N 2.85Å; F378-S382 PolarHBondContact O-OG 2.94Å
379	F	97.3	Very high	95.4	Very high	123 Å²	123	61.8 Å²	61.8	54%	0.539	35%	0.351	S	S	.	.	H	α-helix	trans	-63.9	-45.9	-179.9	-66.4	-59.4	0	0	0	112.8	N375 V376 G381 S382 L383	N375-F379 HydrophobicContact CB-CE2 4.32Å; N375-F379 WeakPolarHBondContact O-CD2 3.26Å; N375-F379 PolarHBondContact O-N 2.84Å; V376-F379 PolarHBondContact O-N 3.43Å; F379-G381 VanDerWaalsContact C-N 3.27Å; F379-G381 PolarHBondContact O-N 3.18Å; F379-S382 PolarHBondContact O-N 3.39Å; F379-S382 PolarHBondContact O-OG 2.84Å; F379-L383 PolarHBondContact O-N 2.92Å; F379-L383 VanDerWaalsContact O-N 3.09Å
380	A	96.9	Very high	95.7	Very high	7 Å²	7	62.3 Å²	62.3	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-64.3	-36.5	175.6	0	0	0	0	0	111.3	V376 L384 L410 I414	V376-A380 VanDerWaalsContact O-CB 3.26Å; V376-A380 WeakPolarHBondContact O-CB 3.32Å; V376-A380 PolarHBondContact O-N 3.5Å; A380-L384 VanDerWaalsContact O-CB 3.26Å; A380-L384 WeakPolarHBondContact O-CB 3.49Å; A380-L384 PolarHBondContact O-N 2.86Å; A380-L410 HydrophobicContact CB-CD2 3.86Å; A380-I414 HydrophobicContact CB-CD1 4.33Å; A380-I414 HydrophobicContact CB-CG1 3.69Å
381	G	96.9	Very high	95.8	Very high	23 Å²	23	62.8 Å²	62.8	24%	0.237	36%	0.357	C	S	.	.	H	α-helix	trans	-65.3	-41.8	175.9	0	0	0	0	0	113.9	A377 F378 F379 A385	A377-G381 WeakPolarHBondContact O-CA 3.22Å; A377-G381 PolarHBondContact O-N 2.78Å; F378-G381 PolarHBondContact O-N 3.3Å; F379-G381 VanDerWaalsContact C-N 3.27Å; F379-G381 PolarHBondContact O-N 3.18Å; G381-A385 VanDerWaalsContact O-CB 3.27Å; G381-A385 WeakPolarHBondContact O-CB 3.48Å; G381-A385 PolarHBondContact O-N 3.06Å
382	S	96.9	Very high	95.8	Very high	53 Å²	53	65.3 Å²	65.3	37%	0.371	37%	0.366	S	S	.	.	H	α-helix	trans	-70	-41.3	177	56.9	0	0	0	0	112.1	F378 F379 A385 V386	F378-S382 PolarHBondContact O-N 2.85Å; F378-S382 PolarHBondContact O-OG 2.94Å; F379-S382 PolarHBondContact O-N 3.39Å; F379-S382 PolarHBondContact O-OG 2.84Å; S382-A385 PolarHBondContact O-N 3.38Å; S382-V386 WeakPolarHBondContact O-CG2 3.45Å; S382-V386 PolarHBondContact O-N 2.98Å; S382-V386 VanDerWaalsContact O-N 3.08Å
383	L	96.3	Very high	95.8	Very high	104 Å²	104	71.3 Å²	71.3	55%	0.545	38%	0.382	S	S	.	.	H	α-helix	trans	-59.8	-47	172.9	-81.3	158.5	0	0	0	111.3	F379 V386 L387 L410	F379-L383 PolarHBondContact O-N 2.92Å; F379-L383 VanDerWaalsContact O-N 3.09Å; L383-V386 PolarHBondContact O-N 3.31Å; L383-L387 WeakPolarHBondContact O-CG 3.5Å; L383-L387 PolarHBondContact O-N 3.42Å; L383-L387 VanDerWaalsContact O-N 3.09Å; L383-L410 HydrophobicContact CB-CD1 3.99Å; L383-L410 HydrophobicContact CB-CD2 4.31Å
384	L	96.1	Very high	95.8	Very high	24 Å²	24	74.7 Å²	74.7	13%	0.126	40%	0.399	C	S	.	.	H	α-helix	trans	-65.1	-39.9	177.8	-177.8	61.9	0	0	0	112.2	A380 V386 L387 I388 V407 L410 I414	A380-L384 VanDerWaalsContact O-CB 3.26Å; A380-L384 WeakPolarHBondContact O-CB 3.49Å; A380-L384 PolarHBondContact O-N 2.86Å; L384-V386 PolarHBondContact O-N 3.37Å; L384-L387 PolarHBondContact O-N 2.98Å; L384-I388 HydrophobicContact CD1-CD1 3.94Å; L384-I388 HydrophobicContact CD1-CG1 4.07Å; L384-I388 HydrophobicContact CD2-CD1 4.27Å; L384-I388 HydrophobicContact CG-CD1 3.73Å; L384-I388 HydrophobicContact CG-CG1 4.27Å; L384-I388 WeakPolarHBondContact O-CB 3.46Å; L384-I388 VanDerWaalsContact O-CG1 3.3Å; L384-I388 WeakPolarHBondContact O-CG1 3.41Å; L384-I388 PolarHBondContact O-N 3.48Å; L384-V407 HydrophobicContact CD1-CB 4.21Å; L384-V407 HydrophobicContact CD1-CG1 3.94Å; L384-V407 HydrophobicContact CD1-CG2 4.23Å; L384-L410 HydrophobicContact CB-CB 4.15Å; L384-L410 HydrophobicContact CB-CD1 4.36Å; L384-L410 HydrophobicContact CD1-CB 4.35Å; L384-I414 HydrophobicContact CB-CD1 3.96Å; L384-I414 HydrophobicContact CD2-CD1 3.42Å; L384-I414 VanDerWaalsContact CD2-CD1 3.42Å; L384-I414 HydrophobicContact CG-CD1 4.33Å
385	A	96.4	Very high	95.6	Very high	58 Å²	58	77 Å²	77	48%	0.479	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-39.4	178.6	0	0	0	0	0	112.4	G381 S382 A389	G381-A385 VanDerWaalsContact O-CB 3.27Å; G381-A385 WeakPolarHBondContact O-CB 3.48Å; G381-A385 PolarHBondContact O-N 3.06Å; S382-A385 PolarHBondContact O-N 3.38Å; A385-A389 WeakPolarHBondContact O-CB 3.36Å; A385-A389 PolarHBondContact O-N 3.28Å
386	V	96.3	Very high	95.4	Very high	90 Å²	90	79 Å²	79	55%	0.545	42%	0.422	S	S	.	.	H	α-helix	trans	-65.7	-45.4	174.2	172	0	0	0	0	111	S382 L383 L384 I388 A389 L390	S382-V386 WeakPolarHBondContact O-CG2 3.45Å; S382-V386 PolarHBondContact O-N 2.98Å; S382-V386 VanDerWaalsContact O-N 3.08Å; L383-V386 PolarHBondContact O-N 3.31Å; L384-V386 PolarHBondContact O-N 3.37Å; V386-I388 PolarHBondContact O-N 2.88Å; V386-A389 PolarHBondContact O-N 2.98Å; V386-L390 HydrophobicContact CG1-CD1 4.05Å; V386-L390 WeakPolarHBondContact O-CG 3.4Å; V386-L390 PolarHBondContact O-N 3.09Å
387	L	94.5	Very high	95.1	Very high	34 Å²	34	77.7 Å²	77.7	18%	0.178	41%	0.414	C	S	.	.	H	α-helix	trans	-61.3	-45.1	176.4	-70.3	173.6	0	0	0	111.8	L383 L384 A389 L390 T391 V403 V407 L410	L383-L387 WeakPolarHBondContact O-CG 3.5Å; L383-L387 PolarHBondContact O-N 3.42Å; L383-L387 VanDerWaalsContact O-N 3.09Å; L384-L387 PolarHBondContact O-N 2.98Å; L387-A389 PolarHBondContact O-N 3.04Å; L387-L390 PolarHBondContact O-N 3.4Å; L387-T391 WeakPolarHBondContact O-CG2 3.44Å; L387-T391 PolarHBondContact O-N 3.45Å; L387-T391 PolarHBondContact O-OG1 3.23Å; L387-V403 HydrophobicContact CD2-CG1 4.48Å; L387-V407 HydrophobicContact CB-CG2 4.01Å; L387-V407 HydrophobicContact CD1-CG2 4.08Å; L387-L410 HydrophobicContact CD1-CD1 3.84Å
388	I	94.8	Very high	94.9	Very high	73 Å²	73	80.9 Å²	80.9	37%	0.374	43%	0.429	S	S	.	.	H	α-helix	trans	-60.6	-45.9	176.7	-72.7	173.2	0	0	0	110.9	L384 V386 L390 T391 I392	L384-I388 HydrophobicContact CD1-CD1 3.94Å; L384-I388 HydrophobicContact CD1-CG1 4.07Å; L384-I388 HydrophobicContact CD2-CD1 4.27Å; L384-I388 HydrophobicContact CG-CD1 3.73Å; L384-I388 HydrophobicContact CG-CG1 4.27Å; L384-I388 WeakPolarHBondContact O-CB 3.46Å; L384-I388 VanDerWaalsContact O-CG1 3.3Å; L384-I388 WeakPolarHBondContact O-CG1 3.41Å; L384-I388 PolarHBondContact O-N 3.48Å; V386-I388 PolarHBondContact O-N 2.88Å; I388-L390 VanDerWaalsContact C-N 3.33Å; I388-L390 PolarHBondContact O-N 3.21Å; I388-T391 WeakPolarHBondContact CA-OG1 3.2Å; I388-T391 PolarHBondContact O-N 3.02Å; I388-T391 PolarHBondContact O-OG1 3.39Å; I388-I392 HydrophobicContact CG2-CD1 3.64Å; I388-I392 HydrophobicContact CG2-CG1 4.44Å; I388-I392 VanDerWaalsContact O-CG1 3.31Å; I388-I392 WeakPolarHBondContact O-CG1 3.22Å; I388-I392 PolarHBondContact O-N 2.68Å
389	A	95.6	Very high	94.4	Very high	58 Å²	58	78.4 Å²	78.4	48%	0.479	44%	0.435	S	S	.	.	H	α-helix	trans	-61.4	-40.4	178.2	0	0	0	0	0	112.4	A385 V386 L387 I392 Y393	A385-A389 WeakPolarHBondContact O-CB 3.36Å; A385-A389 PolarHBondContact O-N 3.28Å; V386-A389 PolarHBondContact O-N 2.98Å; L387-A389 PolarHBondContact O-N 3.04Å; A389-I392 PolarHBondContact O-N 3.4Å; A389-Y393 WeakPolarHBondContact O-CB 3.49Å; A389-Y393 PolarHBondContact O-N 3.21Å
390	L	94.8	Very high	94.2	Very high	81 Å²	81	76.6 Å²	76.6	42%	0.424	43%	0.434	S	S	.	.	H	α-helix	trans	-64.4	-44.8	174.3	-70.4	169.1	0	0	0	111.6	V386 L387 I388 I392 Y393 D394 V397	V386-L390 HydrophobicContact CG1-CD1 4.05Å; V386-L390 WeakPolarHBondContact O-CG 3.4Å; V386-L390 PolarHBondContact O-N 3.09Å; L387-L390 PolarHBondContact O-N 3.4Å; I388-L390 VanDerWaalsContact C-N 3.33Å; I388-L390 PolarHBondContact O-N 3.21Å; L390-I392 PolarHBondContact O-N 3.37Å; L390-Y393 PolarHBondContact O-N 3.01Å; L390-Y393 VanDerWaalsContact O-N 3.14Å; L390-D394 PolarHBondContact O-N 3.48Å; L390-V397 HydrophobicContact CB-CG1 4.1Å; L390-V397 HydrophobicContact CB-CG2 4.42Å
391	T	93.7	Very high	93.7	Very high	24 Å²	24	83.7 Å²	83.7	15%	0.147	47%	0.466	C	S	.	.	H	α-helix	trans	-70.1	-13.1	177.8	57	0	0	0	0	114.8	L387 I388 D394 V397 L398 V403	L387-T391 WeakPolarHBondContact O-CG2 3.44Å; L387-T391 PolarHBondContact O-N 3.45Å; L387-T391 PolarHBondContact O-OG1 3.23Å; I388-T391 WeakPolarHBondContact CA-OG1 3.2Å; I388-T391 PolarHBondContact O-N 3.02Å; I388-T391 PolarHBondContact O-OG1 3.39Å; T391-D394 WeakPolarHBondContact CA-O 3.33Å; T391-V397 HydrophobicContact CG2-CB 4Å; T391-V397 HydrophobicContact CG2-CG1 3.76Å; T391-L398 HydrophobicContact CG2-CD2 3.54Å; T391-L398 HydrophobicContact CG2-CG 3.75Å; T391-V403 HydrophobicContact CG2-CG1 4.48Å
392	I	95.1	Very high	93.4	Very high	136 Å²	136	88.8 Å²	88.8	70%	0.697	48%	0.483	S	S	*	.	H	α-helix	trans	-92.2	-28.3	172.1	-70.1	168.9	0	0	0	110.9	I388 A389 L390	I388-I392 HydrophobicContact CG2-CD1 3.64Å; I388-I392 HydrophobicContact CG2-CG1 4.44Å; I388-I392 VanDerWaalsContact O-CG1 3.31Å; I388-I392 WeakPolarHBondContact O-CG1 3.22Å; I388-I392 PolarHBondContact O-N 2.68Å; A389-I392 PolarHBondContact O-N 3.4Å; L390-I392 PolarHBondContact O-N 3.37Å
393	Y	95.7	Very high	93.2	Very high	204 Å²	204	87 Å²	87	80%	0.8	47%	0.47	S	S	*	.	H	α-helix	trans	-75.4	-38.6	173.5	-179.6	-97.6	0	0	0	112	A389 L390	A389-Y393 WeakPolarHBondContact O-CB 3.49Å; A389-Y393 PolarHBondContact O-N 3.21Å; L390-Y393 PolarHBondContact O-N 3.01Å; L390-Y393 VanDerWaalsContact O-N 3.14Å
394	D	93.9	Very high	93	Very high	75 Å²	75	87.3 Å²	87.3	40%	0.401	47%	0.471	S	S	.	.			trans	-147.8	120.1	-179.3	-177.8	-0.3	0	0	0	110.1	L390 T391 D396 V397	L390-D394 PolarHBondContact O-N 3.48Å; T391-D394 WeakPolarHBondContact CA-O 3.33Å; D394-D396 VanDerWaalsContact C-N 3.3Å; D394-D396 PolarHBondContact O-N 3.15Å; D394-D396 WeakPolarHBondContact OD1-CB 3.47Å; D394-D396 PolarHBondContact OD1-N 2.91Å; D394-V397 HydrophobicContact CB-CG2 4.07Å; D394-V397 WeakPolarHBondContact O-CB 3.38Å; D394-V397 WeakPolarHBondContact O-CG2 3.31Å; D394-V397 PolarHBondContact O-N 3.38Å
395	E	91.2	Very high	92.7	Very high	159 Å²	159	89.8 Å²	89.8	74%	0.743	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-70.3	-25.2	-178.8	-64.2	-168.4	163.8	0	0	112.5	V397 L398	E395-V397 PolarHBondContact O-N 3.5Å; E395-V397 VanDerWaalsContact O-N 3.11Å; E395-L398 WeakPolarHBondContact O-CB 3.45Å; E395-L398 PolarHBondContact O-N 3.49Å
396	D	91.6	Very high	92.6	Very high	122 Å²	122	89.1 Å²	89.1	65%	0.652	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-64.4	-18.8	179.9	-79.4	-18	0	0	0	112.1	D394 L398 A399	D394-D396 VanDerWaalsContact C-N 3.3Å; D394-D396 PolarHBondContact O-N 3.15Å; D394-D396 WeakPolarHBondContact OD1-CB 3.47Å; D394-D396 PolarHBondContact OD1-N 2.91Å; D396-L398 PolarHBondContact O-N 3.25Å; D396-A399 WeakPolarHBondContact O-CB 3.37Å; D396-A399 PolarHBondContact O-N 3.2Å
397	V	90.8	Very high	92.5	Very high	29 Å²	29	86.3 Å²	86.3	18%	0.176	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-58.4	-26.8	171.3	179.7	0	0	0	0	111.9	L390 T391 D394 E395 A399 V400 V403	L390-V397 HydrophobicContact CB-CG1 4.1Å; L390-V397 HydrophobicContact CB-CG2 4.42Å; T391-V397 HydrophobicContact CG2-CB 4Å; T391-V397 HydrophobicContact CG2-CG1 3.76Å; D394-V397 HydrophobicContact CB-CG2 4.07Å; D394-V397 WeakPolarHBondContact O-CB 3.38Å; D394-V397 WeakPolarHBondContact O-CG2 3.31Å; D394-V397 PolarHBondContact O-N 3.38Å; E395-V397 PolarHBondContact O-N 3.5Å; E395-V397 VanDerWaalsContact O-N 3.11Å; V397-A399 VanDerWaalsContact C-N 3.31Å; V397-A399 PolarHBondContact O-N 3.45Å; V397-V400 PolarHBondContact O-N 3.23Å; V397-V403 HydrophobicContact CG1-CG1 4.35Å; V397-V403 WeakPolarHBondContact O-CG1 3.39Å
398	L	90.1	Very high	92.4	Very high	82 Å²	82	88.5 Å²	88.5	43%	0.429	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-72.1	-22.1	174.6	-69.6	172	0	0	0	113.6	T391 E395 D396	T391-L398 HydrophobicContact CG2-CD2 3.54Å; T391-L398 HydrophobicContact CG2-CG 3.75Å; E395-L398 WeakPolarHBondContact O-CB 3.45Å; E395-L398 PolarHBondContact O-N 3.49Å; D396-L398 PolarHBondContact O-N 3.25Å
399	A	88.5	Confident	92.2	Very high	88 Å²	88	90.8 Å²	90.8	73%	0.727	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-83.4	-13.1	177.1	0	0	0	0	0	113	D396 V397	D396-A399 WeakPolarHBondContact O-CB 3.37Å; D396-A399 PolarHBondContact O-N 3.2Å; V397-A399 VanDerWaalsContact C-N 3.31Å; V397-A399 PolarHBondContact O-N 3.45Å
400	V	91.6	Very high	92.2	Very high	85 Å²	85	89.5 Å²	89.5	52%	0.515	48%	0.477	S	S	.	.	S	Bend	trans	-67.6	139.8	178.2	177.4	0	0	0	0	111	V397 H402 V403	V397-V400 PolarHBondContact O-N 3.23Å; V400-H402 PolarHBondContact O-N 2.99Å; V400-V403 HydrophobicContact CB-CG2 3.75Å; V400-V403 HydrophobicContact CG1-CG2 3.86Å; V400-V403 PolarHBondContact O-N 3.47Å
401	E	87.6	Confident	92.1	Very high	156 Å²	156	86.7 Å²	86.7	73%	0.729	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	136.2	-175.9	-170.7	173.1	-162.1	0	0	112.3	V403	E401-V403 PolarHBondContact O-N 3.37Å
402	H	90.9	Very high	91.9	Very high	130 Å²	130	88.1 Å²	88.1	60%	0.602	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	-2.2	-177.2	-50.7	-33.2	0	0	0	117.5	V400 S405 S406	V400-H402 PolarHBondContact O-N 2.99Å; H402-S405 PolarHBondContact O-N 3.23Å; H402-S406 WeakPolarHBondContact O-CB 3.28Å; H402-S406 PolarHBondContact O-N 3.06Å; H402-S406 PolarHBondContact O-OG 2.87Å
403	V	92.4	Very high	91.8	Very high	16 Å²	16	83.8 Å²	83.8	10%	0.097	46%	0.458	C	S	.	.	H	α-helix	trans	-61.1	-51.4	-178.5	171.8	0	0	0	0	111.5	L387 T391 V397 V400 E401 S405 S406 V407	L387-V403 HydrophobicContact CD2-CG1 4.48Å; T391-V403 HydrophobicContact CG2-CG1 4.48Å; V397-V403 HydrophobicContact CG1-CG1 4.35Å; V397-V403 WeakPolarHBondContact O-CG1 3.39Å; V400-V403 HydrophobicContact CB-CG2 3.75Å; V400-V403 HydrophobicContact CG1-CG2 3.86Å; V400-V403 PolarHBondContact O-N 3.47Å; E401-V403 PolarHBondContact O-N 3.37Å; V403-S405 VanDerWaalsContact C-N 3.27Å; V403-S405 PolarHBondContact O-N 3.26Å; V403-S406 WeakPolarHBondContact O-CB 3.29Å; V403-S406 PolarHBondContact O-N 3.14Å; V403-S406 VanDerWaalsContact O-N 3.11Å; V403-V407 HydrophobicContact CG1-CG2 4.31Å; V403-V407 WeakPolarHBondContact O-CG2 3.36Å; V403-V407 PolarHBondContact O-N 3.49Å
404	L	90.6	Very high	91.7	Very high	109 Å²	109	74.7 Å²	74.7	57%	0.571	42%	0.423	S	S	*	.	H	α-helix	trans	-61.5	-34.5	177.8	-176.3	61.5	0	0	0	112.9	T408	L404-T408 WeakPolarHBondContact O-CG2 3.36Å; L404-T408 PolarHBondContact O-N 3.42Å; L404-T408 VanDerWaalsContact O-N 3.11Å; L404-T408 PolarHBondContact O-OG1 2.85Å
405	S	91.7	Very high	91.5	Very high	76 Å²	76	74.4 Å²	74.4	53%	0.531	43%	0.425	S	S	.	.	H	α-helix	trans	-69.6	-39.2	174.9	-170.5	0	0	0	0	111.6	H402 V403 T408 L409	H402-S405 PolarHBondContact O-N 3.23Å; V403-S405 VanDerWaalsContact C-N 3.27Å; V403-S405 PolarHBondContact O-N 3.26Å; S405-T408 WeakPolarHBondContact CA-OG1 3.49Å; S405-T408 PolarHBondContact O-OG1 3.46Å; S405-T408 VanDerWaalsContact O-OG1 3.06Å; S405-L409 VanDerWaalsContact O-CB 3.24Å; S405-L409 WeakPolarHBondContact O-CB 3.49Å; S405-L409 PolarHBondContact O-N 3.4Å
406	S	93.6	Very high	91.4	Very high	45 Å²	45	69.2 Å²	69.2	32%	0.315	40%	0.403	S	S	.	.	H	α-helix	trans	-67.8	-46.7	177	-58.2	0	0	0	0	111.3	H402 V403 T408 L409 L410	H402-S406 WeakPolarHBondContact O-CB 3.28Å; H402-S406 PolarHBondContact O-N 3.06Å; H402-S406 PolarHBondContact O-OG 2.87Å; V403-S406 WeakPolarHBondContact O-CB 3.29Å; V403-S406 PolarHBondContact O-N 3.14Å; V403-S406 VanDerWaalsContact O-N 3.11Å; S406-T408 VanDerWaalsContact C-N 3.34Å; S406-T408 PolarHBondContact O-N 3.31Å; S406-L409 PolarHBondContact O-N 3.02Å; S406-L410 VanDerWaalsContact O-CB 3.24Å; S406-L410 WeakPolarHBondContact O-CB 3.29Å; S406-L410 WeakPolarHBondContact O-CD1 3.36Å; S406-L410 WeakPolarHBondContact O-CG 3.42Å; S406-L410 PolarHBondContact O-N 3.5Å
407	V	93.7	Very high	91.4	Very high	31 Å²	31	64 Å²	64	19%	0.188	38%	0.376	C	S	.	.	H	α-helix	trans	-55.8	-47.2	175	165.2	0	0	0	0	111.1	L384 L387 V403 G411	L384-V407 HydrophobicContact CD1-CB 4.21Å; L384-V407 HydrophobicContact CD1-CG1 3.94Å; L384-V407 HydrophobicContact CD1-CG2 4.23Å; L387-V407 HydrophobicContact CB-CG2 4.01Å; L387-V407 HydrophobicContact CD1-CG2 4.08Å; V403-V407 HydrophobicContact CG1-CG2 4.31Å; V403-V407 WeakPolarHBondContact O-CG2 3.36Å; V403-V407 PolarHBondContact O-N 3.49Å; V407-G411 PolarHBondContact O-N 3.45Å
408	T	91.6	Very high	91.3	Very high	79 Å²	79	71 Å²	71	49%	0.485	40%	0.4	S	S	.	.	H	α-helix	trans	-70	-42	179.6	48.7	0	0	0	0	112.9	L404 S405 S406 G411 V412	L404-T408 WeakPolarHBondContact O-CG2 3.36Å; L404-T408 PolarHBondContact O-N 3.42Å; L404-T408 VanDerWaalsContact O-N 3.11Å; L404-T408 PolarHBondContact O-OG1 2.85Å; S405-T408 WeakPolarHBondContact CA-OG1 3.49Å; S405-T408 PolarHBondContact O-OG1 3.46Å; S405-T408 VanDerWaalsContact O-OG1 3.06Å; S406-T408 VanDerWaalsContact C-N 3.34Å; S406-T408 PolarHBondContact O-N 3.31Å; T408-G411 PolarHBondContact O-N 3.47Å; T408-V412 WeakPolarHBondContact O-CG2 3.44Å; T408-V412 PolarHBondContact O-N 3.42Å
409	L	92.5	Very high	91.2	Very high	121 Å²	121	69.7 Å²	69.7	63%	0.634	40%	0.397	S	S	*	.	H	α-helix	trans	-65.2	-42.7	176.7	-178.3	61.5	0	0	0	112.3	S405 S406 V412 C413	S405-L409 VanDerWaalsContact O-CB 3.24Å; S405-L409 WeakPolarHBondContact O-CB 3.49Å; S405-L409 PolarHBondContact O-N 3.4Å; S406-L409 PolarHBondContact O-N 3.02Å; L409-V412 PolarHBondContact O-N 3.22Å; L409-C413 VanDerWaalsContact O-CB 3.3Å; L409-C413 WeakPolarHBondContact O-CB 3.35Å; L409-C413 PolarHBondContact O-N 2.89Å
410	L	94.5	Very high	91.1	Very high	31 Å²	31	69.2 Å²	69.2	16%	0.162	38%	0.379	C	S	.	.	H	α-helix	trans	-63.8	-42.7	174.8	-70.3	167.2	0	0	0	111.1	A380 L383 L384 L387 S406 V412 C413 I414	A380-L410 HydrophobicContact CB-CD2 3.86Å; L383-L410 HydrophobicContact CB-CD1 3.99Å; L383-L410 HydrophobicContact CB-CD2 4.31Å; L384-L410 HydrophobicContact CB-CB 4.15Å; L384-L410 HydrophobicContact CB-CD1 4.36Å; L384-L410 HydrophobicContact CD1-CB 4.35Å; L387-L410 HydrophobicContact CD1-CD1 3.84Å; S406-L410 VanDerWaalsContact O-CB 3.24Å; S406-L410 WeakPolarHBondContact O-CB 3.29Å; S406-L410 WeakPolarHBondContact O-CD1 3.36Å; S406-L410 WeakPolarHBondContact O-CG 3.42Å; S406-L410 PolarHBondContact O-N 3.5Å; L410-V412 PolarHBondContact O-N 2.71Å; L410-C413 WeakPolarHBondContact O-CB 3.38Å; L410-C413 PolarHBondContact O-N 3.24Å; L410-I414 WeakPolarHBondContact O-CD1 3.43Å; L410-I414 VanDerWaalsContact O-CG1 3.24Å; L410-I414 WeakPolarHBondContact O-CG1 3.28Å; L410-I414 PolarHBondContact O-N 3.36Å
411	G	92.2	Very high	91	Very high	23 Å²	23	67.7 Å²	67.7	24%	0.237	37%	0.368	C	S	.	.	H	α-helix	trans	-58.5	-45.6	174.9	0	0	0	0	0	113.1	V407 T408 T415	V407-G411 PolarHBondContact O-N 3.45Å; T408-G411 PolarHBondContact O-N 3.47Å; G411-T415 WeakPolarHBondContact O-CB 3.37Å; G411-T415 PolarHBondContact O-N 3.02Å; G411-T415 VanDerWaalsContact O-N 3.09Å; G411-T415 PolarHBondContact O-OG1 3.36Å
412	V	90.5	Very high	90.9	Very high	54 Å²	54	62.2 Å²	62.2	33%	0.327	35%	0.345	S	S	.	.	H	α-helix	trans	-63.1	-45.5	173.1	173	0	0	0	0	110.8	T408 L409 L410 I414 T415 V416	T408-V412 WeakPolarHBondContact O-CG2 3.44Å; T408-V412 PolarHBondContact O-N 3.42Å; L409-V412 PolarHBondContact O-N 3.22Å; L410-V412 PolarHBondContact O-N 2.71Å; V412-I414 PolarHBondContact O-N 2.88Å; V412-T415 PolarHBondContact O-N 3.01Å; V412-V416 HydrophobicContact CG1-CG2 4.24Å; V412-V416 WeakPolarHBondContact O-CB 3.42Å; V412-V416 WeakPolarHBondContact O-CG2 3.37Å; V412-V416 PolarHBondContact O-N 3.27Å
413	C	92.3	Very high	90.7	Very high	45 Å²	45	61.1 Å²	61.1	30%	0.304	34%	0.344	S	S	.	.	H	α-helix	trans	-58.3	-46.8	179.2	-174.2	0	0	0	0	112.5	L409 L410 T415 V416 C417	L409-C413 VanDerWaalsContact O-CB 3.3Å; L409-C413 WeakPolarHBondContact O-CB 3.35Å; L409-C413 PolarHBondContact O-N 2.89Å; L410-C413 WeakPolarHBondContact O-CB 3.38Å; L410-C413 PolarHBondContact O-N 3.24Å; C413-T415 VanDerWaalsContact C-N 3.34Å; C413-T415 PolarHBondContact O-N 3.22Å; C413-V416 PolarHBondContact O-N 2.91Å; C413-C417 WeakPolarHBondContact O-CB 3.3Å; C413-C417 PolarHBondContact O-N 3.25Å; C413-C417 PolarHBondContact O-SG 3.43Å
414	I	93.2	Very high	90.2	Very high	12 Å²	12	69.5 Å²	69.5	6%	0.062	38%	0.379	C	S	.	.	H	α-helix	trans	-62.7	-42.1	176.6	-65.1	157.1	0	0	0	110.7	A380 L384 L410 V412 C417 R418	A380-I414 HydrophobicContact CB-CD1 4.33Å; A380-I414 HydrophobicContact CB-CG1 3.69Å; L384-I414 HydrophobicContact CB-CD1 3.96Å; L384-I414 HydrophobicContact CD2-CD1 3.42Å; L384-I414 VanDerWaalsContact CD2-CD1 3.42Å; L384-I414 HydrophobicContact CG-CD1 4.33Å; L410-I414 WeakPolarHBondContact O-CD1 3.43Å; L410-I414 VanDerWaalsContact O-CG1 3.24Å; L410-I414 WeakPolarHBondContact O-CG1 3.28Å; L410-I414 PolarHBondContact O-N 3.36Å; V412-I414 PolarHBondContact O-N 2.88Å; I414-C417 PolarHBondContact O-N 3.3Å; I414-R418 HydrophobicContact CG2-CG 4.36Å; I414-R418 WeakPolarHBondContact O-CB 3.49Å; I414-R418 WeakPolarHBondContact O-CG 3.34Å; I414-R418 PolarHBondContact O-N 3.43Å
415	T	90.3	Very high	89.9	Confident	70 Å²	70	71.7 Å²	71.7	43%	0.429	39%	0.386	S	S	.	.	H	α-helix	trans	-67.3	-41.6	-179.3	-52.7	0	0	0	0	111.5	P320 G411 V412 C413 S419	P320-T415 HydrophobicContact CG-CG2 3.73Å; G411-T415 WeakPolarHBondContact O-CB 3.37Å; G411-T415 PolarHBondContact O-N 3.02Å; G411-T415 VanDerWaalsContact O-N 3.09Å; G411-T415 PolarHBondContact O-OG1 3.36Å; V412-T415 PolarHBondContact O-N 3.01Å; C413-T415 VanDerWaalsContact C-N 3.34Å; C413-T415 PolarHBondContact O-N 3.22Å; T415-S419 PolarHBondContact O-N 2.91Å; T415-S419 VanDerWaalsContact O-N 3.17Å
416	V	89.9	Confident	89.5	Confident	49 Å²	49	71.6 Å²	71.6	30%	0.297	38%	0.378	S	S	.	.	H	α-helix	trans	-60.1	-51.9	171.5	169	0	0	0	0	110.4	P320 V412 C413 R418 S419 F420	P320-V416 HydrophobicContact CB-CG2 3.8Å; P320-V416 HydrophobicContact CG-CG2 4.02Å; V412-V416 HydrophobicContact CG1-CG2 4.24Å; V412-V416 WeakPolarHBondContact O-CB 3.42Å; V412-V416 WeakPolarHBondContact O-CG2 3.37Å; V412-V416 PolarHBondContact O-N 3.27Å; C413-V416 PolarHBondContact O-N 2.91Å; V416-R418 PolarHBondContact O-N 3.44Å; V416-S419 PolarHBondContact O-N 3.41Å; V416-S419 PolarHBondContact O-OG 2.83Å; V416-F420 HydrophobicContact CG1-CD2 4.36Å; V416-F420 HydrophobicContact CG1-CE2 3.73Å; V416-F420 WeakPolarHBondContact O-CD2 3.33Å
417	C	91.4	Very high	89.3	Confident	13 Å²	13	74.7 Å²	74.7	9%	0.088	40%	0.395	C	S	.	.	H	α-helix	trans	-62.2	-40.7	-178.6	-67.3	0	0	0	0	112.3	A373 V376 A377 C413 I414 S419 F420	A373-C417 HydrophobicContact CB-CB 4.44Å; V376-C417 VanDerWaalsContact CG1-SG 3.55Å; A377-C417 HydrophobicContact CB-CB 3.81Å; C413-C417 WeakPolarHBondContact O-CB 3.3Å; C413-C417 PolarHBondContact O-N 3.25Å; C413-C417 PolarHBondContact O-SG 3.43Å; I414-C417 PolarHBondContact O-N 3.3Å; C417-S419 VanDerWaalsContact C-N 3.26Å; C417-S419 PolarHBondContact O-N 2.82Å; C417-F420 PolarHBondContact O-N 2.94Å; C417-F420 VanDerWaalsContact O-N 3.13Å
418	R	88.9	Confident	89	Confident	176 Å²	176	79.2 Å²	79.2	66%	0.664	41%	0.412	S	S	*	.	H	α-helix	trans	-62.3	-31	174.5	-77.2	179.4	176.6	168.9	0.2	112.7	I414 V416 F420 I421	I414-R418 HydrophobicContact CG2-CG 4.36Å; I414-R418 WeakPolarHBondContact O-CB 3.49Å; I414-R418 WeakPolarHBondContact O-CG 3.34Å; I414-R418 PolarHBondContact O-N 3.43Å; V416-R418 PolarHBondContact O-N 3.44Å; R418-F420 PolarHBondContact O-N 3.3Å; R418-I421 PolarHBondContact O-N 3.47Å
419	S	87.2	Confident	89	Confident	54 Å²	54	77 Å²	77	38%	0.378	40%	0.4	S	S	.	.	H	α-helix	trans	-70.3	-15.9	176.3	77.2	0	0	0	0	114.2	T415 V416 C417	T415-S419 PolarHBondContact O-N 2.91Å; T415-S419 VanDerWaalsContact O-N 3.17Å; V416-S419 PolarHBondContact O-N 3.41Å; V416-S419 PolarHBondContact O-OG 2.83Å; C417-S419 VanDerWaalsContact C-N 3.26Å; C417-S419 PolarHBondContact O-N 2.82Å
420	F	87.4	Confident	89	Confident	78 Å²	78	71.7 Å²	71.7	34%	0.342	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-0.3	172.4	-62.2	-54.4	0	0	0	114.5	L369 A373 V416 C417 R418	L369-F420 HydrophobicContact CD2-CB 4.37Å; L369-F420 HydrophobicContact CD2-CD1 3.89Å; L369-F420 HydrophobicContact CD2-CE1 4.41Å; L369-F420 HydrophobicContact CD2-CG 4.17Å; L369-F420 HydrophobicContact CG-CB 4.26Å; L369-F420 HydrophobicContact CG-CG 4.35Å; A373-F420 HydrophobicContact CB-CB 3.88Å; V416-F420 HydrophobicContact CG1-CD2 4.36Å; V416-F420 HydrophobicContact CG1-CE2 3.73Å; V416-F420 WeakPolarHBondContact O-CD2 3.33Å; C417-F420 PolarHBondContact O-N 2.94Å; C417-F420 VanDerWaalsContact O-N 3.13Å; R418-F420 PolarHBondContact O-N 3.3Å
421	I	89.5	Confident	88.8	Confident	54 Å²	54	72.4 Å²	72.4	28%	0.277	38%	0.375	S	S	.	.	S	Bend	trans	-94.9	117.2	179.3	-63.1	172.5	0	0	0	109.1	A373 K374 R418	A373-I421 HydrophobicContact CB-CG1 4.13Å; K374-I421 HydrophobicContact CG-CD1 3.78Å; K374-I421 HydrophobicContact CG-CG1 4.02Å; R418-I421 PolarHBondContact O-N 3.47Å
422	P	85.8	Confident	88.8	Confident	40 Å²	40	76 Å²	76	26%	0.26	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-62.4	151	174.8	20.1	-28.9	0	0	0	113	L365 T370 M426	L365-P422 HydrophobicContact CD1-CB 3.68Å; L365-P422 HydrophobicContact CD1-CG 4.22Å; T370-P422 HydrophobicContact CG2-CG 4.16Å; P422-M426 HydrophobicContact CB-CE 4.06Å
423	D	85.4	Confident	88.9	Confident	107 Å²	107	74.4 Å²	74.4	57%	0.572	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-58.3	135.9	161.9	179	10.5	0	0	0	110.3	H425	D423-H425 VanDerWaalsContact C-N 3.25Å; D423-H425 PolarHBondContact O-N 3.17Å; D423-H425 IonicContact OD1-CD2 3.28Å; D423-H425 PolarHBondContact OD1-N 3.42Å
424	K	81.9	Confident	89	Confident	193 Å²	193	72.4 Å²	72.4	84%	0.839	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.1	177.4	-61.7	178.4	-177.1	175.3	0	112.6
425	H	85.3	Confident	88.9	Confident	155 Å²	155	76 Å²	76	72%	0.718	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	12.9	-172.6	-58.2	-77.1	0	0	0	113.5	D423 V427	D423-H425 VanDerWaalsContact C-N 3.25Å; D423-H425 PolarHBondContact O-N 3.17Å; D423-H425 IonicContact OD1-CD2 3.28Å; D423-H425 PolarHBondContact OD1-N 3.42Å; H425-V427 PolarHBondContact O-N 2.96Å
426	M	83.6	Confident	89	Confident	73 Å²	73	74.8 Å²	74.8	36%	0.36	37%	0.366	S	S	.	.			trans	-70.6	118.1	177.1	179.1	169.7	56.7	0	0	112.1	N362 P422	N362-M426 HydrophobicContact CB-SD 3.83Å; N362-M426 VanDerWaalsContact O-CE 3.29Å; N362-M426 WeakPolarHBondContact O-CE 3.29Å; P422-M426 HydrophobicContact CB-CE 4.06Å
427	V	88.2	Confident	89.2	Confident	110 Å²	110	72.4 Å²	72.4	67%	0.667	35%	0.352	S	S	*	.			trans	-73.9	130.7	175	-179	0	0	0	0	110.9	H425 C429	H425-V427 PolarHBondContact O-N 2.96Å; V427-C429 HydrophobicContact CG1-CB 4.47Å; V427-C429 PolarHBondContact O-N 3.42Å
428	F	87.7	Confident	89.3	Confident	126 Å²	126	72.1 Å²	72.1	55%	0.553	35%	0.35	S	S	*	.			trans	-90.8	97.5	177.3	-174.3	-95.5	0	0	0	111.1	C363 F364 P430	C363-F428 HydrophobicContact CB-CD2 3.82Å; C363-F428 HydrophobicContact CB-CE2 3.98Å; F364-F428 HydrophobicContact CE1-CE2 4.28Å; F364-F428 HydrophobicContact CE1-CZ 4.31Å; F428-P430 HydrophobicContact CD1-CG 4.28Å; F428-P430 HydrophobicContact CE1-CG 3.7Å; F428-P430 HydrophobicContact CE2-CG 4.41Å; F428-P430 HydrophobicContact CZ-CG 3.78Å
429	C	90.9	Very high	89.5	Confident	34 Å²	34	63.8 Å²	63.8	23%	0.23	32%	0.319	C	S	.	.			trans	-135.5	56.9	-179.8	55.2	0	0	0	0	113.5	V427 E431 Q432 L433	V427-C429 HydrophobicContact CG1-CB 4.47Å; V427-C429 PolarHBondContact O-N 3.42Å; C429-E431 PolarHBondContact O-N 3.04Å; C429-Q432 HydrophobicContact CB-CB 4.4Å; C429-Q432 PolarHBondContact O-N 3.41Å; C429-L433 WeakPolarHBondContact O-CG 3.26Å; C429-L433 PolarHBondContact O-N 3.11Å; C429-L433 VanDerWaalsContact O-N 3.07Å
430	P	92.8	Very high	89.7	Confident	9 Å²	9	63.6 Å²	63.6	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-40.2	-169.1	24	-35.1	0	0	0	114.6	Y360 F364 F428 Q432 L433 L434 A452 H453	Y360-P430 HydrophobicContact CD2-CB 4.15Å; Y360-P430 HydrophobicContact CE2-CB 3.85Å; F364-P430 HydrophobicContact CE2-CB 4.25Å; F364-P430 HydrophobicContact CZ-CB 3.77Å; F364-P430 HydrophobicContact CZ-CG 4.39Å; F428-P430 HydrophobicContact CD1-CG 4.28Å; F428-P430 HydrophobicContact CE1-CG 3.7Å; F428-P430 HydrophobicContact CE2-CG 4.41Å; F428-P430 HydrophobicContact CZ-CG 3.78Å; P430-Q432 PolarHBondContact O-N 3.17Å; P430-L433 PolarHBondContact O-N 3.33Å; P430-L434 VanDerWaalsContact O-CB 3.31Å; P430-L434 WeakPolarHBondContact O-CB 3.19Å; P430-L434 PolarHBondContact O-N 3.01Å; P430-A452 HydrophobicContact CB-CB 4.34Å; P430-H453 HydrophobicContact CG-CB 4.15Å
431	E	91.4	Very high	90	Very high	46 Å²	46	59.9 Å²	59.9	22%	0.215	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-41.6	178.2	-67	-68.1	153.7	0	0	112.4	C429 L434 R435 G450 N451 A452 H453	C429-E431 PolarHBondContact O-N 3.04Å; E431-L434 PolarHBondContact O-N 2.94Å; E431-R435 WeakPolarHBondContact O-CG 3.29Å; E431-R435 PolarHBondContact O-N 3Å; E431-R435 VanDerWaalsContact O-N 3.09Å; E431-G450 WeakPolarHBondContact OE1-CA 3.3Å; E431-G450 WeakPolarHBondContact OE2-CA 3.23Å; E431-G450 PolarHBondContact OE2-N 3.43Å; E431-N451 PolarHBondContact OE1-N 3.29Å; E431-A452 HydrophobicContact CG-CB 4.11Å; E431-A452 WeakPolarHBondContact OE1-CB 3.46Å; E431-A452 PolarHBondContact OE1-N 2.63Å; E431-H453 IonicContact OE1-ND1 2.74Å
432	Q	91.1	Very high	90.3	Very high	97 Å²	97	57.5 Å²	57.5	45%	0.453	28%	0.283	S	S	.	.	H	α-helix	trans	-69.1	-43.4	178.4	-67.4	178.4	-5	0	0	111.1	C429 P430 L434 R435 V436	C429-Q432 HydrophobicContact CB-CB 4.4Å; C429-Q432 PolarHBondContact O-N 3.41Å; P430-Q432 PolarHBondContact O-N 3.17Å; Q432-L434 VanDerWaalsContact C-N 3.32Å; Q432-L434 PolarHBondContact O-N 2.89Å; Q432-R435 PolarHBondContact O-N 3.46Å; Q432-V436 WeakPolarHBondContact O-CG2 3.36Å; Q432-V436 PolarHBondContact O-N 2.94Å; Q432-V436 VanDerWaalsContact O-N 3.1Å
433	L	93.5	Very high	90.6	Very high	22 Å²	22	55.6 Å²	55.6	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-41.1	175.4	-68.6	168.4	0	0	0	111.3	K359 Y360 C429 P430 V436 I437	K359-L433 HydrophobicContact CB-CD1 4.12Å; K359-L433 HydrophobicContact CB-CD2 3.94Å; K359-L433 HydrophobicContact CD-CD2 4.18Å; Y360-L433 HydrophobicContact CD2-CB 4.32Å; C429-L433 WeakPolarHBondContact O-CG 3.26Å; C429-L433 PolarHBondContact O-N 3.11Å; C429-L433 VanDerWaalsContact O-N 3.07Å; P430-L433 PolarHBondContact O-N 3.33Å; L433-V436 PolarHBondContact O-N 2.89Å; L433-I437 WeakPolarHBondContact O-CD1 3.39Å; L433-I437 WeakPolarHBondContact O-CG1 3.38Å; L433-I437 PolarHBondContact O-N 2.95Å
434	L	93.4	Very high	90.9	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-36.5	179.7	-167.3	62.7	0	0	0	112.6	Y360 P430 E431 Q432 I437 L438 M444 W448 A452 T457	Y360-L434 HydrophobicContact CD2-CB 4.49Å; Y360-L434 HydrophobicContact CE2-CB 4.37Å; P430-L434 VanDerWaalsContact O-CB 3.31Å; P430-L434 WeakPolarHBondContact O-CB 3.19Å; P430-L434 PolarHBondContact O-N 3.01Å; E431-L434 PolarHBondContact O-N 2.94Å; Q432-L434 VanDerWaalsContact C-N 3.32Å; Q432-L434 PolarHBondContact O-N 2.89Å; L434-I437 HydrophobicContact CD1-CD1 4.42Å; L434-I437 PolarHBondContact O-N 2.95Å; L434-L438 WeakPolarHBondContact O-CB 3.42Å; L434-L438 PolarHBondContact O-N 3.48Å; L434-M444 HydrophobicContact CD1-SD 3.66Å; L434-M444 HydrophobicContact CD2-CE 3.92Å; L434-M444 HydrophobicContact CD2-SD 3.76Å; L434-M444 HydrophobicContact CG-CE 4.09Å; L434-M444 HydrophobicContact CG-SD 3.53Å; L434-M444 VanDerWaalsContact CG-SD 3.53Å; L434-W448 HydrophobicContact CD1-CE3 4.41Å; L434-W448 HydrophobicContact CD2-CB 4.21Å; L434-A452 HydrophobicContact CB-CB 4.09Å; L434-A452 HydrophobicContact CD2-CB 3.5Å; L434-A452 VanDerWaalsContact CD2-CB 3.5Å; L434-A452 HydrophobicContact CG-CB 4.44Å; L434-T457 HydrophobicContact CD2-CG2 4.36Å
435	R	91.6	Very high	91.3	Very high	88 Å²	88	42.7 Å²	42.7	33%	0.332	21%	0.212	S	C	.	.	H	α-helix	trans	-63.2	-41.9	171.1	-68.3	174.5	-160.8	-157	5.7	112.3	E431 Q432 L438 A439 E600	E431-R435 WeakPolarHBondContact O-CG 3.29Å; E431-R435 PolarHBondContact O-N 3Å; E431-R435 VanDerWaalsContact O-N 3.09Å; Q432-R435 PolarHBondContact O-N 3.46Å; R435-L438 PolarHBondContact O-N 3.42Å; R435-A439 PolarHBondContact O-N 3.1Å; R435-E600 IonicContact CZ-OE1 3.6Å; R435-E600 IonicContact CZ-OE2 3.44Å; R435-E600 VanDerWaalsContact NH1-CD 3.3Å; R435-E600 IonicContact NH1-OE1 3.75Å; R435-E600 PolarHBondContact NH1-OE1 3.46Å; R435-E600 IonicContact NH1-OE2 3.55Å; R435-E600 PolarHBondContact NH1-OE2 3.01Å; R435-E600 IonicContact NH2-OE1 3.62Å; R435-E600 PolarHBondContact NH2-OE1 3.27Å; R435-E600 IonicContact NH2-OE2 2.72Å
436	V	92.6	Very high	91.4	Very high	43 Å²	43	38.3 Å²	38.3	26%	0.261	19%	0.194	S	C	.	.	H	α-helix	trans	-68.3	-33.9	175.6	174.3	0	0	0	0	112	A356 Q432 L433 H440 L604	A356-V436 HydrophobicContact CB-CG1 3.95Å; Q432-V436 WeakPolarHBondContact O-CG2 3.36Å; Q432-V436 PolarHBondContact O-N 2.94Å; Q432-V436 VanDerWaalsContact O-N 3.1Å; L433-V436 PolarHBondContact O-N 2.89Å; V436-H440 PolarHBondContact O-CD2 3.04Å; V436-H440 VanDerWaalsContact O-CD2 3.3Å; V436-L604 HydrophobicContact CG2-CD2 4.05Å
437	I	94.7	Very high	91.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.2	-51	171.7	-70.1	160.4	0	0	0	110	A356 A357 Y360 L433 L434 A439 H440 I441 F461	A356-I437 HydrophobicContact CB-CG1 3.66Å; A357-I437 HydrophobicContact CB-CD1 4.35Å; A357-I437 HydrophobicContact CB-CG1 4.4Å; Y360-I437 HydrophobicContact CD1-CD1 4.4Å; Y360-I437 HydrophobicContact CG-CD1 3.96Å; L433-I437 WeakPolarHBondContact O-CD1 3.39Å; L433-I437 WeakPolarHBondContact O-CG1 3.38Å; L433-I437 PolarHBondContact O-N 2.95Å; L434-I437 HydrophobicContact CD1-CD1 4.42Å; L434-I437 PolarHBondContact O-N 2.95Å; I437-A439 VanDerWaalsContact C-N 3.28Å; I437-A439 PolarHBondContact O-N 3.13Å; I437-H440 PolarHBondContact O-N 3.44Å; I437-I441 HydrophobicContact CG2-CD1 3.64Å; I437-I441 HydrophobicContact CG2-CG1 4Å; I437-I441 HydrophobicContact CG2-CG2 4.16Å; I437-I441 WeakPolarHBondContact O-CG1 3.39Å; I437-I441 PolarHBondContact O-N 3.44Å; I437-F461 HydrophobicContact CD1-CZ 4.18Å; I437-F461 HydrophobicContact CG2-CE2 3.85Å; I437-F461 HydrophobicContact CG2-CZ 4.07Å
438	L	93.3	Very high	91.7	Very high	6 Å²	6	34.2 Å²	34.2	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-54.8	-43.3	178.6	172.3	57.9	0	0	0	112	L434 R435 H440 I441 H442 M444 L710 H713	L434-L438 WeakPolarHBondContact O-CB 3.42Å; L434-L438 PolarHBondContact O-N 3.48Å; R435-L438 PolarHBondContact O-N 3.42Å; L438-H440 PolarHBondContact O-N 3.32Å; L438-I441 PolarHBondContact O-N 3.43Å; L438-H442 WeakPolarHBondContact O-CA 3.31Å; L438-H442 PolarHBondContact O-N 3.37Å; L438-M444 HydrophobicContact CB-SD 4.39Å; L438-M444 HydrophobicContact CD1-CB 3.88Å; L438-M444 HydrophobicContact CD2-CE 4.31Å; L438-L710 HydrophobicContact CD2-CD2 4.1Å; L438-L710 HydrophobicContact CG-CD2 4.13Å; L438-H713 HydrophobicContact CD2-CB 4.15Å
439	A	91.8	Very high	91.6	Very high	2 Å²	2	30.2 Å²	30.2	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-54.6	-25	175.6	0	0	0	0	0	114	R435 I437 S706 L710	R435-A439 PolarHBondContact O-N 3.1Å; I437-A439 VanDerWaalsContact C-N 3.28Å; I437-A439 PolarHBondContact O-N 3.13Å; A439-S706 WeakPolarHBondContact O-CA 3.35Å; A439-S706 WeakPolarHBondContact O-CB 3.44Å; A439-L710 HydrophobicContact CB-CD1 3.98Å; A439-L710 HydrophobicContact CB-CD2 4.35Å; A439-L710 HydrophobicContact CB-CG 4.17Å
440	H	93	Very high	91.3	Very high	49 Å²	49	31 Å²	31	23%	0.227	16%	0.162	C	C	.	.	H	α-helix	trans	-106.3	-31.7	178.4	-61.2	-42.5	0	0	0	114.1	R349 V436 I437 L438	R349-H440 PolarHBondContact NE-O 2.95Å; V436-H440 PolarHBondContact O-CD2 3.04Å; V436-H440 VanDerWaalsContact O-CD2 3.3Å; I437-H440 PolarHBondContact O-N 3.44Å; L438-H440 PolarHBondContact O-N 3.32Å
441	I	93.4	Very high	91.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-92.1	-14.2	-179.2	73.8	171.3	0	0	0	113.8	W328 L336 R349 L350 I437 L438 Y443 F461	W328-I441 HydrophobicContact CH2-CG2 3.78Å; W328-I441 HydrophobicContact CZ2-CG2 4.28Å; W328-I441 HydrophobicContact CZ3-CG2 4.41Å; L336-I441 HydrophobicContact CD1-CB 4.16Å; L336-I441 HydrophobicContact CD1-CD1 4.36Å; L336-I441 HydrophobicContact CD1-CG2 4.26Å; L336-I441 HydrophobicContact CD2-CB 4.21Å; L336-I441 HydrophobicContact CD2-CD1 3.95Å; L336-I441 HydrophobicContact CD2-CG1 4.33Å; R349-I441 PolarHBondContact NH2-O 2.88Å; L350-I441 HydrophobicContact CD2-CG2 4.46Å; I437-I441 HydrophobicContact CG2-CD1 3.64Å; I437-I441 HydrophobicContact CG2-CG1 4Å; I437-I441 HydrophobicContact CG2-CG2 4.16Å; I437-I441 WeakPolarHBondContact O-CG1 3.39Å; I437-I441 PolarHBondContact O-N 3.44Å; L438-I441 PolarHBondContact O-N 3.43Å; I441-Y443 WeakPolarHBondContact CD1-O 3.24Å; I441-Y443 PolarHBondContact O-N 3.1Å; I441-F461 HydrophobicContact CD1-CE2 4.49Å
442	H	94.2	Very high	91.2	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.019	16%	0.16	C	C	.	.			trans	57.6	-18.9	178	-45.4	165.3	0	0	0	117.3	H338 R349 L438 L551 M705 A709	H338-H442 AromaticContact CE1-CE1 3.77Å; H338-H442 AromaticContact CE1-ND1 3.18Å; H338-H442 PolarHBondContact CE1-ND1 3.5Å; H338-H442 AromaticContact NE2-CE1 3.91Å; H338-H442 AromaticContact NE2-CG 3.93Å; H338-H442 AromaticContact NE2-ND1 2.98Å; H338-H442 PolarHBondContact NE2-ND1 3.42Å; R349-H442 PolarHBondContact NE-CE1 2.95Å; R349-H442 PolarHBondContact NE-ND1 3.35Å; L438-H442 WeakPolarHBondContact O-CA 3.31Å; L438-H442 PolarHBondContact O-N 3.37Å; H442-L551 WeakPolarHBondContact O-CD1 3.15Å; H442-M705 WeakPolarHBondContact CE1-CG 3.48Å; H442-A709 HydrophobicContact CB-CB 4.06Å
443	Y	93.8	Very high	91.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.161	C	C	.	.			trans	-119.5	127	-176.5	-66.1	-67.6	0	0	0	110.6	H338 I441 D546 K548 L551 S552	H338-Y443 AromaticContact CD2-CE2 3.64Å; H338-Y443 AromaticContact CD2-CZ 3.74Å; H338-Y443 PolarHBondContact CD2-OH 3.26Å; H338-Y443 AromaticContact NE2-CE2 4Å; I441-Y443 WeakPolarHBondContact CD1-O 3.24Å; I441-Y443 PolarHBondContact O-N 3.1Å; Y443-D546 WeakPolarHBondContact CD1-O 3.36Å; Y443-K548 HydrophobicContact CD1-CG 4.32Å; Y443-K548 HydrophobicContact CE1-CB 4.38Å; Y443-K548 HydrophobicContact CE1-CG 3.62Å; Y443-K548 PolarHBondContact OH-O 2.85Å; Y443-L551 HydrophobicContact CD1-CD1 3.75Å; Y443-L551 HydrophobicContact CE1-CB 3.84Å; Y443-L551 HydrophobicContact CE1-CD1 3.46Å; Y443-L551 VanDerWaalsContact CE1-CD1 3.46Å; Y443-L551 HydrophobicContact CE1-CG 4.3Å; Y443-S552 PolarHBondContact OH-OG 3.06Å
444	M	91.1	Very high	91.3	Very high	6 Å²	6	34.5 Å²	34.5	3%	0.03	17%	0.174	C	C	.	.			trans	-155.2	132.1	179.7	-167.1	169.1	88.8	0	0	110.8	L434 L438 W448 Q449 H713	L434-M444 HydrophobicContact CD1-SD 3.66Å; L434-M444 HydrophobicContact CD2-CE 3.92Å; L434-M444 HydrophobicContact CD2-SD 3.76Å; L434-M444 HydrophobicContact CG-CE 4.09Å; L434-M444 HydrophobicContact CG-SD 3.53Å; L434-M444 VanDerWaalsContact CG-SD 3.53Å; L438-M444 HydrophobicContact CB-SD 4.39Å; L438-M444 HydrophobicContact CD1-CB 3.88Å; L438-M444 HydrophobicContact CD2-CE 4.31Å; M444-W448 HydrophobicContact CE-CB 4.06Å; M444-W448 HydrophobicContact CG-CB 4.24Å; M444-W448 HydrophobicContact CG-CD2 3.99Å; M444-W448 HydrophobicContact CG-CE3 3.24Å; M444-W448 HydrophobicContact CG-CG 4.44Å; M444-W448 HydrophobicContact CG-CZ3 3.74Å; M444-W448 HydrophobicContact SD-CB 4.35Å; M444-W448 HydrophobicContact SD-CE3 3.76Å; M444-W448 HydrophobicContact SD-CZ3 4.44Å; M444-Q449 HydrophobicContact CE-CG 3.42Å; M444-Q449 VanDerWaalsContact CE-CG 3.42Å; M444-H713 PolarHBondContact N-NE2 3.42Å; M444-H713 PolarHBondContact O-NE2 2.86Å
445	P	90.9	Very high	91.1	Very high	23 Å²	23	41.6 Å²	41.6	15%	0.149	20%	0.202	C	C	.	.			trans	-59	136.7	174	-25.7	35.3	0	0	0	112.8	H447 W448	P445-H447 VanDerWaalsContact C-N 3.31Å; P445-H447 VanDerWaalsContact CB-CE1 3.47Å; P445-H447 WeakPolarHBondContact CB-CE1 3.19Å; P445-H447 PolarHBondContact O-N 3.44Å; P445-W448 HydrophobicContact CB-CD2 4.45Å; P445-W448 HydrophobicContact CB-CG 4.43Å; P445-W448 HydrophobicContact CG-CD2 4.32Å; P445-W448 HydrophobicContact CG-CH2 4.29Å; P445-W448 HydrophobicContact CG-CZ2 3.78Å; P445-W448 WeakPolarHBondContact O-CB 3.39Å; P445-W448 PolarHBondContact O-N 3.17Å; P445-W448 VanDerWaalsContact O-N 3.1Å
446	D	86.1	Confident	91.1	Very high	63 Å²	63	40.9 Å²	40.9	34%	0.337	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-61.8	-36.9	-167.3	-50.6	-57.8	0	0	0	113.3	W448 Q449 H713 H716	D446-W448 PolarHBondContact O-N 2.76Å; D446-W448 VanDerWaalsContact O-N 3.11Å; D446-Q449 PolarHBondContact O-N 2.54Å; D446-Q449 VanDerWaalsContact O-N 3.13Å; D446-H713 IonicContact OD1-CE1 3.91Å; D446-H716 IonicContact OD1-CD2 3.15Å; D446-H716 PolarHBondContact OD1-CD2 3.34Å; D446-H716 VanDerWaalsContact OD1-CD2 3.28Å; D446-H716 IonicContact OD1-NE2 3.95Å; D446-H716 PolarHBondContact OD1-NE2 2.85Å; D446-H716 IonicContact OD2-NE2 2.71Å
447	H	88.5	Confident	91.2	Very high	93 Å²	93	38.9 Å²	38.9	43%	0.431	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-67.3	-10.8	-178.9	67.3	-76	0	0	0	114.1	P445 N451 Q460	P445-H447 VanDerWaalsContact C-N 3.31Å; P445-H447 VanDerWaalsContact CB-CE1 3.47Å; P445-H447 WeakPolarHBondContact CB-CE1 3.19Å; P445-H447 PolarHBondContact O-N 3.44Å; H447-N451 WeakPolarHBondContact O-CB 3.45Å; H447-N451 PolarHBondContact O-ND2 3.35Å; H447-Q460 PolarHBondContact CE1-OE1 3.2Å; H447-Q460 PolarHBondContact NE2-OE1 3.38Å
448	W	90.3	Very high	91.1	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.015	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-74.6	-26.4	173.2	-65.6	8.1	0	0	0	112.7	L434 M444 P445 D446 G450 N451 A452 T457 Q460 F461 L464	L434-W448 HydrophobicContact CD1-CE3 4.41Å; L434-W448 HydrophobicContact CD2-CB 4.21Å; M444-W448 HydrophobicContact CE-CB 4.06Å; M444-W448 HydrophobicContact CG-CB 4.24Å; M444-W448 HydrophobicContact CG-CD2 3.99Å; M444-W448 HydrophobicContact CG-CE3 3.24Å; M444-W448 HydrophobicContact CG-CG 4.44Å; M444-W448 HydrophobicContact CG-CZ3 3.74Å; M444-W448 HydrophobicContact SD-CB 4.35Å; M444-W448 HydrophobicContact SD-CE3 3.76Å; M444-W448 HydrophobicContact SD-CZ3 4.44Å; P445-W448 HydrophobicContact CB-CD2 4.45Å; P445-W448 HydrophobicContact CB-CG 4.43Å; P445-W448 HydrophobicContact CG-CD2 4.32Å; P445-W448 HydrophobicContact CG-CH2 4.29Å; P445-W448 HydrophobicContact CG-CZ2 3.78Å; P445-W448 WeakPolarHBondContact O-CB 3.39Å; P445-W448 PolarHBondContact O-N 3.17Å; P445-W448 VanDerWaalsContact O-N 3.1Å; D446-W448 PolarHBondContact O-N 2.76Å; D446-W448 VanDerWaalsContact O-N 3.11Å; W448-G450 PolarHBondContact O-N 2.91Å; W448-N451 CarbonylContact O-C 3.57Å; W448-N451 PolarHBondContact O-N 3.3Å; W448-N451 VanDerWaalsContact O-N 3.13Å; W448-A452 PolarHBondContact O-N 3.33Å; W448-T457 HydrophobicContact CB-CG2 3.75Å; W448-T457 HydrophobicContact CD2-CG2 3.76Å; W448-T457 HydrophobicContact CE3-CG2 4.23Å; W448-T457 HydrophobicContact CG-CG2 3.51Å; W448-Q460 HydrophobicContact CZ2-CB 3.63Å; W448-F461 HydrophobicContact CE3-CD2 4.49Å; W448-F461 HydrophobicContact CH2-CB 4.15Å; W448-F461 HydrophobicContact CH2-CD2 4.04Å; W448-F461 HydrophobicContact CZ3-CB 4.33Å; W448-F461 AromaticContact CZ3-CD2 3.64Å; W448-F461 HydrophobicContact CZ3-CD2 3.64Å; W448-F461 HydrophobicContact CZ3-CG 4.49Å; W448-L464 HydrophobicContact CH2-CD1 3.79Å; W448-L464 HydrophobicContact CZ3-CD1 4.41Å
449	Q	84.9	Confident	91.1	Very high	43 Å²	43	45.3 Å²	45.3	20%	0.201	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	124	-178.1	-64.7	-165.9	35.6	0	0	111.4	M444 D446 N451 H713	M444-Q449 HydrophobicContact CE-CG 3.42Å; M444-Q449 VanDerWaalsContact CE-CG 3.42Å; D446-Q449 PolarHBondContact O-N 2.54Å; D446-Q449 VanDerWaalsContact O-N 3.13Å; Q449-N451 PolarHBondContact O-N 3.16Å; Q449-H713 PolarHBondContact NE2-CE1 2.89Å; Q449-H713 PolarHBondContact NE2-ND1 3.41Å
450	G	85.1	Confident	91.2	Very high	49 Å²	49	48.5 Å²	48.5	51%	0.505	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	0.6	-174.8	0	0	0	0	0	114.7	E431 W448	E431-G450 WeakPolarHBondContact OE1-CA 3.3Å; E431-G450 WeakPolarHBondContact OE2-CA 3.23Å; E431-G450 PolarHBondContact OE2-N 3.43Å; W448-G450 PolarHBondContact O-N 2.91Å
451	N	91	Very high	91.3	Very high	41 Å²	41	46.1 Å²	46.1	22%	0.219	22%	0.223	C	C	.	.			trans	-120.3	17.7	173.8	-66.1	-56.5	0	0	0	111.6	E431 H447 W448 Q449 H453 R454 T457	E431-N451 PolarHBondContact OE1-N 3.29Å; H447-N451 WeakPolarHBondContact O-CB 3.45Å; H447-N451 PolarHBondContact O-ND2 3.35Å; W448-N451 CarbonylContact O-C 3.57Å; W448-N451 PolarHBondContact O-N 3.3Å; W448-N451 VanDerWaalsContact O-N 3.13Å; Q449-N451 PolarHBondContact O-N 3.16Å; N451-H453 PolarHBondContact O-N 3.36Å; N451-R454 HydrophobicContact CB-CG 4.14Å; N451-R454 WeakPolarHBondContact O-CB 3.36Å; N451-R454 WeakPolarHBondContact O-CG 3.44Å; N451-R454 PolarHBondContact O-N 2.99Å; N451-R454 PolarHBondContact OD1-NE 3.48Å; N451-R454 PolarHBondContact OD1-NH2 3.22Å; N451-T457 PolarHBondContact O-OG1 2.75Å
452	A	92	Very high	91.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-17.3	-171.4	0	0	0	0	0	113.7	Y360 F364 P430 E431 L434 W448	Y360-A452 HydrophobicContact CE2-CB 4.34Å; Y360-A452 WeakPolarHBondContact CE2-O 3.4Å; Y360-A452 PolarHBondContact OH-O 2.67Å; F364-A452 VanDerWaalsContact CZ-O 3.26Å; F364-A452 WeakPolarHBondContact CZ-O 3.22Å; P430-A452 HydrophobicContact CB-CB 4.34Å; E431-A452 HydrophobicContact CG-CB 4.11Å; E431-A452 WeakPolarHBondContact OE1-CB 3.46Å; E431-A452 PolarHBondContact OE1-N 2.63Å; L434-A452 HydrophobicContact CB-CB 4.09Å; L434-A452 HydrophobicContact CD2-CB 3.5Å; L434-A452 VanDerWaalsContact CD2-CB 3.5Å; L434-A452 HydrophobicContact CG-CB 4.44Å; W448-A452 PolarHBondContact O-N 3.33Å
453	H	91.8	Very high	91.4	Very high	102 Å²	102	49.6 Å²	49.6	47%	0.472	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-4.9	177.2	63.6	-88.2	0	0	0	114.4	P430 E431 N451	P430-H453 HydrophobicContact CG-CB 4.15Å; E431-H453 IonicContact OE1-ND1 2.74Å; N451-H453 PolarHBondContact O-N 3.36Å
454	R	93.3	Very high	91.5	Very high	106 Å²	106	49.9 Å²	49.9	40%	0.4	24%	0.244	S	C	.	.	S	Bend	trans	-83.4	148.4	-178.2	-62.9	-167.5	-169.5	-166.6	5.2	113	N451 E456 T457 R458	N451-R454 HydrophobicContact CB-CG 4.14Å; N451-R454 WeakPolarHBondContact O-CB 3.36Å; N451-R454 WeakPolarHBondContact O-CG 3.44Å; N451-R454 PolarHBondContact O-N 2.99Å; N451-R454 PolarHBondContact OD1-NE 3.48Å; N451-R454 PolarHBondContact OD1-NH2 3.22Å; R454-E456 VanDerWaalsContact C-N 3.25Å; R454-E456 HydrophobicContact CB-CB 4.45Å; R454-E456 WeakPolarHBondContact CD-OE2 3.33Å; R454-E456 IonicContact NH1-OE2 2.63Å; R454-E456 PolarHBondContact NH1-OE2 3.36Å; R454-E456 PolarHBondContact O-N 3.14Å; R454-T457 PolarHBondContact O-N 3.23Å; R454-R458 PolarHBondContact O-N 2.96Å; R454-R458 VanDerWaalsContact O-N 3.1Å
455	Y	89.9	Confident	91.7	Very high	151 Å²	151	49.6 Å²	49.6	59%	0.592	24%	0.242	S	C	*	.	H	α-helix	trans	-60.8	-35.1	172.4	70.4	-85.1	0	0	0	112	T457 R458 D459	Y455-T457 PolarHBondContact O-N 3.39Å; Y455-R458 WeakPolarHBondContact O-CB 3.36Å; Y455-R458 PolarHBondContact O-N 3.38Å; Y455-D459 WeakPolarHBondContact O-CB 3.4Å; Y455-D459 VanDerWaalsContact O-CG 3.24Å; Y455-D459 PolarHBondContact O-N 3.49Å
456	E	91.9	Very high	91.9	Very high	73 Å²	73	49.2 Å²	49.2	34%	0.341	24%	0.238	S	C	.	.	H	α-helix	trans	-55.4	-48.6	175.6	-63.9	162	168.1	0	0	111.6	R454 Q460	R454-E456 VanDerWaalsContact C-N 3.25Å; R454-E456 HydrophobicContact CB-CB 4.45Å; R454-E456 WeakPolarHBondContact CD-OE2 3.33Å; R454-E456 IonicContact NH1-OE2 2.63Å; R454-E456 PolarHBondContact NH1-OE2 3.36Å; R454-E456 PolarHBondContact O-N 3.14Å; E456-Q460 WeakPolarHBondContact O-CG 3.29Å; E456-Q460 PolarHBondContact O-N 2.85Å; E456-Q460 VanDerWaalsContact O-N 3.16Å
457	T	94.6	Very high	92.3	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-67.4	-44	177.1	-59	0	0	0	0	111.6	L434 W448 N451 R454 Y455 D459 F461	L434-T457 HydrophobicContact CD2-CG2 4.36Å; W448-T457 HydrophobicContact CB-CG2 3.75Å; W448-T457 HydrophobicContact CD2-CG2 3.76Å; W448-T457 HydrophobicContact CE3-CG2 4.23Å; W448-T457 HydrophobicContact CG-CG2 3.51Å; N451-T457 PolarHBondContact O-OG1 2.75Å; R454-T457 PolarHBondContact O-N 3.23Å; Y455-T457 PolarHBondContact O-N 3.39Å; T457-D459 VanDerWaalsContact C-N 3.34Å; T457-D459 PolarHBondContact O-N 2.84Å; T457-F461 VanDerWaalsContact O-CB 3.31Å; T457-F461 WeakPolarHBondContact O-CB 3.48Å; T457-F461 PolarHBondContact O-N 2.91Å
458	R	93.3	Very high	92.5	Very high	75 Å²	75	48.4 Å²	48.4	28%	0.283	23%	0.229	S	C	.	.	H	α-helix	trans	-56.1	-46.9	174.9	-176.6	-158.1	76.5	174.6	-6.7	111.9	M361 F364 R454 Y455 F461 S462	M361-R458 HydrophobicContact CE-CG 3.79Å; M361-R458 WeakPolarHBondContact CE-O 3.23Å; M361-R458 HydrophobicContact SD-CG 4.03Å; F364-R458 HydrophobicContact CB-CG 3.91Å; F364-R458 HydrophobicContact CD2-CG 4.15Å; F364-R458 HydrophobicContact CG-CB 4.43Å; F364-R458 HydrophobicContact CG-CG 4.04Å; F364-R458 PolarHBondContact O-NH1 2.85Å; R454-R458 PolarHBondContact O-N 2.96Å; R454-R458 VanDerWaalsContact O-N 3.1Å; Y455-R458 WeakPolarHBondContact O-CB 3.36Å; Y455-R458 PolarHBondContact O-N 3.38Å; R458-F461 PolarHBondContact O-N 3.39Å; R458-S462 WeakPolarHBondContact O-CB 3.5Å; R458-S462 PolarHBondContact O-N 3.34Å
459	D	92.5	Very high	92.6	Very high	65 Å²	65	50.4 Å²	50.4	35%	0.348	25%	0.247	S	C	.	.	H	α-helix	trans	-73.4	-38.7	-172.1	-69.2	-15.7	0	0	0	111.4	Y455 T457 S462 Q463	Y455-D459 WeakPolarHBondContact O-CB 3.4Å; Y455-D459 VanDerWaalsContact O-CG 3.24Å; Y455-D459 PolarHBondContact O-N 3.49Å; T457-D459 VanDerWaalsContact C-N 3.34Å; T457-D459 PolarHBondContact O-N 2.84Å; D459-S462 WeakPolarHBondContact O-CB 3.31Å; D459-S462 PolarHBondContact O-N 3.24Å; D459-Q463 PolarHBondContact O-N 2.9Å
460	Q	93.4	Very high	93	Very high	69 Å²	69	51.1 Å²	51.1	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-67.4	-39.3	171.3	-64.9	175.8	-0.7	0	0	111.9	H447 W448 E456 S462 Q463	H447-Q460 PolarHBondContact CE1-OE1 3.2Å; H447-Q460 PolarHBondContact NE2-OE1 3.38Å; W448-Q460 HydrophobicContact CZ2-CB 3.63Å; E456-Q460 WeakPolarHBondContact O-CG 3.29Å; E456-Q460 PolarHBondContact O-N 2.85Å; E456-Q460 VanDerWaalsContact O-N 3.16Å; Q460-S462 VanDerWaalsContact C-N 3.27Å; Q460-S462 PolarHBondContact O-N 3.05Å; Q460-Q463 WeakPolarHBondContact O-CB 3.25Å; Q460-Q463 PolarHBondContact O-N 2.97Å; Q460-Q463 VanDerWaalsContact O-N 3.14Å
461	F	95.6	Very high	93.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.6	-34.7	171.3	-169.2	-92.2	0	0	0	112	W328 A357 Y360 M361 I437 I441 W448 T457 R458 Q463 L464 F465	W328-F461 HydrophobicContact CH2-CZ 4.18Å; W328-F461 HydrophobicContact CZ3-CZ 4.25Å; A357-F461 HydrophobicContact CB-CE1 4.04Å; A357-F461 HydrophobicContact CB-CZ 3.78Å; Y360-F461 HydrophobicContact CD1-CD1 4.07Å; Y360-F461 HydrophobicContact CD1-CE1 4.23Å; Y360-F461 HydrophobicContact CD1-CG 4.4Å; Y360-F461 HydrophobicContact CE1-CB 4.31Å; Y360-F461 HydrophobicContact CE1-CD1 4.2Å; Y360-F461 HydrophobicContact CE1-CG 4.15Å; M361-F461 HydrophobicContact CE-CD1 4.3Å; M361-F461 HydrophobicContact CG-CD1 3.82Å; M361-F461 HydrophobicContact CG-CE1 3.95Å; M361-F461 HydrophobicContact SD-CB 4.46Å; M361-F461 HydrophobicContact SD-CD1 3.51Å; M361-F461 VanDerWaalsContact SD-CD1 3.51Å; M361-F461 HydrophobicContact SD-CE1 4.23Å; M361-F461 HydrophobicContact SD-CG 4.36Å; I437-F461 HydrophobicContact CD1-CZ 4.18Å; I437-F461 HydrophobicContact CG2-CE2 3.85Å; I437-F461 HydrophobicContact CG2-CZ 4.07Å; I441-F461 HydrophobicContact CD1-CE2 4.49Å; W448-F461 HydrophobicContact CE3-CD2 4.49Å; W448-F461 HydrophobicContact CH2-CB 4.15Å; W448-F461 HydrophobicContact CH2-CD2 4.04Å; W448-F461 HydrophobicContact CZ3-CB 4.33Å; W448-F461 AromaticContact CZ3-CD2 3.64Å; W448-F461 HydrophobicContact CZ3-CD2 3.64Å; W448-F461 HydrophobicContact CZ3-CG 4.49Å; T457-F461 VanDerWaalsContact O-CB 3.31Å; T457-F461 WeakPolarHBondContact O-CB 3.48Å; T457-F461 PolarHBondContact O-N 2.91Å; R458-F461 PolarHBondContact O-N 3.39Å; F461-Q463 PolarHBondContact O-N 3.32Å; F461-L464 WeakPolarHBondContact O-CA 3.2Å; F461-L464 WeakPolarHBondContact O-CB 3.38Å; F461-L464 PolarHBondContact O-N 3.08Å; F461-F465 HydrophobicContact CD1-CB 4Å; F461-F465 HydrophobicContact CE1-CB 3.57Å; F461-F465 AromaticContact CE1-CD1 3.89Å; F461-F465 HydrophobicContact CE1-CD1 3.89Å; F461-F465 HydrophobicContact CE1-CG 4.01Å; F461-F465 HydrophobicContact CZ-CB 4.22Å; F461-F465 PolarHBondContact O-N 2.89Å
462	S	94.4	Very high	93.6	Very high	31 Å²	31	49.8 Å²	49.8	22%	0.217	23%	0.233	C	C	.	.	H	α-helix	trans	-65.2	-18.4	175.8	-163.4	0	0	0	0	113.7	R326 R458 D459 Q460 F465 Q466	R326-S462 PolarHBondContact NH1-OG 3.38Å; R458-S462 WeakPolarHBondContact O-CB 3.5Å; R458-S462 PolarHBondContact O-N 3.34Å; D459-S462 WeakPolarHBondContact O-CB 3.31Å; D459-S462 PolarHBondContact O-N 3.24Å; Q460-S462 VanDerWaalsContact C-N 3.27Å; Q460-S462 PolarHBondContact O-N 3.05Å; S462-F465 CarbonylContact O-C 3.44Å; S462-Q466 WeakPolarHBondContact O-CA 3.13Å; S462-Q466 PolarHBondContact O-N 2.89Å
463	Q	94.4	Very high	93.7	Very high	46 Å²	46	54.3 Å²	54.3	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-75.5	-25	170.4	-59.3	171.9	-5.6	0	0	112	D235 V237 S329 D459 Q460 F461	D235-Q463 PolarHBondContact O-NE2 2.93Å; V237-Q463 HydrophobicContact CB-CB 4.48Å; V237-Q463 HydrophobicContact CG2-CB 3.97Å; V237-Q463 VanDerWaalsContact CG2-CD 3.48Å; V237-Q463 HydrophobicContact CG2-CG 3.84Å; S329-Q463 WeakPolarHBondContact CB-O 3.25Å; S329-Q463 PolarHBondContact OG-O 2.99Å; D459-Q463 PolarHBondContact O-N 2.9Å; Q460-Q463 WeakPolarHBondContact O-CB 3.25Å; Q460-Q463 PolarHBondContact O-N 2.97Å; Q460-Q463 VanDerWaalsContact O-N 3.14Å; F461-Q463 PolarHBondContact O-N 3.32Å
464	L	95.6	Very high	93.8	Very high	5 Å²	5	51 Å²	51	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-88.2	-33.3	173.6	-55	-178.1	0	0	0	112	W328 S329 Y331 Y335 L336 W448 F461	W328-L464 WeakPolarHBondContact CA-O 3.27Å; S329-L464 PolarHBondContact N-O 3.44Å; S329-L464 PolarHBondContact OG-O 3.04Å; Y331-L464 HydrophobicContact CD1-CD2 3.9Å; Y331-L464 HydrophobicContact CE1-CD2 3.66Å; Y335-L464 HydrophobicContact CD1-CD1 4.19Å; Y335-L464 HydrophobicContact CD1-CD2 3.6Å; Y335-L464 HydrophobicContact CE1-CD1 4.38Å; Y335-L464 HydrophobicContact CE1-CD2 4.38Å; Y335-L464 HydrophobicContact CG-CD2 4.16Å; L336-L464 HydrophobicContact CD2-CD1 4.19Å; W448-L464 HydrophobicContact CH2-CD1 3.79Å; W448-L464 HydrophobicContact CZ3-CD1 4.41Å; F461-L464 WeakPolarHBondContact O-CA 3.2Å; F461-L464 WeakPolarHBondContact O-CB 3.38Å; F461-L464 PolarHBondContact O-N 3.08Å
465	F	96.7	Very high	93.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	68.3	-171.8	-166.1	-119.4	0	0	0	111.6	R326 C327 W328 Y354 A357 M361 F461 S462	R326-F465 HydrophobicContact CB-CD1 3.75Å; R326-F465 HydrophobicContact CB-CD2 4.49Å; R326-F465 HydrophobicContact CB-CE1 3.39Å; R326-F465 HydrophobicContact CB-CE2 4.18Å; R326-F465 HydrophobicContact CB-CG 4.29Å; R326-F465 HydrophobicContact CB-CZ 3.63Å; R326-F465 HydrophobicContact CG-CD1 4.36Å; R326-F465 HydrophobicContact CG-CE1 4.24Å; R326-F465 PolarHBondContact NH1-O 3.11Å; C327-F465 CarbonylContact O-C 3.57Å; C327-F465 WeakPolarHBondContact O-CA 3.22Å; W328-F465 AromaticContact CD2-CD2 3.64Å; W328-F465 HydrophobicContact CD2-CD2 3.64Å; W328-F465 HydrophobicContact CD2-CE2 4.14Å; W328-F465 AromaticContact CE2-CD2 3.93Å; W328-F465 HydrophobicContact CE3-CB 4.16Å; W328-F465 AromaticContact CE3-CD2 3.72Å; W328-F465 HydrophobicContact CE3-CD2 3.72Å; W328-F465 HydrophobicContact CE3-CG 4.34Å; W328-F465 HydrophobicContact CG-CD2 4.13Å; W328-F465 HydrophobicContact CG-CE2 4.41Å; W328-F465 HydrophobicContact CH2-CD2 4.36Å; W328-F465 HydrophobicContact CZ2-CD2 4.3Å; W328-F465 HydrophobicContact CZ2-CE2 4.46Å; W328-F465 HydrophobicContact CZ3-CB 4.14Å; W328-F465 HydrophobicContact CZ3-CD2 4.08Å; W328-F465 HydrophobicContact CZ3-CG 4.38Å; Y354-F465 AromaticContact CD2-CE2 3.6Å; Y354-F465 HydrophobicContact CD2-CE2 3.6Å; Y354-F465 AromaticContact CD2-CZ 3.76Å; Y354-F465 HydrophobicContact CD2-CZ 3.76Å; Y354-F465 AromaticContact CE2-CE2 3.68Å; Y354-F465 HydrophobicContact CE2-CE2 3.68Å; Y354-F465 AromaticContact CE2-CZ 3.63Å; Y354-F465 HydrophobicContact CE2-CZ 3.63Å; A357-F465 HydrophobicContact CB-CD1 3.98Å; A357-F465 HydrophobicContact CB-CD2 4.45Å; A357-F465 HydrophobicContact CB-CE1 3.84Å; A357-F465 HydrophobicContact CB-CE2 4.35Å; A357-F465 HydrophobicContact CB-CG 4.29Å; A357-F465 HydrophobicContact CB-CZ 4.05Å; M361-F465 HydrophobicContact CG-CD1 4.07Å; F461-F465 HydrophobicContact CD1-CB 4Å; F461-F465 HydrophobicContact CE1-CB 3.57Å; F461-F465 AromaticContact CE1-CD1 3.89Å; F461-F465 HydrophobicContact CE1-CD1 3.89Å; F461-F465 HydrophobicContact CE1-CG 4.01Å; F461-F465 HydrophobicContact CZ-CB 4.22Å; F461-F465 PolarHBondContact O-N 2.89Å; S462-F465 CarbonylContact O-C 3.44Å
466	Q	95.1	Very high	94.2	Very high	15 Å²	15	42.2 Å²	42.2	7%	0.07	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	167.5	-172.5	70.7	-167.4	56.2	0	0	113.8	R326 C327 S462 F471 E474	R326-Q466 CarbonylContact C-O 3.58Å; R326-Q466 WeakPolarHBondContact CA-O 3.39Å; R326-Q466 WeakPolarHBondContact CB-O 3.48Å; C327-Q466 PolarHBondContact N-O 2.9Å; C327-Q466 PolarHBondContact O-N 3.4Å; C327-Q466 VanDerWaalsContact O-N 3.08Å; S462-Q466 WeakPolarHBondContact O-CA 3.13Å; S462-Q466 PolarHBondContact O-N 2.89Å; Q466-F471 VanDerWaalsContact NE2-CA 3.34Å; Q466-E474 PolarHBondContact NE2-OE2 2.9Å
467	Y	93.4	Very high	94.4	Very high	83 Å²	83	42.5 Å²	42.5	33%	0.325	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	145.1	173.1	-72.9	-70.2	0	0	0	112.1	G324 R326 A469 V470 F471	G324-Y467 WeakPolarHBondContact O-CD1 3.4Å; G324-Y467 VanDerWaalsContact O-CE1 3.28Å; G324-Y467 WeakPolarHBondContact O-CE1 3.33Å; R326-Y467 HydrophobicContact CG-CD1 3.74Å; R326-Y467 HydrophobicContact CG-CE1 3.95Å; R326-Y467 HydrophobicContact CG-CG 4.32Å; R326-Y467 PolarHBondContact NH2-OH 3.21Å; R326-Y467 VanDerWaalsContact NH2-OH 3.08Å; Y467-A469 VanDerWaalsContact C-N 3.29Å; Y467-A469 PolarHBondContact O-N 3.46Å; Y467-V470 WeakPolarHBondContact O-CB 3.49Å; Y467-V470 PolarHBondContact O-N 3.04Å; Y467-F471 PolarHBondContact O-N 3.26Å
468	K	93.2	Very high	94.5	Very high	56 Å²	56	42.6 Å²	42.6	24%	0.243	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-37.9	174.3	-173	-174.2	176.7	-171.3	0	111.7	S322 L323 A325 V470 F471 I472	S322-K468 WeakPolarHBondContact O-CD 3.47Å; L323-K468 HydrophobicContact CD2-CD 4.03Å; L323-K468 HydrophobicContact CD2-CG 4.34Å; A325-K468 WeakPolarHBondContact O-CB 3.31Å; A325-K468 PolarHBondContact O-N 3.01Å; K468-V470 VanDerWaalsContact C-N 3.33Å; K468-V470 PolarHBondContact O-N 3.39Å; K468-F471 PolarHBondContact O-N 2.81Å; K468-I472 HydrophobicContact CG-CD1 4.29Å; K468-I472 WeakPolarHBondContact O-CG1 3.38Å; K468-I472 PolarHBondContact O-N 2.99Å
469	A	92	Very high	94.6	Very high	47 Å²	47	39.5 Å²	39.5	39%	0.388	21%	0.206	S	C	.	.	H	α-helix	trans	-58.4	-41.6	171.3	0	0	0	0	0	113.1	L323 Y467 I472 L473	L323-A469 HydrophobicContact CB-CB 4.36Å; L323-A469 PolarHBondContact O-N 3.49Å; L323-A469 VanDerWaalsContact O-N 3.12Å; Y467-A469 VanDerWaalsContact C-N 3.29Å; Y467-A469 PolarHBondContact O-N 3.46Å; A469-I472 PolarHBondContact O-N 2.67Å; A469-L473 PolarHBondContact O-N 3.1Å
470	V	93.5	Very high	94.8	Very high	57 Å²	57	39.4 Å²	39.4	35%	0.345	21%	0.207	S	C	.	.	H	α-helix	trans	-68.6	-42.1	177.9	171.8	0	0	0	0	110.9	Y467 K468 I472 L473 E474	Y467-V470 WeakPolarHBondContact O-CB 3.49Å; Y467-V470 PolarHBondContact O-N 3.04Å; K468-V470 VanDerWaalsContact C-N 3.33Å; K468-V470 PolarHBondContact O-N 3.39Å; V470-I472 VanDerWaalsContact C-N 3.32Å; V470-I472 PolarHBondContact O-N 3.05Å; V470-L473 PolarHBondContact O-N 3.36Å; V470-E474 HydrophobicContact CG1-CG 4.33Å; V470-E474 VanDerWaalsContact CG1-OE1 3.29Å; V470-E474 WeakPolarHBondContact CG1-OE1 3.42Å; V470-E474 WeakPolarHBondContact O-CB 3.44Å; V470-E474 WeakPolarHBondContact O-CG 3.39Å; V470-E474 PolarHBondContact O-N 2.96Å
471	F	94.4	Very high	94.9	Very high	35 Å²	35	38.1 Å²	38.1	15%	0.154	20%	0.204	C	C	.	.	H	α-helix	trans	-56.7	-42.4	172.7	172.4	-102.7	0	0	0	113	Q466 Y467 K468 E474 E475	Q466-F471 VanDerWaalsContact NE2-CA 3.34Å; Y467-F471 PolarHBondContact O-N 3.26Å; K468-F471 PolarHBondContact O-N 2.81Å; F471-E474 PolarHBondContact O-N 3.42Å; F471-E475 HydrophobicContact CD2-CG 4.37Å; F471-E475 HydrophobicContact CE1-CG 4.3Å; F471-E475 HydrophobicContact CE2-CG 3.73Å; F471-E475 HydrophobicContact CZ-CG 3.68Å; F471-E475 PolarHBondContact O-N 3.46Å
472	I	93.8	Very high	95	Very high	28 Å²	28	38.2 Å²	38.2	14%	0.144	21%	0.205	C	C	.	.	H	α-helix	trans	-66.9	-41.5	177.4	-64.8	162.9	0	0	0	110.8	Y312 L323 K468 A469 V470 E475 L476	Y312-I472 HydrophobicContact CD1-CD1 3.87Å; Y312-I472 HydrophobicContact CD2-CD1 3.82Å; Y312-I472 HydrophobicContact CD2-CG1 4.17Å; Y312-I472 HydrophobicContact CD2-CG2 4.03Å; Y312-I472 HydrophobicContact CE1-CD1 3.81Å; Y312-I472 HydrophobicContact CE1-CG1 4.36Å; Y312-I472 HydrophobicContact CE2-CB 4.49Å; Y312-I472 HydrophobicContact CE2-CD1 3.74Å; Y312-I472 HydrophobicContact CE2-CG1 3.68Å; Y312-I472 HydrophobicContact CE2-CG2 4Å; Y312-I472 HydrophobicContact CG-CD1 3.9Å; L323-I472 HydrophobicContact CD2-CD1 3.79Å; K468-I472 HydrophobicContact CG-CD1 4.29Å; K468-I472 WeakPolarHBondContact O-CG1 3.38Å; K468-I472 PolarHBondContact O-N 2.99Å; A469-I472 PolarHBondContact O-N 2.67Å; V470-I472 VanDerWaalsContact C-N 3.32Å; V470-I472 PolarHBondContact O-N 3.05Å; I472-E475 PolarHBondContact O-N 2.91Å; I472-L476 VanDerWaalsContact O-CB 3.32Å; I472-L476 WeakPolarHBondContact O-CB 3.47Å; I472-L476 PolarHBondContact O-N 2.9Å
473	L	94.3	Very high	95.1	Very high	94 Å²	94	36.8 Å²	36.8	49%	0.492	20%	0.195	S	C	.	.	H	α-helix	trans	-64.5	-39.9	176.4	-178.6	61.2	0	0	0	112.3	A469 V470 L476 L477	A469-L473 PolarHBondContact O-N 3.1Å; V470-L473 PolarHBondContact O-N 3.36Å; L473-L476 PolarHBondContact O-N 3.36Å; L473-L477 HydrophobicContact CD1-CD1 4.07Å; L473-L477 HydrophobicContact CD1-CG 4.24Å; L473-L477 HydrophobicContact CG-CD1 4.01Å; L473-L477 WeakPolarHBondContact O-CB 3.46Å; L473-L477 VanDerWaalsContact O-CG 3.29Å; L473-L477 WeakPolarHBondContact O-CG 3.32Å; L473-L477 PolarHBondContact O-N 3.46Å
474	E	94.8	Very high	95.2	Very high	32 Å²	32	38.7 Å²	38.7	15%	0.15	21%	0.206	C	C	.	.	H	α-helix	trans	-64.1	-46.5	175.8	-75.6	169.7	-172.2	0	0	112.1	F238 T240 Q466 V470 F471 L476 L477 S478	F238-E474 HydrophobicContact CD2-CG 4.35Å; F238-E474 HydrophobicContact CE2-CB 4.23Å; F238-E474 HydrophobicContact CE2-CG 4.26Å; T240-E474 HydrophobicContact CG2-CB 4.1Å; T240-E474 WeakPolarHBondContact CG2-O 3.49Å; Q466-E474 PolarHBondContact NE2-OE2 2.9Å; V470-E474 HydrophobicContact CG1-CG 4.33Å; V470-E474 VanDerWaalsContact CG1-OE1 3.29Å; V470-E474 WeakPolarHBondContact CG1-OE1 3.42Å; V470-E474 WeakPolarHBondContact O-CB 3.44Å; V470-E474 WeakPolarHBondContact O-CG 3.39Å; V470-E474 PolarHBondContact O-N 2.96Å; F471-E474 PolarHBondContact O-N 3.42Å; E474-L476 VanDerWaalsContact C-N 3.28Å; E474-L476 PolarHBondContact O-N 3.19Å; E474-L477 PolarHBondContact O-N 2.65Å; E474-S478 WeakPolarHBondContact O-CB 3.16Å; E474-S478 PolarHBondContact O-N 2.97Å
475	E	95.6	Very high	95.3	Very high	19 Å²	19	38.8 Å²	38.8	9%	0.089	21%	0.206	C	C	.	.	H	α-helix	trans	-66.9	-29.1	176.1	-68.1	-66.3	175.1	0	0	112.5	R241 F471 I472 S478	R241-E475 WeakPolarHBondContact CB-OE1 3.39Å; R241-E475 WeakPolarHBondContact CG-OE1 3.39Å; R241-E475 PolarHBondContact N-OE1 3.48Å; R241-E475 PolarHBondContact N-OE2 3.27Å; F471-E475 HydrophobicContact CD2-CG 4.37Å; F471-E475 HydrophobicContact CE1-CG 4.3Å; F471-E475 HydrophobicContact CE2-CG 3.73Å; F471-E475 HydrophobicContact CZ-CG 3.68Å; F471-E475 PolarHBondContact O-N 3.46Å; I472-E475 PolarHBondContact O-N 2.91Å; E475-S478 WeakPolarHBondContact O-CB 3.14Å
476	L	95.6	Very high	95.3	Very high	54 Å²	54	38.8 Å²	38.8	28%	0.283	21%	0.206	S	C	.	.	H	α-helix	trans	-72.3	-38.2	173.3	-178.6	61	0	0	0	112.7	L301 Q304 I305 I472 L473 E474 S478 P479	L301-L476 HydrophobicContact CD1-CD1 4.13Å; L301-L476 WeakPolarHBondContact CD1-O 3.44Å; Q304-L476 HydrophobicContact CB-CD1 4.19Å; I305-L476 HydrophobicContact CG1-CD1 3.65Å; I472-L476 VanDerWaalsContact O-CB 3.32Å; I472-L476 WeakPolarHBondContact O-CB 3.47Å; I472-L476 PolarHBondContact O-N 2.9Å; L473-L476 PolarHBondContact O-N 3.36Å; E474-L476 VanDerWaalsContact C-N 3.28Å; E474-L476 PolarHBondContact O-N 3.19Å; L476-S478 VanDerWaalsContact C-N 3.33Å; L476-P479 WeakPolarHBondContact O-CD 3.24Å
477	L	95.4	Very high	95.3	Very high	80 Å²	80	39.3 Å²	39.3	42%	0.419	21%	0.209	S	C	.	.	H	α-helix	trans	-78.2	-18.6	174.4	-68.1	172.3	0	0	0	112.9	L473 E474 V480 V481	L473-L477 HydrophobicContact CD1-CD1 4.07Å; L473-L477 HydrophobicContact CD1-CG 4.24Å; L473-L477 HydrophobicContact CG-CD1 4.01Å; L473-L477 WeakPolarHBondContact O-CB 3.46Å; L473-L477 VanDerWaalsContact O-CG 3.29Å; L473-L477 WeakPolarHBondContact O-CG 3.32Å; L473-L477 PolarHBondContact O-N 3.46Å; E474-L477 PolarHBondContact O-N 2.65Å; L477-V480 PolarHBondContact O-N 3.3Å; L477-V481 HydrophobicContact CB-CG2 4.23Å; L477-V481 WeakPolarHBondContact O-CG2 3.01Å; L477-V481 PolarHBondContact O-N 3.24Å
478	S	96.9	Very high	95.5	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.028	22%	0.219	C	C	.	.	H	α-helix	trans	-43.5	-46.6	179.5	-166.1	0	0	0	0	115	T240 E474 E475 L476 V480 T482	T240-S478 VanDerWaalsContact CB-OG 3.31Å; T240-S478 WeakPolarHBondContact CB-OG 3.32Å; T240-S478 PolarHBondContact OG1-OG 3.18Å; E474-S478 WeakPolarHBondContact O-CB 3.16Å; E474-S478 PolarHBondContact O-N 2.97Å; E475-S478 WeakPolarHBondContact O-CB 3.14Å; L476-S478 VanDerWaalsContact C-N 3.33Å; S478-V480 VanDerWaalsContact C-N 3.3Å; S478-V480 PolarHBondContact O-N 3.18Å; S478-T482 WeakPolarHBondContact O-CB 3.46Å; S478-T482 PolarHBondContact O-N 3.02Å; S478-T482 PolarHBondContact O-OG1 2.88Å
479	P	96.6	Very high	95.6	Very high	10 Å²	10	40.5 Å²	40.5	7%	0.065	22%	0.221	C	C	.	.	H	α-helix	trans	-67.2	-31.5	-177.3	-19.4	35	0	0	0	113	C297 I300 L301 Q304 L476 P483	C297-P479 PolarHBondContact SG-O 3Å; I300-P479 HydrophobicContact CB-CB 4.13Å; I300-P479 HydrophobicContact CB-CG 4.35Å; I300-P479 HydrophobicContact CG2-CB 3.95Å; I300-P479 HydrophobicContact CG2-CG 3.73Å; L301-P479 HydrophobicContact CB-CB 4.37Å; L301-P479 HydrophobicContact CB-CG 4.44Å; L301-P479 HydrophobicContact CD1-CG 4.47Å; Q304-P479 HydrophobicContact CG-CG 4.09Å; L476-P479 WeakPolarHBondContact O-CD 3.24Å; P479-P483 WeakPolarHBondContact O-CD 3.32Å; P479-P483 WeakPolarHBondContact O-CG 3.41Å
480	V	96.4	Very high	95.8	Very high	62 Å²	62	38.3 Å²	38.3	38%	0.376	20%	0.203	S	C	.	.	H	α-helix	trans	-83	-43	-178.7	-175.2	0	0	0	0	110.9	L301 L477 S478 P483 I484	L301-V480 HydrophobicContact CD2-CG2 4.25Å; L477-V480 PolarHBondContact O-N 3.3Å; S478-V480 VanDerWaalsContact C-N 3.3Å; S478-V480 PolarHBondContact O-N 3.18Å; V480-P483 WeakPolarHBondContact O-CG 3.45Å; V480-I484 WeakPolarHBondContact O-CD1 3.5Å
481	V	96.2	Very high	95.9	Very high	42 Å²	42	40.4 Å²	40.4	26%	0.255	20%	0.204	S	C	.	.	H	α-helix	trans	-81.2	-34.3	-173.6	179.2	0	0	0	0	112.3	F238 L477 I484 I485	F238-V481 HydrophobicContact CD1-CG1 3.84Å; F238-V481 HydrophobicContact CE1-CB 3.82Å; F238-V481 HydrophobicContact CE1-CG1 3.55Å; F238-V481 HydrophobicContact CE2-CB 4.48Å; F238-V481 HydrophobicContact CE2-CG1 4.36Å; F238-V481 HydrophobicContact CG-CG1 4.36Å; F238-V481 HydrophobicContact CZ-CB 3.75Å; F238-V481 HydrophobicContact CZ-CG1 3.84Å; F238-V481 HydrophobicContact CZ-CG2 4.27Å; L477-V481 HydrophobicContact CB-CG2 4.23Å; L477-V481 WeakPolarHBondContact O-CG2 3.01Å; L477-V481 PolarHBondContact O-N 3.24Å; V481-I484 WeakPolarHBondContact O-CB 3.14Å; V481-I484 PolarHBondContact O-N 2.96Å; V481-I485 HydrophobicContact CG1-CD1 3.69Å; V481-I485 HydrophobicContact CG1-CG1 4.1Å; V481-I485 PolarHBondContact O-N 2.85Å
482	T	97	Very high	96	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-54.4	-53.6	-179.9	-64.2	0	0	0	0	113.9	L243 N246 S478 I484 I485 L486	L243-T482 HydrophobicContact CD1-CG2 4.02Å; N246-T482 HydrophobicContact CB-CG2 4.43Å; S478-T482 WeakPolarHBondContact O-CB 3.46Å; S478-T482 PolarHBondContact O-N 3.02Å; S478-T482 PolarHBondContact O-OG1 2.88Å; T482-I484 VanDerWaalsContact C-N 3.25Å; T482-I484 PolarHBondContact O-N 3.27Å; T482-I485 PolarHBondContact O-N 2.96Å; T482-L486 HydrophobicContact CG2-CD1 3.92Å; T482-L486 HydrophobicContact CG2-CG 4.26Å; T482-L486 WeakPolarHBondContact O-CG 3.23Å; T482-L486 PolarHBondContact O-N 2.71Å
483	P	97	Very high	96	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-61.1	-33.4	180	22.9	-33.3	0	0	0	112.8	G290 N293 L294 P479 V480 L486 I487	G290-P483 WeakPolarHBondContact O-CB 3.44Å; N293-P483 HydrophobicContact CB-CB 4.05Å; L294-P483 HydrophobicContact CB-CB 3.97Å; L294-P483 HydrophobicContact CB-CG 4.41Å; L294-P483 HydrophobicContact CD1-CB 4.46Å; L294-P483 HydrophobicContact CD1-CG 4.23Å; P479-P483 WeakPolarHBondContact O-CD 3.32Å; P479-P483 WeakPolarHBondContact O-CG 3.41Å; V480-P483 WeakPolarHBondContact O-CG 3.45Å; P483-L486 PolarHBondContact O-N 3.41Å; P483-I487 WeakPolarHBondContact O-CB 3.43Å; P483-I487 VanDerWaalsContact O-CG1 3.23Å; P483-I487 WeakPolarHBondContact O-CG1 3.23Å; P483-I487 PolarHBondContact O-N 3.06Å
484	I	96.1	Very high	96.1	Very high	87 Å²	87	45.7 Å²	45.7	45%	0.446	22%	0.218	S	C	.	.	H	α-helix	trans	-64.2	-48	176.1	-57	174.1	0	0	0	110.2	V480 V481 T482 L486 F488	V480-I484 WeakPolarHBondContact O-CD1 3.5Å; V481-I484 WeakPolarHBondContact O-CB 3.14Å; V481-I484 PolarHBondContact O-N 2.96Å; T482-I484 VanDerWaalsContact C-N 3.25Å; T482-I484 PolarHBondContact O-N 3.27Å; I484-L486 PolarHBondContact O-N 3.47Å; I484-F488 HydrophobicContact CG2-CD2 3.86Å; I484-F488 HydrophobicContact CG2-CE2 4.42Å; I484-F488 WeakPolarHBondContact O-CB 3.39Å; I484-F488 WeakPolarHBondContact O-CD2 3.14Å; I484-F488 PolarHBondContact O-N 2.95Å
485	I	96.4	Very high	96.2	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.031	23%	0.225	C	C	.	.	I	π-helix	trans	-61.5	-43	177.1	-67.3	174.9	0	0	0	111.2	P225 F228 F238 L243 V481 T482 C489 L490	P225-I485 HydrophobicContact CG-CG2 4.03Å; F228-I485 HydrophobicContact CE1-CG1 4.35Å; F228-I485 HydrophobicContact CE2-CD1 3.69Å; F228-I485 HydrophobicContact CE2-CG1 4.28Å; F228-I485 HydrophobicContact CZ-CD1 3.61Å; F228-I485 HydrophobicContact CZ-CG1 3.69Å; F228-I485 HydrophobicContact CZ-CG2 4.09Å; F238-I485 HydrophobicContact CD1-CD1 3.57Å; F238-I485 HydrophobicContact CE1-CD1 4.17Å; F238-I485 HydrophobicContact CG-CD1 4.42Å; L243-I485 HydrophobicContact CD1-CB 4.37Å; L243-I485 HydrophobicContact CD1-CG2 3.99Å; L243-I485 HydrophobicContact CD2-CD1 3.97Å; L243-I485 HydrophobicContact CD2-CG2 4.25Å; V481-I485 HydrophobicContact CG1-CD1 3.69Å; V481-I485 HydrophobicContact CG1-CG1 4.1Å; V481-I485 PolarHBondContact O-N 2.85Å; T482-I485 PolarHBondContact O-N 2.96Å; I485-C489 HydrophobicContact CG2-CB 4.38Å; I485-C489 CarbonylContact O-C 3.56Å; I485-C489 WeakPolarHBondContact O-CA 3.08Å; I485-C489 VanDerWaalsContact O-CB 3.25Å; I485-C489 WeakPolarHBondContact O-CB 3.29Å; I485-C489 PolarHBondContact O-N 2.93Å; I485-L490 PolarHBondContact O-N 3.41Å
486	L	96.8	Very high	96.2	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-63.6	-52.5	179.4	-66.1	177.2	0	0	0	111.9	L243 N246 F247 I250 I286 I289 T482 P483 I484 L490 R491	L243-L486 HydrophobicContact CD1-CD2 4.24Å; N246-L486 HydrophobicContact CB-CD1 3.97Å; N246-L486 HydrophobicContact CB-CD2 4.4Å; F247-L486 HydrophobicContact CD1-CD2 4.2Å; F247-L486 HydrophobicContact CE1-CD2 3.98Å; I250-L486 HydrophobicContact CD1-CD2 3.68Å; I286-L486 HydrophobicContact CG2-CB 4.46Å; I286-L486 VanDerWaalsContact CG2-O 3.22Å; I286-L486 WeakPolarHBondContact CG2-O 3.41Å; I289-L486 HydrophobicContact CG2-CD1 4.42Å; T482-L486 HydrophobicContact CG2-CD1 3.92Å; T482-L486 HydrophobicContact CG2-CG 4.26Å; T482-L486 WeakPolarHBondContact O-CG 3.23Å; T482-L486 PolarHBondContact O-N 2.71Å; P483-L486 PolarHBondContact O-N 3.41Å; I484-L486 PolarHBondContact O-N 3.47Å; L486-L490 HydrophobicContact CD2-CB 4.5Å; L486-L490 HydrophobicContact CD2-CD2 3.74Å; L486-R491 PolarHBondContact O-N 2.84Å
487	I	96.8	Very high	96.2	Very high	27 Å²	27	47.4 Å²	47.4	14%	0.138	23%	0.226	C	C	.	.	I	π-helix	trans	-68.8	-44.2	-173.7	-66.3	170.2	0	0	0	112	L287 I291 P483 R491	L287-I487 HydrophobicContact CD1-CG1 4.37Å; L287-I487 HydrophobicContact CD1-CG2 4.07Å; I291-I487 HydrophobicContact CG1-CD1 4.46Å; P483-I487 WeakPolarHBondContact O-CB 3.43Å; P483-I487 VanDerWaalsContact O-CG1 3.23Å; P483-I487 WeakPolarHBondContact O-CG1 3.23Å; P483-I487 PolarHBondContact O-N 3.06Å; I487-R491 WeakPolarHBondContact O-CB 3.29Å
488	F	96	Very high	96.2	Very high	121 Å²	121	43.7 Å²	43.7	53%	0.531	21%	0.206	S	C	.	.	I	π-helix	trans	-99.7	-29.8	-170.1	-62	-70.7	0	0	0	114.4	I484 R492	I484-F488 HydrophobicContact CG2-CD2 3.86Å; I484-F488 HydrophobicContact CG2-CE2 4.42Å; I484-F488 WeakPolarHBondContact O-CB 3.39Å; I484-F488 WeakPolarHBondContact O-CD2 3.14Å; I484-F488 PolarHBondContact O-N 2.95Å; F488-R492 VanDerWaalsContact O-CD 3.29Å; F488-R492 WeakPolarHBondContact O-CD 3.33Å; F488-R492 WeakPolarHBondContact O-CG 3.3Å; F488-R492 PolarHBondContact O-NE 3.11Å
489	C	95.6	Very high	96.1	Very high	43 Å²	43	44.5 Å²	44.5	29%	0.291	21%	0.211	S	C	.	.	I	π-helix	trans	-104.9	-57.6	-174.5	-53.6	0	0	0	0	111.8	P225 I485 R491 R492	P225-C489 HydrophobicContact CB-CB 3.83Å; P225-C489 HydrophobicContact CG-CB 3.97Å; I485-C489 HydrophobicContact CG2-CB 4.38Å; I485-C489 CarbonylContact O-C 3.56Å; I485-C489 WeakPolarHBondContact O-CA 3.08Å; I485-C489 VanDerWaalsContact O-CB 3.25Å; I485-C489 WeakPolarHBondContact O-CB 3.29Å; I485-C489 PolarHBondContact O-N 2.93Å; C489-R491 PolarHBondContact O-N 3.46Å; C489-R492 PolarHBondContact O-N 2.87Å
490	L	96.2	Very high	96.1	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-64.5	-43	-176	-171.1	75.4	0	0	0	111.6	L224 P225 F247 I250 F251 I286 I485 L486 R492 K493 I497	L224-L490 HydrophobicContact CD2-CD1 4.29Å; P225-L490 HydrophobicContact CG-CB 4.11Å; P225-L490 HydrophobicContact CG-CD1 4.06Å; F247-L490 HydrophobicContact CD1-CD1 4.42Å; F247-L490 HydrophobicContact CD1-CD2 3.95Å; F247-L490 HydrophobicContact CE1-CD1 3.91Å; F247-L490 HydrophobicContact CE1-CD2 3.87Å; F247-L490 HydrophobicContact CE1-CG 4.37Å; I250-L490 HydrophobicContact CD1-CD2 3.86Å; F251-L490 HydrophobicContact CZ-CD1 4.3Å; F251-L490 HydrophobicContact CZ-CD2 4.27Å; I286-L490 HydrophobicContact CD1-CD2 3.98Å; I286-L490 HydrophobicContact CD1-CG 4.1Å; I286-L490 HydrophobicContact CG1-CD2 4.1Å; I286-L490 HydrophobicContact CG2-CB 4.35Å; I286-L490 HydrophobicContact CG2-CD2 4.09Å; I286-L490 HydrophobicContact CG2-CG 4.48Å; I485-L490 PolarHBondContact O-N 3.41Å; L486-L490 HydrophobicContact CD2-CB 4.5Å; L486-L490 HydrophobicContact CD2-CD2 3.74Å; L490-R492 PolarHBondContact O-N 2.88Å; L490-R492 VanDerWaalsContact O-N 3.11Å; L490-K493 PolarHBondContact O-N 3.37Å; L490-I497 HydrophobicContact CD1-CD1 3.96Å
491	R	95.9	Very high	96	Very high	102 Å²	102	41 Å²	41	39%	0.385	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-52.7	-34.4	179.2	-172.9	-179.9	173.8	-160.5	-3.2	113.3	A283 I286 L486 I487 C489 K493	A283-R491 HydrophobicContact CB-CG 3.85Å; I286-R491 HydrophobicContact CG2-CB 4.05Å; L486-R491 PolarHBondContact O-N 2.84Å; I487-R491 WeakPolarHBondContact O-CB 3.29Å; C489-R491 PolarHBondContact O-N 3.46Å; R491-K493 VanDerWaalsContact C-N 3.29Å; R491-K493 PolarHBondContact O-N 3.39Å
492	R	95.6	Very high	95.9	Very high	206 Å²	206	41.8 Å²	41.8	78%	0.777	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-72.3	-21.2	-179.6	-62.3	-177	-172.8	-166.9	0.3	113.4	F488 C489 L490	F488-R492 VanDerWaalsContact O-CD 3.29Å; F488-R492 WeakPolarHBondContact O-CD 3.33Å; F488-R492 WeakPolarHBondContact O-CG 3.3Å; F488-R492 PolarHBondContact O-NE 3.11Å; C489-R492 PolarHBondContact O-N 2.87Å; L490-R492 PolarHBondContact O-N 2.88Å; L490-R492 VanDerWaalsContact O-N 3.11Å
493	K	95.8	Very high	95.8	Very high	50 Å²	50	45.4 Å²	45.4	22%	0.217	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-95.9	9.3	179.7	-72.9	-165.8	159.8	-121.1	0	113.8	S222 L223 L490 R491 L495 E496 I497	S222-K493 PolarHBondContact O-NZ 3.34Å; S222-K493 VanDerWaalsContact O-NZ 3.15Å; L223-K493 WeakPolarHBondContact O-CD 3.46Å; L490-K493 PolarHBondContact O-N 3.37Å; R491-K493 VanDerWaalsContact C-N 3.29Å; R491-K493 PolarHBondContact O-N 3.39Å; K493-L495 VanDerWaalsContact C-N 3.28Å; K493-L495 PolarHBondContact O-N 3.47Å; K493-E496 WeakPolarHBondContact CD-OE2 3.36Å; K493-E496 WeakPolarHBondContact CE-OE2 3.47Å; K493-E496 IonicContact NZ-OE1 2.92Å; K493-E496 IonicContact NZ-OE2 3.23Å; K493-E496 PolarHBondContact NZ-OE2 3.1Å; K493-E496 PolarHBondContact O-N 3.18Å; K493-E496 VanDerWaalsContact O-N 3.14Å; K493-I497 HydrophobicContact CB-CD1 4.23Å; K493-I497 WeakPolarHBondContact O-CG1 3.5Å; K493-I497 PolarHBondContact O-N 3.39Å
494	S	95.6	Very high	95.7	Very high	11 Å²	11	45.6 Å²	45.6	8%	0.077	21%	0.208	C	C	.	.	H	α-helix	trans	-55.7	-41.4	-176.8	64.2	0	0	0	0	112.7	A279 I497 I498	A279-S494 VanDerWaalsContact O-CB 3.25Å; A279-S494 WeakPolarHBondContact O-CB 3.34Å; A279-S494 PolarHBondContact O-OG 3Å; S494-I497 PolarHBondContact O-N 2.93Å; S494-I498 WeakPolarHBondContact O-CG1 3.09Å; S494-I498 PolarHBondContact O-N 3.43Å
495	L	95.9	Very high	95.6	Very high	57 Å²	57	42.6 Å²	42.6	30%	0.298	19%	0.193	S	C	.	.	H	α-helix	trans	-64.7	-43.5	177.5	-176.7	60.7	0	0	0	112.7	R275 L276 A279 K493 I497 I498 D499	R275-L495 HydrophobicContact CG-CD1 4.38Å; L276-L495 HydrophobicContact CD2-CD1 4.13Å; L276-L495 HydrophobicContact CD2-CD2 4.12Å; A279-L495 HydrophobicContact CB-CB 4.01Å; A279-L495 HydrophobicContact CB-CD1 3.99Å; K493-L495 VanDerWaalsContact C-N 3.28Å; K493-L495 PolarHBondContact O-N 3.47Å; L495-I497 PolarHBondContact O-N 2.94Å; L495-I498 PolarHBondContact O-N 3.38Å; L495-D499 WeakPolarHBondContact O-CB 3.47Å; L495-D499 PolarHBondContact O-N 2.64Å
496	E	95.4	Very high	95.5	Very high	84 Å²	84	44.7 Å²	44.7	39%	0.393	21%	0.206	S	C	.	.	H	α-helix	trans	-59.2	-38.6	174.7	-62.8	173.8	-152.2	0	0	111.3	L223 K493 F500	L223-E496 HydrophobicContact CD2-CB 4.12Å; K493-E496 WeakPolarHBondContact CD-OE2 3.36Å; K493-E496 WeakPolarHBondContact CE-OE2 3.47Å; K493-E496 IonicContact NZ-OE1 2.92Å; K493-E496 IonicContact NZ-OE2 3.23Å; K493-E496 PolarHBondContact NZ-OE2 3.1Å; K493-E496 PolarHBondContact O-N 3.18Å; K493-E496 VanDerWaalsContact O-N 3.14Å; E496-F500 VanDerWaalsContact O-CB 3.29Å; E496-F500 WeakPolarHBondContact O-CB 3.41Å; E496-F500 PolarHBondContact O-N 3.44Å
497	I	96.3	Very high	95.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-71.9	-41.5	179.8	-65.3	162.3	0	0	0	111.3	F251 L282 L490 K493 S494 L495 F500 F501	F251-I497 HydrophobicContact CD1-CG2 4.21Å; F251-I497 HydrophobicContact CE1-CD1 4.16Å; F251-I497 HydrophobicContact CE1-CG2 3.76Å; F251-I497 HydrophobicContact CZ-CD1 4.03Å; F251-I497 HydrophobicContact CZ-CG2 4.39Å; L282-I497 HydrophobicContact CD2-CB 4.3Å; L282-I497 HydrophobicContact CD2-CG2 3.99Å; L490-I497 HydrophobicContact CD1-CD1 3.96Å; K493-I497 HydrophobicContact CB-CD1 4.23Å; K493-I497 WeakPolarHBondContact O-CG1 3.5Å; K493-I497 PolarHBondContact O-N 3.39Å; S494-I497 PolarHBondContact O-N 2.93Å; L495-I497 PolarHBondContact O-N 2.94Å; I497-F500 PolarHBondContact O-N 3.01Å; I497-F501 HydrophobicContact CG2-CD2 3.81Å; I497-F501 HydrophobicContact CG2-CE2 3.91Å; I497-F501 WeakPolarHBondContact O-CD2 3.29Å; I497-F501 PolarHBondContact O-N 3.3Å
498	I	95.9	Very high	95.1	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-65.3	-44.7	174.4	-65.7	-49.3	0	0	0	111.1	L258 Y269 R275 L278 A279 L282 S494 L495 F500 F501 R502	L258-I498 HydrophobicContact CD2-CD1 3.97Å; Y269-I498 HydrophobicContact CD1-CD1 3.78Å; Y269-I498 HydrophobicContact CE1-CD1 3.64Å; R275-I498 HydrophobicContact CB-CG2 4.48Å; L278-I498 HydrophobicContact CB-CG1 4.48Å; L278-I498 HydrophobicContact CB-CG2 4.2Å; A279-I498 HydrophobicContact CB-CG1 4.21Å; L282-I498 HydrophobicContact CB-CD1 4.26Å; L282-I498 HydrophobicContact CD2-CD1 3.59Å; L282-I498 HydrophobicContact CD2-CG1 4Å; S494-I498 WeakPolarHBondContact O-CG1 3.09Å; S494-I498 PolarHBondContact O-N 3.43Å; L495-I498 PolarHBondContact O-N 3.38Å; I498-F500 VanDerWaalsContact C-N 3.29Å; I498-F500 PolarHBondContact O-N 2.89Å; I498-F501 PolarHBondContact O-N 3.2Å; I498-R502 PolarHBondContact O-N 3.42Å
499	D	94.8	Very high	94.6	Very high	21 Å²	21	52.2 Å²	52.2	11%	0.112	25%	0.248	C	C	.	.	H	α-helix	trans	-64.1	-34.3	176.1	-78	-29.7	0	0	0	111.5	R275 L495 R502 N503	R275-D499 WeakPolarHBondContact CD-OD1 3.31Å; R275-D499 IonicContact CZ-OD2 3.83Å; R275-D499 IonicContact NH1-OD1 2.68Å; R275-D499 IonicContact NH1-OD2 3.35Å; R275-D499 PolarHBondContact NH1-OD2 3.5Å; L495-D499 WeakPolarHBondContact O-CB 3.47Å; L495-D499 PolarHBondContact O-N 2.64Å; D499-R502 IonicContact OD1-CZ 3.25Å; D499-R502 IonicContact OD1-NH1 3.53Å; D499-R502 PolarHBondContact OD1-NH1 2.03Å; D499-R502 IonicContact OD1-NH2 3.78Å; D499-R502 PolarHBondContact OD1-NH2 2.84Å; D499-N503 WeakPolarHBondContact O-CB 3.12Å; D499-N503 PolarHBondContact O-N 3.47Å; D499-N503 PolarHBondContact O-ND2 2.89Å; D499-N503 PolarHBondContact O-OD1 2.83Å
500	F	95.8	Very high	94	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-52	171.3	168	-91.8	0	0	0	112.7	Y214 A217 M218 L223 E496 I497 I498 R502 N503 F504 F517	Y214-F500 HydrophobicContact CD1-CE1 4.11Å; Y214-F500 HydrophobicContact CD1-CZ 4.42Å; A217-F500 HydrophobicContact CB-CE2 4.13Å; A217-F500 HydrophobicContact CB-CZ 3.83Å; M218-F500 HydrophobicContact CG-CD1 3.95Å; M218-F500 HydrophobicContact CG-CE1 3.41Å; M218-F500 VanDerWaalsContact CG-CE1 3.41Å; M218-F500 HydrophobicContact CG-CE2 4.37Å; M218-F500 HydrophobicContact CG-CZ 3.66Å; M218-F500 HydrophobicContact SD-CD1 4.34Å; M218-F500 HydrophobicContact SD-CE1 4.04Å; L223-F500 HydrophobicContact CD1-CB 3.62Å; L223-F500 HydrophobicContact CD1-CD1 4.11Å; L223-F500 HydrophobicContact CD1-CD2 3.33Å; L223-F500 HydrophobicContact CD1-CE2 4Å; L223-F500 HydrophobicContact CD1-CG 3.41Å; L223-F500 VanDerWaalsContact CD1-CG 3.41Å; E496-F500 VanDerWaalsContact O-CB 3.29Å; E496-F500 WeakPolarHBondContact O-CB 3.41Å; E496-F500 PolarHBondContact O-N 3.44Å; I497-F500 PolarHBondContact O-N 3.01Å; I498-F500 VanDerWaalsContact C-N 3.29Å; I498-F500 PolarHBondContact O-N 2.89Å; F500-R502 VanDerWaalsContact C-N 3.27Å; F500-R502 PolarHBondContact O-N 3.35Å; F500-N503 PolarHBondContact O-N 3.39Å; F500-N503 VanDerWaalsContact O-N 3.17Å; F500-F504 HydrophobicContact CB-CD2 4.38Å; F500-F504 HydrophobicContact CD2-CB 4.32Å; F500-F504 AromaticContact CD2-CD2 3.33Å; F500-F504 HydrophobicContact CD2-CD2 3.33Å; F500-F504 AromaticContact CD2-CE2 3.93Å; F500-F504 HydrophobicContact CD2-CE2 3.93Å; F500-F504 HydrophobicContact CD2-CG 4.14Å; F500-F504 HydrophobicContact CE2-CB 4.13Å; F500-F504 AromaticContact CE2-CD2 3.81Å; F500-F504 HydrophobicContact CE2-CD2 3.81Å; F500-F504 HydrophobicContact CE2-CG 4.19Å; F500-F504 HydrophobicContact CG-CD2 4.05Å; F500-F504 HydrophobicContact CZ-CB 4.49Å; F500-F504 WeakPolarHBondContact O-CB 3.36Å; F500-F504 WeakPolarHBondContact O-CD2 3.47Å; F500-F504 PolarHBondContact O-N 3Å; F500-F517 HydrophobicContact CE2-CE2 4.15Å
501	F	95.4	Very high	93.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-28.8	-178.9	-87.4	-74.1	0	0	0	113	Y214 M218 F251 F252 L258 F259 L265 I497 I498 T505	Y214-F501 HydrophobicContact CD1-CD1 4.15Å; Y214-F501 AromaticContact CD1-CE1 3.58Å; Y214-F501 HydrophobicContact CD1-CE1 3.58Å; Y214-F501 HydrophobicContact CD1-CZ 4.34Å; Y214-F501 HydrophobicContact CD2-CE1 4.41Å; Y214-F501 AromaticContact CE1-CD1 3.96Å; Y214-F501 HydrophobicContact CE1-CD1 3.96Å; Y214-F501 AromaticContact CE1-CE1 3.78Å; Y214-F501 HydrophobicContact CE1-CE1 3.78Å; Y214-F501 AromaticContact CG-CE1 3.92Å; Y214-F501 HydrophobicContact CG-CE1 3.92Å; Y214-F501 HydrophobicContact CG-CZ 4.48Å; M218-F501 HydrophobicContact CE-CZ 4.28Å; M218-F501 HydrophobicContact SD-CE2 3.89Å; M218-F501 HydrophobicContact SD-CZ 4.13Å; F251-F501 HydrophobicContact CB-CE2 4.42Å; F251-F501 HydrophobicContact CB-CZ 4.26Å; F251-F501 HydrophobicContact CD1-CE2 4.29Å; F251-F501 HydrophobicContact CG-CE2 4.35Å; F252-F501 HydrophobicContact CE1-CE1 4.1Å; F252-F501 AromaticContact CE1-CZ 3.85Å; F252-F501 HydrophobicContact CE1-CZ 3.85Å; F252-F501 HydrophobicContact CZ-CZ 4.31Å; L258-F501 HydrophobicContact CD2-CB 3.99Å; L258-F501 HydrophobicContact CD2-CD1 4.45Å; L258-F501 HydrophobicContact CD2-CD2 3.51Å; L258-F501 HydrophobicContact CD2-CE2 4.08Å; L258-F501 HydrophobicContact CD2-CG 3.73Å; F259-F501 HydrophobicContact CE2-CE1 4.04Å; L265-F501 HydrophobicContact CD1-CD1 4.28Å; I497-F501 HydrophobicContact CG2-CD2 3.81Å; I497-F501 HydrophobicContact CG2-CE2 3.91Å; I497-F501 WeakPolarHBondContact O-CD2 3.29Å; I497-F501 PolarHBondContact O-N 3.3Å; I498-F501 PolarHBondContact O-N 3.2Å; F501-T505 WeakPolarHBondContact O-CB 3.36Å; F501-T505 PolarHBondContact O-OG1 3.49Å
502	R	94.1	Very high	93.5	Very high	57 Å²	57	47.1 Å²	47.1	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-72	-45.3	170.2	-173.4	-172.8	64	-111.4	-16.9	112.2	Y269 I498 D499 F500	Y269-R502 VanDerWaalsContact O-CB 3.29Å; Y269-R502 WeakPolarHBondContact O-CB 3.12Å; Y269-R502 VanDerWaalsContact O-CG 3.27Å; Y269-R502 WeakPolarHBondContact O-CG 3.42Å; I498-R502 PolarHBondContact O-N 3.42Å; D499-R502 IonicContact OD1-CZ 3.25Å; D499-R502 IonicContact OD1-NH1 3.53Å; D499-R502 PolarHBondContact OD1-NH1 2.03Å; D499-R502 IonicContact OD1-NH2 3.78Å; D499-R502 PolarHBondContact OD1-NH2 2.84Å; F500-R502 VanDerWaalsContact C-N 3.27Å; F500-R502 PolarHBondContact O-N 3.35Å
503	N	93.6	Very high	93.5	Very high	79 Å²	79	37.4 Å²	37.4	42%	0.422	20%	0.197	S	C	.	.	H	α-helix	trans	-83.8	-19	-169.6	-65.9	1.3	0	0	0	113.9	D499 F500 Y541	D499-N503 WeakPolarHBondContact O-CB 3.12Å; D499-N503 PolarHBondContact O-N 3.47Å; D499-N503 PolarHBondContact O-ND2 2.89Å; D499-N503 PolarHBondContact O-OD1 2.83Å; F500-N503 PolarHBondContact O-N 3.39Å; F500-N503 VanDerWaalsContact O-N 3.17Å; N503-Y541 HydrophobicContact CB-CE1 4.44Å
504	F	95.1	Very high	93.4	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.018	19%	0.188	C	C	.	.	S	Bend	trans	-124.8	27	-175	-60	-73.8	0	0	0	114	F500 S516 F517 H525 Y541 Q542	F500-F504 HydrophobicContact CB-CD2 4.38Å; F500-F504 HydrophobicContact CD2-CB 4.32Å; F500-F504 AromaticContact CD2-CD2 3.33Å; F500-F504 HydrophobicContact CD2-CD2 3.33Å; F500-F504 AromaticContact CD2-CE2 3.93Å; F500-F504 HydrophobicContact CD2-CE2 3.93Å; F500-F504 HydrophobicContact CD2-CG 4.14Å; F500-F504 HydrophobicContact CE2-CB 4.13Å; F500-F504 AromaticContact CE2-CD2 3.81Å; F500-F504 HydrophobicContact CE2-CD2 3.81Å; F500-F504 HydrophobicContact CE2-CG 4.19Å; F500-F504 HydrophobicContact CG-CD2 4.05Å; F500-F504 HydrophobicContact CZ-CB 4.49Å; F500-F504 WeakPolarHBondContact O-CB 3.36Å; F500-F504 WeakPolarHBondContact O-CD2 3.47Å; F500-F504 PolarHBondContact O-N 3Å; F504-S516 WeakPolarHBondContact O-CB 3.49Å; F504-S516 PolarHBondContact O-N 3Å; F504-F517 HydrophobicContact CB-CD2 4.48Å; F504-F517 HydrophobicContact CB-CE2 4.09Å; F504-F517 HydrophobicContact CD1-CD2 4.17Å; F504-F517 AromaticContact CD1-CE2 3.33Å; F504-F517 HydrophobicContact CD1-CE2 3.33Å; F504-F517 AromaticContact CD1-CZ 3.56Å; F504-F517 HydrophobicContact CD1-CZ 3.56Å; F504-F517 HydrophobicContact CD2-CE2 4.22Å; F504-F517 HydrophobicContact CE1-CE1 4.34Å; F504-F517 AromaticContact CE1-CE2 3.68Å; F504-F517 HydrophobicContact CE1-CE2 3.68Å; F504-F517 AromaticContact CE1-CZ 3.4Å; F504-F517 HydrophobicContact CE1-CZ 3.4Å; F504-F517 HydrophobicContact CE2-CE2 4.5Å; F504-F517 HydrophobicContact CG-CD2 4.45Å; F504-F517 AromaticContact CG-CE2 3.63Å; F504-F517 HydrophobicContact CG-CE2 3.63Å; F504-F517 HydrophobicContact CG-CZ 4.23Å; F504-F517 HydrophobicContact CZ-CE2 4.25Å; F504-F517 AromaticContact CZ-CZ 3.95Å; F504-F517 HydrophobicContact CZ-CZ 3.95Å; F504-H525 AromaticContact CD1-CE1 3.77Å; F504-H525 AromaticContact CE1-CE1 3.87Å; F504-Y541 HydrophobicContact CE2-CD1 4.11Å; F504-Y541 AromaticContact CE2-CE1 3.37Å; F504-Y541 HydrophobicContact CE2-CE1 3.37Å; F504-Y541 AromaticContact CE2-CZ 3.78Å; F504-Y541 AromaticContact CZ-CD1 3.79Å; F504-Y541 HydrophobicContact CZ-CD1 3.79Å; F504-Y541 AromaticContact CZ-CE1 3.54Å; F504-Y541 HydrophobicContact CZ-CE1 3.54Å; F504-Y541 WeakPolarHBondContact CZ-O 3.36Å; F504-Q542 HydrophobicContact CE1-CB 4.42Å; F504-Q542 HydrophobicContact CE1-CG 4.34Å
505	T	95.5	Very high	93.5	Very high	24 Å²	24	34.6 Å²	34.6	15%	0.147	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.8	168.2	-71.7	0	0	0	0	110	Y214 L265 F501 D513 T514	Y214-T505 PolarHBondContact OH-OG1 3.37Å; L265-T505 HydrophobicContact CD2-CG2 4.19Å; F501-T505 WeakPolarHBondContact O-CB 3.36Å; F501-T505 PolarHBondContact O-OG1 3.49Å; T505-D513 HydrophobicContact CG2-CB 3.67Å; T505-T514 CarbonylContact C-O 3.52Å; T505-T514 WeakPolarHBondContact CA-O 3.42Å
506	V	94.1	Very high	93.4	Very high	50 Å²	50	32.2 Å²	32.2	30%	0.303	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.7	177.1	172.7	0	0	0	0	109.7	T514 S516	V506-T514 PolarHBondContact N-O 2.95Å; V506-T514 PolarHBondContact O-N 3.03Å; V506-T514 PolarHBondContact O-OG1 2.78Å; V506-S516 VanDerWaalsContact CG2-OG 3.24Å; V506-S516 WeakPolarHBondContact CG2-OG 3.48Å
507	E	93.8	Very high	93.3	Very high	128 Å²	128	28.2 Å²	28.2	60%	0.598	15%	0.153	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	111.9	179.8	-165.5	170.5	148.9	0	0	110.2	K270	K270-E507 IonicContact NZ-OE2 3.87Å; K270-E507 PolarHBondContact NZ-OE2 3.08Å
508	V	90.8	Very high	93.3	Very high	27 Å²	27	28.2 Å²	28.2	16%	0.164	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.1	-176.1	176.5	0	0	0	0	109.9	G510 V511 G512 T514	V508-G510 PolarHBondContact O-N 2.92Å; V508-V511 HydrophobicContact CB-CB 4.07Å; V508-V511 HydrophobicContact CG1-CB 3.97Å; V508-V511 HydrophobicContact CG1-CG2 4.18Å; V508-V511 PolarHBondContact O-N 3.03Å; V508-G512 PolarHBondContact N-O 2.99Å; V508-G512 PolarHBondContact O-N 3.38Å; V508-T514 HydrophobicContact CB-CG2 4.39Å; V508-T514 HydrophobicContact CG2-CG2 3.96Å; V508-T514 WeakPolarHBondContact CG2-OG1 3.43Å
509	I	85.9	Confident	93.1	Very high	151 Å²	151	30.5 Å²	30.5	77%	0.774	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	121.9	-178.2	-58.9	174.6	0	0	0	110.4	V511	I509-V511 VanDerWaalsContact C-N 3.28Å; I509-V511 PolarHBondContact O-N 3.09Å
510	G	83.1	Confident	92.9	Very high	19 Å²	19	29.6 Å²	29.6	20%	0.196	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	-21.1	-177.3	0	0	0	0	0	115.3	R207 V508	R207-G510 PolarHBondContact NH2-O 2.9Å; V508-G510 PolarHBondContact O-N 2.92Å
511	V	88.8	Confident	92.5	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.018	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-28.9	-177.7	178.1	0	0	0	0	112.9	D203 H206 R207 R210 V508 I509 T514	D203-V511 HydrophobicContact CB-CG2 3.96Å; H206-V511 HydrophobicContact CB-CG1 3.91Å; R207-V511 HydrophobicContact CG-CG1 4.26Å; R210-V511 PolarHBondContact NH1-O 2.95Å; R210-V511 VanDerWaalsContact NH1-O 3.08Å; R210-V511 PolarHBondContact NH2-O 3.48Å; V508-V511 HydrophobicContact CB-CB 4.07Å; V508-V511 HydrophobicContact CG1-CB 3.97Å; V508-V511 HydrophobicContact CG1-CG2 4.18Å; V508-V511 PolarHBondContact O-N 3.03Å; I509-V511 VanDerWaalsContact C-N 3.28Å; I509-V511 PolarHBondContact O-N 3.09Å; V511-T514 HydrophobicContact CG1-CG2 3.95Å
512	G	91.6	Very high	92.1	Very high	17 Å²	17	31.9 Å²	31.9	18%	0.175	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88	-152.5	-177.6	0	0	0	0	0	113.4	V508 T514	V508-G512 PolarHBondContact N-O 2.99Å; V508-G512 PolarHBondContact O-N 3.38Å; G512-T514 PolarHBondContact O-N 3.45Å
513	D	95.6	Very high	91.6	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	116.9	-169.3	-71.4	-56.5	0	0	0	113.2	R210 F259 W263 S264 L265 K270 T505	R210-D513 PolarHBondContact NH1-O 3.4Å; F259-D513 HydrophobicContact CE1-CB 4.5Å; W263-D513 PolarHBondContact O-N 3.43Å; S264-D513 WeakPolarHBondContact CA-OD2 3.48Å; S264-D513 WeakPolarHBondContact CB-OD2 3.37Å; S264-D513 PolarHBondContact OG-OD2 2.87Å; L265-D513 HydrophobicContact CB-CB 4.3Å; L265-D513 PolarHBondContact N-OD2 3.44Å; K270-D513 WeakPolarHBondContact CE-OD1 3.38Å; K270-D513 IonicContact NZ-OD1 3.91Å; K270-D513 PolarHBondContact NZ-OD1 3.44Å; K270-D513 IonicContact NZ-OD2 2.68Å; K270-D513 PolarHBondContact NZ-OD2 2.87Å; T505-D513 HydrophobicContact CG2-CB 3.67Å
514	T	95.3	Very high	91.2	Very high	2 Å²	2	35 Å²	35	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	156.5	-176	64.7	0	0	0	0	111.9	H206 Y214 T505 V506 V508 V511 G512 S516 Q519	H206-T514 HydrophobicContact CB-CG2 4.37Å; Y214-T514 PolarHBondContact OH-O 3.37Å; T505-T514 CarbonylContact C-O 3.52Å; T505-T514 WeakPolarHBondContact CA-O 3.42Å; V506-T514 PolarHBondContact N-O 2.95Å; V506-T514 PolarHBondContact O-N 3.03Å; V506-T514 PolarHBondContact O-OG1 2.78Å; V508-T514 HydrophobicContact CB-CG2 4.39Å; V508-T514 HydrophobicContact CG2-CG2 3.96Å; V508-T514 WeakPolarHBondContact CG2-OG1 3.43Å; V511-T514 HydrophobicContact CG1-CG2 3.95Å; G512-T514 PolarHBondContact O-N 3.45Å; T514-S516 PolarHBondContact O-N 2.95Å; T514-Q519 PolarHBondContact OG1-NE2 3.28Å
515	C	95.9	Very high	90.7	Very high	1 Å²	1	35 Å²	35	1%	0.007	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	125.6	173	-177.3	0	0	0	0	109.7	N213 Y214 F517 A518	N213-C515 HydrophobicContact CB-CB 4.13Å; Y214-C515 HydrophobicContact CD1-CB 3.66Å; Y214-C515 HydrophobicContact CD2-CB 4.24Å; Y214-C515 HydrophobicContact CE1-CB 3.7Å; Y214-C515 HydrophobicContact CE2-CB 4.26Å; Y214-C515 HydrophobicContact CG-CB 3.95Å; Y214-C515 PolarHBondContact OH-N 2.91Å; C515-F517 VanDerWaalsContact C-N 3.31Å; C515-F517 PolarHBondContact O-N 3.13Å; C515-A518 HydrophobicContact CB-CB 4.29Å; C515-A518 WeakPolarHBondContact O-CA 3.32Å; C515-A518 VanDerWaalsContact O-CB 3.28Å; C515-A518 WeakPolarHBondContact O-CB 3.44Å; C515-A518 PolarHBondContact O-N 2.93Å
516	S	94.6	Very high	90.2	Very high	6 Å²	6	33.9 Å²	33.9	4%	0.042	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-58.7	-40	-173.7	-161.5	0	0	0	0	112.9	F504 V506 T514 A518 Q519 H525	F504-S516 WeakPolarHBondContact O-CB 3.49Å; F504-S516 PolarHBondContact O-N 3Å; V506-S516 VanDerWaalsContact CG2-OG 3.24Å; V506-S516 WeakPolarHBondContact CG2-OG 3.48Å; T514-S516 PolarHBondContact O-N 2.95Å; S516-A518 PolarHBondContact O-N 3.26Å; S516-A518 VanDerWaalsContact O-N 3.14Å; S516-Q519 WeakPolarHBondContact O-CB 3.5Å; S516-Q519 PolarHBondContact O-N 3.38Å; S516-H525 VanDerWaalsContact CB-NE2 3.25Å; S516-H525 WeakPolarHBondContact CB-NE2 3.16Å; S516-H525 PolarHBondContact OG-NE2 3.46Å
517	F	94.2	Very high	89.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-58.2	-26.9	173.2	-61.8	-78.9	0	0	0	113.6	A217 F339 F500 F504 C515 Q519 M520 H525 Q542 A544	A217-F517 HydrophobicContact CB-CD2 3.78Å; A217-F517 HydrophobicContact CB-CE2 4.32Å; A217-F517 HydrophobicContact CB-CG 4.48Å; F339-F517 HydrophobicContact CD1-CB 4.26Å; F339-F517 HydrophobicContact CD2-CB 4.16Å; F339-F517 HydrophobicContact CE1-CB 3.8Å; F339-F517 HydrophobicContact CE2-CB 3.68Å; F339-F517 HydrophobicContact CE2-CG 4.42Å; F339-F517 HydrophobicContact CG-CB 4.44Å; F339-F517 HydrophobicContact CZ-CB 3.49Å; F339-F517 VanDerWaalsContact CZ-CB 3.49Å; F339-F517 HydrophobicContact CZ-CG 4.09Å; F500-F517 HydrophobicContact CE2-CE2 4.15Å; F504-F517 HydrophobicContact CB-CD2 4.48Å; F504-F517 HydrophobicContact CB-CE2 4.09Å; F504-F517 HydrophobicContact CD1-CD2 4.17Å; F504-F517 AromaticContact CD1-CE2 3.33Å; F504-F517 HydrophobicContact CD1-CE2 3.33Å; F504-F517 AromaticContact CD1-CZ 3.56Å; F504-F517 HydrophobicContact CD1-CZ 3.56Å; F504-F517 HydrophobicContact CD2-CE2 4.22Å; F504-F517 HydrophobicContact CE1-CE1 4.34Å; F504-F517 AromaticContact CE1-CE2 3.68Å; F504-F517 HydrophobicContact CE1-CE2 3.68Å; F504-F517 AromaticContact CE1-CZ 3.4Å; F504-F517 HydrophobicContact CE1-CZ 3.4Å; F504-F517 HydrophobicContact CE2-CE2 4.5Å; F504-F517 HydrophobicContact CG-CD2 4.45Å; F504-F517 AromaticContact CG-CE2 3.63Å; F504-F517 HydrophobicContact CG-CE2 3.63Å; F504-F517 HydrophobicContact CG-CZ 4.23Å; F504-F517 HydrophobicContact CZ-CE2 4.25Å; F504-F517 AromaticContact CZ-CZ 3.95Å; F504-F517 HydrophobicContact CZ-CZ 3.95Å; C515-F517 VanDerWaalsContact C-N 3.31Å; C515-F517 PolarHBondContact O-N 3.13Å; F517-Q519 VanDerWaalsContact C-N 3.26Å; F517-Q519 PolarHBondContact O-N 2.7Å; F517-M520 PolarHBondContact O-N 2.85Å; F517-M520 VanDerWaalsContact O-N 3.1Å; F517-H525 HydrophobicContact CD1-CB 3.84Å; F517-H525 AromaticContact CD1-CG 3.66Å; F517-H525 AromaticContact CD1-ND1 3.79Å; F517-H525 HydrophobicContact CE1-CB 4.11Å; F517-H525 AromaticContact CE1-CG 3.85Å; F517-H525 AromaticContact CE1-ND1 3.52Å; F517-Q542 WeakPolarHBondContact CE1-O 3.17Å; F517-A544 HydrophobicContact CD1-CB 4.01Å; F517-A544 HydrophobicContact CE1-CB 4.13Å
518	A	94.8	Very high	89.2	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-81.1	0.9	176.9	0	0	0	0	0	114.2	H206 N213 F339 N340 C515 S516	H206-A518 PolarHBondContact NE2-O 3.25Å; N213-A518 HydrophobicContact CB-CB 3.88Å; N213-A518 VanDerWaalsContact ND2-CB 3.35Å; N213-A518 WeakPolarHBondContact ND2-CB 3.45Å; F339-A518 HydrophobicContact CB-CB 4.4Å; N340-A518 PolarHBondContact ND2-O 3.1Å; C515-A518 HydrophobicContact CB-CB 4.29Å; C515-A518 WeakPolarHBondContact O-CA 3.32Å; C515-A518 VanDerWaalsContact O-CB 3.28Å; C515-A518 WeakPolarHBondContact O-CB 3.44Å; C515-A518 PolarHBondContact O-N 2.93Å; S516-A518 PolarHBondContact O-N 3.26Å; S516-A518 VanDerWaalsContact O-N 3.14Å
519	Q	91.9	Very high	88.6	Confident	51 Å²	51	30.7 Å²	30.7	24%	0.238	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-77.4	-14.4	160.5	-57.8	-51.1	-40.7	0	0	112.2	H206 T514 S516 F517 D521	H206-Q519 PolarHBondContact CE1-NE2 2.81Å; H206-Q519 PolarHBondContact CE1-OE1 3.35Å; T514-Q519 PolarHBondContact OG1-NE2 3.28Å; S516-Q519 WeakPolarHBondContact O-CB 3.5Å; S516-Q519 PolarHBondContact O-N 3.38Å; F517-Q519 VanDerWaalsContact C-N 3.26Å; F517-Q519 PolarHBondContact O-N 2.7Å; Q519-D521 PolarHBondContact O-N 2.71Å
520	M	91.7	Very high	88.3	Confident	1 Å²	1	24 Å²	24	1%	0.005	13%	0.132	C	C	.	.			trans	58.2	30.5	-179.8	-52.6	173.6	-62.7	0	0	112.6	L202 N340 F517 I522 L553 F556 W563	L202-M520 HydrophobicContact CD1-CE 3.89Å; N340-M520 HydrophobicContact CB-SD 4.47Å; N340-M520 WeakPolarHBondContact ND2-CE 3.08Å; N340-M520 PolarHBondContact ND2-SD 3.04Å; N340-M520 VanDerWaalsContact ND2-SD 3.44Å; F517-M520 PolarHBondContact O-N 2.85Å; F517-M520 VanDerWaalsContact O-N 3.1Å; M520-I522 PolarHBondContact O-N 2.72Å; M520-L553 HydrophobicContact CB-CB 4.18Å; M520-L553 HydrophobicContact CB-CD1 4.21Å; M520-F556 HydrophobicContact CE-CB 4.03Å; M520-F556 HydrophobicContact CE-CD1 3.78Å; M520-F556 HydrophobicContact CE-CE1 4.44Å; M520-F556 HydrophobicContact CE-CG 3.84Å; M520-F556 HydrophobicContact SD-CB 3.85Å; M520-F556 HydrophobicContact SD-CG 4.19Å; M520-W563 HydrophobicContact CE-CH2 4.11Å; M520-W563 HydrophobicContact CE-CZ2 4.46Å
521	D	87.6	Confident	87.9	Confident	32 Å²	32	23.7 Å²	23.7	17%	0.171	13%	0.125	C	C	.	.			trans	-78.2	112.8	-179.7	-176.5	-19.6	0	0	0	111.3	Q519 R523 Q524 H525	Q519-D521 PolarHBondContact O-N 2.71Å; D521-R523 WeakPolarHBondContact OD1-CA 3.43Å; D521-R523 WeakPolarHBondContact OD1-CB 3.49Å; D521-R523 PolarHBondContact OD1-N 3.23Å; D521-Q524 HydrophobicContact CB-CB 4.35Å; D521-Q524 PolarHBondContact OD1-N 3.37Å; D521-Q524 WeakPolarHBondContact OD2-CG 3.26Å; D521-Q524 PolarHBondContact OD2-NE2 3.34Å; D521-H525 WeakPolarHBondContact O-CB 3.38Å; D521-H525 PolarHBondContact O-N 2.88Å
522	I	85.9	Confident	86.5	Confident	16 Å²	16	24.4 Å²	24.4	8%	0.082	13%	0.13	C	C	.	.	H	α-helix	trans	-70.6	-31	-179.6	-55	163.5	0	0	0	111.8	M520 G526 M531 T549 L553 F572	M520-I522 PolarHBondContact O-N 2.72Å; I522-G526 WeakPolarHBondContact O-CA 3.43Å; I522-G526 PolarHBondContact O-N 2.86Å; I522-M531 HydrophobicContact CG2-CG 4.16Å; I522-M531 HydrophobicContact CG2-SD 3.46Å; I522-M531 WeakPolarHBondContact CG2-SD 3.35Å; I522-T549 HydrophobicContact CG1-CG2 4.42Å; I522-L553 HydrophobicContact CD1-CD2 3.65Å; I522-L553 HydrophobicContact CG1-CD2 4.16Å; I522-F572 HydrophobicContact CD1-CB 3.53Å; I522-F572 HydrophobicContact CD1-CD1 3.45Å; I522-F572 VanDerWaalsContact CD1-CD1 3.45Å; I522-F572 HydrophobicContact CD1-CD2 4.02Å; I522-F572 HydrophobicContact CD1-CE1 4.11Å; I522-F572 HydrophobicContact CD1-CG 3.39Å
523	R	84.9	Confident	84.8	Confident	96 Å²	96	28.7 Å²	28.7	36%	0.362	15%	0.146	S	C	.	.	H	α-helix	trans	-70.9	-39.6	178.9	-69.4	-178.1	67.2	-162	-9	111.4	D521 T536 E537 A538 E568	D521-R523 WeakPolarHBondContact OD1-CA 3.43Å; D521-R523 WeakPolarHBondContact OD1-CB 3.49Å; D521-R523 PolarHBondContact OD1-N 3.23Å; R523-T536 PolarHBondContact O-OG1 2.86Å; R523-E537 IonicContact CZ-OE1 3.88Å; R523-E537 IonicContact NE-OE1 2.63Å; R523-E537 PolarHBondContact NE-OE1 3.12Å; R523-E537 IonicContact NH2-OE1 3.78Å; R523-E537 PolarHBondContact NH2-OE1 2.89Å; R523-E537 IonicContact NH2-OE2 3.84Å; R523-E537 PolarHBondContact NH2-OE2 2.82Å; R523-E537 PolarHBondContact O-N 3.08Å; R523-A538 PolarHBondContact O-N 3.19Å; R523-E568 VanDerWaalsContact CD-CD 3.41Å; R523-E568 WeakPolarHBondContact CD-OE1 3.42Å; R523-E568 WeakPolarHBondContact CD-OE2 3.45Å; R523-E568 IonicContact CZ-OE1 3.65Å; R523-E568 IonicContact NE-OE1 2.7Å; R523-E568 IonicContact NH1-OE1 2.75Å; R523-E568 PolarHBondContact NH1-OE1 3.09Å; R523-E568 IonicContact NH1-OE2 3.16Å
524	Q	83.3	Confident	83	Confident	105 Å²	105	31.2 Å²	31.2	49%	0.491	17%	0.172	S	C	.	.	H	α-helix	trans	-89.1	-29.4	-177.5	-67.1	-173.3	74.4	0	0	114.1	D521 A538	D521-Q524 HydrophobicContact CB-CB 4.35Å; D521-Q524 PolarHBondContact OD1-N 3.37Å; D521-Q524 WeakPolarHBondContact OD2-CG 3.26Å; D521-Q524 PolarHBondContact OD2-NE2 3.34Å; Q524-A538 VanDerWaalsContact O-CB 3.23Å; Q524-A538 WeakPolarHBondContact O-CB 3.44Å
525	H	86.4	Confident	81.4	Confident	5 Å²	5	39.9 Å²	39.9	2%	0.023	21%	0.209	C	C	.	.	H	α-helix	trans	-134.7	4.8	-172.7	-60.5	-52.5	0	0	0	114.8	F504 S516 F517 D521 Q542 A544 T549	F504-H525 AromaticContact CD1-CE1 3.77Å; F504-H525 AromaticContact CE1-CE1 3.87Å; S516-H525 VanDerWaalsContact CB-NE2 3.25Å; S516-H525 WeakPolarHBondContact CB-NE2 3.16Å; S516-H525 PolarHBondContact OG-NE2 3.46Å; F517-H525 HydrophobicContact CD1-CB 3.84Å; F517-H525 AromaticContact CD1-CG 3.66Å; F517-H525 AromaticContact CD1-ND1 3.79Å; F517-H525 HydrophobicContact CE1-CB 4.11Å; F517-H525 AromaticContact CE1-CG 3.85Å; F517-H525 AromaticContact CE1-ND1 3.52Å; D521-H525 WeakPolarHBondContact O-CB 3.38Å; D521-H525 PolarHBondContact O-N 2.88Å; H525-Q542 PolarHBondContact ND1-O 3.43Å; H525-A544 PolarHBondContact O-N 2.92Å; H525-T549 HydrophobicContact CB-CG2 4.35Å; H525-T549 PolarHBondContact O-OG1 3.45Å
526	G	84.1	Confident	80.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.218	C	C	.	.			trans	-72.5	141.7	176.1	0	0	0	0	0	112.4	I522 T536 E550	I522-G526 WeakPolarHBondContact O-CA 3.43Å; I522-G526 PolarHBondContact O-N 2.86Å; G526-T536 WeakPolarHBondContact O-CB 3.38Å; G526-T536 PolarHBondContact O-OG1 3.39Å; G526-E550 WeakPolarHBondContact CA-OE1 3.45Å
527	H	84.2	Confident	79.2	Confident	35 Å²	35	47.2 Å²	47.2	16%	0.162	25%	0.245	C	C	.	.			trans	-89.7	124.8	-180	-171.1	-64.2	0	0	0	110	A529 W530 Q543 A544 E550	H527-A529 VanDerWaalsContact C-N 3.33Å; H527-A529 PolarHBondContact ND1-N 3.38Å; H527-A529 PolarHBondContact O-N 2.75Å; H527-W530 HydrophobicContact CB-CB 4.37Å; H527-W530 HydrophobicContact CB-CG 4.43Å; H527-W530 AromaticContact CG-CD1 3.71Å; H527-W530 AromaticContact ND1-CD1 3.45Å; H527-W530 PolarHBondContact O-N 2.99Å; H527-Q543 PolarHBondContact CD2-NE2 3.09Å; H527-Q543 PolarHBondContact NE2-NE2 3.39Å; H527-Q543 VanDerWaalsContact NE2-NE2 3.11Å; H527-A544 PolarHBondContact CD2-O 3.46Å; H527-E550 PolarHBondContact N-OE1 3.42Å
528	P	81.8	Confident	78.3	Confident	69 Å²	69	48 Å²	48	45%	0.448	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-57.1	-42.6	-170.2	20.8	-32	0	0	0	113.5	W530 M531 T536	P528-W530 PolarHBondContact O-N 2.87Å; P528-M531 PolarHBondContact O-N 3.06Å; P528-T536 HydrophobicContact CB-CG2 3.98Å; P528-T536 HydrophobicContact CG-CG2 4.44Å
529	A	79.8	Confident	77.7	Confident	35 Å²	35	50.5 Å²	50.5	29%	0.289	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-72.8	-2.8	178.7	0	0	0	0	0	115.7	H527 H716 Q719	H527-A529 VanDerWaalsContact C-N 3.33Å; H527-A529 PolarHBondContact ND1-N 3.38Å; H527-A529 PolarHBondContact O-N 2.75Å; A529-H716 PolarHBondContact O-ND1 3.49Å; A529-Q719 PolarHBondContact O-OE1 2.94Å
530	W	79.9	Confident	77.2	Confident	11 Å²	11	54.7 Å²	54.7	4%	0.042	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-108.5	-2.1	178.1	-70.8	71	0	0	0	112.6	H527 P528 G547 E550 L551 I712 H713 H716	H527-W530 HydrophobicContact CB-CB 4.37Å; H527-W530 HydrophobicContact CB-CG 4.43Å; H527-W530 AromaticContact CG-CD1 3.71Å; H527-W530 AromaticContact ND1-CD1 3.45Å; H527-W530 PolarHBondContact O-N 2.99Å; P528-W530 PolarHBondContact O-N 2.87Å; W530-G547 VanDerWaalsContact CD2-CA 3.43Å; W530-E550 HydrophobicContact CB-CG 4.46Å; W530-L551 HydrophobicContact CZ3-CD1 4.02Å; W530-I712 HydrophobicContact CE3-CG2 3.58Å; W530-I712 HydrophobicContact CZ3-CG2 4.01Å; W530-H713 AromaticContact CH2-CE1 3.82Å; W530-H713 AromaticContact CH2-ND1 3.75Å; W530-H713 AromaticContact CH2-NE2 3.3Å; W530-H713 VanDerWaalsContact CH2-NE2 3.3Å; W530-H713 WeakPolarHBondContact CH2-NE2 3.31Å; W530-H716 AromaticContact NE1-CE1 3.82Å; W530-H716 AromaticContact NE1-ND1 3.9Å
531	M	73.8	Confident	76.8	Confident	11 Å²	11	59.7 Å²	59.7	5%	0.054	31%	0.312	C	S	.	.			trans	-94.4	136.7	173.3	-65.5	-172.7	-70.9	0	0	111.2	I522 P528 T536 F572 Q719	I522-M531 HydrophobicContact CG2-CG 4.16Å; I522-M531 HydrophobicContact CG2-SD 3.46Å; I522-M531 WeakPolarHBondContact CG2-SD 3.35Å; P528-M531 PolarHBondContact O-N 3.06Å; M531-T536 HydrophobicContact CE-CG2 3.58Å; M531-F572 HydrophobicContact CG-CE2 4.47Å; M531-Q719 PolarHBondContact O-NE2 3.3Å
532	S	59.1	Low	76.6	Confident	18 Å²	18	62.2 Å²	62.2	13%	0.126	32%	0.322	C	S	.	.	S	Bend	trans	-72.2	-44.4	170.9	51.6	0	0	0	0	112.1
533	E	56.9	Low	76.7	Confident	107 Å²	107	62.2 Å²	62.2	50%	0.5	32%	0.322	S	S	.	.	S	Bend	trans	-152.1	125.9	173.9	-101.6	150	-136.9	0	0	108.7	R579	E533-R579 IonicContact OE1-CZ 3.44Å; E533-R579 IonicContact OE1-NH1 2.67Å; E533-R579 IonicContact OE1-NH2 2.63Å; E533-R579 PolarHBondContact OE1-NH2 3.28Å; E533-R579 IonicContact OE2-NH2 3.66Å; E533-R579 PolarHBondContact OE2-NH2 3.33Å
534	G	57	Low	76.8	Confident	54 Å²	54	57.7 Å²	57.7	56%	0.557	31%	0.305	S	S	*	.			trans	169.7	153.6	179.2	0	0	0	0	0	112.5
535	K	61.9	Low	77	Confident	184 Å²	184	55.1 Å²	55.1	80%	0.8	29%	0.293	S	S	*	.			trans	-103.7	107.7	167.7	-70.4	-174.9	179	-178.2	0	108.3
536	T	70	Confident	76.9	Confident	31 Å²	31	56.9 Å²	56.9	19%	0.19	30%	0.302	C	S	.	.			trans	-82.2	137.5	162.1	-177.4	0	0	0	0	108	R523 G526 P528 M531 A538	R523-T536 PolarHBondContact O-OG1 2.86Å; G526-T536 WeakPolarHBondContact O-CB 3.38Å; G526-T536 PolarHBondContact O-OG1 3.39Å; P528-T536 HydrophobicContact CB-CG2 3.98Å; P528-T536 HydrophobicContact CG-CG2 4.44Å; M531-T536 HydrophobicContact CE-CG2 3.58Å; T536-A538 WeakPolarHBondContact OG1-CB 3.22Å; T536-A538 PolarHBondContact OG1-N 3.45Å
537	E	74.5	Confident	77	Confident	130 Å²	130	56.9 Å²	56.9	61%	0.607	30%	0.302	S	S	*	.			trans	-97.7	0.9	171.5	-73.8	158.3	-133.9	0	0	110.7	R523 S539	R523-E537 IonicContact CZ-OE1 3.88Å; R523-E537 IonicContact NE-OE1 2.63Å; R523-E537 PolarHBondContact NE-OE1 3.12Å; R523-E537 IonicContact NH2-OE1 3.78Å; R523-E537 PolarHBondContact NH2-OE1 2.89Å; R523-E537 IonicContact NH2-OE2 3.84Å; R523-E537 PolarHBondContact NH2-OE2 2.82Å; R523-E537 PolarHBondContact O-N 3.08Å; E537-S539 PolarHBondContact O-N 3.28Å
538	A	75.3	Confident	77.4	Confident	17 Å²	17	55.2 Å²	55.2	14%	0.14	30%	0.295	C	S	.	.			trans	-65.7	126.4	177.9	0	0	0	0	0	112	R523 Q524 T536 Q542 Q543	R523-A538 PolarHBondContact O-N 3.19Å; Q524-A538 VanDerWaalsContact O-CB 3.23Å; Q524-A538 WeakPolarHBondContact O-CB 3.44Å; T536-A538 WeakPolarHBondContact OG1-CB 3.22Å; T536-A538 PolarHBondContact OG1-N 3.45Å; A538-Q542 HydrophobicContact CB-CB 4.2Å; A538-Q543 HydrophobicContact CB-CB 4.16Å
539	S	81.1	Confident	77.9	Confident	53 Å²	53	52 Å²	52	37%	0.371	27%	0.274	S	S	.	.			trans	-69.2	165.6	160.6	68.2	0	0	0	0	111.3	E537 Y541 Q542 Q543	E537-S539 PolarHBondContact O-N 3.28Å; S539-Y541 PolarHBondContact O-N 3Å; S539-Y541 VanDerWaalsContact O-N 3.08Å; S539-Q542 WeakPolarHBondContact O-CA 3.33Å; S539-Q542 PolarHBondContact O-N 3.12Å; S539-Q542 PolarHBondContact OG-OE1 3.21Å; S539-Q543 PolarHBondContact O-N 3.36Å
540	I	81.3	Confident	78.5	Confident	139 Å²	139	50.3 Å²	50.3	71%	0.713	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-30.8	174.3	-58.1	170.8	0	0	0	111.7	K221	K221-I540 PolarHBondContact NZ-O 3.27Å
541	Y	82.9	Confident	79	Confident	106 Å²	106	49.8 Å²	49.8	42%	0.416	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-35.8	174.1	-176	-99.8	0	0	0	112.4	K221 N503 F504 S539	K221-Y541 VanDerWaalsContact CE-O 3.3Å; K221-Y541 WeakPolarHBondContact CE-O 3.4Å; K221-Y541 PolarHBondContact NZ-O 3Å; N503-Y541 HydrophobicContact CB-CE1 4.44Å; F504-Y541 HydrophobicContact CE2-CD1 4.11Å; F504-Y541 AromaticContact CE2-CE1 3.37Å; F504-Y541 HydrophobicContact CE2-CE1 3.37Å; F504-Y541 AromaticContact CE2-CZ 3.78Å; F504-Y541 AromaticContact CZ-CD1 3.79Å; F504-Y541 HydrophobicContact CZ-CD1 3.79Å; F504-Y541 AromaticContact CZ-CE1 3.54Å; F504-Y541 HydrophobicContact CZ-CE1 3.54Å; F504-Y541 WeakPolarHBondContact CZ-O 3.36Å; S539-Y541 PolarHBondContact O-N 3Å; S539-Y541 VanDerWaalsContact O-N 3.08Å
542	Q	85.5	Confident	80	Confident	84 Å²	84	49.2 Å²	49.2	39%	0.393	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-27.7	-171.9	-70.1	161	-66.3	0	0	115.6	F504 F517 H525 A538 S539	F504-Q542 HydrophobicContact CE1-CB 4.42Å; F504-Q542 HydrophobicContact CE1-CG 4.34Å; F517-Q542 WeakPolarHBondContact CE1-O 3.17Å; H525-Q542 PolarHBondContact ND1-O 3.43Å; A538-Q542 HydrophobicContact CB-CB 4.2Å; S539-Q542 WeakPolarHBondContact O-CA 3.33Å; S539-Q542 PolarHBondContact O-N 3.12Å; S539-Q542 PolarHBondContact OG-OE1 3.21Å
543	Q	86.8	Confident	81.6	Confident	17 Å²	17	48.4 Å²	48.4	8%	0.079	25%	0.249	C	C	.	.	S	Bend	trans	-57.4	155	176.3	67	177.3	33.8	0	0	111.5	K221 H527 A538 S539 E545	K221-Q543 WeakPolarHBondContact CE-O 3.46Å; K221-Q543 PolarHBondContact NZ-O 3.46Å; H527-Q543 PolarHBondContact CD2-NE2 3.09Å; H527-Q543 PolarHBondContact NE2-NE2 3.39Å; H527-Q543 VanDerWaalsContact NE2-NE2 3.11Å; A538-Q543 HydrophobicContact CB-CB 4.16Å; S539-Q543 PolarHBondContact O-N 3.36Å; Q543-E545 PolarHBondContact NE2-OE2 2.78Å
544	A	87.5	Confident	83.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-82.7	145.4	163.6	0	0	0	0	0	110.5	F517 H525 H527 K548 T549	F517-A544 HydrophobicContact CD1-CB 4.01Å; F517-A544 HydrophobicContact CE1-CB 4.13Å; H525-A544 PolarHBondContact O-N 2.92Å; H527-A544 PolarHBondContact CD2-O 3.46Å; A544-K548 HydrophobicContact CB-CB 3.97Å; A544-T549 VanDerWaalsContact CB-OG1 3.23Å; A544-T549 WeakPolarHBondContact CB-OG1 3.33Å
545	E	87.4	Confident	85	Confident	51 Å²	51	41.3 Å²	41.3	24%	0.238	20%	0.202	C	C	.	.	S	Bend	trans	-83.9	160.5	175.2	-38.1	-55.8	168.4	0	0	110.5	N220 K221 Q543 G547 K548	N220-E545 PolarHBondContact ND2-O 2.59Å; N220-E545 PolarHBondContact OD1-N 3.42Å; N220-E545 VanDerWaalsContact OD1-N 3.1Å; K221-E545 WeakPolarHBondContact CE-OE1 3.33Å; K221-E545 IonicContact NZ-OE1 3.04Å; K221-E545 PolarHBondContact NZ-OE1 3.23Å; Q543-E545 PolarHBondContact NE2-OE2 2.78Å; E545-G547 VanDerWaalsContact C-N 3.33Å; E545-G547 PolarHBondContact O-N 3.43Å; E545-K548 WeakPolarHBondContact O-CB 3.37Å; E545-K548 WeakPolarHBondContact O-CG 3.37Å; E545-K548 PolarHBondContact O-N 3.15Å
546	D	84.3	Confident	86.5	Confident	42 Å²	42	32.6 Å²	32.6	23%	0.225	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	36.5	175.8	-48.8	-29	0	0	0	114.7	Y335 Y443 K548	Y335-D546 WeakPolarHBondContact CE2-OD2 3.22Å; Y335-D546 VanDerWaalsContact CZ-OD2 3.24Å; Y335-D546 PolarHBondContact OH-OD2 2.86Å; Y443-D546 WeakPolarHBondContact CD1-O 3.36Å; D546-K548 PolarHBondContact O-N 3.32Å; D546-K548 VanDerWaalsContact O-N 3.13Å
547	G	86.8	Confident	87.6	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	23.4	177.6	0	0	0	0	0	114.7	W530 E545 T549 E550 L551	W530-G547 VanDerWaalsContact CD2-CA 3.43Å; E545-G547 VanDerWaalsContact C-N 3.33Å; E545-G547 PolarHBondContact O-N 3.43Å; G547-T549 PolarHBondContact O-N 3.13Å; G547-E550 WeakPolarHBondContact CA-OE2 3.36Å; G547-E550 PolarHBondContact O-N 3.45Å; G547-L551 WeakPolarHBondContact O-CB 3.43Å; G547-L551 PolarHBondContact O-N 3.41Å; G547-L551 VanDerWaalsContact O-N 3.08Å
548	K	92.3	Very high	88.3	Confident	1 Å²	1	26.4 Å²	26.4	0%	0.004	14%	0.136	C	C	.	.	H	α-helix	trans	-64	-35.6	-168.2	-86.8	-147.3	174	-155.1	0	114.5	N220 Y335 R337 F339 Y443 A544 E545 D546 S552	N220-K548 HydrophobicContact CB-CD 4.23Å; Y335-K548 VanDerWaalsContact O-CE 3.23Å; Y335-K548 WeakPolarHBondContact O-CE 3.19Å; Y335-K548 PolarHBondContact O-NZ 3.09Å; R337-K548 PolarHBondContact O-NZ 3.23Å; F339-K548 HydrophobicContact CE2-CB 3.99Å; F339-K548 HydrophobicContact CE2-CD 4.29Å; Y443-K548 HydrophobicContact CD1-CG 4.32Å; Y443-K548 HydrophobicContact CE1-CB 4.38Å; Y443-K548 HydrophobicContact CE1-CG 3.62Å; Y443-K548 PolarHBondContact OH-O 2.85Å; A544-K548 HydrophobicContact CB-CB 3.97Å; E545-K548 WeakPolarHBondContact O-CB 3.37Å; E545-K548 WeakPolarHBondContact O-CG 3.37Å; E545-K548 PolarHBondContact O-N 3.15Å; D546-K548 PolarHBondContact O-N 3.32Å; D546-K548 VanDerWaalsContact O-N 3.13Å; K548-S552 WeakPolarHBondContact O-CB 3.27Å; K548-S552 PolarHBondContact O-N 3.48Å; K548-S552 PolarHBondContact O-OG 3.31Å
549	T	92.2	Very high	89	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.2	-48.8	-178.4	-57.8	0	0	0	0	110.3	I522 H525 A544 G547 L553	I522-T549 HydrophobicContact CG1-CG2 4.42Å; H525-T549 HydrophobicContact CB-CG2 4.35Å; H525-T549 PolarHBondContact O-OG1 3.45Å; A544-T549 VanDerWaalsContact CB-OG1 3.23Å; A544-T549 WeakPolarHBondContact CB-OG1 3.33Å; G547-T549 PolarHBondContact O-N 3.13Å; T549-L553 WeakPolarHBondContact O-CB 3.39Å; T549-L553 PolarHBondContact O-N 3.2Å
550	E	91.2	Very high	89.5	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66	-48.7	-176.3	-60.6	76.5	-171.8	0	0	111.6	G526 H527 W530 G547 L553 M554 F572	G526-E550 WeakPolarHBondContact CA-OE1 3.45Å; H527-E550 PolarHBondContact N-OE1 3.42Å; W530-E550 HydrophobicContact CB-CG 4.46Å; G547-E550 WeakPolarHBondContact CA-OE2 3.36Å; G547-E550 PolarHBondContact O-N 3.45Å; E550-L553 PolarHBondContact O-N 3.08Å; E550-M554 PolarHBondContact O-N 3.22Å; E550-M554 VanDerWaalsContact O-N 3.08Å; E550-F572 HydrophobicContact CB-CE1 4.38Å; E550-F572 HydrophobicContact CB-CZ 4.05Å; E550-F572 HydrophobicContact CG-CZ 3.99Å
551	L	92.3	Very high	89.8	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-70.1	-36.8	179.2	-72.8	166.8	0	0	0	112.2	H442 Y443 W530 G547 H555 M705 A709 I712	H442-L551 WeakPolarHBondContact O-CD1 3.15Å; Y443-L551 HydrophobicContact CD1-CD1 3.75Å; Y443-L551 HydrophobicContact CE1-CB 3.84Å; Y443-L551 HydrophobicContact CE1-CD1 3.46Å; Y443-L551 VanDerWaalsContact CE1-CD1 3.46Å; Y443-L551 HydrophobicContact CE1-CG 4.3Å; W530-L551 HydrophobicContact CZ3-CD1 4.02Å; G547-L551 WeakPolarHBondContact O-CB 3.43Å; G547-L551 PolarHBondContact O-N 3.41Å; G547-L551 VanDerWaalsContact O-N 3.08Å; L551-H555 WeakPolarHBondContact O-CB 3.37Å; L551-H555 PolarHBondContact O-N 3.06Å; L551-M705 HydrophobicContact CB-CE 4.42Å; L551-M705 HydrophobicContact CD2-CE 3.87Å; L551-M705 WeakPolarHBondContact O-CE 3.41Å; L551-A709 HydrophobicContact CD2-CB 4.21Å; L551-I712 HydrophobicContact CD2-CD1 3.68Å; L551-I712 HydrophobicContact CG-CD1 4.46Å
552	S	94.4	Very high	89.9	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.6	-42.4	175.4	-58	0	0	0	0	111.7	H338 F339 Y443 K548 H555 F556	H338-S552 WeakPolarHBondContact CA-OG 3.36Å; H338-S552 WeakPolarHBondContact CB-OG 3.5Å; F339-S552 PolarHBondContact N-OG 3.48Å; Y443-S552 PolarHBondContact OH-OG 3.06Å; K548-S552 WeakPolarHBondContact O-CB 3.27Å; K548-S552 PolarHBondContact O-N 3.48Å; K548-S552 PolarHBondContact O-OG 3.31Å; S552-H555 PolarHBondContact O-N 3.07Å; S552-F556 WeakPolarHBondContact O-CB 3.33Å; S552-F556 PolarHBondContact O-N 3.1Å
553	L	93.1	Very high	90.1	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.1	-50.7	177	174.8	64	0	0	0	111.8	M520 I522 T549 E550 H555 F556 A557 W563 T569 F572 I573	M520-L553 HydrophobicContact CB-CB 4.18Å; M520-L553 HydrophobicContact CB-CD1 4.21Å; I522-L553 HydrophobicContact CD1-CD2 3.65Å; I522-L553 HydrophobicContact CG1-CD2 4.16Å; T549-L553 WeakPolarHBondContact O-CB 3.39Å; T549-L553 PolarHBondContact O-N 3.2Å; E550-L553 PolarHBondContact O-N 3.08Å; L553-H555 VanDerWaalsContact C-N 3.32Å; L553-H555 PolarHBondContact O-N 3.23Å; L553-F556 PolarHBondContact O-N 2.99Å; L553-A557 WeakPolarHBondContact O-CB 3.28Å; L553-A557 PolarHBondContact O-N 3.47Å; L553-W563 HydrophobicContact CD1-CH2 3.86Å; L553-W563 HydrophobicContact CD1-CZ3 3.98Å; L553-T569 HydrophobicContact CD1-CG2 3.19Å; L553-T569 HydrophobicContact CD2-CG2 3.37Å; L553-T569 HydrophobicContact CG-CG2 3.85Å; L553-F572 HydrophobicContact CD2-CD1 4.07Å; L553-I573 HydrophobicContact CD1-CD1 4.14Å; L553-I573 HydrophobicContact CD2-CD1 4.15Å; L553-I573 HydrophobicContact CD2-CG1 4.1Å; L553-I573 HydrophobicContact CG-CD1 4.05Å; L553-I573 HydrophobicContact CG-CG1 4.32Å
554	M	91.1	Very high	90	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63	-41.4	-178.2	-170.1	57.6	59.1	0	0	110.9	E550 F556 A557 I558 I573 L576 M705 H708	E550-M554 PolarHBondContact O-N 3.22Å; E550-M554 VanDerWaalsContact O-N 3.08Å; M554-F556 PolarHBondContact O-N 3.43Å; M554-A557 PolarHBondContact O-N 3.4Å; M554-I558 HydrophobicContact CG-CD1 3.73Å; M554-I558 WeakPolarHBondContact O-CB 3.39Å; M554-I558 VanDerWaalsContact O-CG1 3.26Å; M554-I558 WeakPolarHBondContact O-CG1 3.29Å; M554-I558 PolarHBondContact O-N 3.48Å; M554-I558 HydrophobicContact SD-CD1 3.78Å; M554-I558 HydrophobicContact SD-CG1 4.16Å; M554-I573 HydrophobicContact CE-CB 4.25Å; M554-I573 HydrophobicContact CE-CG1 4.01Å; M554-I573 HydrophobicContact CE-CG2 4.08Å; M554-I573 HydrophobicContact SD-CG2 4.48Å; M554-L576 HydrophobicContact CE-CB 4.3Å; M554-L576 HydrophobicContact CE-CD2 3.72Å; M554-M705 HydrophobicContact CB-CE 4.33Å; M554-M705 HydrophobicContact CB-SD 3.96Å; M554-M705 HydrophobicContact CG-SD 3.74Å; M554-H708 HydrophobicContact CG-CB 4.01Å
555	H	93.3	Very high	89.9	Confident	13 Å²	13	30.9 Å²	30.9	6%	0.06	16%	0.161	C	C	.	.	H	α-helix	trans	-58.5	-47.5	173	-178.9	-94.4	0	0	0	112.4	H338 E341 E345 L551 S552 L553 T559 M705	H338-H555 AromaticContact CE1-CD2 3.21Å; H338-H555 PolarHBondContact CE1-CD2 2.63Å; H338-H555 AromaticContact CE1-CG 3.38Å; H338-H555 AromaticContact CE1-ND1 3.98Å; H338-H555 AromaticContact CE1-NE2 3.72Å; H338-H555 AromaticContact CG-CG 3.99Å; H338-H555 AromaticContact ND1-CD2 3.67Å; H338-H555 AromaticContact ND1-CE1 3.89Å; H338-H555 AromaticContact ND1-CG 3.53Å; H338-H555 AromaticContact ND1-ND1 3.68Å; H338-H555 AromaticContact ND1-NE2 3.86Å; H338-H555 AromaticContact NE2-CD2 3.9Å; H338-H555 AromaticContact NE2-CG 3.82Å; E341-H555 IonicContact OE1-CE1 2.67Å; E341-H555 IonicContact OE1-NE2 2.71Å; E345-H555 IonicContact OE2-CE1 2.75Å; L551-H555 WeakPolarHBondContact O-CB 3.37Å; L551-H555 PolarHBondContact O-N 3.06Å; S552-H555 PolarHBondContact O-N 3.07Å; L553-H555 VanDerWaalsContact C-N 3.32Å; L553-H555 PolarHBondContact O-N 3.23Å; H555-T559 VanDerWaalsContact O-CB 3.26Å; H555-T559 WeakPolarHBondContact O-CB 3.44Å; H555-T559 PolarHBondContact O-N 3.39Å; H555-T559 PolarHBondContact O-OG1 3.09Å; H555-M705 HydrophobicContact CB-CE 4.09Å; H555-M705 HydrophobicContact CB-SD 4.2Å
556	F	93.8	Very high	89.8	Confident	1 Å²	1	32 Å²	32	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-66	-43.4	-178.1	-169.3	-93.7	0	0	0	112.1	L202 Y205 N340 M520 S552 L553 M554 T559 N560 W563	L202-F556 HydrophobicContact CB-CE1 4.21Å; L202-F556 HydrophobicContact CB-CZ 4.1Å; L202-F556 HydrophobicContact CD1-CE1 3.98Å; L202-F556 HydrophobicContact CD1-CE2 4.24Å; L202-F556 HydrophobicContact CD1-CZ 3.79Å; Y205-F556 HydrophobicContact CD1-CD2 4.49Å; Y205-F556 AromaticContact CD1-CE2 3.8Å; Y205-F556 HydrophobicContact CD1-CE2 3.8Å; Y205-F556 AromaticContact CD2-CE2 3.72Å; Y205-F556 HydrophobicContact CD2-CE2 3.72Å; Y205-F556 HydrophobicContact CD2-CZ 4.03Å; Y205-F556 AromaticContact CE1-CE2 3.99Å; Y205-F556 HydrophobicContact CE1-CE2 3.99Å; Y205-F556 AromaticContact CE2-CE2 3.93Å; Y205-F556 HydrophobicContact CE2-CE2 3.93Å; Y205-F556 HydrophobicContact CE2-CZ 4.33Å; Y205-F556 AromaticContact CG-CE2 3.64Å; Y205-F556 HydrophobicContact CG-CE2 3.64Å; Y205-F556 HydrophobicContact CG-CZ 4.27Å; N340-F556 HydrophobicContact CB-CD2 3.78Å; N340-F556 HydrophobicContact CB-CE2 3.98Å; M520-F556 HydrophobicContact CE-CB 4.03Å; M520-F556 HydrophobicContact CE-CD1 3.78Å; M520-F556 HydrophobicContact CE-CE1 4.44Å; M520-F556 HydrophobicContact CE-CG 3.84Å; M520-F556 HydrophobicContact SD-CB 3.85Å; M520-F556 HydrophobicContact SD-CG 4.19Å; S552-F556 WeakPolarHBondContact O-CB 3.33Å; S552-F556 PolarHBondContact O-N 3.1Å; L553-F556 PolarHBondContact O-N 2.99Å; M554-F556 PolarHBondContact O-N 3.43Å; F556-T559 PolarHBondContact O-N 3.41Å; F556-N560 HydrophobicContact CE1-CB 4.4Å; F556-N560 WeakPolarHBondContact CE2-ND2 3.21Å; F556-N560 WeakPolarHBondContact O-CB 3.46Å; F556-N560 PolarHBondContact O-N 3.46Å; F556-N560 PolarHBondContact O-ND2 2.92Å; F556-N560 VanDerWaalsContact O-ND2 3.15Å; F556-W563 AromaticContact CD1-CD2 3.92Å; F556-W563 HydrophobicContact CD1-CD2 3.92Å; F556-W563 AromaticContact CD1-CE3 3.64Å; F556-W563 HydrophobicContact CD1-CE3 3.64Å; F556-W563 HydrophobicContact CD1-CH2 4.28Å; F556-W563 AromaticContact CD1-CZ3 3.83Å; F556-W563 HydrophobicContact CD1-CZ3 3.83Å; F556-W563 HydrophobicContact CE1-CB 4.37Å; F556-W563 AromaticContact CE1-CD2 3.63Å; F556-W563 HydrophobicContact CE1-CD2 3.63Å; F556-W563 AromaticContact CE1-CE2 3.99Å; F556-W563 AromaticContact CE1-CE3 3.87Å; F556-W563 HydrophobicContact CE1-CE3 3.87Å; F556-W563 AromaticContact CE1-CG 3.85Å; F556-W563 HydrophobicContact CE1-CG 3.85Å; F556-W563 HydrophobicContact CE1-CZ3 4.38Å
557	A	91.7	Very high	89.6	Confident	18 Å²	18	41.1 Å²	41.1	15%	0.149	20%	0.204	C	C	.	.	H	α-helix	trans	-68.9	-32.5	179.7	0	0	0	0	0	113.5	L553 M554 W563 I573	L553-A557 WeakPolarHBondContact O-CB 3.28Å; L553-A557 PolarHBondContact O-N 3.47Å; M554-A557 PolarHBondContact O-N 3.4Å; A557-W563 HydrophobicContact CB-CE3 4.39Å; A557-W563 HydrophobicContact CB-CZ3 4.2Å; A557-I573 HydrophobicContact CB-CD1 3.88Å
558	I	90.2	Very high	89.1	Confident	12 Å²	12	45.7 Å²	45.7	6%	0.062	23%	0.226	C	C	.	.	H	α-helix	trans	-76	-37	173.8	-69.5	170.7	0	0	0	111	M554 A701 E704 M705	M554-I558 HydrophobicContact CG-CD1 3.73Å; M554-I558 WeakPolarHBondContact O-CB 3.39Å; M554-I558 VanDerWaalsContact O-CG1 3.26Å; M554-I558 WeakPolarHBondContact O-CG1 3.29Å; M554-I558 PolarHBondContact O-N 3.48Å; M554-I558 HydrophobicContact SD-CD1 3.78Å; M554-I558 HydrophobicContact SD-CG1 4.16Å; I558-A701 HydrophobicContact CG2-CB 3.67Å; I558-A701 WeakPolarHBondContact CG2-O 3.09Å; I558-E704 HydrophobicContact CD1-CB 4.42Å; I558-E704 HydrophobicContact CD1-CG 4Å; I558-E704 HydrophobicContact CG2-CB 4.39Å; I558-M705 HydrophobicContact CD1-CB 4.03Å; I558-M705 HydrophobicContact CD1-SD 4.1Å
559	T	90.3	Very high	88.6	Confident	32 Å²	32	46.2 Å²	46.2	20%	0.196	23%	0.229	C	C	.	.	H	α-helix	trans	-73.3	-33	-179.7	-57.2	0	0	0	0	112.6	H555 F556 P561	H555-T559 VanDerWaalsContact O-CB 3.26Å; H555-T559 WeakPolarHBondContact O-CB 3.44Å; H555-T559 PolarHBondContact O-N 3.39Å; H555-T559 PolarHBondContact O-OG1 3.09Å; F556-T559 PolarHBondContact O-N 3.41Å; T559-P561 WeakPolarHBondContact O-CD 3.41Å
560	N	91.3	Very high	88.2	Confident	2 Å²	2	49 Å²	49	1%	0.011	25%	0.246	C	C	.	.			trans	-121.7	72.9	-175	-58.2	-85.3	0	0	0	110.7	Q177 Y205 F556 H562 W563	Q177-N560 PolarHBondContact NE2-OD1 3.23Å; Q177-N560 PolarHBondContact OE1-OD1 3.31Å; Y205-N560 WeakPolarHBondContact CE2-OD1 3.31Å; Y205-N560 PolarHBondContact OH-ND2 3.25Å; Y205-N560 PolarHBondContact OH-OD1 3.18Å; F556-N560 HydrophobicContact CE1-CB 4.4Å; F556-N560 WeakPolarHBondContact CE2-ND2 3.21Å; F556-N560 WeakPolarHBondContact O-CB 3.46Å; F556-N560 PolarHBondContact O-N 3.46Å; F556-N560 PolarHBondContact O-ND2 2.92Å; F556-N560 VanDerWaalsContact O-ND2 3.15Å; N560-H562 PolarHBondContact O-N 2.89Å; N560-H562 VanDerWaalsContact O-N 3.09Å; N560-W563 HydrophobicContact CB-CB 4.2Å; N560-W563 VanDerWaalsContact O-CB 3.31Å; N560-W563 WeakPolarHBondContact O-CB 3.26Å; N560-W563 PolarHBondContact O-N 3.4Å
561	P	87.1	Confident	87.8	Confident	98 Å²	98	54.4 Å²	54.4	64%	0.636	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-10.1	-169.9	28.4	-37.2	0	0	0	115.2	T559	T559-P561 WeakPolarHBondContact O-CD 3.41Å
562	H	85.7	Confident	87.4	Confident	151 Å²	151	55 Å²	55	70%	0.699	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-17.9	173.6	-63	-54.2	0	0	0	113.4	N560	N560-H562 PolarHBondContact O-N 2.89Å; N560-H562 VanDerWaalsContact O-N 3.09Å
563	W	88.9	Confident	86.9	Confident	23 Å²	23	55.8 Å²	55.8	9%	0.087	28%	0.278	C	S	.	.			trans	-65.7	134.5	177.3	175	64.5	0	0	0	110.9	E201 L202 M520 L553 F556 A557 N560 P565 T569	E201-W563 HydrophobicContact CB-CB 4.41Å; E201-W563 HydrophobicContact CG-CB 4.36Å; E201-W563 PolarHBondContact OE1-N 3.36Å; E201-W563 WeakPolarHBondContact OE2-CA 3.41Å; L202-W563 HydrophobicContact CD2-CZ2 3.98Å; M520-W563 HydrophobicContact CE-CH2 4.11Å; M520-W563 HydrophobicContact CE-CZ2 4.46Å; L553-W563 HydrophobicContact CD1-CH2 3.86Å; L553-W563 HydrophobicContact CD1-CZ3 3.98Å; F556-W563 AromaticContact CD1-CD2 3.92Å; F556-W563 HydrophobicContact CD1-CD2 3.92Å; F556-W563 AromaticContact CD1-CE3 3.64Å; F556-W563 HydrophobicContact CD1-CE3 3.64Å; F556-W563 HydrophobicContact CD1-CH2 4.28Å; F556-W563 AromaticContact CD1-CZ3 3.83Å; F556-W563 HydrophobicContact CD1-CZ3 3.83Å; F556-W563 HydrophobicContact CE1-CB 4.37Å; F556-W563 AromaticContact CE1-CD2 3.63Å; F556-W563 HydrophobicContact CE1-CD2 3.63Å; F556-W563 AromaticContact CE1-CE2 3.99Å; F556-W563 AromaticContact CE1-CE3 3.87Å; F556-W563 HydrophobicContact CE1-CE3 3.87Å; F556-W563 AromaticContact CE1-CG 3.85Å; F556-W563 HydrophobicContact CE1-CG 3.85Å; F556-W563 HydrophobicContact CE1-CZ3 4.38Å; A557-W563 HydrophobicContact CB-CE3 4.39Å; A557-W563 HydrophobicContact CB-CZ3 4.2Å; N560-W563 HydrophobicContact CB-CB 4.2Å; N560-W563 VanDerWaalsContact O-CB 3.31Å; N560-W563 WeakPolarHBondContact O-CB 3.26Å; N560-W563 PolarHBondContact O-N 3.4Å; W563-P565 HydrophobicContact CE3-CB 4.29Å; W563-P565 HydrophobicContact CH2-CB 3.8Å; W563-P565 HydrophobicContact CZ2-CB 4.36Å; W563-P565 HydrophobicContact CZ3-CB 3.75Å; W563-P565 HydrophobicContact CZ3-CG 4.32Å; W563-P565 WeakPolarHBondContact O-CD 3.3Å; W563-T569 HydrophobicContact CH2-CG2 4.47Å
564	Q	86.2	Confident	86.5	Confident	171 Å²	171	58.7 Å²	58.7	80%	0.799	30%	0.298	S	S	*	.			trans	-98.2	104.9	178.2	-63.9	-175.3	22	0	0	110.4
565	P	85	Confident	86.2	Confident	33 Å²	33	60.4 Å²	60.4	21%	0.214	31%	0.306	C	S	.	.			trans	-63.7	152	176.6	16.9	-26.4	0	0	0	113.2	W563 T569 T570 I573	W563-P565 HydrophobicContact CE3-CB 4.29Å; W563-P565 HydrophobicContact CH2-CB 3.8Å; W563-P565 HydrophobicContact CZ2-CB 4.36Å; W563-P565 HydrophobicContact CZ3-CB 3.75Å; W563-P565 HydrophobicContact CZ3-CG 4.32Å; W563-P565 WeakPolarHBondContact O-CD 3.3Å; P565-T569 HydrophobicContact CB-CG2 3.88Å; P565-T570 WeakPolarHBondContact CG-OG1 3.49Å; P565-T570 PolarHBondContact O-OG1 3.46Å; P565-T570 VanDerWaalsContact O-OG1 3.07Å; P565-I573 HydrophobicContact CB-CD1 4.21Å; P565-I573 HydrophobicContact CG-CD1 4.12Å
566	P	85.4	Confident	85.7	Confident	75 Å²	75	60 Å²	60	49%	0.487	31%	0.305	S	S	.	.			trans	-57.3	150.1	169	-22.5	32.5	0	0	0	112.2	E568 T569 T570	P566-E568 VanDerWaalsContact C-N 3.26Å; P566-E568 PolarHBondContact O-N 2.82Å; P566-T569 CarbonylContact O-C 3.54Å; P566-T569 WeakPolarHBondContact O-CA 3.03Å; P566-T569 WeakPolarHBondContact O-CB 3.27Å; P566-T569 PolarHBondContact O-N 3.39Å; P566-T570 PolarHBondContact O-N 3.15Å; P566-T570 PolarHBondContact O-OG1 3.34Å
567	R	80.4	Confident	85.3	Confident	233 Å²	233	62.5 Å²	62.5	88%	0.879	32%	0.316	S	S	*	.	H	α-helix	trans	-50.6	-40.1	-170.2	-66.5	-178	177	-179.2	-0.8	115.1	T570 H571	R567-T570 PolarHBondContact O-N 2.99Å; R567-H571 PolarHBondContact O-N 2.81Å; R567-H571 VanDerWaalsContact O-N 3.13Å
568	E	74.7	Confident	85	Confident	96 Å²	96	68 Å²	68	45%	0.449	34%	0.338	S	S	.	.	H	α-helix	trans	-71.5	-45	-177.9	-55.9	173.6	151.8	0	0	110.7	R523 P566 T570 H571 F572	R523-E568 VanDerWaalsContact CD-CD 3.41Å; R523-E568 WeakPolarHBondContact CD-OE1 3.42Å; R523-E568 WeakPolarHBondContact CD-OE2 3.45Å; R523-E568 IonicContact CZ-OE1 3.65Å; R523-E568 IonicContact NE-OE1 2.7Å; R523-E568 IonicContact NH1-OE1 2.75Å; R523-E568 PolarHBondContact NH1-OE1 3.09Å; R523-E568 IonicContact NH1-OE2 3.16Å; P566-E568 VanDerWaalsContact C-N 3.26Å; P566-E568 PolarHBondContact O-N 2.82Å; E568-T570 VanDerWaalsContact C-N 3.34Å; E568-T570 PolarHBondContact O-N 3.21Å; E568-H571 WeakPolarHBondContact O-CB 3.43Å; E568-H571 PolarHBondContact O-N 2.89Å; E568-F572 PolarHBondContact O-N 3.14Å
569	T	82.4	Confident	84.5	Confident	12 Å²	12	70.9 Å²	70.9	7%	0.074	35%	0.348	C	S	.	.	H	α-helix	trans	-56.5	-45.1	170.8	-43.9	0	0	0	0	111.6	L553 W563 P565 P566 H571 F572 I573	L553-T569 HydrophobicContact CD1-CG2 3.19Å; L553-T569 HydrophobicContact CD2-CG2 3.37Å; L553-T569 HydrophobicContact CG-CG2 3.85Å; W563-T569 HydrophobicContact CH2-CG2 4.47Å; P565-T569 HydrophobicContact CB-CG2 3.88Å; P566-T569 CarbonylContact O-C 3.54Å; P566-T569 WeakPolarHBondContact O-CA 3.03Å; P566-T569 WeakPolarHBondContact O-CB 3.27Å; P566-T569 PolarHBondContact O-N 3.39Å; T569-H571 PolarHBondContact O-N 3.45Å; T569-F572 PolarHBondContact O-N 2.79Å; T569-I573 HydrophobicContact CG2-CD1 4.19Å; T569-I573 WeakPolarHBondContact O-CG1 3.46Å; T569-I573 PolarHBondContact O-N 3.37Å; T569-I573 VanDerWaalsContact O-N 3.1Å
570	T	84.5	Confident	84.1	Confident	60 Å²	60	69.9 Å²	69.9	37%	0.368	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-42.3	177.2	-49.3	0	0	0	0	112	P565 P566 R567 E568 I573 S574	P565-T570 WeakPolarHBondContact CG-OG1 3.49Å; P565-T570 PolarHBondContact O-OG1 3.46Å; P565-T570 VanDerWaalsContact O-OG1 3.07Å; P566-T570 PolarHBondContact O-N 3.15Å; P566-T570 PolarHBondContact O-OG1 3.34Å; R567-T570 PolarHBondContact O-N 2.99Å; E568-T570 VanDerWaalsContact C-N 3.34Å; E568-T570 PolarHBondContact O-N 3.21Å; T570-I573 PolarHBondContact O-N 3.01Å; T570-S574 WeakPolarHBondContact O-CB 3.13Å; T570-S574 PolarHBondContact O-N 3.39Å; T570-S574 PolarHBondContact O-OG 3.11Å; T570-S574 VanDerWaalsContact O-OG 3.13Å
571	H	82.9	Confident	83.7	Confident	113 Å²	113	75 Å²	75	52%	0.523	37%	0.369	S	S	.	.	H	α-helix	trans	-58.3	-51.9	178.2	-174.6	-87.9	0	0	0	111	R567 E568 T569 I573 S574 Q575	R567-H571 PolarHBondContact O-N 2.81Å; R567-H571 VanDerWaalsContact O-N 3.13Å; E568-H571 WeakPolarHBondContact O-CB 3.43Å; E568-H571 PolarHBondContact O-N 2.89Å; T569-H571 PolarHBondContact O-N 3.45Å; H571-I573 PolarHBondContact O-N 3.45Å; H571-S574 PolarHBondContact O-N 3.17Å; H571-S574 PolarHBondContact O-OG 3.4Å; H571-Q575 PolarHBondContact CE1-NE2 2.64Å; H571-Q575 PolarHBondContact CE1-OE1 3.21Å; H571-Q575 PolarHBondContact ND1-OE1 2.71Å; H571-Q575 WeakPolarHBondContact O-CG 3.29Å; H571-Q575 PolarHBondContact O-N 2.91Å
572	F	83.3	Confident	83.3	Confident	11 Å²	11	76.6 Å²	76.6	5%	0.048	36%	0.363	C	S	.	.	H	α-helix	trans	-56.9	-46.9	176	174.8	-96.5	0	0	0	112.7	I522 M531 E550 L553 E568 T569 S574 Q575 L576	I522-F572 HydrophobicContact CD1-CB 3.53Å; I522-F572 HydrophobicContact CD1-CD1 3.45Å; I522-F572 VanDerWaalsContact CD1-CD1 3.45Å; I522-F572 HydrophobicContact CD1-CD2 4.02Å; I522-F572 HydrophobicContact CD1-CE1 4.11Å; I522-F572 HydrophobicContact CD1-CG 3.39Å; M531-F572 HydrophobicContact CG-CE2 4.47Å; E550-F572 HydrophobicContact CB-CE1 4.38Å; E550-F572 HydrophobicContact CB-CZ 4.05Å; E550-F572 HydrophobicContact CG-CZ 3.99Å; L553-F572 HydrophobicContact CD2-CD1 4.07Å; E568-F572 PolarHBondContact O-N 3.14Å; T569-F572 PolarHBondContact O-N 2.79Å; F572-S574 PolarHBondContact O-N 3.42Å; F572-Q575 PolarHBondContact O-N 2.82Å; F572-L576 PolarHBondContact O-N 2.98Å
573	I	84.6	Confident	82.7	Confident	17 Å²	17	74.9 Å²	74.9	9%	0.087	36%	0.355	C	S	.	.	H	α-helix	trans	-60.3	-46.7	178.3	-66.4	163.7	0	0	0	110.6	L553 M554 A557 P565 T569 T570 H571 L576 K577	L553-I573 HydrophobicContact CD1-CD1 4.14Å; L553-I573 HydrophobicContact CD2-CD1 4.15Å; L553-I573 HydrophobicContact CD2-CG1 4.1Å; L553-I573 HydrophobicContact CG-CD1 4.05Å; L553-I573 HydrophobicContact CG-CG1 4.32Å; M554-I573 HydrophobicContact CE-CB 4.25Å; M554-I573 HydrophobicContact CE-CG1 4.01Å; M554-I573 HydrophobicContact CE-CG2 4.08Å; M554-I573 HydrophobicContact SD-CG2 4.48Å; A557-I573 HydrophobicContact CB-CD1 3.88Å; P565-I573 HydrophobicContact CB-CD1 4.21Å; P565-I573 HydrophobicContact CG-CD1 4.12Å; T569-I573 HydrophobicContact CG2-CD1 4.19Å; T569-I573 WeakPolarHBondContact O-CG1 3.46Å; T569-I573 PolarHBondContact O-N 3.37Å; T569-I573 VanDerWaalsContact O-N 3.1Å; T570-I573 PolarHBondContact O-N 3.01Å; H571-I573 PolarHBondContact O-N 3.45Å; I573-L576 PolarHBondContact O-N 2.98Å; I573-K577 HydrophobicContact CG2-CD 4.3Å; I573-K577 HydrophobicContact CG2-CG 4.5Å; I573-K577 WeakPolarHBondContact O-CB 3.4Å; I573-K577 WeakPolarHBondContact O-CG 3.35Å; I573-K577 PolarHBondContact O-N 3.37Å
574	S	84.6	Confident	81.8	Confident	62 Å²	62	77.6 Å²	77.6	43%	0.434	38%	0.382	S	S	.	.	H	α-helix	trans	-62.9	-43.8	179.1	60.4	0	0	0	0	112.6	T570 H571 F572 L576 K577 E578	T570-S574 WeakPolarHBondContact O-CB 3.13Å; T570-S574 PolarHBondContact O-N 3.39Å; T570-S574 PolarHBondContact O-OG 3.11Å; T570-S574 VanDerWaalsContact O-OG 3.13Å; H571-S574 PolarHBondContact O-N 3.17Å; H571-S574 PolarHBondContact O-OG 3.4Å; F572-S574 PolarHBondContact O-N 3.42Å; S574-L576 PolarHBondContact O-N 3.27Å; S574-K577 PolarHBondContact O-N 3.33Å; S574-E578 WeakPolarHBondContact O-CB 3.48Å; S574-E578 PolarHBondContact O-N 3.41Å
575	Q	84.1	Confident	80.8	Confident	36 Å²	36	73.5 Å²	73.5	17%	0.168	38%	0.378	C	S	.	.	H	α-helix	trans	-63.7	-41.4	177.3	-73.3	-175.9	-61.9	0	0	112.3	H571 F572 E578 R579	H571-Q575 PolarHBondContact CE1-NE2 2.64Å; H571-Q575 PolarHBondContact CE1-OE1 3.21Å; H571-Q575 PolarHBondContact ND1-OE1 2.71Å; H571-Q575 WeakPolarHBondContact O-CG 3.29Å; H571-Q575 PolarHBondContact O-N 2.91Å; F572-Q575 PolarHBondContact O-N 2.82Å; Q575-E578 PolarHBondContact O-N 3.45Å; Q575-R579 WeakPolarHBondContact O-CG 3.35Å; Q575-R579 PolarHBondContact O-N 3.01Å
576	L	83.6	Confident	79.3	Confident	4 Å²	4	74.6 Å²	74.6	2%	0.021	40%	0.395	C	S	.	.	H	α-helix	trans	-68.3	-42	178.3	-161.4	81.6	0	0	0	111.4	M554 F572 I573 S574 R579 V580 Y711 I712	M554-L576 HydrophobicContact CE-CB 4.3Å; M554-L576 HydrophobicContact CE-CD2 3.72Å; F572-L576 PolarHBondContact O-N 2.98Å; I573-L576 PolarHBondContact O-N 2.98Å; S574-L576 PolarHBondContact O-N 3.27Å; L576-R579 PolarHBondContact O-N 3.39Å; L576-V580 WeakPolarHBondContact O-CB 3.45Å; L576-V580 WeakPolarHBondContact O-CG2 3.48Å; L576-V580 PolarHBondContact O-N 3.38Å; L576-Y711 HydrophobicContact CD1-CD1 4Å; L576-Y711 HydrophobicContact CD1-CE1 3.89Å; L576-Y711 HydrophobicContact CG-CD1 4.45Å; L576-I712 HydrophobicContact CD1-CG1 4.26Å; L576-I712 HydrophobicContact CD2-CD1 3.77Å; L576-I712 HydrophobicContact CD2-CG1 3.82Å
577	K	84.7	Confident	77.1	Confident	54 Å²	54	73.7 Å²	73.7	24%	0.235	39%	0.393	C	S	.	.	H	α-helix	trans	-64	-40.3	175	-70	-164.3	177.9	-157.2	0	112	I573 S574 N581 E704	I573-K577 HydrophobicContact CG2-CD 4.3Å; I573-K577 HydrophobicContact CG2-CG 4.5Å; I573-K577 WeakPolarHBondContact O-CB 3.4Å; I573-K577 WeakPolarHBondContact O-CG 3.35Å; I573-K577 PolarHBondContact O-N 3.37Å; S574-K577 PolarHBondContact O-N 3.33Å; K577-N581 VanDerWaalsContact O-CB 3.26Å; K577-N581 WeakPolarHBondContact O-CB 3.36Å; K577-N581 PolarHBondContact O-N 2.9Å; K577-N581 PolarHBondContact O-ND2 3.35Å; K577-N581 VanDerWaalsContact O-ND2 3.15Å; K577-E704 WeakPolarHBondContact CE-OE1 3.5Å; K577-E704 IonicContact NZ-OE1 3.3Å; K577-E704 PolarHBondContact NZ-OE1 3.47Å; K577-E704 IonicContact NZ-OE2 2.67Å
578	E	85.1	Confident	75.1	Confident	132 Å²	132	67.8 Å²	67.8	62%	0.617	39%	0.388	S	S	*	.	H	α-helix	trans	-62.5	-46.9	174.9	-170	-175.1	165.6	0	0	112.1	S574 Q575 N581 R582	S574-E578 WeakPolarHBondContact O-CB 3.48Å; S574-E578 PolarHBondContact O-N 3.41Å; Q575-E578 PolarHBondContact O-N 3.45Å; E578-N581 PolarHBondContact O-N 3.22Å; E578-R582 VanDerWaalsContact O-CB 3.28Å; E578-R582 WeakPolarHBondContact O-CB 3.34Å; E578-R582 PolarHBondContact O-N 3.06Å
579	R	80.7	Confident	73.1	Confident	74 Å²	74	67.6 Å²	67.6	28%	0.279	40%	0.397	S	S	.	.	H	α-helix	trans	-62.7	-48.5	178.4	-72.2	-179.1	-171.8	-133	-3.8	112.5	E533 Q575 L576 N581 R582 E583 Y711	E533-R579 IonicContact OE1-CZ 3.44Å; E533-R579 IonicContact OE1-NH1 2.67Å; E533-R579 IonicContact OE1-NH2 2.63Å; E533-R579 PolarHBondContact OE1-NH2 3.28Å; E533-R579 IonicContact OE2-NH2 3.66Å; E533-R579 PolarHBondContact OE2-NH2 3.33Å; Q575-R579 WeakPolarHBondContact O-CG 3.35Å; Q575-R579 PolarHBondContact O-N 3.01Å; L576-R579 PolarHBondContact O-N 3.39Å; R579-N581 VanDerWaalsContact C-N 3.31Å; R579-N581 PolarHBondContact O-N 3.48Å; R579-R582 PolarHBondContact O-N 3.4Å; R579-E583 PolarHBondContact O-N 2.97Å; R579-Y711 HydrophobicContact CB-CE1 4.39Å; R579-Y711 WeakPolarHBondContact CB-OH 3.4Å
580	V	81.9	Confident	70.8	Confident	10 Å²	10	75.5 Å²	75.5	6%	0.061	43%	0.433	C	S	.	.	H	α-helix	trans	-57.7	-45.1	176.6	168.3	0	0	0	0	110.9	L576 A584 I707 Y711	L576-V580 WeakPolarHBondContact O-CB 3.45Å; L576-V580 WeakPolarHBondContact O-CG2 3.48Å; L576-V580 PolarHBondContact O-N 3.38Å; V580-A584 WeakPolarHBondContact O-CB 3.32Å; V580-A584 PolarHBondContact O-N 3.13Å; V580-I707 HydrophobicContact CG1-CG2 3.84Å; V580-Y711 HydrophobicContact CG2-CD1 3.39Å; V580-Y711 HydrophobicContact CG2-CD2 4.03Å; V580-Y711 HydrophobicContact CG2-CE1 3.87Å; V580-Y711 HydrophobicContact CG2-CE2 4.45Å; V580-Y711 HydrophobicContact CG2-CG 3.48Å; V580-Y711 VanDerWaalsContact CG2-CG 3.48Å
581	N	81.2	Confident	68.1	Low	109 Å²	109	78.7 Å²	78.7	58%	0.583	45%	0.453	S	S	*	.	H	α-helix	trans	-66.2	-39.4	177.5	-71.7	-22.7	0	0	0	112.6	K577 E578 R579 A585	K577-N581 VanDerWaalsContact O-CB 3.26Å; K577-N581 WeakPolarHBondContact O-CB 3.36Å; K577-N581 PolarHBondContact O-N 2.9Å; K577-N581 PolarHBondContact O-ND2 3.35Å; K577-N581 VanDerWaalsContact O-ND2 3.15Å; E578-N581 PolarHBondContact O-N 3.22Å; R579-N581 VanDerWaalsContact C-N 3.31Å; R579-N581 PolarHBondContact O-N 3.48Å; N581-A585 WeakPolarHBondContact O-CB 3.42Å; N581-A585 PolarHBondContact O-N 3.15Å
582	R	80.1	Confident	65.5	Low	133 Å²	133	82.1 Å²	82.1	50%	0.502	47%	0.469	S	S	.	.	H	α-helix	trans	-65.7	-41.2	178.3	179.3	175.5	173.7	168.1	-2.7	112.4	E578 R579 G586 A587 S589	E578-R582 VanDerWaalsContact O-CB 3.28Å; E578-R582 WeakPolarHBondContact O-CB 3.34Å; E578-R582 PolarHBondContact O-N 3.06Å; R579-R582 PolarHBondContact O-N 3.4Å; R582-G586 PolarHBondContact O-N 2.75Å; R582-A587 HydrophobicContact CG-CB 3.82Å; R582-A587 WeakPolarHBondContact O-CB 3.29Å; R582-A587 PolarHBondContact O-N 3.16Å; R582-S589 PolarHBondContact NH2-OG 2.9Å; R582-S589 VanDerWaalsContact NH2-OG 3.15Å
583	E	73.5	Confident	63.2	Low	114 Å²	114	87.4 Å²	87.4	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-75	-40.5	177.6	-70.7	-177	-127.3	0	0	111.8	R579 A585 G586 Y711	R579-E583 PolarHBondContact O-N 2.97Å; E583-A585 VanDerWaalsContact C-N 3.29Å; E583-A585 PolarHBondContact O-N 3.12Å; E583-G586 PolarHBondContact O-N 3.31Å; E583-Y711 VanDerWaalsContact OE1-CE2 3.28Å; E583-Y711 WeakPolarHBondContact OE1-CE2 3.44Å; E583-Y711 PolarHBondContact OE1-OH 3.11Å
584	A	69.2	Low	60.5	Low	81 Å²	81	94.2 Å²	94.2	67%	0.669	54%	0.54	S	S	*	.	H	α-helix	trans	-63.4	-33.2	173	0	0	0	0	0	112.8	V580 G586	V580-A584 WeakPolarHBondContact O-CB 3.32Å; V580-A584 PolarHBondContact O-N 3.13Å; A584-G586 PolarHBondContact O-N 3.21Å
585	A	65.9	Low	57.7	Low	85 Å²	85	95.7 Å²	95.7	70%	0.702	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	0.2	172.6	0	0	0	0	0	114.1	N581 E583 A587	N581-A585 WeakPolarHBondContact O-CB 3.42Å; N581-A585 PolarHBondContact O-N 3.15Å; E583-A585 VanDerWaalsContact C-N 3.29Å; E583-A585 PolarHBondContact O-N 3.12Å; A585-A587 PolarHBondContact O-N 3.49Å
586	G	52.9	Low	55	Low	55 Å²	55	102 Å²	102	57%	0.567	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.1	25.5	172.8	0	0	0	0	0	115.1	R582 E583 A584 S588	R582-G586 PolarHBondContact O-N 2.75Å; E583-G586 PolarHBondContact O-N 3.31Å; A584-G586 PolarHBondContact O-N 3.21Å; G586-S588 VanDerWaalsContact C-N 3.27Å; G586-S588 PolarHBondContact O-N 2.89Å
587	A	39.7	Very low	52.2	Low	56 Å²	56	107.4 Å²	107.4	46%	0.463	62%	0.622	S	S	.	*			trans	-74.7	72.8	-177.9	0	0	0	0	0	112.9	R582 A585 S589	R582-A587 HydrophobicContact CG-CB 3.82Å; R582-A587 WeakPolarHBondContact O-CB 3.29Å; R582-A587 PolarHBondContact O-N 3.16Å; A585-A587 PolarHBondContact O-N 3.49Å; A587-S589 PolarHBondContact O-N 2.95Å
588	S	38.5	Very low	49.8	Very low	109 Å²	109	113.3 Å²	113.3	76%	0.762	65%	0.651	S	S	*	*			trans	-67.1	94.2	172.5	57.9	0	0	0	0	111.4	G586 E590	G586-S588 VanDerWaalsContact C-N 3.27Å; G586-S588 PolarHBondContact O-N 2.89Å; S588-E590 PolarHBondContact O-N 3.19Å
589	S	32.5	Very low	47.4	Very low	92 Å²	92	112.7 Å²	112.7	64%	0.643	66%	0.661	S	S	*	*			trans	-73.5	119.6	162.6	-63.4	0	0	0	0	109.1	R582 A587	R582-S589 PolarHBondContact NH2-OG 2.9Å; R582-S589 VanDerWaalsContact NH2-OG 3.15Å; A587-S589 PolarHBondContact O-N 2.95Å
590	E	32.4	Very low	44.9	Very low	179 Å²	179	115.1 Å²	115.1	84%	0.836	68%	0.675	S	S	*	*			trans	-70.7	127.6	-176.7	-56.1	173.6	123.8	0	0	111.7	S588	S588-E590 PolarHBondContact O-N 3.19Å
591	T	29.6	Very low	43	Very low	127 Å²	127	117.5 Å²	117.5	78%	0.779	69%	0.691	S	S	*	*				177.3	114.3	116.9	24.5	0	0	0	0	112
592	H	26.6	Very low	40.9	Very low	185 Å²	185	123.7 Å²	123.7	86%	0.856	71%	0.706	S	S	*	*			trans	155	102.3	139.6	-89.4	-67.3	0	0	0	110.1
593	P	34.9	Very low	39.1	Very low	122 Å²	122	120.5 Å²	120.5	79%	0.792	71%	0.705	S	S	*	*			trans	-87	123	175.6	32.4	-30.4	0	0	0	111.1
594	L	27.9	Very low	37.6	Very low	160 Å²	160	117.3 Å²	117.3	84%	0.838	69%	0.691	S	S	*	*			trans	-165.4	94.6	154.7	-110.1	166.9	0	0	0	112.7
595	S	26.9	Very low	36.4	Very low	92 Å²	92	117.2 Å²	117.2	64%	0.643	68%	0.682	S	S	*	*			trans	54.8	139.4	145.2	64.2	0	0	0	0	123.3
596	L	26.3	Very low	35.1	Very low	169 Å²	169	115.5 Å²	115.5	89%	0.885	67%	0.668	S	S	*	*			trans	75.3	82.1	150.3	-65.6	157.4	0	0	0	119.4
597	S	25.4	Very low	34.6	Very low	118 Å²	118	118.1 Å²	118.1	83%	0.825	67%	0.669	S	S	*	*				-176.7	138.6	89.7	-171.6	0	0	0	0	111.1
598	E	34.5	Very low	34.9	Very low	177 Å²	177	117.5 Å²	117.5	83%	0.827	66%	0.657	S	S	*	*			trans	-83.4	174.4	171.4	-65.3	-172.3	111	0	0	112
599	S	34.7	Very low	35	Very low	119 Å²	119	118.1 Å²	118.1	83%	0.832	65%	0.651	S	S	*	*			trans	78	49.2	171.1	72.9	0	0	0	0	119.6
600	E	29.2	Very low	35.3	Very low	125 Å²	125	117 Å²	117	58%	0.584	65%	0.648	S	S	*	*			trans	-105.6	131.3	150.1	-73.1	-121.8	148.3	0	0	111	R435 R602	R435-E600 IonicContact CZ-OE1 3.6Å; R435-E600 IonicContact CZ-OE2 3.44Å; R435-E600 VanDerWaalsContact NH1-CD 3.3Å; R435-E600 IonicContact NH1-OE1 3.75Å; R435-E600 PolarHBondContact NH1-OE1 3.46Å; R435-E600 IonicContact NH1-OE2 3.55Å; R435-E600 PolarHBondContact NH1-OE2 3.01Å; R435-E600 IonicContact NH2-OE1 3.62Å; R435-E600 PolarHBondContact NH2-OE1 3.27Å; R435-E600 IonicContact NH2-OE2 2.72Å; E600-R602 PolarHBondContact O-N 2.86Å; E600-R602 VanDerWaalsContact O-N 3.09Å
601	P	41.2	Very low	35.2	Very low	60 Å²	60	110.8 Å²	110.8	39%	0.39	63%	0.631	S	S	.	*			trans	-80.3	96.3	-172.6	31.3	-34.8	0	0	0	112.5	S603 L604	P601-S603 PolarHBondContact O-N 3.3Å; P601-L604 PolarHBondContact O-N 3.38Å; P601-L604 VanDerWaalsContact O-N 3.08Å
602	R	37.4	Very low	35.2	Very low	240 Å²	240	110 Å²	110	91%	0.906	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-16.6	167.1	-71.6	-178.7	172.7	171.8	-3.1	113.8	E600 L604	E600-R602 PolarHBondContact O-N 2.86Å; E600-R602 VanDerWaalsContact O-N 3.09Å; R602-L604 VanDerWaalsContact C-N 3.29Å; R602-L604 PolarHBondContact O-N 3.08Å
603	S	41.6	Very low	35.4	Very low	66 Å²	66	107 Å²	107	46%	0.462	63%	0.628	S	S	.	*	H	α-helix	trans	-67.5	-19.8	174.3	59.1	0	0	0	0	114.5	P601 A606 N607	P601-S603 PolarHBondContact O-N 3.3Å; S603-A606 PolarHBondContact O-N 3.08Å; S603-N607 VanDerWaalsContact O-CB 3.29Å; S603-N607 WeakPolarHBondContact O-CB 3.38Å; S603-N607 PolarHBondContact O-N 3.38Å; S603-N607 PolarHBondContact O-OD1 2.69Å
604	L	42.3	Very low	35.3	Very low	46 Å²	46	107 Å²	107	24%	0.241	63%	0.626	C	S	.	*	H	α-helix	trans	-72.7	-37.9	-176.1	-126.6	172.3	0	0	0	112.5	V436 P601 R602 N607 I608	V436-L604 HydrophobicContact CG2-CD2 4.05Å; P601-L604 PolarHBondContact O-N 3.38Å; P601-L604 VanDerWaalsContact O-N 3.08Å; R602-L604 VanDerWaalsContact C-N 3.29Å; R602-L604 PolarHBondContact O-N 3.08Å; L604-N607 PolarHBondContact O-N 2.63Å; L604-I608 HydrophobicContact CD2-CD1 4.38Å; L604-I608 WeakPolarHBondContact O-CG1 3.48Å; L604-I608 PolarHBondContact O-N 2.78Å
605	V	43	Very low	35.5	Very low	79 Å²	79	107.4 Å²	107.4	48%	0.479	63%	0.628	S	S	.	*	H	α-helix	trans	-68.1	-40.5	171.8	179.7	0	0	0	0	110.4	N607 I608 L609	V605-N607 VanDerWaalsContact C-N 3.29Å; V605-N607 PolarHBondContact O-N 3.31Å; V605-I608 PolarHBondContact O-N 3.05Å; V605-I608 VanDerWaalsContact O-N 3.09Å; V605-L609 HydrophobicContact CG1-CD1 4.18Å; V605-L609 PolarHBondContact O-N 2.97Å
606	A	39.6	Very low	35.5	Very low	50 Å²	50	106.5 Å²	106.5	41%	0.413	63%	0.634	S	S	.	*	H	α-helix	trans	-61	-36.6	173.7	0	0	0	0	0	112.5	S603 I608 L609 A610	S603-A606 PolarHBondContact O-N 3.08Å; A606-I608 VanDerWaalsContact C-N 3.29Å; A606-I608 PolarHBondContact O-N 3.4Å; A606-L609 PolarHBondContact O-N 2.81Å; A606-A610 VanDerWaalsContact O-CB 3.26Å; A606-A610 WeakPolarHBondContact O-CB 3.46Å; A606-A610 PolarHBondContact O-N 3.3Å
607	N	42.4	Very low	35.7	Very low	110 Å²	110	102.6 Å²	102.6	59%	0.588	62%	0.62	S	S	*	*	H	α-helix	trans	-78.4	-6.6	175.8	-70.7	-3.3	0	0	0	114.1	S603 L604 V605	S603-N607 VanDerWaalsContact O-CB 3.29Å; S603-N607 WeakPolarHBondContact O-CB 3.38Å; S603-N607 PolarHBondContact O-N 3.38Å; S603-N607 PolarHBondContact O-OD1 2.69Å; L604-N607 PolarHBondContact O-N 2.63Å; V605-N607 VanDerWaalsContact C-N 3.29Å; V605-N607 PolarHBondContact O-N 3.31Å
608	I	45.3	Very low	35.6	Very low	42 Å²	42	103.6 Å²	103.6	22%	0.215	62%	0.621	C	S	.	*	H	α-helix	trans	-94.5	-35.2	169.1	-69.7	166.1	0	0	0	110	L604 V605 A606 L710	L604-I608 HydrophobicContact CD2-CD1 4.38Å; L604-I608 WeakPolarHBondContact O-CG1 3.48Å; L604-I608 PolarHBondContact O-N 2.78Å; V605-I608 PolarHBondContact O-N 3.05Å; V605-I608 VanDerWaalsContact O-N 3.09Å; A606-I608 VanDerWaalsContact C-N 3.29Å; A606-I608 PolarHBondContact O-N 3.4Å; I608-L710 HydrophobicContact CD1-CD1 4.37Å
609	L	40.8	Very low	35.1	Very low	123 Å²	123	103 Å²	103	64%	0.644	62%	0.618	S	S	*	*	H	α-helix	trans	-68.3	-38.7	169.7	-75	160.9	0	0	0	112.1	V605 A606 G611 I707	V605-L609 HydrophobicContact CG1-CD1 4.18Å; V605-L609 PolarHBondContact O-N 2.97Å; A606-L609 PolarHBondContact O-N 2.81Å; L609-G611 VanDerWaalsContact C-N 3.35Å; L609-G611 PolarHBondContact O-N 3.2Å; L609-G611 VanDerWaalsContact O-N 3.14Å; L609-I707 HydrophobicContact CD2-CD1 4.13Å
610	A	38.9	Very low	34.6	Very low	68 Å²	68	106.9 Å²	106.9	56%	0.562	62%	0.62	S	S	*	*	S	Bend	trans	-82.2	79.8	169.3	0	0	0	0	0	110	A606	A606-A610 VanDerWaalsContact O-CB 3.26Å; A606-A610 WeakPolarHBondContact O-CB 3.46Å; A606-A610 PolarHBondContact O-N 3.3Å
611	G	29.8	Very low	34.4	Very low	48 Å²	48	105.5 Å²	105.5	50%	0.495	63%	0.63	S	S	.	*			trans	-56	164.9	173.4	0	0	0	0	0	113.3	L609 S613	L609-G611 VanDerWaalsContact C-N 3.35Å; L609-G611 PolarHBondContact O-N 3.2Å; L609-G611 VanDerWaalsContact O-N 3.14Å; G611-S613 PolarHBondContact O-N 3.49Å
612	P	30.2	Very low	33.5	Very low	111 Å²	111	108 Å²	108	72%	0.721	65%	0.648	S	S	*	*			trans	-58.5	124.7	-174.8	25	-34.3	0	0	0	111.4	T614	P612-T614 PolarHBondContact O-N 3.23Å
613	S	31.2	Very low	32.8	Very low	121 Å²	121	103.2 Å²	103.2	85%	0.846	64%	0.64	S	S	*	*			trans	-76.3	51.8	-179	43.6	0	0	0	0	113	G611	G611-S613 PolarHBondContact O-N 3.49Å
614	T	32.9	Very low	32	Very low	123 Å²	123	105.2 Å²	105.2	76%	0.755	65%	0.654	S	S	*	*			trans	-105.7	44.6	-179.6	53.7	0	0	0	0	112.5	P612	P612-T614 PolarHBondContact O-N 3.23Å
615	L	31.2	Very low	31.2	Very low	169 Å²	169	108.7 Å²	108.7	89%	0.885	68%	0.682	S	S	*	*			trans	-140	39.8	169.9	-117.1	166.8	0	0	0	111.6	S617	L615-S617 PolarHBondContact O-N 2.94Å; L615-S617 VanDerWaalsContact O-N 3.08Å
616	G	28.2	Very low	30.4	Very low	73 Å²	73	113 Å²	113	75%	0.753	70%	0.702	S	S	*	*			trans	-73.9	92.2	173.9	0	0	0	0	0	112.3
617	S	29	Very low	29.8	Very low	86 Å²	86	114.7 Å²	114.7	60%	0.601	72%	0.715	S	S	*	*			trans	39.7	90.3	153.9	-166.2	0	0	0	0	117.4	L615 H619	L615-S617 PolarHBondContact O-N 2.94Å; L615-S617 VanDerWaalsContact O-N 3.08Å; S617-H619 PolarHBondContact O-N 3.48Å; S617-H619 PolarHBondContact OG-CD2 3.41Å
618	V	23.3	Very low	29.1	Very low	139 Å²	139	116 Å²	116	84%	0.842	72%	0.723	S	S	*	*			trans	-79.1	72.5	159.5	-174.4	0	0	0	0	108.9
619	H	25.8	Very low	28.2	Very low	164 Å²	164	120.6 Å²	120.6	76%	0.759	75%	0.748	S	S	*	*			trans	-91.4	113.1	169.2	-109.8	-84.1	0	0	0	109.8	S617 A621	S617-H619 PolarHBondContact O-N 3.48Å; S617-H619 PolarHBondContact OG-CD2 3.41Å; H619-A621 PolarHBondContact O-N 3.27Å
620	F	23.4	Very low	27.4	Very low	201 Å²	201	119 Å²	119	88%	0.882	75%	0.752	S	S	*	*			trans	-65.3	121.4	164.9	-90.7	-96.8	0	0	0	109.6
621	A	24.6	Very low	26.8	Very low	97 Å²	97	121.6 Å²	121.6	80%	0.802	76%	0.76	S	S	*	*			trans	-143.7	121.5	162.8	0	0	0	0	0	107.8	H619	H619-A621 PolarHBondContact O-N 3.27Å
622	C	23.2	Very low	26.7	Very low	112 Å²	112	126 Å²	126	76%	0.757	78%	0.778	S	S	*	*			trans	-98.1	145.4	177.5	-149.8	0	0	0	0	109.6
623	D	22.8	Very low	26.4	Very low	140 Å²	140	123.7 Å²	123.7	75%	0.749	77%	0.774	S	S	*	*			trans	57.6	117	162.7	-55.9	-46.7	0	0	0	120.1
624	S	23.9	Very low	26.2	Very low	108 Å²	108	126.3 Å²	126.3	76%	0.755	78%	0.775	S	S	*	*				136.3	150.5	106.3	68.3	0	0	0	0	116.7
625	S	25.3	Very low	26.6	Very low	118 Å²	118	126.1 Å²	126.1	83%	0.825	78%	0.776	S	S	*	*			trans	72.3	128.8	168.1	72.5	0	0	0	0	118.8
626	L	26.1	Very low	26.3	Very low	171 Å²	171	122 Å²	122	90%	0.895	77%	0.774	S	S	*	*			trans	-89	153.3	161.9	-55.2	88	0	0	0	108.8
627	A	26.9	Very low	26.1	Very low	84 Å²	84	122.1 Å²	122.1	69%	0.694	78%	0.776	S	S	*	*				171.6	142.4	115.8	0	0	0	0	0	114.6
628	N	28.2	Very low	25.9	Very low	139 Å²	139	122.4 Å²	122.4	74%	0.743	78%	0.784	S	S	*	*			trans	61.7	118.8	140	-64.1	-3.7	0	0	0	122.7
629	N	26.9	Very low	26.1	Very low	138 Å²	138	122.6 Å²	122.6	74%	0.738	79%	0.785	S	S	*	*				76.7	95.1	123.1	-60.2	-6.6	0	0	0	122
630	A	24.2	Very low	26.1	Very low	88 Å²	88	119.8 Å²	119.8	73%	0.727	79%	0.79	S	S	*	*				84.2	146.1	101	0	0	0	0	0	122.9
631	V	26.2	Very low	26.3	Very low	123 Å²	123	118.2 Å²	118.2	75%	0.745	79%	0.79	S	S	*	*			trans	82.1	111.4	142	159	0	0	0	0	120.4
632	T	27.8	Very low	26.3	Very low	142 Å²	142	125.2 Å²	125.2	87%	0.871	80%	0.796	S	S	*	*			trans	62.4	155.6	155	55.1	0	0	0	0	120
633	G	23.6	Very low	26.3	Very low	62 Å²	62	125 Å²	125	64%	0.639	80%	0.796	S	S	*	*			cis	154.7	104.9	-12.5	0	0	0	0	0	115.5
634	M	26.6	Very low	26.5	Very low	176 Å²	176	127.2 Å²	127.2	87%	0.867	81%	0.806	S	S	*	*			trans	68	170.3	165.3	-59.6	-79.7	94	0	0	116.2
635	P	41.7	Very low	26.5	Very low	119 Å²	119	126.6 Å²	126.6	77%	0.773	80%	0.802	S	S	*	*				-139.4	166.8	-64.8	40.9	-26	0	0	0	115.8
636	G	23.8	Very low	26.8	Very low	82 Å²	82	127.3 Å²	127.3	85%	0.845	80%	0.804	S	S	*	*			trans	118.7	164.4	152.4	0	0	0	0	0	116.7
637	G	23.9	Very low	26.9	Very low	76 Å²	76	127 Å²	127	78%	0.784	80%	0.802	S	S	*	*			trans	132.5	14.9	156	0	0	0	0	0	122.8
638	A	25.5	Very low	26.8	Very low	92 Å²	92	128.1 Å²	128.1	76%	0.76	80%	0.804	S	S	*	*			trans	57.3	161.9	155.8	0	0	0	0	0	122.6
639	T	26.8	Very low	26.8	Very low	142 Å²	142	127.4 Å²	127.4	87%	0.871	81%	0.81	S	S	*	*			trans	57.5	94.8	156.5	42.3	0	0	0	0	120.9
640	A	26.6	Very low	26.8	Very low	106 Å²	106	126.1 Å²	126.1	88%	0.876	81%	0.812	S	S	*	*			trans	-149.7	62.7	150.9	0	0	0	0	0	111.8
641	L	26.8	Very low	26.9	Very low	167 Å²	167	129.1 Å²	129.1	87%	0.874	82%	0.815	S	S	*	*			trans	-115.2	107.6	176.4	-76.7	177.3	0	0	0	111.9
642	R	25.1	Very low	27	Very low	244 Å²	244	132.4 Å²	132.4	92%	0.921	82%	0.822	S	S	*	*			trans	-176.7	164.3	143.1	-106.3	161.4	-177.7	150.7	2.5	112.8
643	S	24.6	Very low	26.9	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	82%	0.82	S	S	*	*			trans	54.9	88.8	169.3	60.5	0	0	0	0	118.2
644	L	25.7	Very low	27.1	Very low	186 Å²	186	141.9 Å²	141.9	97%	0.974	83%	0.833	S	S	*	*				-132.8	128.2	126.6	-76.9	-178	0	0	0	108.5
645	S	23.4	Very low	27	Very low	96 Å²	96	136.9 Å²	136.9	67%	0.671	83%	0.827	S	S	*	*			trans	-138.7	126.8	175.9	53.8	0	0	0	0	108.1
646	P	31.8	Very low	26.2	Very low	133 Å²	133	137.2 Å²	137.2	86%	0.864	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-70	134.8	-179	29.1	-33.7	0	0	0	110.6
647	I	28.4	Very low	26.3	Very low	165 Å²	165	140.9 Å²	140.9	85%	0.846	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-88.8	132.4	176	-67.7	175.8	0	0	0	109.2
648	S	26.1	Very low	26.4	Very low	106 Å²	106	143 Å²	143	74%	0.741	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-65.9	154.4	-178.6	-53.7	0	0	0	0	113.6	S650	S648-S650 PolarHBondContact O-N 2.94Å
649	S	27.1	Very low	26.4	Very low	124 Å²	124	143.1 Å²	143.1	87%	0.867	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-68.2	118.4	177.5	51.2	0	0	0	0	113.4
650	S	27.3	Very low	26.4	Very low	111 Å²	111	140.4 Å²	140.4	78%	0.776	83%	0.827	S	S	*	*			trans	-156.4	117	155.5	64	0	0	0	0	111.1	S648	S648-S650 PolarHBondContact O-N 2.94Å
651	L	27.3	Very low	26.3	Very low	152 Å²	152	143.2 Å²	143.2	80%	0.796	82%	0.822	S	S	*	*			trans	-152	72.9	170.7	-121.3	167.1	0	0	0	111.8	L653	L651-L653 HydrophobicContact CD2-CD1 3.82Å; L651-L653 PolarHBondContact O-N 2.84Å
652	H	26.7	Very low	26.3	Very low	192 Å²	192	146.9 Å²	146.9	89%	0.889	82%	0.824	S	S	*	*			trans	-62.5	128.5	152.1	-90.4	-82.5	0	0	0	108.2
653	L	27.4	Very low	26.3	Very low	158 Å²	158	140.7 Å²	140.7	83%	0.827	81%	0.813	S	S	*	*			trans	-122.6	95.5	163.4	-145	80.6	0	0	0	110.9	L651	L651-L653 HydrophobicContact CD2-CD1 3.82Å; L651-L653 PolarHBondContact O-N 2.84Å
654	R	26.2	Very low	26.4	Very low	244 Å²	244	141.6 Å²	141.6	92%	0.921	82%	0.819	S	S	*	*			trans	-88.9	121.4	165.6	-173.7	178.9	-173.2	170	2.7	107.3
655	G	24.1	Very low	26.4	Very low	71 Å²	71	135.7 Å²	135.7	73%	0.732	80%	0.804	S	S	*	*			trans	-70.2	155.3	-171.9	0	0	0	0	0	114.9
656	S	25.5	Very low	26.5	Very low	127 Å²	127	140.8 Å²	140.8	89%	0.888	81%	0.814	S	S	*	*			trans	-151.1	166.6	156.7	-164.3	0	0	0	0	109.7
657	L	26	Very low	26.3	Very low	159 Å²	159	141.3 Å²	141.3	83%	0.832	82%	0.815	S	S	*	*			trans	-110.2	167.8	-164.4	-74.2	143.7	0	0	0	113.8
658	S	25.6	Very low	26	Very low	119 Å²	119	136.5 Å²	136.5	83%	0.832	81%	0.806	S	S	*	*			trans	74.2	151.6	160.9	-57.2	0	0	0	0	117.5
659	A	25.5	Very low	26	Very low	95 Å²	95	143.5 Å²	143.5	79%	0.785	82%	0.817	S	S	*	*			cis	-166.9	177.9	-24	0	0	0	0	0	107.3
660	A	26.6	Very low	25.8	Very low	85 Å²	85	141.6 Å²	141.6	70%	0.702	81%	0.808	S	S	*	*			cis	-156.3	-162	9.3	0	0	0	0	0	111.9
661	H	26.3	Very low	25.8	Very low	166 Å²	166	144.5 Å²	144.5	77%	0.769	81%	0.812	S	S	*	*			trans	-18.6	146.3	165.6	-60.9	-56.3	0	0	0	119.7
662	R	25	Very low	25.7	Very low	243 Å²	243	143.7 Å²	143.7	92%	0.917	81%	0.813	S	S	*	*				-164.5	175.2	63.3	-81.1	179.4	179.3	176.4	-0.2	111.5
663	V	26.6	Very low	25.6	Very low	114 Å²	114	138 Å²	138	69%	0.691	81%	0.807	S	S	*	*			cis	-178.4	134.8	-47.6	136.3	0	0	0	0	108.3
664	S	27	Very low	25.4	Very low	127 Å²	127	136.8 Å²	136.8	89%	0.888	81%	0.812	S	S	*	*			trans	65.7	151.7	169.8	-140.2	0	0	0	0	118.1
665	G	25	Very low	25.3	Very low	63 Å²	63	128.8 Å²	128.8	65%	0.649	81%	0.805	S	S	*	*			cis	169.5	135.3	-13.2	0	0	0	0	0	116.1
666	F	24.9	Very low	25.5	Very low	202 Å²	202	131.5 Å²	131.5	89%	0.886	81%	0.808	S	S	*	*			trans	43.6	117.7	144.7	-134.9	-95.1	0	0	0	122.8
667	T	26.9	Very low	25.5	Very low	144 Å²	144	132.9 Å²	132.9	88%	0.883	81%	0.805	S	S	*	*			trans	175.8	145.4	132.8	23.4	0	0	0	0	110.3
668	G	23.6	Very low	25.5	Very low	64 Å²	64	130 Å²	130	66%	0.66	80%	0.804	S	S	*	*			cis	145.7	83.5	-15.3	0	0	0	0	0	114.9
669	R	26.1	Very low	25.6	Very low	254 Å²	254	136.3 Å²	136.3	96%	0.958	81%	0.81	S	S	*	*			trans	-154.3	124.7	163.6	-137.3	171.3	-177.3	155.9	1.3	116.1
670	A	23.2	Very low	25.7	Very low	84 Å²	84	138.5 Å²	138.5	69%	0.694	81%	0.813	S	S	*	*			trans	-65.3	168.1	161.4	0	0	0	0	0	112.3
671	M	26.4	Very low	25.8	Very low	171 Å²	171	140.6 Å²	140.6	84%	0.842	82%	0.817	S	S	*	*			cis	-165.4	-171.4	-13.5	-91.7	-99.1	-146.2	0	0	104.5
672	T	25.2	Very low	25.8	Very low	135 Å²	135	138.2 Å²	138.2	83%	0.828	82%	0.819	S	S	*	*			cis	-160.5	157.5	10.8	-24.3	0	0	0	0	107.8
673	G	24.5	Very low	26	Very low	73 Å²	73	131.6 Å²	131.6	75%	0.753	81%	0.811	S	S	*	*			trans	164.4	77	166.2	0	0	0	0	0	119
674	S	22.9	Very low	26.2	Very low	133 Å²	133	128.4 Å²	128.4	93%	0.93	80%	0.8	S	S	*	*			trans	11.5	122.6	156.4	-166	0	0	0	0	120.8
675	G	24.5	Very low	26.5	Very low	76 Å²	76	126.3 Å²	126.3	78%	0.784	79%	0.786	S	S	*	*			trans	176.8	105.6	166.8	0	0	0	0	0	114.7
676	T	27.6	Very low	27.4	Very low	128 Å²	128	127.8 Å²	127.8	79%	0.785	79%	0.786	S	S	*	*			trans	-52.3	140.3	-176.2	44.7	0	0	0	0	118.2
677	D	25.2	Very low	27.9	Very low	156 Å²	156	121.5 Å²	121.5	83%	0.834	77%	0.772	S	S	*	*			trans	48.7	114.8	141.1	-59.2	-38.9	0	0	0	122.6
678	A	26.7	Very low	28.2	Very low	99 Å²	99	123 Å²	123	82%	0.818	76%	0.761	S	S	*	*				-157.4	134	117.3	0	0	0	0	0	111.1
679	R	28.2	Very low	28.8	Very low	250 Å²	250	126.1 Å²	126.1	94%	0.943	76%	0.758	S	S	*	*			trans	-104.3	126.5	165.3	-69.3	179.6	-177.4	150.6	0.8	109.2
680	T	28.3	Very low	29.7	Very low	141 Å²	141	115.8 Å²	115.8	87%	0.865	73%	0.731	S	S	*	*			trans	-130.4	139.2	164.2	36	0	0	0	0	110.1
681	V	27.8	Very low	30.7	Very low	129 Å²	129	114.4 Å²	114.4	78%	0.782	71%	0.71	S	S	*	*			trans	-94.3	123.4	-172.5	176.1	0	0	0	0	109.6	S683	V681-S683 WeakPolarHBondContact CG1-OG 3.41Å; V681-S683 PolarHBondContact O-N 2.91Å
682	S	25.6	Very low	31.5	Very low	116 Å²	116	111.5 Å²	111.5	81%	0.811	70%	0.698	S	S	*	*			trans	-84.3	103.9	166.1	-171.2	0	0	0	0	109.5
683	S	30.2	Very low	33	Very low	105 Å²	105	108.8 Å²	108.8	73%	0.734	68%	0.681	S	S	*	*			trans	-149.2	37.4	172.5	-65.2	0	0	0	0	111.1	V681	V681-S683 WeakPolarHBondContact CG1-OG 3.41Å; V681-S683 PolarHBondContact O-N 2.91Å
684	G	30.3	Very low	34.5	Very low	46 Å²	46	106.8 Å²	106.8	47%	0.474	66%	0.655	S	S	.	*			trans	-116.5	-5.9	-177.6	0	0	0	0	0	115.8
685	S	33.4	Very low	36.2	Very low	84 Å²	84	105 Å²	105	59%	0.587	64%	0.635	S	S	*	*	H	α-helix	trans	-77.2	-39.5	-167.6	-155.4	0	0	0	0	114.4	A687 E689	S685-A687 PolarHBondContact O-N 3.19Å; S685-E689 PolarHBondContact O-N 3.43Å
686	S	43.7	Very low	38.1	Very low	94 Å²	94	106 Å²	106	66%	0.657	63%	0.625	S	S	*	*	H	α-helix	trans	-69.4	-33.4	-167.7	47.5	0	0	0	0	114.5	G690	S686-G690 PolarHBondContact O-N 3.36Å
687	A	35.5	Very low	39.9	Very low	70 Å²	70	105.3 Å²	105.3	58%	0.579	62%	0.616	S	S	*	*	H	α-helix	trans	-66.3	-45.3	-178.1	0	0	0	0	0	112.3	S685 G690 Q691	S685-A687 PolarHBondContact O-N 3.19Å; A687-G690 PolarHBondContact O-N 3.35Å; A687-Q691 WeakPolarHBondContact O-CB 3.39Å; A687-Q691 PolarHBondContact O-N 3.09Å
688	W	33.8	Very low	42.1	Very low	176 Å²	176	101 Å²	101	67%	0.667	60%	0.599	S	S	*	*	H	α-helix	trans	-67.3	-37.2	178.9	-66.3	97.7	0	0	0	112.3	Q691 L692	W688-Q691 PolarHBondContact O-N 3.16Å; W688-L692 WeakPolarHBondContact O-CB 3.44Å; W688-L692 WeakPolarHBondContact O-CG 3.39Å; W688-L692 PolarHBondContact O-N 3.44Å
689	E	36.4	Very low	44.5	Very low	128 Å²	128	102.1 Å²	102.1	60%	0.598	59%	0.587	S	S	*	*	H	α-helix	trans	-70.3	-39.3	178.5	-164.1	161.7	-154.4	0	0	111.8	S685 T693	S685-E689 PolarHBondContact O-N 3.43Å; E689-T693 WeakPolarHBondContact O-CB 3.14Å; E689-T693 WeakPolarHBondContact O-CG2 3.18Å; E689-T693 PolarHBondContact O-N 3.48Å; E689-T693 VanDerWaalsContact O-N 3.08Å; E689-T693 PolarHBondContact O-OG1 3.18Å
690	G	43.9	Very low	47	Very low	38 Å²	38	97.2 Å²	97.2	39%	0.392	57%	0.569	S	S	.	*	H	α-helix	trans	-63.8	-39.1	169.6	0	0	0	0	0	113.5	S686 A687 T693 S694	S686-G690 PolarHBondContact O-N 3.36Å; A687-G690 PolarHBondContact O-N 3.35Å; G690-T693 WeakPolarHBondContact CA-OG1 3.25Å; G690-T693 PolarHBondContact O-OG1 3.34Å; G690-S694 VanDerWaalsContact O-CB 3.29Å; G690-S694 WeakPolarHBondContact O-CB 3.43Å; G690-S694 PolarHBondContact O-N 3.17Å
691	Q	44.9	Very low	49.4	Very low	54 Å²	54	91.3 Å²	91.3	25%	0.252	54%	0.535	S	S	.	.	H	α-helix	trans	-72.5	-41.8	179.1	-162.8	177.5	21.7	0	0	112.4	Y173 A687 W688 S694 L695	Y173-Q691 PolarHBondContact O-NE2 3.38Å; A687-Q691 WeakPolarHBondContact O-CB 3.39Å; A687-Q691 PolarHBondContact O-N 3.09Å; W688-Q691 PolarHBondContact O-N 3.16Å; Q691-S694 PolarHBondContact O-N 2.89Å; Q691-L695 HydrophobicContact CG-CD1 4.39Å; Q691-L695 WeakPolarHBondContact O-CB 3.3Å; Q691-L695 WeakPolarHBondContact O-CG 3.39Å; Q691-L695 PolarHBondContact O-N 2.87Å
692	L	43.3	Very low	51.9	Low	111 Å²	111	86.3 Å²	86.3	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-61	-46.2	174.5	-78.9	167.5	0	0	0	111.5	W688 L695 V696	W688-L692 WeakPolarHBondContact O-CB 3.44Å; W688-L692 WeakPolarHBondContact O-CG 3.39Å; W688-L692 PolarHBondContact O-N 3.44Å; L692-L695 PolarHBondContact O-N 2.88Å; L692-V696 WeakPolarHBondContact O-CG2 3.24Å; L692-V696 PolarHBondContact O-N 3.42Å
693	T	56.6	Low	54.7	Low	78 Å²	78	83.4 Å²	83.4	48%	0.479	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-41.8	176.3	48.1	0	0	0	0	111.9	E689 G690 L695 V696 L697	E689-T693 WeakPolarHBondContact O-CB 3.14Å; E689-T693 WeakPolarHBondContact O-CG2 3.18Å; E689-T693 PolarHBondContact O-N 3.48Å; E689-T693 VanDerWaalsContact O-N 3.08Å; E689-T693 PolarHBondContact O-OG1 3.18Å; G690-T693 WeakPolarHBondContact CA-OG1 3.25Å; G690-T693 PolarHBondContact O-OG1 3.34Å; T693-L695 PolarHBondContact O-N 3.2Å; T693-V696 PolarHBondContact O-N 3.48Å; T693-L697 WeakPolarHBondContact O-CB 3.43Å; T693-L697 WeakPolarHBondContact O-CG 3.35Å; T693-L697 PolarHBondContact O-N 3.01Å
694	S	55.1	Low	57.4	Low	30 Å²	30	80.2 Å²	80.2	21%	0.21	46%	0.457	C	S	.	.	H	α-helix	trans	-65.4	-36.4	177.3	-164.6	0	0	0	0	113.2	T175 G690 Q691 S698	T175-S694 VanDerWaalsContact CG2-OG 3.31Å; T175-S694 WeakPolarHBondContact CG2-OG 3.45Å; T175-S694 PolarHBondContact OG1-OG 3.44Å; G690-S694 VanDerWaalsContact O-CB 3.29Å; G690-S694 WeakPolarHBondContact O-CB 3.43Å; G690-S694 PolarHBondContact O-N 3.17Å; Q691-S694 PolarHBondContact O-N 2.89Å; S694-S698 WeakPolarHBondContact O-CB 3.36Å; S694-S698 PolarHBondContact O-N 2.84Å
695	L	60.3	Low	60.2	Low	97 Å²	97	78.2 Å²	78.2	51%	0.508	44%	0.435	S	S	.	.	H	α-helix	trans	-67	-48	173.5	-74.6	170.2	0	0	0	111.8	Q691 L692 T693 L697 S698 E699	Q691-L695 HydrophobicContact CG-CD1 4.39Å; Q691-L695 WeakPolarHBondContact O-CB 3.3Å; Q691-L695 WeakPolarHBondContact O-CG 3.39Å; Q691-L695 PolarHBondContact O-N 2.87Å; L692-L695 PolarHBondContact O-N 2.88Å; T693-L695 PolarHBondContact O-N 3.2Å; L695-L697 VanDerWaalsContact C-N 3.3Å; L695-L697 PolarHBondContact O-N 2.86Å; L695-S698 WeakPolarHBondContact O-CB 3.49Å; L695-S698 PolarHBondContact O-N 3.19Å; L695-S698 VanDerWaalsContact O-N 3.1Å; L695-E699 PolarHBondContact O-N 2.74Å
696	V	62.7	Low	62.8	Low	95 Å²	95	74.4 Å²	74.4	58%	0.576	41%	0.408	S	S	*	.	H	α-helix	trans	-60.4	-40	176.9	169.8	0	0	0	0	111.3	L692 T693 E699 Y700	L692-V696 WeakPolarHBondContact O-CG2 3.24Å; L692-V696 PolarHBondContact O-N 3.42Å; T693-V696 PolarHBondContact O-N 3.48Å; V696-E699 PolarHBondContact O-N 3.09Å; V696-Y700 VanDerWaalsContact O-CB 3.29Å; V696-Y700 WeakPolarHBondContact O-CB 3.41Å; V696-Y700 PolarHBondContact O-N 2.9Å
697	L	67.3	Low	64.9	Low	114 Å²	114	72 Å²	72	60%	0.597	39%	0.387	S	S	*	.	H	α-helix	trans	-64.5	-38.6	174	-73.3	167.7	0	0	0	112.3	T693 L695 Y700 A701	T693-L697 WeakPolarHBondContact O-CB 3.43Å; T693-L697 WeakPolarHBondContact O-CG 3.35Å; T693-L697 PolarHBondContact O-N 3.01Å; L695-L697 VanDerWaalsContact C-N 3.3Å; L695-L697 PolarHBondContact O-N 2.86Å; L697-Y700 PolarHBondContact O-N 3.06Å; L697-A701 WeakPolarHBondContact O-CB 3.43Å; L697-A701 PolarHBondContact O-N 2.8Å
698	S	70.8	Confident	67.4	Low	66 Å²	66	68.9 Å²	68.9	46%	0.462	36%	0.361	S	S	.	.	H	α-helix	trans	-69	-34.6	176.5	-170.4	0	0	0	0	112.9	S694 L695 S702	S694-S698 WeakPolarHBondContact O-CB 3.36Å; S694-S698 PolarHBondContact O-N 2.84Å; L695-S698 WeakPolarHBondContact O-CB 3.49Å; L695-S698 PolarHBondContact O-N 3.19Å; L695-S698 VanDerWaalsContact O-N 3.1Å; S698-S702 VanDerWaalsContact O-CB 3.23Å; S698-S702 WeakPolarHBondContact O-CB 3.45Å; S698-S702 PolarHBondContact O-N 2.87Å
699	E	76.3	Confident	69.9	Low	123 Å²	123	60.5 Å²	60.5	58%	0.575	33%	0.329	S	S	*	.	H	α-helix	trans	-72.2	-42.8	172	-66.4	-158.8	140.2	0	0	112.1	L695 V696 S702 T703	L695-E699 PolarHBondContact O-N 2.74Å; V696-E699 PolarHBondContact O-N 3.09Å; E699-S702 CarbonylContact O-C 3.46Å; E699-S702 WeakPolarHBondContact O-CB 3.48Å; E699-S702 PolarHBondContact O-N 3Å; E699-T703 PolarHBondContact O-N 3.42Å; E699-T703 PolarHBondContact O-OG1 3.01Å
700	Y	80.5	Confident	72.4	Confident	146 Å²	146	56.5 Å²	56.5	57%	0.573	31%	0.312	S	S	*	.	H	α-helix	trans	-60.5	-49.6	174.8	-178.9	-91.6	0	0	0	112.3	V696 L697 S702 T703 E704	V696-Y700 VanDerWaalsContact O-CB 3.29Å; V696-Y700 WeakPolarHBondContact O-CB 3.41Å; V696-Y700 PolarHBondContact O-N 2.9Å; L697-Y700 PolarHBondContact O-N 3.06Å; Y700-S702 PolarHBondContact O-N 3.41Å; Y700-T703 PolarHBondContact O-N 3.34Å; Y700-T703 PolarHBondContact O-OG1 3.15Å; Y700-E704 HydrophobicContact CE1-CB 4.46Å; Y700-E704 WeakPolarHBondContact O-CB 3.26Å; Y700-E704 PolarHBondContact O-N 3.48Å
701	A	79.6	Confident	74.4	Confident	17 Å²	17	56.2 Å²	56.2	14%	0.14	30%	0.299	C	S	.	.	H	α-helix	trans	-55.3	-39	173.9	0	0	0	0	0	111.8	I558 L697 M705	I558-A701 HydrophobicContact CG2-CB 3.67Å; I558-A701 WeakPolarHBondContact CG2-O 3.09Å; L697-A701 WeakPolarHBondContact O-CB 3.43Å; L697-A701 PolarHBondContact O-N 2.8Å; A701-M705 VanDerWaalsContact O-CB 3.29Å; A701-M705 WeakPolarHBondContact O-CB 3.4Å; A701-M705 PolarHBondContact O-N 2.92Å
702	S	80.7	Confident	76.4	Confident	24 Å²	24	53.9 Å²	53.9	17%	0.168	29%	0.288	C	S	.	.	H	α-helix	trans	-72.4	-26.8	177.9	-177.5	0	0	0	0	114.1	K352 S698 E699 Y700 S706	K352-S702 PolarHBondContact NZ-OG 3.26Å; S698-S702 VanDerWaalsContact O-CB 3.23Å; S698-S702 WeakPolarHBondContact O-CB 3.45Å; S698-S702 PolarHBondContact O-N 2.87Å; E699-S702 CarbonylContact O-C 3.46Å; E699-S702 WeakPolarHBondContact O-CB 3.48Å; E699-S702 PolarHBondContact O-N 3Å; Y700-S702 PolarHBondContact O-N 3.41Å; S702-S706 WeakPolarHBondContact O-CB 3.16Å; S702-S706 PolarHBondContact O-N 2.81Å
703	T	83.9	Confident	78.5	Confident	55 Å²	55	48.7 Å²	48.7	34%	0.337	26%	0.261	S	S	.	.	H	α-helix	trans	-86	-41.5	174.7	53.4	0	0	0	0	111.1	E699 Y700 M705 S706 I707	E699-T703 PolarHBondContact O-N 3.42Å; E699-T703 PolarHBondContact O-OG1 3.01Å; Y700-T703 PolarHBondContact O-N 3.34Å; Y700-T703 PolarHBondContact O-OG1 3.15Å; T703-M705 PolarHBondContact O-N 2.97Å; T703-S706 WeakPolarHBondContact CA-OG 3.24Å; T703-S706 PolarHBondContact O-N 2.85Å; T703-S706 VanDerWaalsContact O-N 3.1Å; T703-S706 PolarHBondContact O-OG 3.42Å; T703-I707 WeakPolarHBondContact O-CG1 3.38Å; T703-I707 PolarHBondContact O-N 3.37Å
704	E	86.3	Confident	79.8	Confident	39 Å²	39	48.1 Å²	48.1	18%	0.182	25%	0.253	C	S	.	.	H	α-helix	trans	-54.6	-51.4	172.9	-168	-174.3	-173.5	0	0	110.6	I558 K577 Y700 S706 I707 H708	I558-E704 HydrophobicContact CD1-CB 4.42Å; I558-E704 HydrophobicContact CD1-CG 4Å; I558-E704 HydrophobicContact CG2-CB 4.39Å; K577-E704 WeakPolarHBondContact CE-OE1 3.5Å; K577-E704 IonicContact NZ-OE1 3.3Å; K577-E704 PolarHBondContact NZ-OE1 3.47Å; K577-E704 IonicContact NZ-OE2 2.67Å; Y700-E704 HydrophobicContact CE1-CB 4.46Å; Y700-E704 WeakPolarHBondContact O-CB 3.26Å; Y700-E704 PolarHBondContact O-N 3.48Å; E704-S706 VanDerWaalsContact C-N 3.33Å; E704-S706 PolarHBondContact O-N 3.05Å; E704-I707 PolarHBondContact O-N 3.39Å; E704-H708 PolarHBondContact O-CD2 2.96Å; E704-H708 PolarHBondContact O-N 2.97Å
705	M	89.8	Confident	81.1	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.02	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-34.1	176.9	-175.3	59.7	-164.7	0	0	112.8	H442 L551 M554 H555 I558 A701 T703 I707 H708 A709	H442-M705 WeakPolarHBondContact CE1-CG 3.48Å; L551-M705 HydrophobicContact CB-CE 4.42Å; L551-M705 HydrophobicContact CD2-CE 3.87Å; L551-M705 WeakPolarHBondContact O-CE 3.41Å; M554-M705 HydrophobicContact CB-CE 4.33Å; M554-M705 HydrophobicContact CB-SD 3.96Å; M554-M705 HydrophobicContact CG-SD 3.74Å; H555-M705 HydrophobicContact CB-CE 4.09Å; H555-M705 HydrophobicContact CB-SD 4.2Å; I558-M705 HydrophobicContact CD1-CB 4.03Å; I558-M705 HydrophobicContact CD1-SD 4.1Å; A701-M705 VanDerWaalsContact O-CB 3.29Å; A701-M705 WeakPolarHBondContact O-CB 3.4Å; A701-M705 PolarHBondContact O-N 2.92Å; T703-M705 PolarHBondContact O-N 2.97Å; M705-I707 VanDerWaalsContact C-N 3.34Å; M705-I707 PolarHBondContact O-N 2.95Å; M705-H708 PolarHBondContact O-N 3.38Å; M705-A709 WeakPolarHBondContact O-CB 3.24Å; M705-A709 PolarHBondContact O-N 3.11Å
706	S	88.2	Confident	82.2	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-65.9	-36.2	176.1	74.9	0	0	0	0	112.9	A439 S702 T703 E704 L710	A439-S706 WeakPolarHBondContact O-CA 3.35Å; A439-S706 WeakPolarHBondContact O-CB 3.44Å; S702-S706 WeakPolarHBondContact O-CB 3.16Å; S702-S706 PolarHBondContact O-N 2.81Å; T703-S706 WeakPolarHBondContact CA-OG 3.24Å; T703-S706 PolarHBondContact O-N 2.85Å; T703-S706 VanDerWaalsContact O-N 3.1Å; T703-S706 PolarHBondContact O-OG 3.42Å; E704-S706 VanDerWaalsContact C-N 3.33Å; E704-S706 PolarHBondContact O-N 3.05Å; S706-L710 WeakPolarHBondContact O-CG 3.39Å; S706-L710 PolarHBondContact O-N 3.25Å; S706-L710 VanDerWaalsContact O-N 3.11Å
707	I	87.1	Confident	83.1	Confident	43 Å²	43	41 Å²	41	22%	0.221	21%	0.208	C	C	.	.	H	α-helix	trans	-68.8	-45.5	175.6	-67.7	164.7	0	0	0	109.3	V580 L609 T703 E704 M705 A709 L710 Y711	V580-I707 HydrophobicContact CG1-CG2 3.84Å; L609-I707 HydrophobicContact CD2-CD1 4.13Å; T703-I707 WeakPolarHBondContact O-CG1 3.38Å; T703-I707 PolarHBondContact O-N 3.37Å; E704-I707 PolarHBondContact O-N 3.39Å; M705-I707 VanDerWaalsContact C-N 3.34Å; M705-I707 PolarHBondContact O-N 2.95Å; I707-A709 PolarHBondContact O-N 2.81Å; I707-L710 PolarHBondContact O-N 2.85Å; I707-Y711 WeakPolarHBondContact O-CB 3.26Å; I707-Y711 PolarHBondContact O-N 3.18Å
708	H	87.4	Confident	83.7	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.028	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-43.1	175.7	-77.4	-60.2	0	0	0	113.1	M554 E704 M705 Y711 I712	M554-H708 HydrophobicContact CG-CB 4.01Å; E704-H708 PolarHBondContact O-CD2 2.96Å; E704-H708 PolarHBondContact O-N 2.97Å; M705-H708 PolarHBondContact O-N 3.38Å; H708-Y711 PolarHBondContact O-N 3.43Å; H708-I712 WeakPolarHBondContact O-CB 3.3Å; H708-I712 WeakPolarHBondContact O-CD1 3.46Å; H708-I712 VanDerWaalsContact O-CG1 3.24Å; H708-I712 WeakPolarHBondContact O-CG1 3.27Å; H708-I712 PolarHBondContact O-N 3.46Å
709	A	87.3	Confident	84	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-47.7	177.5	0	0	0	0	0	111.8	H442 L551 M705 I707 Y711 I712 H713	H442-A709 HydrophobicContact CB-CB 4.06Å; L551-A709 HydrophobicContact CD2-CB 4.21Å; M705-A709 WeakPolarHBondContact O-CB 3.24Å; M705-A709 PolarHBondContact O-N 3.11Å; I707-A709 PolarHBondContact O-N 2.81Å; A709-Y711 VanDerWaalsContact C-N 3.32Å; A709-Y711 PolarHBondContact O-N 3.31Å; A709-I712 PolarHBondContact O-N 3.22Å; A709-H713 PolarHBondContact O-CD2 3.3Å; A709-H713 PolarHBondContact O-N 3.44Å; A709-H713 VanDerWaalsContact O-N 3.12Å
710	L	87.8	Confident	83.6	Confident	43 Å²	43	37.5 Å²	37.5	23%	0.225	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-41.1	175.4	-72.1	173.5	0	0	0	112.1	L438 A439 I608 S706 I707 E714	L438-L710 HydrophobicContact CD2-CD2 4.1Å; L438-L710 HydrophobicContact CG-CD2 4.13Å; A439-L710 HydrophobicContact CB-CD1 3.98Å; A439-L710 HydrophobicContact CB-CD2 4.35Å; A439-L710 HydrophobicContact CB-CG 4.17Å; I608-L710 HydrophobicContact CD1-CD1 4.37Å; S706-L710 WeakPolarHBondContact O-CG 3.39Å; S706-L710 PolarHBondContact O-N 3.25Å; S706-L710 VanDerWaalsContact O-N 3.11Å; I707-L710 PolarHBondContact O-N 2.85Å; L710-E714 PolarHBondContact O-N 3.44Å
711	Y	86.7	Confident	82.8	Confident	32 Å²	32	39 Å²	39	13%	0.125	19%	0.192	C	C	.	.	H	α-helix	trans	-65.9	-47.4	179	-178.9	-100.7	0	0	0	112.9	L576 R579 V580 E583 I707 H708 A709 H713 E714 L715	L576-Y711 HydrophobicContact CD1-CD1 4Å; L576-Y711 HydrophobicContact CD1-CE1 3.89Å; L576-Y711 HydrophobicContact CG-CD1 4.45Å; R579-Y711 HydrophobicContact CB-CE1 4.39Å; R579-Y711 WeakPolarHBondContact CB-OH 3.4Å; V580-Y711 HydrophobicContact CG2-CD1 3.39Å; V580-Y711 HydrophobicContact CG2-CD2 4.03Å; V580-Y711 HydrophobicContact CG2-CE1 3.87Å; V580-Y711 HydrophobicContact CG2-CE2 4.45Å; V580-Y711 HydrophobicContact CG2-CG 3.48Å; V580-Y711 VanDerWaalsContact CG2-CG 3.48Å; E583-Y711 VanDerWaalsContact OE1-CE2 3.28Å; E583-Y711 WeakPolarHBondContact OE1-CE2 3.44Å; E583-Y711 PolarHBondContact OE1-OH 3.11Å; I707-Y711 WeakPolarHBondContact O-CB 3.26Å; I707-Y711 PolarHBondContact O-N 3.18Å; H708-Y711 PolarHBondContact O-N 3.43Å; A709-Y711 VanDerWaalsContact C-N 3.32Å; A709-Y711 PolarHBondContact O-N 3.31Å; Y711-H713 VanDerWaalsContact C-N 3.3Å; Y711-H713 PolarHBondContact O-N 3.09Å; Y711-E714 PolarHBondContact O-N 3.22Å; Y711-L715 HydrophobicContact CE1-CD1 3.87Å; Y711-L715 WeakPolarHBondContact O-CB 3.42Å; Y711-L715 PolarHBondContact O-N 3.09Å
712	I	86.1	Confident	81.4	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-58.1	-45.1	177.4	-69.1	162.5	0	0	0	110.2	W530 L551 L576 H708 A709 E714 L715 H716	W530-I712 HydrophobicContact CE3-CG2 3.58Å; W530-I712 HydrophobicContact CZ3-CG2 4.01Å; L551-I712 HydrophobicContact CD2-CD1 3.68Å; L551-I712 HydrophobicContact CG-CD1 4.46Å; L576-I712 HydrophobicContact CD1-CG1 4.26Å; L576-I712 HydrophobicContact CD2-CD1 3.77Å; L576-I712 HydrophobicContact CD2-CG1 3.82Å; H708-I712 WeakPolarHBondContact O-CB 3.3Å; H708-I712 WeakPolarHBondContact O-CD1 3.46Å; H708-I712 VanDerWaalsContact O-CG1 3.24Å; H708-I712 WeakPolarHBondContact O-CG1 3.27Å; H708-I712 PolarHBondContact O-N 3.46Å; A709-I712 PolarHBondContact O-N 3.22Å; I712-E714 PolarHBondContact O-N 2.93Å; I712-L715 PolarHBondContact O-N 3.44Å; I712-H716 WeakPolarHBondContact O-CB 3.36Å; I712-H716 PolarHBondContact O-N 2.89Å
713	H	87.3	Confident	79.8	Confident	3 Å²	3	41.8 Å²	41.8	1%	0.014	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-38.3	177.8	-91.9	-84.4	0	0	0	113.6	L438 M444 D446 Q449 W530 A709 Y711 K717	L438-H713 HydrophobicContact CD2-CB 4.15Å; M444-H713 PolarHBondContact N-NE2 3.42Å; M444-H713 PolarHBondContact O-NE2 2.86Å; D446-H713 IonicContact OD1-CE1 3.91Å; Q449-H713 PolarHBondContact NE2-CE1 2.89Å; Q449-H713 PolarHBondContact NE2-ND1 3.41Å; W530-H713 AromaticContact CH2-CE1 3.82Å; W530-H713 AromaticContact CH2-ND1 3.75Å; W530-H713 AromaticContact CH2-NE2 3.3Å; W530-H713 VanDerWaalsContact CH2-NE2 3.3Å; W530-H713 WeakPolarHBondContact CH2-NE2 3.31Å; A709-H713 PolarHBondContact O-CD2 3.3Å; A709-H713 PolarHBondContact O-N 3.44Å; A709-H713 VanDerWaalsContact O-N 3.12Å; Y711-H713 VanDerWaalsContact C-N 3.3Å; Y711-H713 PolarHBondContact O-N 3.09Å; H713-K717 VanDerWaalsContact O-CB 3.31Å; H713-K717 WeakPolarHBondContact O-CB 3.4Å; H713-K717 PolarHBondContact O-N 3Å; H713-K717 VanDerWaalsContact O-N 3.1Å
714	E	85.9	Confident	77.6	Confident	65 Å²	65	46.1 Å²	46.1	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-71.4	-37.8	176.4	-172.4	58.3	-139.3	0	0	111.6	L710 Y711 I712 K717 Q718	L710-E714 PolarHBondContact O-N 3.44Å; Y711-E714 PolarHBondContact O-N 3.22Å; I712-E714 PolarHBondContact O-N 2.93Å; E714-K717 WeakPolarHBondContact O-CB 3.33Å; E714-K717 PolarHBondContact O-N 3.43Å; E714-K717 IonicContact OE1-NZ 3.08Å; E714-K717 PolarHBondContact OE1-NZ 2.95Å; E714-K717 IonicContact OE2-NZ 2.66Å; E714-K717 PolarHBondContact OE2-NZ 2.98Å; E714-Q718 WeakPolarHBondContact O-CG 3.39Å; E714-Q718 PolarHBondContact O-N 3.18Å
715	L	82	Confident	74.8	Confident	20 Å²	20	47.9 Å²	47.9	11%	0.105	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-43.9	175.4	-173	149	0	0	0	111.5	Y711 I712 K717 Q718 Q719	Y711-L715 HydrophobicContact CE1-CD1 3.87Å; Y711-L715 WeakPolarHBondContact O-CB 3.42Å; Y711-L715 PolarHBondContact O-N 3.09Å; I712-L715 PolarHBondContact O-N 3.44Å; L715-K717 VanDerWaalsContact C-N 3.32Å; L715-K717 PolarHBondContact O-N 3.49Å; L715-Q718 PolarHBondContact O-N 3.37Å; L715-Q718 VanDerWaalsContact O-N 3.15Å; L715-Q719 HydrophobicContact CD2-CG 4.25Å; L715-Q719 PolarHBondContact O-N 2.98Å
716	H	83.2	Confident	72	Confident	16 Å²	16	55.9 Å²	55.9	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-57.9	-43.3	172.3	177.2	59.3	0	0	0	112	D446 A529 W530 I712 Q718 Q719 S720	D446-H716 IonicContact OD1-CD2 3.15Å; D446-H716 PolarHBondContact OD1-CD2 3.34Å; D446-H716 VanDerWaalsContact OD1-CD2 3.28Å; D446-H716 IonicContact OD1-NE2 3.95Å; D446-H716 PolarHBondContact OD1-NE2 2.85Å; D446-H716 IonicContact OD2-NE2 2.71Å; A529-H716 PolarHBondContact O-ND1 3.49Å; W530-H716 AromaticContact NE1-CE1 3.82Å; W530-H716 AromaticContact NE1-ND1 3.9Å; I712-H716 WeakPolarHBondContact O-CB 3.36Å; I712-H716 PolarHBondContact O-N 2.89Å; H716-Q718 VanDerWaalsContact C-N 3.32Å; H716-Q718 PolarHBondContact O-N 3.08Å; H716-Q719 PolarHBondContact O-N 3.34Å; H716-S720 WeakPolarHBondContact O-CB 3.43Å; H716-S720 PolarHBondContact O-N 2.91Å; H716-S720 PolarHBondContact O-OG 3.14Å
717	K	81.9	Confident	69.2	Low	38 Å²	38	64 Å²	64	17%	0.165	31%	0.314	C	S	.	.	H	α-helix	trans	-65.1	-30.2	175.5	165.8	166.9	160.4	-89.5	0	113.4	H713 E714 L715 S720 R721	H713-K717 VanDerWaalsContact O-CB 3.31Å; H713-K717 WeakPolarHBondContact O-CB 3.4Å; H713-K717 PolarHBondContact O-N 3Å; H713-K717 VanDerWaalsContact O-N 3.1Å; E714-K717 WeakPolarHBondContact O-CB 3.33Å; E714-K717 PolarHBondContact O-N 3.43Å; E714-K717 IonicContact OE1-NZ 3.08Å; E714-K717 PolarHBondContact OE1-NZ 2.95Å; E714-K717 IonicContact OE2-NZ 2.66Å; E714-K717 PolarHBondContact OE2-NZ 2.98Å; L715-K717 VanDerWaalsContact C-N 3.32Å; L715-K717 PolarHBondContact O-N 3.49Å; K717-S720 WeakPolarHBondContact CA-OG 3.37Å; K717-S720 PolarHBondContact O-OG 3.26Å; K717-R721 WeakPolarHBondContact O-CB 3.39Å; K717-R721 WeakPolarHBondContact O-CD 3.39Å; K717-R721 WeakPolarHBondContact O-CG 3.31Å; K717-R721 PolarHBondContact O-N 2.88Å
718	Q	79.8	Confident	66.6	Low	115 Å²	115	66.8 Å²	66.8	54%	0.537	33%	0.333	S	S	.	.	H	α-helix	trans	-75.4	-44.4	172.7	-71.3	175.6	27.6	0	0	111.9	E714 L715 H716 R721 G722	E714-Q718 WeakPolarHBondContact O-CG 3.39Å; E714-Q718 PolarHBondContact O-N 3.18Å; L715-Q718 PolarHBondContact O-N 3.37Å; L715-Q718 VanDerWaalsContact O-N 3.15Å; H716-Q718 VanDerWaalsContact C-N 3.32Å; H716-Q718 PolarHBondContact O-N 3.08Å; Q718-R721 PolarHBondContact O-N 3.17Å; Q718-G722 PolarHBondContact O-N 3.24Å
719	Q	75.5	Confident	63.9	Low	55 Å²	55	77 Å²	77	26%	0.257	37%	0.372	S	S	.	.	H	α-helix	trans	-60.4	-49.9	177.1	-73.6	179.3	-21.5	0	0	112.1	A529 M531 L715 H716 R721 G722 D723	A529-Q719 PolarHBondContact O-OE1 2.94Å; M531-Q719 PolarHBondContact O-NE2 3.3Å; L715-Q719 HydrophobicContact CD2-CG 4.25Å; L715-Q719 PolarHBondContact O-N 2.98Å; H716-Q719 PolarHBondContact O-N 3.34Å; Q719-R721 VanDerWaalsContact C-N 3.29Å; Q719-R721 PolarHBondContact O-N 3.5Å; Q719-G722 WeakPolarHBondContact O-CA 3.48Å; Q719-G722 PolarHBondContact O-N 2.94Å; Q719-D723 PolarHBondContact O-N 3.3Å
720	S	68.5	Low	61.1	Low	59 Å²	59	85.5 Å²	85.5	41%	0.413	41%	0.411	S	S	.	.	H	α-helix	trans	-62.4	-31.4	179.1	52	0	0	0	0	113.7	H716 K717	H716-S720 WeakPolarHBondContact O-CB 3.43Å; H716-S720 PolarHBondContact O-N 2.91Å; H716-S720 PolarHBondContact O-OG 3.14Å; K717-S720 WeakPolarHBondContact CA-OG 3.37Å; K717-S720 PolarHBondContact O-OG 3.26Å
721	R	62.9	Low	58.3	Low	176 Å²	176	95 Å²	95	66%	0.664	44%	0.444	S	S	*	.	H	α-helix	trans	-71.7	-35.7	169.2	-74.2	173.5	175.1	-158.2	-4.7	112.5	K717 Q718 Q719	K717-R721 WeakPolarHBondContact O-CB 3.39Å; K717-R721 WeakPolarHBondContact O-CD 3.39Å; K717-R721 WeakPolarHBondContact O-CG 3.31Å; K717-R721 PolarHBondContact O-N 2.88Å; Q718-R721 PolarHBondContact O-N 3.17Å; Q719-R721 VanDerWaalsContact C-N 3.29Å; Q719-R721 PolarHBondContact O-N 3.5Å
722	G	50.3	Low	55.6	Low	30 Å²	30	101.9 Å²	101.9	31%	0.309	48%	0.477	S	S	.	.	H	α-helix	trans	-65	-49.6	177.5	0	0	0	0	0	113.1	Q718 Q719 L724 S725	Q718-G722 PolarHBondContact O-N 3.24Å; Q719-G722 WeakPolarHBondContact O-CA 3.48Å; Q719-G722 PolarHBondContact O-N 2.94Å; G722-L724 VanDerWaalsContact C-N 3.28Å; G722-L724 PolarHBondContact O-N 3.01Å; G722-S725 WeakPolarHBondContact O-CB 3.49Å; G722-S725 PolarHBondContact O-N 3.11Å; G722-S725 PolarHBondContact O-OG 3.43Å
723	D	47.6	Very low	52.9	Low	71 Å²	71	110.4 Å²	110.4	38%	0.38	52%	0.517	S	S	.	.	H	α-helix	trans	-68.8	-25.4	-176.6	-72.2	-33.3	0	0	0	113.3	Q719 S725 R726	Q719-D723 PolarHBondContact O-N 3.3Å; D723-S725 PolarHBondContact O-N 3.45Å; D723-S725 VanDerWaalsContact O-N 3.16Å; D723-R726 PolarHBondContact O-N 3.45Å; D723-R726 VanDerWaalsContact O-N 3.09Å; D723-R726 WeakPolarHBondContact OD1-CD 3.41Å; D723-R726 IonicContact OD1-CZ 3.84Å; D723-R726 IonicContact OD1-NE 2.71Å; D723-R726 IonicContact OD1-NH1 3.73Å; D723-R726 PolarHBondContact OD1-NH1 3.49Å
724	L	37.2	Very low	50.1	Low	146 Å²	146	116 Å²	116	76%	0.764	56%	0.557	S	S	*	*	H	α-helix	trans	-60.1	-23.6	170.4	-150.2	81	0	0	0	112.8	G722	G722-L724 VanDerWaalsContact C-N 3.28Å; G722-L724 PolarHBondContact O-N 3.01Å
725	S	28	Very low	47.4	Very low	76 Å²	76	121.1 Å²	121.1	53%	0.531	59%	0.586	S	S	.	*	H	α-helix	trans	-84.9	-23.5	176.2	76.3	0	0	0	0	114.1	G722 D723 T728	G722-S725 WeakPolarHBondContact O-CB 3.49Å; G722-S725 PolarHBondContact O-N 3.11Å; G722-S725 PolarHBondContact O-OG 3.43Å; D723-S725 PolarHBondContact O-N 3.45Å; D723-S725 VanDerWaalsContact O-N 3.16Å; S725-T728 PolarHBondContact O-OG1 3.03Å
726	R	31.9	Very low	45	Very low	172 Å²	172	129 Å²	129	65%	0.649	62%	0.622	S	S	*	*	H	α-helix	trans	-77.6	-29.5	-175.8	-73.8	178.7	170.1	150.1	-7.8	113.2	D723 T728	D723-R726 PolarHBondContact O-N 3.45Å; D723-R726 VanDerWaalsContact O-N 3.09Å; D723-R726 WeakPolarHBondContact OD1-CD 3.41Å; D723-R726 IonicContact OD1-CZ 3.84Å; D723-R726 IonicContact OD1-NE 2.71Å; D723-R726 IonicContact OD1-NH1 3.73Å; D723-R726 PolarHBondContact OD1-NH1 3.49Å; R726-T728 PolarHBondContact O-N 3.02Å
727	H	29.9	Very low	42.5	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.796	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-1.6	-179	-76.7	-66.7	0	0	0	115
728	T	31.4	Very low	39.9	Very low	103 Å²	103	137.7 Å²	137.7	63%	0.632	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-12.4	-177.1	-27.3	0	0	0	0	114.2	S725 R726	S725-T728 PolarHBondContact O-OG1 3.03Å; R726-T728 PolarHBondContact O-N 3.02Å
729	W	30.3	Very low	37.5	Very low	220 Å²	220	139.9 Å²	139.9	83%	0.833	71%	0.705	S	S	*	*	S	Bend	trans	-121.1	-3.8	-166.8	-80.3	104.5	0	0	0	117.2
730	H	28.7	Very low	35.3	Very low	179 Å²	179	142.1 Å²	142.1	83%	0.829	73%	0.727	S	S	*	*			trans	-108.7	79.9	169.3	-74	-63.4	0	0	0	111.2
731	R	28.6	Very low	33.4	Very low	243 Å²	243	147.2 Å²	147.2	92%	0.917	75%	0.748	S	S	*	*	S	Bend	trans	-144.9	27.2	168.2	-149.3	-162.2	-175.5	131.5	8.2	113.9
732	Q	30.6	Very low	32.2	Very low	175 Å²	175	144.4 Å²	144.4	82%	0.818	75%	0.752	S	S	*	*	S	Bend	trans	-146.8	149.9	176.8	-148.8	152.5	-21	0	0	107.6
733	E	29.5	Very low	31.1	Very low	184 Å²	184	151.1 Å²	151.1	86%	0.86	78%	0.781	S	S	*	*	S	Bend	trans	65.7	75.1	179.6	-57	-179.9	-179.1	0	0	116.6
734	S	29.1	Very low	30.3	Very low	122 Å²	122	156 Å²	156	85%	0.853	80%	0.802	S	S	*	*			trans	-176.4	88	138.4	21.1	0	0	0	0	110.8
735	D	29.4	Very low	30	Very low	172 Å²	172	154.6 Å²	154.6	92%	0.92	80%	0.799	S	S	*	*			trans	-147.5	64.8	174.8	-130.7	-9.2	0	0	0	109.4
736	E	31.3	Very low	30	Very low	186 Å²	186	162.2 Å²	162.2	87%	0.869	82%	0.816	S	S	*	*			trans	-154	161.4	175.7	-130.7	177.1	177.3	0	0	111.4
737	S	29.2	Very low	29.9	Very low	115 Å²	115	159.7 Å²	159.7	80%	0.804	82%	0.824	S	S	*	*			trans	69	79.9	-175.4	63.1	0	0	0	0	117.8
738	S	28.1	Very low	29.6	Very low	120 Å²	120	160 Å²	160	84%	0.839	83%	0.826	S	S	*	*			trans	2.6	143	134.8	-43.7	0	0	0	0	120.4
739	D	28.6	Very low	30	Very low	162 Å²	162	159.5 Å²	159.5	87%	0.866	83%	0.825	S	S	*	*				-147.1	165	118.7	-144.6	-18.7	0	0	0	111.4
740	S	29.7	Very low	29.8	Very low	102 Å²	102	155.4 Å²	155.4	71%	0.713	82%	0.819	S	S	*	*			trans	-143.7	145.6	-162.1	65	0	0	0	0	116
741	I	28.9	Very low	29.7	Very low	166 Å²	166	152.3 Å²	152.3	85%	0.851	81%	0.813	S	S	*	*			trans	-132.2	134.7	162.6	-65.5	-176.8	0	0	0	107.3
742	P	37.3	Very low	29.6	Very low	117 Å²	117	152.3 Å²	152.3	76%	0.76	81%	0.813	S	S	*	*			trans	-92.4	162.7	-169.2	37	-37.1	0	0	0	113.9
743	D	27.8	Very low	29.3	Very low	170 Å²	170	149.4 Å²	149.4	91%	0.909	81%	0.812	S	S	*	*			trans	-150.5	157.6	149.6	-122.9	-31.3	0	0	0	110.4
744	E	30.8	Very low	29.3	Very low	175 Å²	175	151.4 Å²	151.4	82%	0.818	81%	0.811	S	S	*	*			trans	-95.5	149.3	-158.6	-106.5	-164.6	119.7	0	0	117.4
745	V	31.2	Very low	29.2	Very low	116 Å²	116	152 Å²	152	70%	0.703	81%	0.805	S	S	*	*			trans	54.4	81.2	152.9	-168.6	0	0	0	0	119
746	R	27.6	Very low	28.9	Very low	235 Å²	235	153.5 Å²	153.5	89%	0.887	80%	0.804	S	S	*	*				46.3	106.5	110.6	-173.2	-165.7	-166.3	167.9	6.2	119.3
747	S	29	Very low	28.8	Very low	119 Å²	119	150.8 Å²	150.8	83%	0.832	80%	0.803	S	S	*	*				-173.1	127.7	110.2	57.8	0	0	0	0	114
748	E	25.2	Very low	28.7	Very low	179 Å²	179	156.5 Å²	156.5	84%	0.836	81%	0.806	S	S	*	*			trans	-115.1	175.9	167.9	-120	-145.7	-147.5	0	0	108.7
749	P	39.9	Very low	28.6	Very low	92 Å²	92	156.4 Å²	156.4	60%	0.597	81%	0.806	S	S	*	*			cis	-139.9	-176.2	24.6	43	-23.9	0	0	0	117.9
750	N	25	Very low	28.5	Very low	135 Å²	135	157.7 Å²	157.7	72%	0.722	81%	0.806	S	S	*	*			trans	76.9	137.6	163.5	-68.3	-35	0	0	0	117.9
751	T	27.3	Very low	28.4	Very low	113 Å²	113	159.2 Å²	159.2	69%	0.693	81%	0.812	S	S	*	*			cis	-148.6	130.1	3	-9.8	0	0	0	0	113.5
752	R	26.1	Very low	28.3	Very low	244 Å²	244	161 Å²	161	92%	0.921	81%	0.814	S	S	*	*			trans	40.2	98.4	148.9	-67.9	176.9	-179.1	-176.4	0.1	119
753	S	24.7	Very low	28	Very low	114 Å²	114	161.3 Å²	161.3	80%	0.797	82%	0.816	S	S	*	*			trans	-101.1	146.3	140.4	64.3	0	0	0	0	109.8
754	R	28.5	Very low	27.9	Very low	225 Å²	225	158 Å²	158	85%	0.849	81%	0.812	S	S	*	*			trans	179.2	152	134.6	-111.2	-172.9	152.2	134.3	0.8	116.6
755	N	27	Very low	27.7	Very low	135 Å²	135	156.2 Å²	156.2	72%	0.722	81%	0.813	S	S	*	*			trans	78.4	119.8	148.7	-64.3	-5.9	0	0	0	121.1
756	F	24.3	Very low	27.5	Very low	204 Å²	204	158.8 Å²	158.8	90%	0.895	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-64	149.1	153.2	-73	-105.9	0	0	0	111
757	P	29.6	Very low	28	Very low	129 Å²	129	153.2 Å²	153.2	84%	0.838	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-81	154	175.9	33.2	-34.8	0	0	0	113.1
758	R	25.8	Very low	27.9	Very low	235 Å²	235	153.1 Å²	153.1	89%	0.887	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-100.8	152.6	174.1	-163.7	175.1	-173.9	172.3	1.1	109.6
759	S	26.3	Very low	28.7	Very low	118 Å²	118	150.9 Å²	150.9	83%	0.825	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-61.8	149.4	-179.4	42.9	0	0	0	0	113.5
760	Q	26.3	Very low	28	Very low	188 Å²	188	150.5 Å²	150.5	88%	0.879	83%	0.829	S	S	*	*			trans	-112	155.8	175.7	-68.4	-176.3	-10.6	0	0	111.5
761	T	27.3	Very low	28.1	Very low	135 Å²	135	149 Å²	149	83%	0.828	84%	0.836	S	S	*	*			trans	-127.8	148.6	173.2	-50.8	0	0	0	0	109.2
762	F	28.2	Very low	28.1	Very low	202 Å²	202	149.4 Å²	149.4	89%	0.886	84%	0.843	S	S	*	*			trans	-62.3	157.4	-177.6	-61.5	-93.7	0	0	0	114.8
763	P	30.6	Very low	28.2	Very low	124 Å²	124	143.4 Å²	143.4	81%	0.805	84%	0.838	S	S	*	*			trans	-120.4	154.6	142.5	37.3	-28.7	0	0	0	112.5
764	A	25.8	Very low	28.4	Very low	100 Å²	100	141.8 Å²	141.8	83%	0.826	83%	0.832	S	S	*	*			trans	-147.6	138.3	166.2	0	0	0	0	0	109.7
765	T	26.3	Very low	28.3	Very low	139 Å²	139	136.3 Å²	136.3	85%	0.853	83%	0.828	S	S	*	*			trans	-146.8	152.3	178.3	39.5	0	0	0	0	111.2
766	L	27.4	Very low	28.4	Very low	170 Å²	170	134.3 Å²	134.3	89%	0.89	83%	0.83	S	S	*	*			trans	-88.6	155	-179.4	-72.6	79.9	0	0	0	111.9
767	P	37.5	Very low	28.6	Very low	117 Å²	117	131.3 Å²	131.3	76%	0.76	83%	0.829	S	S	*	*			trans	-101.8	139.5	174.7	36.5	-30.8	0	0	0	113.7
768	S	26.6	Very low	28.5	Very low	118 Å²	118	129.2 Å²	129.2	83%	0.825	83%	0.831	S	S	*	*			trans	149.8	157.5	145.4	-74	0	0	0	0	112
769	P	41.6	Very low	28.6	Very low	132 Å²	132	121.2 Å²	121.2	86%	0.857	82%	0.822	S	S	*	*			cis	-120.9	168.7	-21.4	37.4	-24.1	0	0	0	112.3
770	G	25.3	Very low	28.7	Very low	83 Å²	83	122.1 Å²	122.1	86%	0.856	82%	0.823	S	S	*	*			trans	-154.7	131.2	170.5	0	0	0	0	0	110.9
771	A	27.7	Very low	28.8	Very low	104 Å²	104	119.8 Å²	119.8	86%	0.86	82%	0.816	S	S	*	*			trans	-115.9	139.3	-175.6	0	0	0	0	0	111.5
772	S	28.3	Very low	28.9	Very low	122 Å²	122	121.8 Å²	121.8	85%	0.853	82%	0.818	S	S	*	*			trans	-154.1	142.1	162.7	23.4	0	0	0	0	111.4
773	S	27.4	Very low	28.9	Very low	117 Å²	117	115.5 Å²	115.5	82%	0.818	81%	0.81	S	S	*	*			trans	-64.6	169.9	173.8	51.8	0	0	0	0	112.1
774	A	27.7	Very low	28.8	Very low	81 Å²	81	117.9 Å²	117.9	67%	0.669	81%	0.811	S	S	*	*			cis	-163.2	176	26.7	0	0	0	0	0	113
775	S	27.7	Very low	29	Very low	109 Å²	109	119.9 Å²	119.9	76%	0.762	81%	0.807	S	S	*	*			trans	47	114.8	154	52.4	0	0	0	0	119.5
776	A	28.7	Very low	29	Very low	93 Å²	93	117 Å²	117	77%	0.769	81%	0.805	S	S	*	*				67.9	141	76.2	0	0	0	0	0	113.4
777	T	28.5	Very low	29.1	Very low	141 Å²	141	118.5 Å²	118.5	87%	0.865	81%	0.807	S	S	*	*			cis	-152.7	159.2	31	42.5	0	0	0	0	113.7
778	G	27.8	Very low	28.7	Very low	86 Å²	86	123 Å²	123	89%	0.887	82%	0.815	S	S	*	*			trans	73.8	151.2	157.9	0	0	0	0	0	118.1
779	G	27.9	Very low	28.8	Very low	66 Å²	66	121.7 Å²	121.7	68%	0.68	81%	0.811	S	S	*	*			cis	152.6	123.2	-10.4	0	0	0	0	0	113.3
780	T	28.4	Very low	28.2	Very low	138 Å²	138	124.3 Å²	124.3	85%	0.847	81%	0.812	S	S	*	*			trans	52.5	132.9	162.7	54.4	0	0	0	0	118.1
781	N	28.8	Very low	28.2	Very low	139 Å²	139	126 Å²	126	74%	0.743	81%	0.811	S	S	*	*			cis	-168.7	-171.1	47.5	-139.9	-8.5	0	0	0	113.2
782	M	29.1	Very low	28.2	Very low	177 Å²	177	126.6 Å²	126.6	87%	0.872	81%	0.809	S	S	*	*			trans	-31.8	158	167.6	-59.5	177.6	174.8	0	0	116.7
783	G	28.1	Very low	28.2	Very low	69 Å²	69	126.4 Å²	126.4	71%	0.711	81%	0.807	S	S	*	*			cis	134.5	151.2	10.7	0	0	0	0	0	111.5
784	Q	28.8	Very low	28.5	Very low	175 Å²	175	127.9 Å²	127.9	82%	0.818	80%	0.801	S	S	*	*			trans	74.4	124.9	177.6	-72.7	-169.8	-98	0	0	121.1
785	D	28.7	Very low	28.7	Very low	142 Å²	142	133 Å²	133	76%	0.759	80%	0.803	S	S	*	*			trans	56.7	120.5	132.8	-48.6	-21.5	0	0	0	122.1
786	G	27.7	Very low	29	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	80%	0.8	S	S	*	*			trans	169.2	44.4	170	0	0	0	0	0	118.2	K788	G786-K788 PolarHBondContact O-N 3.36Å
787	E	29.6	Very low	29.1	Very low	202 Å²	202	139.1 Å²	139.1	94%	0.944	80%	0.796	S	S	*	*			trans	-65.8	123	174	-73.1	-161.1	136.3	0	0	112.4
788	K	29.2	Very low	29	Very low	211 Å²	211	138.3 Å²	138.3	92%	0.917	80%	0.796	S	S	*	*			trans	-136.5	145.2	164.7	-88.6	-177	174.4	174	0	109.9	G786	G786-K788 PolarHBondContact O-N 3.36Å
789	A	28.7	Very low	28.9	Very low	91 Å²	91	137.6 Å²	137.6	75%	0.752	79%	0.788	S	S	*	*			trans	-107.8	171.6	-162.3	0	0	0	0	0	114.5
790	Q	27.4	Very low	30	Very low	187 Å²	187	140.3 Å²	140.3	87%	0.874	79%	0.794	S	S	*	*			trans	71.5	120.9	161.6	-57.7	178.3	-1.2	0	0	118.5
791	S	26.6	Very low	30.2	Very low	119 Å²	119	138.4 Å²	138.4	83%	0.832	79%	0.792	S	S	*	*				-171.9	116.6	101.1	42	0	0	0	0	113
792	S	27.2	Very low	30.4	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	79%	0.788	S	S	*	*			trans	-164.2	76.2	167.3	49.2	0	0	0	0	111.5
793	S	29.1	Very low	30.5	Very low	117 Å²	117	133.8 Å²	133.8	82%	0.818	78%	0.782	S	S	*	*			trans	-161.5	120.8	175	-79.9	0	0	0	0	113
794	Q	32.4	Very low	30.6	Very low	149 Å²	149	137.9 Å²	137.9	70%	0.696	78%	0.782	S	S	*	*			trans	163.7	116	132.8	-89.5	-172	47.7	0	0	110.2
795	R	33.5	Very low	30.5	Very low	188 Å²	188	138.8 Å²	138.8	71%	0.709	78%	0.784	S	S	*	*				94.4	163.2	100.8	-80.1	-178.2	-177.1	165.4	-10.2	113
796	R	32.1	Very low	30.5	Very low	185 Å²	185	135.1 Å²	135.1	70%	0.698	78%	0.779	S	S	*	*			cis	-162	169.2	1.3	-122.8	-173.2	161.2	176.5	-11.7	107.7
797	H	31.3	Very low	30.5	Very low	146 Å²	146	138.5 Å²	138.5	68%	0.676	79%	0.785	S	S	*	*			cis	-167.9	134.2	-15.2	-138.4	15	0	0	0	108.9
798	S	27.5	Very low	30.5	Very low	123 Å²	123	133.8 Å²	133.8	86%	0.86	78%	0.78	S	S	*	*			trans	-173.3	137.1	151.7	48.8	0	0	0	0	113.3
799	G	25.7	Very low	30.5	Very low	71 Å²	71	127.3 Å²	127.3	73%	0.732	77%	0.773	S	S	*	*			trans	-114.5	-140.7	158.9	0	0	0	0	0	109
800	P	51.2	Low	30.5	Very low	123 Å²	123	132.9 Å²	132.9	80%	0.799	78%	0.781	S	S	*	*			cis	-139.5	-178.1	-3	43	-25.8	0	0	0	115.4
801	A	31.6	Very low	30.5	Very low	98 Å²	98	129.5 Å²	129.5	81%	0.81	77%	0.773	S	S	*	*			trans	56	159	143.8	0	0	0	0	0	122.2
802	A	32.7	Very low	30.6	Very low	79 Å²	79	130.7 Å²	130.7	65%	0.653	78%	0.775	S	S	*	*			cis	-168.7	163.3	-27.7	0	0	0	0	0	111.5
803	D	30.7	Very low	30.7	Very low	141 Å²	141	135.8 Å²	135.8	75%	0.754	78%	0.776	S	S	*	*			trans	70.1	126.4	146.3	-64.4	-11.8	0	0	0	127.1
804	H	30.1	Very low	30.7	Very low	155 Å²	155	137.1 Å²	137.1	72%	0.718	78%	0.779	S	S	*	*			trans	95.3	134.5	131.3	-85.4	-51.8	0	0	0	125.2
805	F	27.6	Very low	30.5	Very low	194 Å²	194	134.5 Å²	134.5	85%	0.851	78%	0.783	S	S	*	*			trans	59.6	140.2	174.4	-64.9	-82.3	0	0	0	117.6
806	G	27.9	Very low	30.2	Very low	64 Å²	64	134.5 Å²	134.5	66%	0.66	79%	0.791	S	S	*	*			cis	129.7	116.1	3.2	0	0	0	0	0	109.5
807	T	28.4	Very low	30.3	Very low	148 Å²	148	132.3 Å²	132.3	91%	0.908	80%	0.798	S	S	*	*				-161.1	-179.7	69.6	39.9	0	0	0	0	114.7
808	A	29.8	Very low	31	Very low	103 Å²	103	130.5 Å²	130.5	85%	0.851	80%	0.799	S	S	*	*			trans	-51	167.1	179.7	0	0	0	0	0	117
809	G	28.9	Very low	31	Very low	75 Å²	75	133.9 Å²	133.9	77%	0.773	80%	0.804	S	S	*	*			cis	-176.5	-171.2	5	0	0	0	0	0	110.1
810	K	29.4	Very low	31.1	Very low	208 Å²	208	134.4 Å²	134.4	90%	0.904	81%	0.809	S	S	*	*			cis	-153.2	147.9	8	-167.7	179.3	-172.7	-179.3	0	108.4
811	V	27.7	Very low	29.8	Very low	116 Å²	116	131.6 Å²	131.6	70%	0.703	80%	0.803	S	S	*	*			trans	-103.4	143.4	-174	172.6	0	0	0	0	112.2	R813	V811-R813 HydrophobicContact CG1-CG 4.16Å
812	V	28.7	Very low	29.7	Very low	144 Å²	144	138.9 Å²	138.9	87%	0.873	81%	0.809	S	S	*	*			trans	-132.1	132.8	143.6	-178.5	0	0	0	0	108.8
813	R	29.2	Very low	29.5	Very low	224 Å²	224	139.1 Å²	139.1	85%	0.845	81%	0.811	S	S	*	*			trans	-121.2	153.4	169.6	-77.4	173.9	165	172.5	-6.4	108.1	V811	V811-R813 HydrophobicContact CG1-CG 4.16Å
814	T	27.7	Very low	29.5	Very low	145 Å²	145	141.2 Å²	141.2	89%	0.89	82%	0.817	S	S	*	*			trans	-152.1	160.8	139.6	10.6	0	0	0	0	109.5
815	A	28	Very low	29.4	Very low	95 Å²	95	141.7 Å²	141.7	79%	0.785	82%	0.824	S	S	*	*			trans	-142	172.2	-173.9	0	0	0	0	0	111.7
816	H	28.2	Very low	29.5	Very low	187 Å²	187	135.6 Å²	135.6	87%	0.866	82%	0.816	S	S	*	*			trans	-42.3	152.3	179.9	-62.9	-91	0	0	0	117
817	V	33.2	Very low	29.5	Very low	140 Å²	140	141.1 Å²	141.1	85%	0.848	82%	0.822	S	S	*	*				-170.5	157	118.7	137.7	0	0	0	0	110.2
818	P	47	Very low	29.5	Very low	108 Å²	108	141.6 Å²	141.6	70%	0.701	81%	0.814	S	S	*	*			trans	-123.9	-167.6	-160.8	43.2	-29.5	0	0	0	116.4
819	M	27.1	Very low	29.5	Very low	194 Å²	194	142.6 Å²	142.6	96%	0.956	82%	0.815	S	S	*	*			trans	85.8	143	166.7	-62	-128.4	-63	0	0	120.1
820	G	27.7	Very low	29.4	Very low	81 Å²	81	144.3 Å²	144.3	84%	0.835	82%	0.815	S	S	*	*			trans	148.8	123	164.9	0	0	0	0	0	113.9
821	G	24.4	Very low	29.4	Very low	65 Å²	65	146.4 Å²	146.4	67%	0.67	82%	0.817	S	S	*	*			trans	-100.4	-135.4	-177.1	0	0	0	0	0	115.5
822	W	28.7	Very low	29.6	Very low	251 Å²	251	148.7 Å²	148.7	95%	0.951	82%	0.82	S	S	*	*			trans	75.3	130.6	-168	-49.1	89.6	0	0	0	112.7
823	A	28.5	Very low	29.6	Very low	84 Å²	84	149.3 Å²	149.3	69%	0.694	81%	0.813	S	S	*	*			cis	77.3	135.4	30.9	0	0	0	0	0	113.5
824	E	31.5	Very low	29.7	Very low	185 Å²	185	146.6 Å²	146.6	86%	0.864	81%	0.81	S	S	*	*			cis	-149.5	-150	1.3	-150.3	172.1	178.8	0	0	110.9
825	D	28.8	Very low	30.8	Very low	164 Å²	164	144.5 Å²	144.5	88%	0.877	80%	0.799	S	S	*	*			trans	67	136.6	177.6	-63.7	-32.8	0	0	0	118.8
826	G	28.4	Very low	30.8	Very low	67 Å²	67	145.8 Å²	145.8	69%	0.691	80%	0.797	S	S	*	*			cis	144.4	114.1	-16.1	0	0	0	0	0	115.4
827	K	28.6	Very low	30.8	Very low	180 Å²	180	144.9 Å²	144.9	78%	0.783	79%	0.793	S	S	*	*			trans	-178.1	142.3	144	-107.9	172.4	177.5	-108	0	115.5
828	E	28.8	Very low	30.7	Very low	158 Å²	158	146.4 Å²	146.4	74%	0.738	79%	0.791	S	S	*	*			trans	30.4	136.9	136.9	-63.5	166	145.6	0	0	120
829	S	29	Very low	29.8	Very low	124 Å²	124	150.8 Å²	150.8	87%	0.867	80%	0.802	S	S	*	*			cis	-153.8	165.5	18.8	58.5	0	0	0	0	113.7
830	S	26.7	Very low	29.8	Very low	110 Å²	110	147.7 Å²	147.7	77%	0.769	79%	0.794	S	S	*	*			trans	-100.1	159.1	-173.2	56.5	0	0	0	0	115.5
831	R	30.4	Very low	29.8	Very low	252 Å²	252	148.7 Å²	148.7	95%	0.951	79%	0.788	S	S	*	*			trans	-164.6	169.6	133.5	-105.5	160.5	-168.6	-167.3	1.9	112.3
832	H	30.1	Very low	30.1	Very low	164 Å²	164	154.1 Å²	154.1	76%	0.759	80%	0.796	S	S	*	*			trans	-125.6	151.8	-157.7	-101.8	-39.7	0	0	0	112.6
833	H	28.7	Very low	30.3	Very low	158 Å²	158	149.7 Å²	149.7	73%	0.731	79%	0.791	S	S	*	*			trans	59.3	155.3	144.5	-71.1	-58.9	0	0	0	119.1
834	E	32.2	Very low	30.4	Very low	167 Å²	167	155.2 Å²	155.2	78%	0.78	80%	0.802	S	S	*	*			cis	-145.9	-158	5.9	-131	-172.8	134.6	0	0	110.6
835	P	51.1	Low	30.6	Very low	101 Å²	101	154.3 Å²	154.3	66%	0.656	80%	0.802	S	S	*	*			trans	-123.1	-149.1	-151.3	32.9	-6.2	0	0	0	114.4
836	V	28.5	Very low	31.4	Very low	122 Å²	122	151.5 Å²	151.5	74%	0.739	79%	0.793	S	S	*	*			trans	82.8	139.7	165.8	-179.6	0	0	0	0	114.5
837	Q	26.9	Very low	31.9	Very low	168 Å²	168	154.3 Å²	154.3	79%	0.785	80%	0.799	S	S	*	*			cis	-142.7	-177.9	1.8	-147.6	149.8	-11.7	0	0	113.3
838	E	31.5	Very low	32	Very low	172 Å²	172	154.1 Å²	154.1	80%	0.804	80%	0.801	S	S	*	*			trans	-73.3	155.2	165.7	-56.3	155.9	112.7	0	0	112.8
839	E	27.4	Very low	32.6	Very low	200 Å²	200	153.6 Å²	153.6	94%	0.935	80%	0.802	S	S	*	*			trans	-153.3	160.7	145.2	-142.6	166.3	-139.3	0	0	111.2
840	T	27.2	Very low	32.6	Very low	129 Å²	129	156.6 Å²	156.6	79%	0.791	80%	0.801	S	S	*	*			trans	-136.5	137.6	-168.9	54.4	0	0	0	0	112.1
841	S	29.4	Very low	33	Very low	102 Å²	102	160 Å²	160	71%	0.713	80%	0.802	S	S	*	*			trans	-173.2	146.7	137.8	58.4	0	0	0	0	115.5
842	E	29.9	Very low	33.1	Very low	179 Å²	179	154.5 Å²	154.5	84%	0.836	80%	0.797	S	S	*	*			trans	67.5	138.5	133.8	-69.7	164.6	149.6	0	0	124.5
843	D	32.5	Very low	33.6	Very low	158 Å²	158	156.6 Å²	156.6	85%	0.845	82%	0.821	S	S	*	*			trans	-62.8	153.7	177.9	-55.1	-81.6	0	0	0	116
844	E	30.7	Very low	33.8	Very low	200 Å²	200	156.5 Å²	156.5	94%	0.935	83%	0.826	S	S	*	*				-153.7	159.3	127.6	-126.3	-177.8	175.7	0	0	112.8
845	L	36.4	Very low	33.9	Very low	165 Å²	165	155.9 Å²	155.9	86%	0.864	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-103.7	162.7	-175.6	-90.1	155.2	0	0	0	112.2
846	P	44.8	Very low	33	Very low	105 Å²	105	159 Å²	159	68%	0.682	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-94.4	160	-156.7	36.4	-39	0	0	0	116.2
847	P	40.1	Very low	33.2	Very low	126 Å²	126	161.2 Å²	161.2	82%	0.818	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-95.4	125	168.8	34.6	-30.7	0	0	0	114.4
848	H	30.1	Very low	33.6	Very low	176 Å²	176	160.8 Å²	160.8	82%	0.815	85%	0.847	S	S	*	*			trans	-7.7	141.7	158.6	-76.1	-92.7	0	0	0	123.5
849	I	40.5	Very low	33.8	Very low	148 Å²	148	160 Å²	160	76%	0.759	85%	0.85	S	S	*	*			trans	-31.6	139.6	148.5	-59.8	157.8	0	0	0	114.2
850	H	30.9	Very low	34.2	Very low	186 Å²	186	157.1 Å²	157.1	86%	0.861	84%	0.844	S	S	*	*			trans	-122.3	151.2	152.1	-108.4	-88.1	0	0	0	112
851	K	34	Very low	34.8	Very low	181 Å²	181	159.3 Å²	159.3	79%	0.787	85%	0.848	S	S	*	*			trans	-115.1	172.7	177.1	-96.2	-170.8	175	-176.2	0	110.6
852	V	32.5	Very low	35.2	Very low	138 Å²	138	164.1 Å²	164.1	84%	0.836	86%	0.859	S	S	*	*			trans	78.3	130.4	172.7	-168.8	0	0	0	0	111.6
853	T	40.1	Very low	35.7	Very low	207 Å²	207	162.7 Å²	162.7	100%	1.27	86%	0.861	S	S	*	*			cis	-91.1	0	14.4	46.2	0	0	0	0	116.5

Retrieved 853 of 853 residues in 523.1 ms (Link to these results)

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