A0A096NC78_PAPAN Loading...

NLR family member X1

Participates in antiviral signaling. Acts as a negative regulator of MAVS-mediated antiviral responses, through the inhibition of the virus-induced RLH (RIG-like helicase)-MAVS interaction. Instead, promotes autophagy by interacting with TUFM and subsequently recruiting the autophagy-related proteins ATG5 and ATG12. Also regulates MAVS-dependent NLRP3 inflammasome activation to attenuate apoptosis. Has no inhibitory function on NF-kappa-B signaling pathway, but enhances NF-kappa-B and JUN N-terminal kinase dependent signaling through the production of reactive oxygen species. Regulates viral mediated-inflammation and energy metabolism in a sex-dependent manner. In females, prevents uncontrolled inflammation and energy metabolism and thus, may contribute to the sex differences observed in infectious and inflammatory diseases.

AlphaFold DB , UniProt , Accession A0A096NC78, Species PAPAN (Papio anubis, Olive baboon), Gene NLRX1, Length 972 aa.

						>A0A096NC78_PAPAN|A0A096NC78|NLRX1
MRWGHHLPRASWGSGFGRALQPPDERIPFLIHWSWPLQGERPLGPPRAFIRHHGNLADSASWSGRHGRLFPSASATEAIQRYRWNLAEWFSRLPREERQFGPTFALDTVHVDPVIRESTPDELLRPPVELALEHQPPQAGLPPLALSQLFNPDASGRRVQTVVLYGTVGTGKSTLVRKMVLDWCYGRLPAFELLIPFSCEDLSSLGPAPVSLCQLVAQRYTPLKKVLPLMAAAGSHLLFVLHGLERLNLDFRLAGTGLCSDPEQPEEPAAIIVNLLRKYMLPEASILVTTRSSAIGRIPSKYVGRYGEICGFSDTNLQKLYFQLRLNQPDCGCGSGVSAAPAQRDNLVQMLSRNLEGHHQIAAACFLPSYCWLVCATLHFLHAPTPAGQTLTSIYTSFLRLNFSGETLDSTDASNLSLMAYAARTMGKLAYEGVSSRKTYFSEEDVCGCLEAGIKTEEEFQLLYIFRRDALRFFLAPCVEPGRAGTFVFTVPAMQEYLAALYIVLGLRKTTLQKVGKEVAELVGRVGEDVSLVLGIMAKLLPLRALPLLFNLIKVVPRVFGRMVGKSREAVAQAMVLEMFREEDYYNDDVLDQMGASILGVEGPRRHPDEPPEDEVFELFPIFMGGLLSAHNRAVLAQLGCPIKNLDALENAQAIKKKLGKLGRQVLPPSELLDHLFFHYEFQNQRFSAEVLSSLRQLNLAGVRMTPVKCTVVSSVLGSGRHALDEVNLASCQLDPAGLRTLMPVFLRARKLGLQLNGLGPEACKDLRDLLLHDQCQITTLRLSNNPLMAAGVALLMEGLAGNTSVTHLSLLHTGLGDEGLELLAAQLDRNRQLQELNVAYNGAGDTAALALARAAREHPSLELLHLYFNELSSEGRQVLRDLGGAAEGGARVVVSLTEGTAVSEYWSVILSEVQRNLNSWDRARVQRHLELLLRDLEDSRGATLNPWRKAQLLRVEGEVRGLLEQLGGSGS
					

Structure Viewer

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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	29.2	Very low	26.4	Very low	174 Å²	174	153 Å²	153	86%	0.857	77%	0.771	S	S	*	*				0	129.7	0	-76.4	171	171.3	0	0	107.7	F380	M1-F380 VanDerWaalsContact N-CE1 3.27Å
2	R	22.6	Very low	26.3	Very low	232 Å²	232	162.3 Å²	162.3	88%	0.875	79%	0.79	S	S	*	*			trans	-77.2	116.5	163.7	-78.5	-176	-178.5	-177.2	0.6	106.3	G4	R2-G4 PolarHBondContact O-N 2.97Å
3	W	29.2	Very low	26.2	Very low	131 Å²	131	155.5 Å²	155.5	50%	0.496	79%	0.789	S	S	.	*	S	Bend	trans	-69.5	90.2	161.2	-69.6	89.6	0	0	0	106.5	D469	W3-D469 HydrophobicContact CH2-CB 3.94Å
4	G	30.9	Very low	26.2	Very low	46 Å²	46	153.8 Å²	153.8	47%	0.474	80%	0.798	S	S	.	*			trans	175.1	110	-175.5	0	0	0	0	0	110.8	R2	R2-G4 PolarHBondContact O-N 2.97Å
5	H	29.8	Very low	26.2	Very low	177 Å²	177	148.6 Å²	148.6	82%	0.819	80%	0.797	S	S	*	*	S	Bend	trans	82.9	85.8	177	-48.8	-62.5	0	0	0	115.8
6	H	25.3	Very low	26.1	Very low	187 Å²	187	153.3 Å²	153.3	87%	0.866	81%	0.809	S	S	*	*				-168	77.7	123.9	-84.6	-53.2	0	0	0	108.3	P8	H6-P8 WeakPolarHBondContact O-CD 3.27Å
7	L	23.7	Very low	26.1	Very low	168 Å²	168	148.7 Å²	148.7	88%	0.88	81%	0.807	S	S	*	*			trans	-83.3	113.6	156.7	-84.9	159	0	0	0	106.7	R9	L7-R9 PolarHBondContact O-N 2.81Å
8	P	24.1	Very low	26.4	Very low	114 Å²	114	154.9 Å²	154.9	74%	0.74	82%	0.816	S	S	*	*			trans	-68	119.5	162.6	15	-7.4	0	0	0	107.7	H6 A10	H6-P8 WeakPolarHBondContact O-CD 3.27Å; P8-A10 PolarHBondContact O-N 3.45Å
9	R	24.8	Very low	26.3	Very low	252 Å²	252	151.8 Å²	151.8	95%	0.951	82%	0.816	S	S	*	*			trans	-58.2	100.4	163.2	-86.1	-179.2	169.9	176.5	-3.2	107.8	L7 S11	L7-R9 PolarHBondContact O-N 2.81Å; R9-S11 PolarHBondContact O-N 3.47Å
10	A	25.7	Very low	26.4	Very low	89 Å²	89	153.2 Å²	153.2	74%	0.736	82%	0.822	S	S	*	*			trans	-76.1	109.8	167	0	0	0	0	0	108.2	P8 W12	P8-A10 PolarHBondContact O-N 3.45Å; A10-W12 PolarHBondContact O-N 2.9Å
11	S	25.2	Very low	26.4	Very low	113 Å²	113	154.9 Å²	154.9	79%	0.79	82%	0.824	S	S	*	*			trans	-53.4	129.2	170.2	49.3	0	0	0	0	110.9	R9 G13	R9-S11 PolarHBondContact O-N 3.47Å; S11-G13 PolarHBondContact O-N 3.5Å
12	W	25.4	Very low	26.3	Very low	264 Å²	264	152 Å²	152	100%	1	82%	0.819	S	S	*	*			trans	-62.9	115.1	167.7	-78.6	41	0	0	0	109.3	A10	A10-W12 PolarHBondContact O-N 2.9Å
13	G	25.1	Very low	26.7	Very low	75 Å²	75	146.6 Å²	146.6	77%	0.773	81%	0.814	S	S	*	*			trans	-116.1	112.4	167.7	0	0	0	0	0	108.9	S11	S11-G13 PolarHBondContact O-N 3.5Å
14	S	26.1	Very low	26.7	Very low	131 Å²	131	148 Å²	148	92%	0.916	83%	0.831	S	S	*	*			trans	-65.4	128.1	173.8	52.1	0	0	0	0	111.6
15	G	25.9	Very low	26.5	Very low	76 Å²	76	154.1 Å²	154.1	78%	0.784	85%	0.847	S	S	*	*			trans	-174.3	109.8	172.1	0	0	0	0	0	112.9
16	F	25.1	Very low	26.3	Very low	224 Å²	224	157.4 Å²	157.4	98%	0.982	85%	0.853	S	S	*	*			trans	-52.4	151.1	-179.3	-88.5	-106.2	0	0	0	116.1
17	G	25.5	Very low	26.4	Very low	75 Å²	75	154.5 Å²	154.5	77%	0.773	84%	0.842	S	S	*	*			trans	162.6	88.9	152.7	0	0	0	0	0	115.7	A19	G17-A19 PolarHBondContact O-N 2.89Å
18	R	30.9	Very low	26.8	Very low	260 Å²	260	150.9 Å²	150.9	98%	0.981	83%	0.828	S	S	*	*			trans	-58	124.6	163.5	-94.5	177.1	168.4	172.2	-4	110
19	A	25.1	Very low	27.5	Very low	97 Å²	97	149.5 Å²	149.5	80%	0.802	81%	0.811	S	S	*	*			trans	-141.6	120.1	155.6	0	0	0	0	0	109.4	G17	G17-A19 PolarHBondContact O-N 2.89Å
20	L	28.8	Very low	28	Very low	179 Å²	179	140.8 Å²	140.8	94%	0.937	78%	0.783	S	S	*	*			trans	-69.5	137.3	169.3	-80.5	123.3	0	0	0	109.8
21	Q	26.6	Very low	28.2	Very low	188 Å²	188	142.5 Å²	142.5	88%	0.879	78%	0.778	S	S	*	*			trans	-131.4	152.7	160.5	-93.2	-168.6	-12.9	0	0	110.2
22	P	26.5	Very low	28.4	Very low	114 Å²	114	144.2 Å²	144.2	74%	0.74	77%	0.774	S	S	*	*			trans	-87.3	169	-148.9	35.7	-35.6	0	0	0	114.4
23	P	30.9	Very low	28.6	Very low	119 Å²	119	136.2 Å²	136.2	77%	0.773	74%	0.743	S	S	*	*	S	Bend	trans	-91.3	104.2	179.2	34	-24.5	0	0	0	110.1
24	D	29.8	Very low	28.5	Very low	160 Å²	160	137 Å²	137	86%	0.856	74%	0.737	S	S	*	*			trans	165.7	80.9	148.2	-98.2	-25	0	0	0	109.9
25	E	25.7	Very low	28.3	Very low	175 Å²	175	139.7 Å²	139.7	82%	0.818	73%	0.727	S	S	*	*			trans	-139.3	102.3	154	-83.8	-171	166.7	0	0	107.9	I27	E25-I27 PolarHBondContact O-N 2.83Å
26	R	27.1	Very low	28.2	Very low	246 Å²	246	141.8 Å²	141.8	93%	0.928	73%	0.727	S	S	*	*			trans	-66.5	88	161.1	-75.1	-176.8	179.8	-174.7	-0.4	107.4	P28	R26-P28 VanDerWaalsContact O-CD 3.32Å; R26-P28 WeakPolarHBondContact O-CD 3.11Å
27	I	27.3	Very low	28.4	Very low	126 Å²	126	137.7 Å²	137.7	65%	0.646	71%	0.714	S	S	*	*			trans	-60.7	119.8	170.8	-59.6	173	0	0	0	107.3	E25 F29 I31	E25-I27 PolarHBondContact O-N 2.83Å; I27-F29 PolarHBondContact O-N 2.8Å; I27-I31 HydrophobicContact CG2-CD1 3.92Å
28	P	30.7	Very low	28.6	Very low	91 Å²	91	143.1 Å²	143.1	59%	0.591	72%	0.72	S	S	*	*			trans	-58.9	135.5	176.2	-21.5	31.7	0	0	0	110.9	R26 L30	R26-P28 VanDerWaalsContact O-CD 3.32Å; R26-P28 WeakPolarHBondContact O-CD 3.11Å; P28-L30 PolarHBondContact O-N 3.47Å
29	F	38.5	Very low	28.3	Very low	86 Å²	86	134.1 Å²	134.1	38%	0.377	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-50.2	-14.8	-174.7	-172.5	-106.5	0	0	0	116	I27 C447 R467	I27-F29 PolarHBondContact O-N 2.8Å; F29-C447 VanDerWaalsContact CE1-SG 3.55Å; F29-C447 WeakPolarHBondContact CZ-SG 3.25Å; F29-R467 VanDerWaalsContact CE2-NH2 3.27Å
30	L	35.8	Very low	28.3	Very low	69 Å²	69	138.5 Å²	138.5	36%	0.361	71%	0.712	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.9	55.6	-172.5	-76.2	-178.8	0	0	0	114	P28 H32 W33	P28-L30 PolarHBondContact O-N 3.47Å; L30-H32 PolarHBondContact O-N 3.02Å; L30-W33 VanDerWaalsContact CD2-CD1 3.48Å
31	I	30.7	Very low	28.6	Very low	124 Å²	124	141.9 Å²	141.9	64%	0.636	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	74.1	163.3	-54.3	-176.4	0	0	0	110.1	I27	I27-I31 HydrophobicContact CG2-CD1 3.92Å
32	H	28.7	Very low	28.6	Very low	150 Å²	150	138.2 Å²	138.2	69%	0.694	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-177.3	55.7	136.9	-105.9	-47.4	0	0	0	109	L30	L30-H32 PolarHBondContact O-N 3.02Å
33	W	30.9	Very low	28.7	Very low	95 Å²	95	141.1 Å²	141.1	36%	0.36	71%	0.713	S	S	.	*			trans	-119.2	27	163.9	-65.7	83	0	0	0	111.1	L30 W35 P477	L30-W33 VanDerWaalsContact CD2-CD1 3.48Å; W33-W35 PolarHBondContact O-N 3.5Å; W33-P477 HydrophobicContact CH2-CG 3.84Å; W33-P477 HydrophobicContact CZ3-CG 3.75Å
34	S	21.8	Very low	28.4	Very low	91 Å²	91	138.7 Å²	138.7	64%	0.636	71%	0.709	S	S	*	*			trans	-67.7	111.1	174.6	51.1	0	0	0	0	110.7	P36	S34-P36 WeakPolarHBondContact O-CD 3.15Å
35	W	22.8	Very low	28.1	Very low	189 Å²	189	136.9 Å²	136.9	72%	0.716	71%	0.706	S	S	*	*			trans	-54.8	126.4	155.1	-112.3	-55.9	0	0	0	109	W33 L37	W33-W35 PolarHBondContact O-N 3.5Å; W35-L37 VanDerWaalsContact C-N 3.28Å; W35-L37 HydrophobicContact CG-CD1 4.48Å; W35-L37 PolarHBondContact O-N 3.41Å; W35-L37 VanDerWaalsContact O-N 3.17Å
36	P	23.9	Very low	28.2	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	71%	0.707	S	S	*	*			trans	-83.9	82.8	158	31.9	-25.1	0	0	0	107.3	S34 Q38	S34-P36 WeakPolarHBondContact O-CD 3.15Å; P36-Q38 VanDerWaalsContact C-N 3.25Å
37	L	28.9	Very low	28.2	Very low	138 Å²	138	134 Å²	134	72%	0.723	70%	0.704	S	S	*	*			trans	-94.7	60.7	157.5	-90.8	167.1	0	0	0	107.9	W35	W35-L37 VanDerWaalsContact C-N 3.28Å; W35-L37 HydrophobicContact CG-CD1 4.48Å; W35-L37 PolarHBondContact O-N 3.41Å; W35-L37 VanDerWaalsContact O-N 3.17Å
38	Q	29.1	Very low	28.1	Very low	190 Å²	190	132.6 Å²	132.6	89%	0.888	71%	0.712	S	S	*	*	S	Bend	trans	173.5	120.9	159.2	-101.2	164.2	18.4	0	0	108.3	P36	P36-Q38 VanDerWaalsContact C-N 3.25Å
39	G	24.8	Very low	27.9	Very low	71 Å²	71	137.9 Å²	137.9	73%	0.732	73%	0.726	S	S	*	*			trans	141.1	85.9	169.6	0	0	0	0	0	115.1
40	E	25.3	Very low	27.2	Very low	188 Å²	188	140.7 Å²	140.7	88%	0.879	74%	0.743	S	S	*	*			trans	66.2	132.4	145.2	-55.9	-167.6	157.3	0	0	121.2	P42	E40-P42 WeakPolarHBondContact O-CD 3.49Å
41	R	35.1	Very low	26.6	Very low	250 Å²	250	147.8 Å²	147.8	94%	0.943	77%	0.766	S	S	*	*			trans	-54.8	139.8	170.3	-68.7	176.1	174.1	177	-1.9	110.4
42	P	27.3	Very low	26.2	Very low	112 Å²	112	150.5 Å²	150.5	73%	0.727	78%	0.775	S	S	*	*			trans	-134.9	128.2	137.3	18.8	3.4	0	0	0	114.1	E40	E40-P42 WeakPolarHBondContact O-CD 3.49Å
43	L	27.5	Very low	26	Very low	174 Å²	174	151.1 Å²	151.1	91%	0.911	78%	0.778	S	S	*	*			trans	59	95.7	134.5	-62.4	161.6	0	0	0	120.1
44	G	25.3	Very low	25.6	Very low	68 Å²	68	150 Å²	150	70%	0.701	80%	0.796	S	S	*	*			trans	96	133.7	136.7	0	0	0	0	0	116.7
45	P	23.9	Very low	25.7	Very low	122 Å²	122	152.9 Å²	152.9	79%	0.792	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.7	140.3	170.6	29.6	-31.6	0	0	0	110	R47	P45-R47 PolarHBondContact O-N 2.79Å
46	P	25.9	Very low	25.8	Very low	128 Å²	128	152 Å²	152	83%	0.831	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-60.6	137.6	166.5	23.7	-29.1	0	0	0	109.6
47	R	27.1	Very low	25.8	Very low	232 Å²	232	150.4 Å²	150.4	88%	0.875	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-49.7	142.7	-166.6	-72.8	174.2	169	173.3	-4.5	113.9	P45	P45-R47 PolarHBondContact O-N 2.79Å
48	A	26.4	Very low	25.6	Very low	98 Å²	98	151.6 Å²	151.6	81%	0.81	82%	0.817	S	S	*	*			trans	-44.7	132.6	174.6	0	0	0	0	0	113.4
49	F	25.7	Very low	25.5	Very low	202 Å²	202	147.9 Å²	147.9	89%	0.886	81%	0.812	S	S	*	*			trans	-108.4	131.5	160.1	-85.2	-82.3	0	0	0	110.2
50	I	24.1	Very low	25.5	Very low	144 Å²	144	148.8 Å²	148.8	74%	0.738	81%	0.812	S	S	*	*			trans	-65	126.6	-169.9	-67.2	164	0	0	0	109.9	H52	I50-H52 PolarHBondContact O-N 3.45Å; I50-H52 VanDerWaalsContact O-N 3.16Å
51	R	22.5	Very low	25.4	Very low	219 Å²	219	144.9 Å²	144.9	83%	0.826	81%	0.806	S	S	*	*			trans	-65.3	107.4	165.4	-78.5	-178.2	179.7	174.3	0.2	108.6	H53	R51-H53 PolarHBondContact O-N 3.16Å
52	H	22.8	Very low	24.8	Very low	180 Å²	180	144.9 Å²	144.9	83%	0.833	81%	0.806	S	S	*	*			trans	-80.3	103.9	156.6	-92.9	-58.8	0	0	0	108.6	I50 G54	I50-H52 PolarHBondContact O-N 3.45Å; I50-H52 VanDerWaalsContact O-N 3.16Å; H52-G54 PolarHBondContact O-N 3.48Å
53	H	24.4	Very low	24.7	Very low	164 Å²	164	145.3 Å²	145.3	76%	0.759	81%	0.812	S	S	*	*			trans	-70.5	102.3	159.7	-91.8	-67.2	0	0	0	108.2	R51	R51-H53 PolarHBondContact O-N 3.16Å
54	G	23.8	Very low	24.6	Very low	71 Å²	71	140.4 Å²	140.4	73%	0.732	80%	0.803	S	S	*	*			trans	-103.9	105.5	161.2	0	0	0	0	0	108.5	H52 L56	H52-G54 PolarHBondContact O-N 3.48Å; G54-L56 PolarHBondContact O-N 2.81Å
55	N	22.8	Very low	24.8	Very low	152 Å²	152	148.9 Å²	148.9	81%	0.813	81%	0.814	S	S	*	*			trans	-66.4	120.2	168	-82.7	-20.8	0	0	0	109.2
56	L	25.2	Very low	25	Very low	169 Å²	169	151.8 Å²	151.8	89%	0.885	82%	0.816	S	S	*	*			trans	-142.5	107.1	142.3	-101.7	118.3	0	0	0	107.6	G54	G54-L56 PolarHBondContact O-N 2.81Å
57	A	24	Very low	25.2	Very low	87 Å²	87	149.6 Å²	149.6	72%	0.719	82%	0.817	S	S	*	*			trans	-64.9	130.5	162.7	0	0	0	0	0	108
58	D	25	Very low	25.6	Very low	162 Å²	162	148.5 Å²	148.5	87%	0.866	81%	0.813	S	S	*	*			trans	-155.4	137.6	131.5	-97.4	-26.1	0	0	0	110.5
59	S	26.3	Very low	26.2	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	82%	0.815	S	S	*	*			trans	-77.6	134.2	-165.7	51	0	0	0	0	113.5
60	A	24.4	Very low	26.8	Very low	90 Å²	90	150.7 Å²	150.7	74%	0.744	81%	0.811	S	S	*	*			trans	-143.4	95.9	147.1	0	0	0	0	0	109.1	W62	A60-W62 PolarHBondContact O-N 3.37Å
61	S	23.2	Very low	28.1	Very low	106 Å²	106	147.3 Å²	147.3	74%	0.741	80%	0.799	S	S	*	*			trans	-67.9	115.1	172.1	50.8	0	0	0	0	110.4
62	W	22.8	Very low	29.8	Very low	250 Å²	250	140.1 Å²	140.1	95%	0.947	78%	0.782	S	S	*	*			trans	-104	90	159.1	-83.2	55.3	0	0	0	108.3	A60	A60-W62 PolarHBondContact O-N 3.37Å
63	S	25.9	Very low	31.5	Very low	121 Å²	121	135.8 Å²	135.8	85%	0.846	78%	0.777	S	S	*	*			trans	-85.5	99.9	167.1	48.1	0	0	0	0	109.5
64	G	24.8	Very low	33.6	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	77%	0.768	S	S	*	*			trans	-138.1	103.7	170	0	0	0	0	0	109.9	H66	G64-H66 PolarHBondContact O-N 2.95Å
65	R	30.4	Very low	35.8	Very low	247 Å²	247	128.9 Å²	128.9	93%	0.932	74%	0.737	S	S	*	*			trans	-69.3	106.7	175.9	-74.2	178.6	-178.9	-169.2	0.2	110.1
66	H	28.7	Very low	38.5	Very low	182 Å²	182	125 Å²	125	84%	0.843	72%	0.718	S	S	*	*			trans	-135	127.7	149.8	-79.7	-68.8	0	0	0	108.2	G64 R68	G64-H66 PolarHBondContact O-N 2.95Å; H66-R68 PolarHBondContact O-N 3.35Å; H66-R68 VanDerWaalsContact O-N 3.07Å
67	G	28.5	Very low	41.2	Very low	83 Å²	83	123.7 Å²	123.7	86%	0.856	71%	0.708	S	S	*	*			trans	-60.5	109	-169.7	0	0	0	0	0	112.4	L69	G67-L69 PolarHBondContact O-N 3.22Å
68	R	36.3	Very low	44	Very low	208 Å²	208	120.4 Å²	120.4	79%	0.785	68%	0.681	S	S	*	*			trans	-69.8	108.2	165.4	-73.5	-176.5	175.9	-164.3	-3.9	108.3	H66 F70	H66-R68 PolarHBondContact O-N 3.35Å; H66-R68 VanDerWaalsContact O-N 3.07Å; R68-F70 VanDerWaalsContact C-N 3.34Å; R68-F70 PolarHBondContact O-N 3.43Å
69	L	39	Very low	46.9	Very low	161 Å²	161	113.7 Å²	113.7	84%	0.843	65%	0.645	S	S	*	*			trans	-59.5	103.6	154	-88.4	134.7	0	0	0	106.5	G67	G67-L69 PolarHBondContact O-N 3.22Å
70	F	38.8	Very low	49.6	Very low	186 Å²	186	113.4 Å²	113.4	82%	0.816	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-54	132.6	175.1	-81.3	-92.6	0	0	0	109.3	R68 S72	R68-F70 VanDerWaalsContact C-N 3.34Å; R68-F70 PolarHBondContact O-N 3.43Å; F70-S72 PolarHBondContact O-N 3.42Å
71	P	50	Low	52.5	Low	73 Å²	73	117.5 Å²	117.5	47%	0.474	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-56.7	128.8	166.4	-16.3	28	0	0	0	107.5	A75	P71-A75 HydrophobicContact CB-CB 3.88Å
72	S	58.3	Low	55.5	Low	68 Å²	68	112.5 Å²	112.5	48%	0.476	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-48.9	148.6	172.1	67.7	0	0	0	0	109.9	F70 S74 A75 T76	F70-S72 PolarHBondContact O-N 3.42Å; S72-S74 PolarHBondContact O-N 2.9Å; S72-A75 WeakPolarHBondContact O-CB 3.43Å; S72-A75 PolarHBondContact O-N 3.3Å; S72-A75 PolarHBondContact OG-N 3.2Å; S72-T76 PolarHBondContact O-N 3.29Å
73	A	59.3	Low	58.5	Low	89 Å²	89	103 Å²	103	74%	0.736	56%	0.556	S	S	*	*	H	α-helix	trans	-49.6	-30.8	179.3	0	0	0	0	0	112.9	E77	A73-E77 PolarHBondContact O-N 3.34Å; A73-E77 VanDerWaalsContact O-N 3.15Å
74	S	67.6	Low	61.1	Low	82 Å²	82	106.1 Å²	106.1	57%	0.573	55%	0.549	S	S	*	.	H	α-helix	trans	-65.7	-36.6	174.7	-178.2	0	0	0	0	114.3	S72 A78	S72-S74 PolarHBondContact O-N 2.9Å; S74-A78 WeakPolarHBondContact O-CB 3.34Å; S74-A78 PolarHBondContact O-N 3.4Å
75	A	70.6	Confident	63.7	Low	8 Å²	8	106 Å²	106	7%	0.066	53%	0.532	C	S	.	.	H	α-helix	trans	-70.2	-41.2	177.9	0	0	0	0	0	111.5	P71 S72 E77 A78 I79	P71-A75 HydrophobicContact CB-CB 3.88Å; S72-A75 WeakPolarHBondContact O-CB 3.43Å; S72-A75 PolarHBondContact O-N 3.3Å; S72-A75 PolarHBondContact OG-N 3.2Å; A75-E77 PolarHBondContact O-N 2.67Å; A75-A78 PolarHBondContact O-N 3.41Å; A75-I79 VanDerWaalsContact O-CG1 3.3Å; A75-I79 WeakPolarHBondContact O-CG1 3.35Å; A75-I79 PolarHBondContact O-N 3.38Å
76	T	78.8	Confident	66	Low	69 Å²	69	94.5 Å²	94.5	42%	0.423	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-42.5	175.6	-52.2	0	0	0	0	111.4	S72 I79 Q80	S72-T76 PolarHBondContact O-N 3.29Å; T76-I79 PolarHBondContact O-N 3.41Å; T76-Q80 WeakPolarHBondContact O-CG 3.12Å; T76-Q80 PolarHBondContact O-N 3.48Å
77	E	82.4	Confident	68.3	Low	143 Å²	143	86.5 Å²	86.5	67%	0.668	46%	0.455	S	S	*	.	H	α-helix	trans	-64	-41.2	176.1	-169.3	179.4	-176.6	0	0	112.1	A73 A75 Q80 R81	A73-E77 PolarHBondContact O-N 3.34Å; A73-E77 VanDerWaalsContact O-N 3.15Å; A75-E77 PolarHBondContact O-N 2.67Å; E77-Q80 PolarHBondContact O-N 2.87Å; E77-R81 WeakPolarHBondContact O-CB 3.27Å; E77-R81 PolarHBondContact O-N 3.07Å
78	A	83.3	Confident	70.5	Confident	18 Å²	18	86.6 Å²	86.6	15%	0.149	43%	0.433	C	S	.	.	H	α-helix	trans	-64.1	-40.4	176.1	0	0	0	0	0	112.8	S74 A75 R81 Y82 V226	S74-A78 WeakPolarHBondContact O-CB 3.34Å; S74-A78 PolarHBondContact O-N 3.4Å; A75-A78 PolarHBondContact O-N 3.41Å; A78-R81 PolarHBondContact O-N 2.64Å; A78-Y82 WeakPolarHBondContact O-CB 3.24Å; A78-Y82 PolarHBondContact O-N 3.3Å; A78-V226 HydrophobicContact CB-CG2 3.59Å
79	I	84.6	Confident	72.1	Confident	21 Å²	21	83.5 Å²	83.5	11%	0.108	42%	0.421	C	S	.	.	H	α-helix	trans	-65.4	-41.5	174.7	-66.7	166.3	0	0	0	110.7	A75 T76 Y82 R83 V226 M230	A75-I79 VanDerWaalsContact O-CG1 3.3Å; A75-I79 WeakPolarHBondContact O-CG1 3.35Å; A75-I79 PolarHBondContact O-N 3.38Å; T76-I79 PolarHBondContact O-N 3.41Å; I79-Y82 WeakPolarHBondContact O-CB 3.46Å; I79-Y82 PolarHBondContact O-N 3.11Å; I79-R83 HydrophobicContact CG2-CG 4.43Å; I79-R83 WeakPolarHBondContact O-CB 3.15Å; I79-R83 WeakPolarHBondContact O-CG 3.11Å; I79-R83 PolarHBondContact O-N 3.29Å; I79-V226 HydrophobicContact CD1-CG1 4.03Å; I79-V226 HydrophobicContact CG1-CG1 3.87Å; I79-M230 HydrophobicContact CD1-SD 3.72Å
80	Q	84.6	Confident	73.6	Confident	107 Å²	107	77.4 Å²	77.4	50%	0.5	39%	0.388	S	S	.	.	H	α-helix	trans	-64.6	-41.7	176.5	-71.4	-62.4	-17.5	0	0	112	T76 E77 Y82 R83 W84	T76-Q80 WeakPolarHBondContact O-CG 3.12Å; T76-Q80 PolarHBondContact O-N 3.48Å; E77-Q80 PolarHBondContact O-N 2.87Å; Q80-Y82 VanDerWaalsContact C-N 3.32Å; Q80-Y82 PolarHBondContact O-N 3.25Å; Q80-R83 PolarHBondContact O-N 2.96Å; Q80-W84 PolarHBondContact O-N 3.44Å
81	R	84.2	Confident	75	Confident	175 Å²	175	70.9 Å²	70.9	66%	0.66	37%	0.365	S	S	*	.	H	α-helix	trans	-63.5	-39.1	174.3	-168.6	172.6	-175.1	163	0.3	111.9	E77 A78 W84 N85 P222	E77-R81 WeakPolarHBondContact O-CB 3.27Å; E77-R81 PolarHBondContact O-N 3.07Å; A78-R81 PolarHBondContact O-N 2.64Å; R81-W84 PolarHBondContact O-N 2.96Å; R81-N85 VanDerWaalsContact O-CG 3.23Å; R81-N85 PolarHBondContact O-N 2.87Å; R81-N85 PolarHBondContact O-OD1 3.04Å; R81-P222 HydrophobicContact CG-CG 4.49Å
82	Y	86.3	Confident	75.5	Confident	2 Å²	2	73 Å²	73	1%	0.008	36%	0.364	C	S	.	.	H	α-helix	trans	-63.6	-47	173.7	174	-119.5	0	0	0	112.4	A78 I79 Q80 W84 N85 L86 W183 L193 L194 P196 Y220 L223	A78-Y82 WeakPolarHBondContact O-CB 3.24Å; A78-Y82 PolarHBondContact O-N 3.3Å; I79-Y82 WeakPolarHBondContact O-CB 3.46Å; I79-Y82 PolarHBondContact O-N 3.11Å; Q80-Y82 VanDerWaalsContact C-N 3.32Å; Q80-Y82 PolarHBondContact O-N 3.25Å; Y82-W84 VanDerWaalsContact C-N 3.3Å; Y82-W84 PolarHBondContact O-N 2.85Å; Y82-N85 PolarHBondContact O-N 3.47Å; Y82-L86 HydrophobicContact CD1-CD1 4.16Å; Y82-L86 HydrophobicContact CD2-CD1 4.35Å; Y82-L86 HydrophobicContact CD2-CG 4.19Å; Y82-L86 HydrophobicContact CE1-CD1 3.47Å; Y82-L86 VanDerWaalsContact CE1-CD1 3.47Å; Y82-L86 HydrophobicContact CE1-CG 4.32Å; Y82-L86 HydrophobicContact CE2-CD1 3.66Å; Y82-L86 HydrophobicContact CE2-CD2 4.12Å; Y82-L86 HydrophobicContact CE2-CG 3.65Å; Y82-L86 PolarHBondContact O-N 3.17Å; Y82-L86 WeakPolarHBondContact OH-CD1 3.23Å; Y82-W183 AromaticContact CD1-CH2 3.87Å; Y82-W183 HydrophobicContact CD1-CH2 3.87Å; Y82-W183 HydrophobicContact CD1-CZ3 4.19Å; Y82-W183 AromaticContact CE1-CH2 3.9Å; Y82-W183 HydrophobicContact CE1-CH2 3.9Å; Y82-W183 HydrophobicContact CE1-CZ3 4.03Å; Y82-L193 HydrophobicContact CD1-CD1 3.73Å; Y82-L193 HydrophobicContact CE1-CD1 3.67Å; Y82-L194 VanDerWaalsContact CE1-O 3.26Å; Y82-L194 WeakPolarHBondContact CE1-O 3.45Å; Y82-L194 PolarHBondContact OH-O 2.84Å; Y82-P196 WeakPolarHBondContact OH-CD 2.92Å; Y82-Y220 HydrophobicContact CD2-CD1 4.22Å; Y82-Y220 HydrophobicContact CD2-CG 4.31Å; Y82-Y220 AromaticContact CE2-CD1 3.41Å; Y82-Y220 HydrophobicContact CE2-CD1 3.41Å; Y82-Y220 VanDerWaalsContact CE2-CD1 3.41Å; Y82-Y220 HydrophobicContact CE2-CD2 4.16Å; Y82-Y220 AromaticContact CE2-CE1 3.95Å; Y82-Y220 HydrophobicContact CE2-CE1 3.95Å; Y82-Y220 AromaticContact CE2-CG 3.5Å; Y82-Y220 HydrophobicContact CE2-CG 3.5Å; Y82-L223 HydrophobicContact CD1-CD1 3.93Å; Y82-L223 HydrophobicContact CD1-CD2 3.88Å; Y82-L223 HydrophobicContact CD1-CG 4.18Å; Y82-L223 HydrophobicContact CD2-CD1 4.02Å; Y82-L223 HydrophobicContact CD2-CG 4.07Å; Y82-L223 HydrophobicContact CE1-CD1 3.72Å; Y82-L223 HydrophobicContact CE1-CD2 4.47Å; Y82-L223 HydrophobicContact CE1-CG 4.46Å; Y82-L223 HydrophobicContact CE2-CD1 3.83Å; Y82-L223 HydrophobicContact CE2-CG 4.38Å; Y82-L223 HydrophobicContact CG-CD1 4.04Å; Y82-L223 HydrophobicContact CG-CD2 3.88Å; Y82-L223 HydrophobicContact CG-CG 3.94Å
83	R	85.5	Confident	75.2	Confident	49 Å²	49	70.8 Å²	70.8	19%	0.185	35%	0.346	C	S	.	.	H	α-helix	trans	-56.7	-43.3	174.5	-77.1	173.5	71.4	137.4	-0.8	111.8	I79 Q80 L86 A87 W183 C184 G186	I79-R83 HydrophobicContact CG2-CG 4.43Å; I79-R83 WeakPolarHBondContact O-CB 3.15Å; I79-R83 WeakPolarHBondContact O-CG 3.11Å; I79-R83 PolarHBondContact O-N 3.29Å; Q80-R83 PolarHBondContact O-N 2.96Å; R83-L86 PolarHBondContact O-N 3.34Å; R83-A87 VanDerWaalsContact O-CB 3.28Å; R83-A87 WeakPolarHBondContact O-CB 3.02Å; R83-A87 PolarHBondContact O-N 3.09Å; R83-W183 HydrophobicContact CB-CZ3 4.4Å; R83-W183 HydrophobicContact CG-CE3 4.15Å; R83-W183 HydrophobicContact CG-CH2 3.3Å; R83-W183 HydrophobicContact CG-CZ2 3.97Å; R83-W183 HydrophobicContact CG-CZ3 3.41Å; R83-W183 VanDerWaalsContact CG-CZ3 3.41Å; R83-W183 VanDerWaalsContact CZ-O 3.28Å; R83-W183 PolarHBondContact NH2-O 3.2Å; R83-C184 PolarHBondContact NE-O 3.44Å; R83-C184 PolarHBondContact NH2-O 3.34Å; R83-C184 PolarHBondContact O-SG 3.48Å; R83-C184 VanDerWaalsContact O-SG 3.37Å; R83-G186 VanDerWaalsContact NH2-N 3.2Å
84	W	81.5	Confident	74.7	Confident	188 Å²	188	67.7 Å²	67.7	71%	0.712	32%	0.319	S	S	*	.	H	α-helix	trans	-61.2	-49.1	175.8	-175.9	-84.5	0	0	0	111.9	Q80 R81 Y82 L86 A87 E88	Q80-W84 PolarHBondContact O-N 3.44Å; R81-W84 PolarHBondContact O-N 2.96Å; Y82-W84 VanDerWaalsContact C-N 3.3Å; Y82-W84 PolarHBondContact O-N 2.85Å; W84-L86 VanDerWaalsContact C-N 3.34Å; W84-L86 PolarHBondContact O-N 3.03Å; W84-A87 PolarHBondContact O-N 3.25Å; W84-E88 WeakPolarHBondContact O-CB 3.38Å; W84-E88 PolarHBondContact O-N 2.82Å
85	N	78.7	Confident	73.6	Confident	67 Å²	67	69 Å²	69	36%	0.358	31%	0.311	S	S	.	.	H	α-helix	trans	-61.6	-41.3	179.2	-68.5	-4.4	0	0	0	112	R81 Y82 E88 W89	R81-N85 VanDerWaalsContact O-CG 3.23Å; R81-N85 PolarHBondContact O-N 2.87Å; R81-N85 PolarHBondContact O-OD1 3.04Å; Y82-N85 PolarHBondContact O-N 3.47Å; N85-E88 PolarHBondContact O-N 2.98Å; N85-W89 WeakPolarHBondContact O-CB 3.33Å; N85-W89 PolarHBondContact O-N 3.2Å
86	L	78.1	Confident	72.3	Confident	5 Å²	5	70.7 Å²	70.7	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-66.7	-44.4	174.8	-79.3	-177.5	0	0	0	111.9	Y82 R83 W84 E88 W89 F90 V180 W183 P196 Y220	Y82-L86 HydrophobicContact CD1-CD1 4.16Å; Y82-L86 HydrophobicContact CD2-CD1 4.35Å; Y82-L86 HydrophobicContact CD2-CG 4.19Å; Y82-L86 HydrophobicContact CE1-CD1 3.47Å; Y82-L86 VanDerWaalsContact CE1-CD1 3.47Å; Y82-L86 HydrophobicContact CE1-CG 4.32Å; Y82-L86 HydrophobicContact CE2-CD1 3.66Å; Y82-L86 HydrophobicContact CE2-CD2 4.12Å; Y82-L86 HydrophobicContact CE2-CG 3.65Å; Y82-L86 PolarHBondContact O-N 3.17Å; Y82-L86 WeakPolarHBondContact OH-CD1 3.23Å; R83-L86 PolarHBondContact O-N 3.34Å; W84-L86 VanDerWaalsContact C-N 3.34Å; W84-L86 PolarHBondContact O-N 3.03Å; L86-E88 VanDerWaalsContact C-N 3.28Å; L86-E88 PolarHBondContact O-N 3.1Å; L86-W89 PolarHBondContact O-N 3.48Å; L86-F90 HydrophobicContact CD2-CD2 3.96Å; L86-F90 HydrophobicContact CD2-CE2 3.66Å; L86-F90 WeakPolarHBondContact O-CB 3.48Å; L86-F90 WeakPolarHBondContact O-CD2 3.33Å; L86-F90 PolarHBondContact O-N 2.82Å; L86-V180 HydrophobicContact CB-CG1 4.38Å; L86-V180 HydrophobicContact CD1-CG1 4.29Å; L86-W183 HydrophobicContact CD1-CE3 4.38Å; L86-W183 HydrophobicContact CD1-CZ3 3.81Å; L86-P196 HydrophobicContact CD2-CG 4.13Å; L86-Y220 HydrophobicContact CD2-CE1 4.1Å
87	A	78.9	Confident	70.7	Confident	15 Å²	15	69 Å²	69	12%	0.124	31%	0.305	C	S	.	.	H	α-helix	trans	-57	-46.4	175.7	0	0	0	0	0	110.2	R83 W84 S91 C184	R83-A87 VanDerWaalsContact O-CB 3.28Å; R83-A87 WeakPolarHBondContact O-CB 3.02Å; R83-A87 PolarHBondContact O-N 3.09Å; W84-A87 PolarHBondContact O-N 3.25Å; A87-S91 WeakPolarHBondContact O-CA 3.46Å; A87-S91 WeakPolarHBondContact O-CB 3.31Å; A87-S91 PolarHBondContact O-N 3.48Å; A87-S91 PolarHBondContact O-OG 2.88Å; A87-C184 HydrophobicContact CB-CB 3.9Å
88	E	74.4	Confident	68.9	Low	85 Å²	85	67.7 Å²	67.7	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-61.8	-45.1	176.4	-162.7	-163.3	170.4	0	0	111.8	W84 N85 L86 S91 R92	W84-E88 WeakPolarHBondContact O-CB 3.38Å; W84-E88 PolarHBondContact O-N 2.82Å; N85-E88 PolarHBondContact O-N 2.98Å; L86-E88 VanDerWaalsContact C-N 3.28Å; L86-E88 PolarHBondContact O-N 3.1Å; E88-S91 PolarHBondContact O-OG 3.31Å; E88-R92 WeakPolarHBondContact O-CB 3.49Å; E88-R92 VanDerWaalsContact O-CD 3.24Å; E88-R92 WeakPolarHBondContact O-CD 3.32Å; E88-R92 WeakPolarHBondContact O-CG 3.47Å; E88-R92 PolarHBondContact O-N 2.88Å; E88-R92 IonicContact OE1-CZ 3.87Å; E88-R92 IonicContact OE1-NE 3.23Å; E88-R92 IonicContact OE1-NH2 3.66Å; E88-R92 PolarHBondContact OE1-NH2 3.19Å
89	W	69.6	Low	67	Low	143 Å²	143	70.8 Å²	70.8	54%	0.542	31%	0.305	S	S	.	.	H	α-helix	trans	-67.1	-42.6	-179.2	-174.5	-82.4	0	0	0	113.4	N85 L86 R92 V479	N85-W89 WeakPolarHBondContact O-CB 3.33Å; N85-W89 PolarHBondContact O-N 3.2Å; L86-W89 PolarHBondContact O-N 3.48Å; W89-R92 WeakPolarHBondContact O-CB 3.37Å; W89-V479 HydrophobicContact CH2-CB 4.37Å; W89-V479 HydrophobicContact CH2-CG1 3.63Å; W89-V479 HydrophobicContact CZ2-CG1 4.25Å; W89-V479 HydrophobicContact CZ3-CG1 4.47Å
90	F	70.3	Confident	65.1	Low	32 Å²	32	71.2 Å²	71.2	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-88.6	-21.5	-175.2	-79.6	-98.8	0	0	0	113.3	L86 R92 R177 V180 L181 P196	L86-F90 HydrophobicContact CD2-CD2 3.96Å; L86-F90 HydrophobicContact CD2-CE2 3.66Å; L86-F90 WeakPolarHBondContact O-CB 3.48Å; L86-F90 WeakPolarHBondContact O-CD2 3.33Å; L86-F90 PolarHBondContact O-N 2.82Å; F90-R92 VanDerWaalsContact C-N 3.35Å; F90-R177 HydrophobicContact CD1-CB 4.08Å; F90-R177 HydrophobicContact CD1-CG 3.78Å; F90-R177 HydrophobicContact CE1-CG 4.12Å; F90-V180 HydrophobicContact CB-CG1 4.32Å; F90-V180 HydrophobicContact CD1-CB 3.96Å; F90-V180 HydrophobicContact CD1-CG1 4.01Å; F90-V180 HydrophobicContact CD1-CG2 4.27Å; F90-V180 HydrophobicContact CD2-CG1 3.69Å; F90-V180 HydrophobicContact CE1-CB 4.14Å; F90-V180 HydrophobicContact CE1-CG1 4.24Å; F90-V180 HydrophobicContact CE1-CG2 3.94Å; F90-V180 HydrophobicContact CE2-CG1 3.95Å; F90-V180 HydrophobicContact CG-CB 4.16Å; F90-V180 HydrophobicContact CG-CG1 3.73Å; F90-V180 HydrophobicContact CZ-CG1 4.22Å; F90-V180 HydrophobicContact CZ-CG2 4.17Å; F90-L181 HydrophobicContact CB-CD2 3.83Å; F90-L181 HydrophobicContact CB-CG 4.05Å; F90-P196 HydrophobicContact CE2-CG 4.08Å; F90-P196 HydrophobicContact CZ-CB 4.22Å; F90-P196 HydrophobicContact CZ-CG 3.92Å
91	S	67.2	Low	63.1	Low	49 Å²	49	67 Å²	67	34%	0.343	29%	0.292	S	S	.	.	H	α-helix	trans	-77.9	-26.3	171.4	62.6	0	0	0	0	111.7	A87 E88 L93	A87-S91 WeakPolarHBondContact O-CA 3.46Å; A87-S91 WeakPolarHBondContact O-CB 3.31Å; A87-S91 PolarHBondContact O-N 3.48Å; A87-S91 PolarHBondContact O-OG 2.88Å; E88-S91 PolarHBondContact O-OG 3.31Å; S91-L93 PolarHBondContact O-N 3.44Å
92	R	61.4	Low	60.9	Low	119 Å²	119	64.4 Å²	64.4	45%	0.449	30%	0.298	S	S	.	.	S	Bend	trans	-61	102.7	166.1	-82.5	171.7	-174.4	-141.7	3	107.9	E88 W89 F90 R98	E88-R92 WeakPolarHBondContact O-CB 3.49Å; E88-R92 VanDerWaalsContact O-CD 3.24Å; E88-R92 WeakPolarHBondContact O-CD 3.32Å; E88-R92 WeakPolarHBondContact O-CG 3.47Å; E88-R92 PolarHBondContact O-N 2.88Å; E88-R92 IonicContact OE1-CZ 3.87Å; E88-R92 IonicContact OE1-NE 3.23Å; E88-R92 IonicContact OE1-NH2 3.66Å; E88-R92 PolarHBondContact OE1-NH2 3.19Å; W89-R92 WeakPolarHBondContact O-CB 3.37Å; F90-R92 VanDerWaalsContact C-N 3.35Å; R92-R98 VanDerWaalsContact CG-NH2 3.29Å
93	L	51.7	Low	59.1	Low	20 Å²	20	65.9 Å²	65.9	11%	0.105	31%	0.307	C	S	.	.			trans	-51.2	149.6	169.7	-80.1	162.3	0	0	0	110.9	S91 R95 E97 R98 F104	S91-L93 PolarHBondContact O-N 3.44Å; L93-R95 PolarHBondContact O-N 3.07Å; L93-E97 HydrophobicContact CB-CB 4.18Å; L93-E97 HydrophobicContact CD1-CB 4.28Å; L93-E97 HydrophobicContact CD2-CB 4.06Å; L93-E97 HydrophobicContact CD2-CG 4.47Å; L93-E97 HydrophobicContact CG-CB 4.43Å; L93-R98 HydrophobicContact CB-CG 4.12Å; L93-R98 PolarHBondContact O-NE 3.14Å; L93-R98 PolarHBondContact O-NH2 2.95Å; L93-F104 HydrophobicContact CD1-CB 3.22Å; L93-F104 HydrophobicContact CD1-CG 4.39Å; L93-F104 WeakPolarHBondContact CD1-O 3.18Å
94	P	48.4	Very low	57.8	Low	24 Å²	24	65.1 Å²	65.1	16%	0.156	31%	0.305	C	S	.	.			trans	-42	133.2	160.5	-23.7	34.4	0	0	0	108.3	E96 E97 R98	P94-E96 WeakPolarHBondContact CA-OE2 3.2Å; P94-E96 HydrophobicContact CB-CB 4.04Å; P94-E96 HydrophobicContact CB-CG 4.21Å; P94-E96 WeakPolarHBondContact CB-OE2 3.18Å; P94-E96 PolarHBondContact O-N 3.11Å; P94-E97 PolarHBondContact O-N 3.45Å; P94-R98 PolarHBondContact O-N 3.43Å
95	R	44.7	Very low	56.9	Low	111 Å²	111	58.1 Å²	58.1	42%	0.419	29%	0.287	S	S	.	.	H	α-helix	trans	-53.2	-28.6	178.5	-74.7	-179.7	167.9	164	-5.1	111.5	L93 E97 R98	L93-R95 PolarHBondContact O-N 3.07Å; R95-E97 VanDerWaalsContact C-N 3.32Å; R95-E97 PolarHBondContact O-N 3.44Å; R95-R98 PolarHBondContact O-N 3.29Å
96	E	44.3	Very low	56.3	Low	42 Å²	42	56 Å²	56	20%	0.196	28%	0.276	C	S	.	.	H	α-helix	trans	-46.5	-46	167.8	-55.9	66.6	-169.1	0	0	112.5	P94 F100 A476 T490	P94-E96 WeakPolarHBondContact CA-OE2 3.2Å; P94-E96 HydrophobicContact CB-CB 4.04Å; P94-E96 HydrophobicContact CB-CG 4.21Å; P94-E96 WeakPolarHBondContact CB-OE2 3.18Å; P94-E96 PolarHBondContact O-N 3.11Å; E96-F100 VanDerWaalsContact O-CD2 3.25Å; E96-F100 WeakPolarHBondContact O-CD2 3.21Å; E96-F100 WeakPolarHBondContact O-CE2 3.34Å; E96-A476 VanDerWaalsContact OE1-CB 3.23Å; E96-A476 WeakPolarHBondContact OE1-CB 3.34Å; E96-T490 HydrophobicContact CB-CG2 3.63Å; E96-T490 HydrophobicContact CG-CG2 3.42Å; E96-T490 VanDerWaalsContact CG-CG2 3.42Å; E96-T490 WeakPolarHBondContact CG-O 3.45Å
97	E	44.3	Very low	55.7	Low	34 Å²	34	58.2 Å²	58.2	16%	0.159	29%	0.287	C	S	.	.	H	α-helix	trans	-87.5	-24.1	-176.2	-76.5	-164.3	-130.9	0	0	113.8	L93 P94 R95 Q99 F100 R325	L93-E97 HydrophobicContact CB-CB 4.18Å; L93-E97 HydrophobicContact CD1-CB 4.28Å; L93-E97 HydrophobicContact CD2-CB 4.06Å; L93-E97 HydrophobicContact CD2-CG 4.47Å; L93-E97 HydrophobicContact CG-CB 4.43Å; P94-E97 PolarHBondContact O-N 3.45Å; R95-E97 VanDerWaalsContact C-N 3.32Å; R95-E97 PolarHBondContact O-N 3.44Å; E97-Q99 PolarHBondContact O-N 3.41Å; E97-F100 PolarHBondContact O-N 3.45Å; E97-R325 IonicContact OE2-CZ 3.52Å; E97-R325 IonicContact OE2-NH1 2.8Å; E97-R325 PolarHBondContact OE2-NH1 3.47Å; E97-R325 IonicContact OE2-NH2 3.45Å; E97-R325 PolarHBondContact OE2-NH2 2.85Å
98	R	46	Very low	55.1	Low	116 Å²	116	60.2 Å²	60.2	44%	0.438	30%	0.298	S	S	.	.	H	α-helix	trans	-66.7	-25.2	178.9	-64	-171.4	-158.2	-178.5	5	113.1	R92 L93 P94 R95 F100 G101	R92-R98 VanDerWaalsContact CG-NH2 3.29Å; L93-R98 HydrophobicContact CB-CG 4.12Å; L93-R98 PolarHBondContact O-NE 3.14Å; L93-R98 PolarHBondContact O-NH2 2.95Å; P94-R98 PolarHBondContact O-N 3.43Å; R95-R98 PolarHBondContact O-N 3.29Å; R98-F100 PolarHBondContact O-N 2.93Å; R98-G101 PolarHBondContact O-N 3.21Å
99	Q	43.5	Very low	54.9	Low	82 Å²	82	56.5 Å²	56.5	38%	0.383	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-19.1	179.1	-65.6	175.8	21.1	0	0	112.5	E97 R472	E97-Q99 PolarHBondContact O-N 3.41Å; Q99-R472 PolarHBondContact NE2-O 2.86Å
100	F	43.2	Very low	55.4	Low	30 Å²	30	51 Å²	51	13%	0.132	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	1.4	-178.8	-58.7	-73.7	0	0	0	113.5	E96 E97 R98 F104 W372 F398 F473	E96-F100 VanDerWaalsContact O-CD2 3.25Å; E96-F100 WeakPolarHBondContact O-CD2 3.21Å; E96-F100 WeakPolarHBondContact O-CE2 3.34Å; E97-F100 PolarHBondContact O-N 3.45Å; R98-F100 PolarHBondContact O-N 2.93Å; F100-F104 HydrophobicContact CB-CE2 4.09Å; F100-F104 WeakPolarHBondContact O-CE2 3.48Å; F100-W372 AromaticContact CD2-CZ2 3.97Å; F100-W372 HydrophobicContact CD2-CZ2 3.97Å; F100-W372 HydrophobicContact CE2-CH2 4.14Å; F100-W372 AromaticContact CE2-CZ2 3.75Å; F100-W372 HydrophobicContact CE2-CZ2 3.75Å; F100-F398 AromaticContact CE1-CE2 3.79Å; F100-F398 HydrophobicContact CE1-CE2 3.79Å; F100-F398 AromaticContact CE1-CZ 3.81Å; F100-F398 HydrophobicContact CE1-CZ 3.81Å; F100-F398 HydrophobicContact CZ-CE2 4.06Å; F100-F398 AromaticContact CZ-CZ 3.65Å; F100-F398 HydrophobicContact CZ-CZ 3.65Å; F100-F473 HydrophobicContact CZ-CE2 4.39Å
101	G	43	Very low	56	Low	19 Å²	19	50 Å²	50	20%	0.196	26%	0.258	C	S	.	.			trans	154	146.7	176.8	0	0	0	0	0	113.9	R98 T103 F104	R98-G101 PolarHBondContact O-N 3.21Å; G101-T103 PolarHBondContact O-N 3.04Å; G101-F104 WeakPolarHBondContact O-CD2 3.45Å
102	P	38.9	Very low	56.5	Low	121 Å²	121	52 Å²	52	79%	0.786	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.5	-175.8	31.1	-34.4	0	0	0	115.1
103	T	48.5	Very low	57.4	Low	33 Å²	33	47 Å²	47	20%	0.202	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	17.5	-167.5	40.5	0	0	0	0	115.7	G101 A105 C331	G101-T103 PolarHBondContact O-N 3.04Å; T103-A105 PolarHBondContact O-N 2.81Å; T103-C331 HydrophobicContact CG2-CB 3.41Å; T103-C331 VanDerWaalsContact CG2-CB 3.41Å; T103-C331 WeakPolarHBondContact CG2-SG 3.29Å
104	F	57.2	Low	58.8	Low	33 Å²	33	47.3 Å²	47.3	15%	0.145	25%	0.25	C	S	.	.			trans	-78	114.6	175.5	-63.5	-58.1	0	0	0	109.5	L93 F100 G101 R325	L93-F104 HydrophobicContact CD1-CB 3.22Å; L93-F104 HydrophobicContact CD1-CG 4.39Å; L93-F104 WeakPolarHBondContact CD1-O 3.18Å; F100-F104 HydrophobicContact CB-CE2 4.09Å; F100-F104 WeakPolarHBondContact O-CE2 3.48Å; G101-F104 WeakPolarHBondContact O-CD2 3.45Å; F104-R325 VanDerWaalsContact CD1-CZ 3.43Å
105	A	62.4	Low	60.6	Low	40 Å²	40	46.2 Å²	46.2	33%	0.331	24%	0.243	S	C	.	.			trans	-108.3	130.5	166.7	0	0	0	0	0	107.7	T103 D107 T108 V109	T103-A105 PolarHBondContact O-N 2.81Å; A105-D107 PolarHBondContact O-N 2.89Å; A105-D107 VanDerWaalsContact O-N 3.15Å; A105-T108 HydrophobicContact CB-CG2 4.26Å; A105-T108 PolarHBondContact O-N 3.44Å; A105-T108 PolarHBondContact O-OG1 2.83Å; A105-T108 VanDerWaalsContact O-OG1 3.07Å; A105-V109 PolarHBondContact O-N 3.28Å
106	L	67	Low	62.4	Low	24 Å²	24	47.2 Å²	47.2	13%	0.126	25%	0.247	C	C	.	.	H	α-helix	trans	-57	-33.2	179.2	-173.8	60.9	0	0	0	110.9	T108 H110 T174 R177 K178 L181	L106-T108 VanDerWaalsContact C-N 3.31Å; L106-T108 PolarHBondContact O-N 3.37Å; L106-H110 HydrophobicContact CD1-CB 4.32Å; L106-H110 WeakPolarHBondContact O-CB 3.48Å; L106-H110 PolarHBondContact O-N 2.98Å; L106-T174 HydrophobicContact CD1-CG2 3.77Å; L106-R177 HydrophobicContact CD2-CB 3.63Å; L106-K178 HydrophobicContact CD2-CB 4.31Å; L106-L181 HydrophobicContact CB-CD1 3.97Å; L106-L181 HydrophobicContact CD2-CD1 3.92Å; L106-L181 HydrophobicContact CG-CD1 4.4Å
107	D	64.4	Low	64.2	Low	50 Å²	50	48 Å²	48	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-29.9	176.3	-73.2	-52	0	0	0	115.1	A105 Y185 R187	A105-D107 PolarHBondContact O-N 2.89Å; A105-D107 VanDerWaalsContact O-N 3.15Å; D107-Y185 WeakPolarHBondContact OD2-CE2 3.19Å; D107-R187 IonicContact OD1-CZ 3.98Å; D107-R187 IonicContact OD1-NH1 3.84Å; D107-R187 PolarHBondContact OD1-NH1 3.18Å; D107-R187 IonicContact OD1-NH2 3.86Å
108	T	66.8	Low	65.9	Low	58 Å²	58	46.8 Å²	46.8	36%	0.356	25%	0.246	S	C	.	.	H	α-helix	trans	-95.7	-13.4	-173.9	60	0	0	0	0	113.3	A105 L106 Q328	A105-T108 HydrophobicContact CB-CG2 4.26Å; A105-T108 PolarHBondContact O-N 3.44Å; A105-T108 PolarHBondContact O-OG1 2.83Å; A105-T108 VanDerWaalsContact O-OG1 3.07Å; L106-T108 VanDerWaalsContact C-N 3.31Å; L106-T108 PolarHBondContact O-N 3.37Å; T108-Q328 PolarHBondContact O-NE2 2.98Å; T108-Q328 PolarHBondContact OG1-NE2 2.59Å; T108-Q328 PolarHBondContact OG1-OE1 3.38Å
109	V	70.4	Confident	67	Low	6 Å²	6	43.9 Å²	43.9	4%	0.036	24%	0.241	C	C	.	.	H	α-helix	trans	-120.8	-17.3	-172.3	-178.8	0	0	0	0	112.6	A105 V111 Y321 R325 Q328	A105-V109 PolarHBondContact O-N 3.28Å; V109-V111 PolarHBondContact O-N 3.36Å; V109-Y321 HydrophobicContact CG1-CE2 4.35Å; V109-R325 HydrophobicContact CG1-CB 4.29Å; V109-R325 HydrophobicContact CG1-CG 4.41Å; V109-Q328 HydrophobicContact CG2-CG 4.01Å
110	H	79.9	Confident	67.8	Low	28 Å²	28	42.6 Å²	42.6	13%	0.13	24%	0.24	C	C	.	.			trans	-62.9	128.5	179.7	-170.4	79.6	0	0	0	111.4	L106 D112 K178	L106-H110 HydrophobicContact CD1-CB 4.32Å; L106-H110 WeakPolarHBondContact O-CB 3.48Å; L106-H110 PolarHBondContact O-N 2.98Å; H110-D112 IonicContact CD2-OD1 2.77Å; H110-D112 PolarHBondContact CD2-OD1 3.05Å; H110-D112 VanDerWaalsContact CD2-OD1 3.23Å; H110-D112 IonicContact NE2-OD1 3.41Å; H110-D112 PolarHBondContact NE2-OD1 3.22Å; H110-K178 HydrophobicContact CB-CD 4.12Å
111	V	82	Confident	68.2	Low	10 Å²	10	45.8 Å²	45.8	6%	0.061	26%	0.259	C	S	.	.			trans	-110.1	123.6	165.7	176	0	0	0	0	106.4	V109 P113 F312 L317 L320 Y321 L324	V109-V111 PolarHBondContact O-N 3.36Å; V111-P113 WeakPolarHBondContact O-CD 3.26Å; V111-F312 HydrophobicContact CB-CE1 3.76Å; V111-F312 HydrophobicContact CB-CZ 3.97Å; V111-F312 HydrophobicContact CG1-CD1 4.25Å; V111-F312 HydrophobicContact CG1-CE1 3.75Å; V111-F312 HydrophobicContact CG1-CZ 4.36Å; V111-L317 HydrophobicContact CG1-CB 4.26Å; V111-L317 HydrophobicContact CG1-CD2 3.93Å; V111-L320 HydrophobicContact CG1-CD2 4.25Å; V111-L320 HydrophobicContact CG2-CD2 4.28Å; V111-L320 HydrophobicContact CG2-CG 4.05Å; V111-Y321 HydrophobicContact CG2-CD2 4.19Å; V111-L324 HydrophobicContact CG2-CD1 3.76Å
112	D	79.2	Confident	68.9	Low	92 Å²	92	49.3 Å²	49.3	49%	0.492	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-62.2	121.8	177.9	-68.1	-41.7	0	0	0	108.8	H110	H110-D112 IonicContact CD2-OD1 2.77Å; H110-D112 PolarHBondContact CD2-OD1 3.05Å; H110-D112 VanDerWaalsContact CD2-OD1 3.23Å; H110-D112 IonicContact NE2-OD1 3.41Å; H110-D112 PolarHBondContact NE2-OD1 3.22Å
113	P	80.1	Confident	69.7	Low	15 Å²	15	45.5 Å²	45.5	10%	0.097	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-69.6	155.6	175.4	30.8	-34.3	0	0	0	109.8	V111 I115 L175 I309	V111-P113 WeakPolarHBondContact O-CD 3.26Å; P113-I115 PolarHBondContact O-N 3.03Å; P113-L175 HydrophobicContact CG-CD1 3.75Å; P113-I309 HydrophobicContact CB-CG2 3.92Å; P113-I309 HydrophobicContact CG-CG2 3.94Å
114	V	81.6	Confident	69.6	Low	25 Å²	25	49.2 Å²	49.2	15%	0.152	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-69.2	120.5	173.1	179.3	0	0	0	0	108.5	R116 P143 C310 G311 S313 L317	V114-R116 HydrophobicContact CG1-CG 4.04Å; V114-P143 HydrophobicContact CG1-CB 4.05Å; V114-P143 HydrophobicContact CG1-CG 4.17Å; V114-C310 HydrophobicContact CB-CB 4.29Å; V114-C310 WeakPolarHBondContact O-CB 3.34Å; V114-C310 PolarHBondContact O-N 2.89Å; V114-G311 PolarHBondContact N-O 3.44Å; V114-S313 VanDerWaalsContact CG2-OG 3.29Å; V114-S313 WeakPolarHBondContact CG2-OG 3.39Å; V114-L317 HydrophobicContact CG2-CD1 3.44Å; V114-L317 VanDerWaalsContact CG2-CD1 3.44Å
115	I	84.6	Confident	68.9	Low	2 Å²	2	50.4 Å²	50.4	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	120.6	172.1	-54.2	175.1	0	0	0	107.7	P113 P143 L144 L146 L149 L164 L175 E308 I309	P113-I115 PolarHBondContact O-N 3.03Å; I115-P143 CarbonylContact O-C 3.51Å; I115-P143 WeakPolarHBondContact O-CA 3.34Å; I115-L144 HydrophobicContact CB-CB 4.46Å; I115-L144 HydrophobicContact CG2-CB 4.42Å; I115-L144 PolarHBondContact O-N 3.14Å; I115-L146 HydrophobicContact CD1-CD2 3.92Å; I115-L146 HydrophobicContact CD1-CG 4.41Å; I115-L149 HydrophobicContact CD1-CD2 4.46Å; I115-L149 HydrophobicContact CG2-CD2 4.44Å; I115-L164 HydrophobicContact CG2-CD2 4.03Å; I115-L175 HydrophobicContact CD1-CD2 4.01Å; I115-E308 CarbonylContact C-O 3.55Å; I115-E308 VanDerWaalsContact CA-O 3.29Å; I115-E308 WeakPolarHBondContact CA-O 3.38Å; I115-I309 HydrophobicContact CG1-CG1 4.45Å
116	R	82.3	Confident	67.7	Low	131 Å²	131	51.1 Å²	51.1	49%	0.494	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	132.3	175.8	-60.8	-175	81.9	151.1	2.3	109	V114 G307 E308	V114-R116 HydrophobicContact CG1-CG 4.04Å; R116-G307 CarbonylContact O-C 3.55Å; R116-G307 VanDerWaalsContact O-CA 3.28Å; R116-G307 WeakPolarHBondContact O-CA 3.13Å; R116-E308 PolarHBondContact N-O 2.93Å; R116-E308 PolarHBondContact O-N 3.25Å
117	E	83.6	Confident	66.3	Low	58 Å²	58	53 Å²	53	27%	0.271	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	140.8	170.5	-147	162.3	-178.1	0	0	109.1	L141 L144 R305	E117-L141 HydrophobicContact CB-CD1 4.26Å; E117-L144 HydrophobicContact CB-CD1 3.54Å; E117-L144 HydrophobicContact CG-CD1 4.1Å; E117-R305 HydrophobicContact CG-CG 4.15Å; E117-R305 IonicContact OE1-CZ 3.54Å; E117-R305 IonicContact OE1-NE 3.51Å; E117-R305 PolarHBondContact OE1-NE 2.77Å; E117-R305 IonicContact OE1-NH2 3.82Å
118	S	78.9	Confident	64.8	Low	9 Å²	9	53.1 Å²	53.1	6%	0.063	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.4	175.9	-50.6	0	0	0	0	108.6	E122 Y165 Y306	S118-E122 WeakPolarHBondContact CA-OE2 3.33Å; S118-Y165 WeakPolarHBondContact CB-OH 3.09Å; S118-Y165 PolarHBondContact OG-OH 3.32Å; S118-Y306 PolarHBondContact N-O 3.49Å
119	T	70.4	Confident	63.1	Low	55 Å²	55	53 Å²	53	34%	0.337	28%	0.277	S	S	.	.			trans	-79.8	150.1	177.2	62.3	0	0	0	0	110.3	D121 E122 L123	T119-D121 PolarHBondContact O-N 3.4Å; T119-D121 VanDerWaalsContact O-N 3.17Å; T119-E122 PolarHBondContact N-OE2 3.47Å; T119-E122 VanDerWaalsContact N-OE2 3.08Å; T119-E122 PolarHBondContact O-N 3.26Å; T119-E122 VanDerWaalsContact O-N 3.1Å; T119-E122 WeakPolarHBondContact OG1-CB 3.47Å; T119-E122 VanDerWaalsContact OG1-CD 3.25Å; T119-E122 WeakPolarHBondContact OG1-CG 3.14Å; T119-E122 PolarHBondContact OG1-N 3.21Å; T119-E122 VanDerWaalsContact OG1-N 3.15Å; T119-L123 VanDerWaalsContact O-CG 3.32Å; T119-L123 WeakPolarHBondContact O-CG 3.21Å; T119-L123 PolarHBondContact O-N 3.03Å
120	P	58.7	Low	61.4	Low	55 Å²	55	56.7 Å²	56.7	36%	0.357	30%	0.296	S	S	.	.	H	α-helix	trans	-54.1	-32.9	173.3	-24.8	34	0	0	0	112.4	L123 L124 Y306	P120-L123 PolarHBondContact O-N 3.13Å; P120-L124 WeakPolarHBondContact O-CB 3.41Å; P120-L124 WeakPolarHBondContact O-CG 3.49Å; P120-L124 PolarHBondContact O-N 3.42Å; P120-L124 VanDerWaalsContact O-N 3.11Å; P120-Y306 HydrophobicContact CB-CE2 4.44Å; P120-Y306 HydrophobicContact CG-CD2 4.38Å; P120-Y306 HydrophobicContact CG-CE2 4.19Å
121	D	52	Low	59.3	Low	98 Å²	98	56.2 Å²	56.2	52%	0.524	30%	0.297	S	S	.	.	H	α-helix	trans	-70.5	-38.5	177.9	-58.3	-40.1	0	0	0	112.3	T119 L123 R125	T119-D121 PolarHBondContact O-N 3.4Å; T119-D121 VanDerWaalsContact O-N 3.17Å; D121-L123 VanDerWaalsContact C-N 3.26Å; D121-L123 PolarHBondContact O-N 2.81Å; D121-R125 WeakPolarHBondContact O-CB 3.45Å; D121-R125 WeakPolarHBondContact O-CD 3.44Å; D121-R125 WeakPolarHBondContact O-CG 3.29Å; D121-R125 PolarHBondContact O-N 2.88Å; D121-R125 VanDerWaalsContact O-N 3.09Å; D121-R125 PolarHBondContact O-NE 2.67Å
122	E	57.6	Low	57	Low	93 Å²	93	59.2 Å²	59.2	44%	0.435	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-28.7	172.6	-78.4	163.6	-169.8	0	0	113.4	S118 T119 L130	S118-E122 WeakPolarHBondContact CA-OE2 3.33Å; T119-E122 PolarHBondContact N-OE2 3.47Å; T119-E122 VanDerWaalsContact N-OE2 3.08Å; T119-E122 PolarHBondContact O-N 3.26Å; T119-E122 VanDerWaalsContact O-N 3.1Å; T119-E122 WeakPolarHBondContact OG1-CB 3.47Å; T119-E122 VanDerWaalsContact OG1-CD 3.25Å; T119-E122 WeakPolarHBondContact OG1-CG 3.14Å; T119-E122 PolarHBondContact OG1-N 3.21Å; T119-E122 VanDerWaalsContact OG1-N 3.15Å; E122-L130 HydrophobicContact CG-CD2 4.03Å
123	L	56.8	Low	54.6	Low	40 Å²	40	60 Å²	60	21%	0.209	31%	0.313	C	S	.	.	H	α-helix	trans	-87.3	-31.4	-174.3	-68	170.3	0	0	0	113.9	T119 P120 D121 Y165 I295 Y306	T119-L123 VanDerWaalsContact O-CG 3.32Å; T119-L123 WeakPolarHBondContact O-CG 3.21Å; T119-L123 PolarHBondContact O-N 3.03Å; P120-L123 PolarHBondContact O-N 3.13Å; D121-L123 VanDerWaalsContact C-N 3.26Å; D121-L123 PolarHBondContact O-N 2.81Å; L123-Y165 HydrophobicContact CD2-CE1 3.62Å; L123-Y165 HydrophobicContact CD2-CE2 4.37Å; L123-Y165 VanDerWaalsContact CD2-CZ 3.48Å; L123-Y165 WeakPolarHBondContact CD2-OH 3.41Å; L123-I295 HydrophobicContact CD1-CG2 4.42Å; L123-I295 HydrophobicContact CD2-CD1 4.01Å; L123-Y306 VanDerWaalsContact CD1-CB 3.43Å; L123-Y306 HydrophobicContact CD1-CD1 3.39Å; L123-Y306 HydrophobicContact CD1-CD2 3.47Å; L123-Y306 VanDerWaalsContact CD1-CD2 3.47Å; L123-Y306 HydrophobicContact CD1-CE1 3.9Å; L123-Y306 HydrophobicContact CD1-CE2 3.97Å; L123-Y306 HydrophobicContact CD1-CG 3.14Å
124	L	45.9	Very low	52.1	Low	112 Å²	112	66.2 Å²	66.2	59%	0.586	34%	0.341	S	S	*	.	H	α-helix	trans	-101.2	-13	-177.5	-65	171.3	0	0	0	112.5	P120	P120-L124 WeakPolarHBondContact O-CB 3.41Å; P120-L124 WeakPolarHBondContact O-CG 3.49Å; P120-L124 PolarHBondContact O-N 3.42Å; P120-L124 VanDerWaalsContact O-N 3.11Å
125	R	42.8	Very low	49.5	Very low	57 Å²	57	70.9 Å²	70.9	22%	0.215	36%	0.361	C	S	.	.	S	Bend	trans	-66.5	128.9	169.5	-84.8	172	-150.9	-172.3	2.4	109.9	D121 E129 L130 E133	D121-R125 WeakPolarHBondContact O-CB 3.45Å; D121-R125 WeakPolarHBondContact O-CD 3.44Å; D121-R125 WeakPolarHBondContact O-CG 3.29Å; D121-R125 PolarHBondContact O-N 2.88Å; D121-R125 VanDerWaalsContact O-N 3.09Å; D121-R125 PolarHBondContact O-NE 2.67Å; R125-E129 HydrophobicContact CB-CB 4.1Å; R125-E129 HydrophobicContact CG-CB 3.86Å; R125-L130 HydrophobicContact CB-CG 4.47Å; R125-E133 IonicContact CZ-OE1 2.67Å; R125-E133 IonicContact CZ-OE2 3.79Å; R125-E133 IonicContact NH1-OE2 3.65Å; R125-E133 PolarHBondContact NH1-OE2 2.95Å; R125-E133 VanDerWaalsContact NH2-CD 3.26Å; R125-E133 IonicContact NH2-OE1 3.76Å; R125-E133 PolarHBondContact NH2-OE1 3.48Å; R125-E133 IonicContact NH2-OE2 3.7Å; R125-E133 PolarHBondContact NH2-OE2 2.95Å
126	P	36.8	Very low	46.7	Very low	56 Å²	56	75.2 Å²	75.2	36%	0.364	39%	0.389	S	S	.	.			trans	-50.2	145.7	159.6	-19.6	30.5	0	0	0	108.7	V128 E129	P126-V128 PolarHBondContact O-N 2.74Å; P126-E129 WeakPolarHBondContact CD-OE2 3.48Å; P126-E129 PolarHBondContact O-N 2.94Å
127	P	36.8	Very low	44.3	Very low	62 Å²	62	73.9 Å²	73.9	40%	0.403	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-19.2	178.2	-27.9	33.8	0	0	0	114.9
128	V	34	Very low	41.9	Very low	54 Å²	54	77.6 Å²	77.6	33%	0.327	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-31.1	178.9	-178	0	0	0	0	113.4	P126 L756	P126-V128 PolarHBondContact O-N 2.74Å; V128-L756 HydrophobicContact CG1-CD1 4.03Å; V128-L756 HydrophobicContact CG1-CD2 4.02Å
129	E	30.2	Very low	39.8	Very low	55 Å²	55	81.8 Å²	81.8	26%	0.257	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-86.6	-15.2	-174.9	-81.2	-175.4	163.2	0	0	114.6	R125 P126 A131 L132	R125-E129 HydrophobicContact CB-CB 4.1Å; R125-E129 HydrophobicContact CG-CB 3.86Å; P126-E129 WeakPolarHBondContact CD-OE2 3.48Å; P126-E129 PolarHBondContact O-N 2.94Å; E129-A131 PolarHBondContact O-N 3.5Å; E129-L132 HydrophobicContact CG-CD1 4.43Å; E129-L132 PolarHBondContact O-N 3.27Å
130	L	35.4	Very low	38.6	Very low	84 Å²	84	81.7 Å²	81.7	44%	0.44	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-59.9	-13.9	169.2	-77.8	163.1	0	0	0	112.8	E122 R125	E122-L130 HydrophobicContact CG-CD2 4.03Å; R125-L130 HydrophobicContact CB-CG 4.47Å
131	A	35.9	Very low	38.4	Very low	18 Å²	18	83.6 Å²	83.6	15%	0.149	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-93.3	-8.3	-178.4	0	0	0	0	0	115.1	E129 L756 N785	E129-A131 PolarHBondContact O-N 3.5Å; A131-L756 HydrophobicContact CB-CD2 3.67Å; A131-N785 HydrophobicContact CB-CB 4.2Å
132	L	33.9	Very low	39	Very low	72 Å²	72	83.6 Å²	83.6	38%	0.377	47%	0.472	S	S	.	.	S	Bend	trans	-104.4	-6.9	-166.6	-71.9	170.6	0	0	0	115.7	E129	E129-L132 HydrophobicContact CG-CD1 4.43Å; E129-L132 PolarHBondContact O-N 3.27Å
133	E	28.8	Very low	39.9	Very low	110 Å²	110	83.1 Å²	83.1	51%	0.514	48%	0.477	S	S	.	.			trans	-102.7	128.9	-179.5	-75.8	-174.3	166.7	0	0	112.9	R125 Q135	R125-E133 IonicContact CZ-OE1 2.67Å; R125-E133 IonicContact CZ-OE2 3.79Å; R125-E133 IonicContact NH1-OE2 3.65Å; R125-E133 PolarHBondContact NH1-OE2 2.95Å; R125-E133 VanDerWaalsContact NH2-CD 3.26Å; R125-E133 IonicContact NH2-OE1 3.76Å; R125-E133 PolarHBondContact NH2-OE1 3.48Å; R125-E133 IonicContact NH2-OE2 3.7Å; R125-E133 PolarHBondContact NH2-OE2 2.95Å; E133-Q135 PolarHBondContact O-N 3.41Å
134	H	28.1	Very low	41.1	Very low	145 Å²	145	82.1 Å²	82.1	67%	0.671	47%	0.472	S	S	*	.			trans	-70	48.3	176.4	-73	75.3	0	0	0	113.1	H813	H134-H813 AromaticContact CE1-CE1 3.96Å
135	Q	26.4	Very low	42.8	Very low	123 Å²	123	78.8 Å²	78.8	58%	0.575	46%	0.46	S	S	*	.			trans	-98.9	125.8	163.2	-69.4	-165.5	10.3	0	0	108.5	E133	E133-Q135 PolarHBondContact O-N 3.41Å
136	P	25.8	Very low	44.4	Very low	92 Å²	92	77.2 Å²	77.2	60%	0.597	46%	0.456	S	S	*	.			trans	-51.9	146.4	164.6	25	-32.4	0	0	0	107.5	Q138 M789	P136-Q138 PolarHBondContact O-N 3.26Å; P136-M789 HydrophobicContact CB-CE 4.41Å
137	P	30.9	Very low	46.4	Very low	103 Å²	103	78.7 Å²	78.7	67%	0.669	47%	0.468	S	S	*	.			trans	-51.6	108.6	178.6	20.6	-30.3	0	0	0	107.1	A139	P137-A139 PolarHBondContact O-N 3.5Å
138	Q	33.2	Very low	48.6	Very low	137 Å²	137	79.8 Å²	79.8	64%	0.64	47%	0.467	S	S	*	.			trans	-54.9	125.4	174.2	-74.2	-171.3	6.8	0	0	104.5	P136 G140	P136-Q138 PolarHBondContact O-N 3.26Å; Q138-G140 WeakPolarHBondContact O-CA 3.44Å; Q138-G140 PolarHBondContact O-N 3.22Å
139	A	35.3	Very low	51.1	Low	96 Å²	96	77.2 Å²	77.2	79%	0.793	45%	0.452	S	S	*	.			trans	-47.4	109.5	173.8	0	0	0	0	0	106.3	P137 L141	P137-A139 PolarHBondContact O-N 3.5Å; A139-L141 PolarHBondContact O-N 3.42Å; A139-L141 VanDerWaalsContact O-N 3.13Å
140	G	45.6	Very low	53.8	Low	53 Å²	53	76.1 Å²	76.1	55%	0.546	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-50.3	127.8	-164.5	0	0	0	0	0	109.1	Q138	Q138-G140 WeakPolarHBondContact O-CA 3.44Å; Q138-G140 PolarHBondContact O-N 3.22Å
141	L	55.4	Low	56.2	Low	95 Å²	95	75.8 Å²	75.8	50%	0.497	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-48.7	138.7	-178.5	-74.9	166.3	0	0	0	109.1	E117 A139	E117-L141 HydrophobicContact CB-CD1 4.26Å; A139-L141 PolarHBondContact O-N 3.42Å; A139-L141 VanDerWaalsContact O-N 3.13Å
142	P	64.5	Low	58.3	Low	98 Å²	98	78.9 Å²	78.9	64%	0.636	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-55.6	147.5	-178.3	23.7	-33.2	0	0	0	109.8	L144	P142-L144 PolarHBondContact O-N 3.31Å
143	P	76.3	Confident	60.1	Low	84 Å²	84	76.6 Å²	76.6	55%	0.545	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-50.7	131.6	177.6	-24.9	32.6	0	0	0	111.2	V114 I115 A145	V114-P143 HydrophobicContact CG1-CB 4.05Å; V114-P143 HydrophobicContact CG1-CG 4.17Å; I115-P143 CarbonylContact O-C 3.51Å; I115-P143 WeakPolarHBondContact O-CA 3.34Å; P143-A145 PolarHBondContact O-N 3.42Å
144	L	81.7	Confident	62	Low	19 Å²	19	77 Å²	77	10%	0.099	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-75.9	126.5	176.4	-85.8	86.5	0	0	0	109.8	I115 E117 P142 L149	I115-L144 HydrophobicContact CB-CB 4.46Å; I115-L144 HydrophobicContact CG2-CB 4.42Å; I115-L144 PolarHBondContact O-N 3.14Å; E117-L144 HydrophobicContact CB-CD1 3.54Å; E117-L144 HydrophobicContact CG-CD1 4.1Å; P142-L144 PolarHBondContact O-N 3.31Å; L144-L149 HydrophobicContact CD2-CD2 4.36Å
145	A	81	Confident	63.7	Low	42 Å²	42	73.8 Å²	73.8	35%	0.347	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-72.4	152	164.9	0	0	0	0	0	110.4	P143 S147 Q148	P143-A145 PolarHBondContact O-N 3.42Å; A145-S147 PolarHBondContact O-N 3.01Å; A145-S147 VanDerWaalsContact O-N 3.16Å; A145-Q148 HydrophobicContact CB-CG 4.12Å; A145-Q148 WeakPolarHBondContact O-CB 3.42Å; A145-Q148 PolarHBondContact O-N 3.1Å
146	L	76.7	Confident	65.6	Low	24 Å²	24	70.7 Å²	70.7	13%	0.126	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-52.7	-36.9	174.3	-83.3	178.6	0	0	0	113.4	I115 Q148 L149 L175	I115-L146 HydrophobicContact CD1-CD2 3.92Å; I115-L146 HydrophobicContact CD1-CG 4.41Å; L146-Q148 PolarHBondContact O-N 3.27Å; L146-L149 HydrophobicContact CD2-CD1 3.73Å; L146-L149 WeakPolarHBondContact O-CG 3.48Å; L146-L149 PolarHBondContact O-N 3.3Å; L146-L175 HydrophobicContact CD1-CD1 3.66Å; L146-L175 HydrophobicContact CD1-CG 4.39Å; L146-L175 HydrophobicContact CD2-CD1 3.71Å; L146-L175 HydrophobicContact CD2-CD2 3.95Å; L146-L175 HydrophobicContact CD2-CG 3.83Å; L146-L175 HydrophobicContact CG-CD1 3.93Å
147	S	77.8	Confident	67.8	Low	87 Å²	87	74.4 Å²	74.4	61%	0.608	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-68.2	-18.2	178.2	54.5	0	0	0	0	113.5	A145	A145-S147 PolarHBondContact O-N 3.01Å; A145-S147 VanDerWaalsContact O-N 3.16Å
148	Q	84	Confident	70.1	Confident	84 Å²	84	75.3 Å²	75.3	39%	0.393	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-97.9	-6.1	-175.8	-62.3	170.5	-25.9	0	0	113	A145 L146 F150 N151 R305	A145-Q148 HydrophobicContact CB-CG 4.12Å; A145-Q148 WeakPolarHBondContact O-CB 3.42Å; A145-Q148 PolarHBondContact O-N 3.1Å; L146-Q148 PolarHBondContact O-N 3.27Å; Q148-F150 PolarHBondContact O-N 3.36Å; Q148-F150 VanDerWaalsContact O-N 3.11Å; Q148-N151 VanDerWaalsContact O-CB 3.3Å; Q148-N151 WeakPolarHBondContact O-CB 3.46Å; Q148-N151 PolarHBondContact O-N 3.48Å; Q148-R305 PolarHBondContact O-NH1 3.44Å
149	L	85.6	Confident	72.6	Confident	1 Å²	1	69 Å²	69	1%	0.005	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-32.9	-173.6	-70.9	178.8	0	0	0	114.2	I115 L144 L146 V162 L164 L287 R305	I115-L149 HydrophobicContact CD1-CD2 4.46Å; I115-L149 HydrophobicContact CG2-CD2 4.44Å; L144-L149 HydrophobicContact CD2-CD2 4.36Å; L146-L149 HydrophobicContact CD2-CD1 3.73Å; L146-L149 WeakPolarHBondContact O-CG 3.48Å; L146-L149 PolarHBondContact O-N 3.3Å; L149-V162 HydrophobicContact CB-CG1 4.46Å; L149-V162 HydrophobicContact CB-CG2 4.49Å; L149-V162 HydrophobicContact CD2-CG1 4.36Å; L149-V162 VanDerWaalsContact O-CG2 3.28Å; L149-V162 WeakPolarHBondContact O-CG2 3.19Å; L149-L164 HydrophobicContact CD1-CD1 4.01Å; L149-L164 HydrophobicContact CD2-CD2 3.96Å; L149-L287 HydrophobicContact CD1-CD1 4.42Å; L149-R305 PolarHBondContact O-NH1 3.03Å
150	F	87.2	Confident	75.1	Confident	32 Å²	32	66.7 Å²	66.7	14%	0.14	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	8.9	-180	-65.3	-85.6	0	0	0	113.4	Q148 V162 M179 F191 L238 L287	Q148-F150 PolarHBondContact O-N 3.36Å; Q148-F150 VanDerWaalsContact O-N 3.11Å; F150-V162 HydrophobicContact CD1-CG2 3.78Å; F150-V162 HydrophobicContact CE1-CB 4.25Å; F150-V162 HydrophobicContact CE1-CG2 3.55Å; F150-V162 HydrophobicContact CE2-CG2 4.36Å; F150-V162 HydrophobicContact CG-CG2 4.29Å; F150-V162 HydrophobicContact CZ-CB 4.23Å; F150-V162 HydrophobicContact CZ-CG2 3.87Å; F150-M179 HydrophobicContact CE2-CE 4.22Å; F150-F191 HydrophobicContact CB-CZ 4.21Å; F150-F191 HydrophobicContact CD1-CZ 4.39Å; F150-F191 HydrophobicContact CD2-CE2 4.04Å; F150-F191 AromaticContact CD2-CZ 3.56Å; F150-F191 HydrophobicContact CD2-CZ 3.56Å; F150-F191 HydrophobicContact CE2-CE2 4.35Å; F150-F191 AromaticContact CE2-CZ 3.97Å; F150-F191 HydrophobicContact CE2-CZ 3.97Å; F150-F191 AromaticContact CG-CZ 3.79Å; F150-F191 HydrophobicContact CG-CZ 3.79Å; F150-L238 HydrophobicContact CE1-CD1 4.28Å; F150-L238 HydrophobicContact CE2-CD1 4.01Å; F150-L238 HydrophobicContact CZ-CD1 3.55Å; F150-L287 HydrophobicContact CZ-CB 4.07Å
151	N	86.4	Confident	77.3	Confident	77 Å²	77	64.4 Å²	64.4	41%	0.412	38%	0.379	S	S	.	.	S	Bend	trans	-62.9	153.3	172.2	-73	-3.8	0	0	0	109.9	Q148 V159 R305	Q148-N151 VanDerWaalsContact O-CB 3.3Å; Q148-N151 WeakPolarHBondContact O-CB 3.46Å; Q148-N151 PolarHBondContact O-N 3.48Å; N151-V159 WeakPolarHBondContact O-CG2 3.39Å; N151-R305 PolarHBondContact O-NH1 3.39Å; N151-R305 PolarHBondContact O-NH2 2.82Å
152	P	80.4	Confident	79.1	Confident	82 Å²	82	59.9 Å²	59.9	53%	0.532	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-49.5	144.9	175.1	-23.9	32.8	0	0	0	111.5	R157 R305	P152-R157 CarbonylContact C-O 3.56Å; P152-R157 VanDerWaalsContact CA-O 3.24Å; P152-R157 WeakPolarHBondContact CA-O 3.29Å; P152-R305 PolarHBondContact O-NH2 2.74Å
153	D	71.3	Confident	80.5	Confident	24 Å²	24	55.2 Å²	55.2	13%	0.128	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-67.1	172.9	172.8	71.3	10	0	0	0	110.8	S155 G156 R157 V159	D153-S155 PolarHBondContact O-N 3.01Å; D153-S155 VanDerWaalsContact OD1-C 3.28Å; D153-S155 VanDerWaalsContact OD1-CA 3.32Å; D153-S155 WeakPolarHBondContact OD1-CA 3.38Å; D153-S155 WeakPolarHBondContact OD1-CB 3.31Å; D153-S155 PolarHBondContact OD1-N 2.93Å; D153-S155 PolarHBondContact OD1-OG 3.44Å; D153-S155 PolarHBondContact OD2-OG 2.85Å; D153-G156 PolarHBondContact O-N 2.94Å; D153-G156 PolarHBondContact OD1-N 3.38Å; D153-R157 PolarHBondContact N-O 2.72Å; D153-R157 WeakPolarHBondContact OD1-CB 3.16Å; D153-R157 PolarHBondContact OD1-N 3.01Å; D153-R157 IonicContact OD2-CZ 3.91Å; D153-R157 IonicContact OD2-NE 3.47Å; D153-R157 PolarHBondContact OD2-NE 3.46Å; D153-R157 IonicContact OD2-NH2 2.69Å; D153-R157 PolarHBondContact OD2-NH2 2.92Å; D153-R157 VanDerWaalsContact OD2-NH2 3.12Å; D153-V159 HydrophobicContact CB-CG2 4.1Å
154	A	68.2	Low	81.2	Confident	118 Å²	118	51.3 Å²	51.3	98%	0.975	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.6	178.9	0	0	0	0	0	113.2
155	S	64	Low	81.3	Confident	78 Å²	78	51.1 Å²	51.1	55%	0.545	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	4.8	174.6	68.5	0	0	0	0	114	D153 R157	D153-S155 PolarHBondContact O-N 3.01Å; D153-S155 VanDerWaalsContact OD1-C 3.28Å; D153-S155 VanDerWaalsContact OD1-CA 3.32Å; D153-S155 WeakPolarHBondContact OD1-CA 3.38Å; D153-S155 WeakPolarHBondContact OD1-CB 3.31Å; D153-S155 PolarHBondContact OD1-N 2.93Å; D153-S155 PolarHBondContact OD1-OG 3.44Å; D153-S155 PolarHBondContact OD2-OG 2.85Å; S155-R157 VanDerWaalsContact C-N 3.27Å; S155-R157 PolarHBondContact O-N 2.93Å; S155-R157 PolarHBondContact OG-NE 3.31Å; S155-R157 VanDerWaalsContact OG-NE 3.14Å
156	G	66.8	Low	80.7	Confident	58 Å²	58	49.1 Å²	49.1	60%	0.598	28%	0.282	S	S	*	.	S	Bend	trans	76.4	7.4	-179.7	0	0	0	0	0	114.5	D153	D153-G156 PolarHBondContact O-N 2.94Å; D153-G156 PolarHBondContact OD1-N 3.38Å
157	R	72.5	Confident	80.1	Confident	171 Å²	171	51.2 Å²	51.2	65%	0.645	30%	0.296	S	S	*	.			trans	-77.5	140	177.4	-61.1	-177.8	-62.5	-163.3	-2.4	110.3	P152 D153 S155 V159	P152-R157 CarbonylContact C-O 3.56Å; P152-R157 VanDerWaalsContact CA-O 3.24Å; P152-R157 WeakPolarHBondContact CA-O 3.29Å; D153-R157 PolarHBondContact N-O 2.72Å; D153-R157 WeakPolarHBondContact OD1-CB 3.16Å; D153-R157 PolarHBondContact OD1-N 3.01Å; D153-R157 IonicContact OD2-CZ 3.91Å; D153-R157 IonicContact OD2-NE 3.47Å; D153-R157 PolarHBondContact OD2-NE 3.46Å; D153-R157 IonicContact OD2-NH2 2.69Å; D153-R157 PolarHBondContact OD2-NH2 2.92Å; D153-R157 VanDerWaalsContact OD2-NH2 3.12Å; S155-R157 VanDerWaalsContact C-N 3.27Å; S155-R157 PolarHBondContact O-N 2.93Å; S155-R157 PolarHBondContact OG-NE 3.31Å; S155-R157 VanDerWaalsContact OG-NE 3.14Å; R157-V159 PolarHBondContact O-N 3.22Å
158	R	79.4	Confident	79.3	Confident	122 Å²	122	51.6 Å²	51.6	46%	0.46	29%	0.294	S	S	.	.			trans	-69	119.4	178	-174.5	176.7	175.4	-154.8	-7.1	109.9	Q160 H236 E283	R158-Q160 HydrophobicContact CG-CG 4.39Å; R158-Q160 PolarHBondContact O-N 3.04Å; R158-H236 PolarHBondContact NH2-ND1 3.13Å; R158-E283 IonicContact CZ-OE2 2.64Å; R158-E283 IonicContact NH1-OE2 3.58Å; R158-E283 PolarHBondContact NH1-OE2 2.79Å; R158-E283 IonicContact NH2-OE2 2.75Å
159	V	85.1	Confident	78	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.024	29%	0.287	C	S	.	.			trans	-81.4	115.7	176	179.4	0	0	0	0	109.2	N151 D153 R157 V162 R305	N151-V159 WeakPolarHBondContact O-CG2 3.39Å; D153-V159 HydrophobicContact CB-CG2 4.1Å; R157-V159 PolarHBondContact O-N 3.22Å; V159-V162 HydrophobicContact CG1-CG2 3.67Å; V159-R305 HydrophobicContact CG1-CB 3.7Å
160	Q	88.4	Confident	77.2	Confident	47 Å²	47	48.7 Å²	48.7	22%	0.22	29%	0.287	C	S	.	.			trans	-110.7	-19	179	-68	-178.9	-22.7	0	0	113.9	R158 K278 P282 S285 I286	R158-Q160 HydrophobicContact CG-CG 4.39Å; R158-Q160 PolarHBondContact O-N 3.04Å; Q160-K278 PolarHBondContact O-NZ 2.63Å; Q160-P282 PolarHBondContact NE2-O 2.93Å; Q160-P282 PolarHBondContact OE1-O 2.83Å; Q160-S285 CarbonylContact O-C 3.59Å; Q160-S285 VanDerWaalsContact O-CA 3.24Å; Q160-S285 WeakPolarHBondContact O-CA 3.46Å; Q160-I286 PolarHBondContact O-N 3.42Å
161	T	91.6	Very high	76.4	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	120.7	177.4	-55.4	0	0	0	0	108.8	L276 K278 I286 Y302 G304 R305	T161-L276 HydrophobicContact CG2-CD2 4.03Å; T161-K278 VanDerWaalsContact OG1-CE 3.26Å; T161-K278 WeakPolarHBondContact OG1-CE 3.33Å; T161-K278 PolarHBondContact OG1-NZ 3.43Å; T161-I286 CarbonylContact C-O 3.57Å; T161-I286 VanDerWaalsContact CA-O 3.32Å; T161-I286 WeakPolarHBondContact CA-O 3.42Å; T161-I286 HydrophobicContact CG2-CB 4.33Å; T161-Y302 VanDerWaalsContact CB-O 3.23Å; T161-Y302 WeakPolarHBondContact CB-O 3.39Å; T161-Y302 WeakPolarHBondContact CG2-O 3.38Å; T161-Y302 PolarHBondContact OG1-O 3.49Å; T161-G304 WeakPolarHBondContact O-CA 3.33Å; T161-G304 PolarHBondContact O-N 3.03Å; T161-R305 PolarHBondContact O-N 2.61Å; T161-R305 VanDerWaalsContact O-N 3.17Å
162	V	93.3	Very high	76.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.9	179	179.5	0	0	0	0	108.6	L149 F150 V159 L164 I286 L287 V288 R305	L149-V162 HydrophobicContact CB-CG1 4.46Å; L149-V162 HydrophobicContact CB-CG2 4.49Å; L149-V162 HydrophobicContact CD2-CG1 4.36Å; L149-V162 VanDerWaalsContact O-CG2 3.28Å; L149-V162 WeakPolarHBondContact O-CG2 3.19Å; F150-V162 HydrophobicContact CD1-CG2 3.78Å; F150-V162 HydrophobicContact CE1-CB 4.25Å; F150-V162 HydrophobicContact CE1-CG2 3.55Å; F150-V162 HydrophobicContact CE2-CG2 4.36Å; F150-V162 HydrophobicContact CG-CG2 4.29Å; F150-V162 HydrophobicContact CZ-CB 4.23Å; F150-V162 HydrophobicContact CZ-CG2 3.87Å; V159-V162 HydrophobicContact CG1-CG2 3.67Å; V162-L164 HydrophobicContact CG1-CD2 4.08Å; V162-L164 HydrophobicContact CG1-CG 4.27Å; V162-I286 PolarHBondContact N-O 3.45Å; V162-L287 HydrophobicContact CB-CD1 3.83Å; V162-L287 HydrophobicContact CG1-CD1 3.77Å; V162-L287 CarbonylContact O-C 3.48Å; V162-L287 WeakPolarHBondContact O-CA 3.49Å; V162-V288 PolarHBondContact O-N 3.46Å; V162-R305 CarbonylContact C-O 3.56Å; V162-R305 WeakPolarHBondContact CA-O 3.26Å; V162-R305 HydrophobicContact CG2-CB 4.39Å
163	V	92.3	Very high	75.9	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	112.6	173.5	178.3	0	0	0	0	109	V288 T290 I298 V303 R305 Y306 G307	V163-V288 HydrophobicContact CG2-CB 4.14Å; V163-V288 HydrophobicContact CG2-CG2 4.46Å; V163-T290 HydrophobicContact CG1-CG2 4.12Å; V163-I298 HydrophobicContact CG2-CD1 4.26Å; V163-V303 HydrophobicContact CB-CG1 4.12Å; V163-V303 HydrophobicContact CG2-CB 4.3Å; V163-V303 HydrophobicContact CG2-CG1 3.63Å; V163-V303 HydrophobicContact CG2-CG2 3.64Å; V163-R305 PolarHBondContact N-O 3.08Å; V163-Y306 HydrophobicContact CB-CD1 3.72Å; V163-Y306 HydrophobicContact CB-CE1 3.96Å; V163-Y306 HydrophobicContact CG1-CD1 4.03Å; V163-Y306 HydrophobicContact CG1-CE1 4.19Å; V163-Y306 HydrophobicContact CG2-CD1 4.45Å; V163-Y306 HydrophobicContact CG2-CE1 4.24Å; V163-Y306 CarbonylContact O-C 3.51Å; V163-Y306 WeakPolarHBondContact O-CA 3.45Å; V163-G307 PolarHBondContact O-N 2.72Å
164	L	91.2	Very high	76.2	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.9	171	-59.5	179.6	0	0	0	110.4	I115 L149 V162 L175 L287 V288 T289 T290 G307 I309	I115-L164 HydrophobicContact CG2-CD2 4.03Å; L149-L164 HydrophobicContact CD1-CD1 4.01Å; L149-L164 HydrophobicContact CD2-CD2 3.96Å; V162-L164 HydrophobicContact CG1-CD2 4.08Å; V162-L164 HydrophobicContact CG1-CG 4.27Å; L164-L175 HydrophobicContact CD1-CD2 3.68Å; L164-L287 HydrophobicContact CD1-CD1 3.81Å; L164-L287 HydrophobicContact CD1-CD2 4.49Å; L164-L287 HydrophobicContact CG-CD1 3.82Å; L164-V288 PolarHBondContact N-O 2.91Å; L164-T289 HydrophobicContact CB-CG2 4.25Å; L164-T289 CarbonylContact O-C 3.58Å; L164-T289 VanDerWaalsContact O-CA 3.23Å; L164-T289 WeakPolarHBondContact O-CA 3.36Å; L164-T290 PolarHBondContact O-N 3.32Å; L164-G307 CarbonylContact C-O 3.5Å; L164-G307 VanDerWaalsContact CA-O 3.26Å; L164-G307 WeakPolarHBondContact CA-O 3.48Å; L164-I309 HydrophobicContact CB-CD1 3.87Å; L164-I309 HydrophobicContact CB-CG1 4.35Å; L164-I309 HydrophobicContact CD1-CD1 4.34Å
165	Y	84.6	Confident	77	Confident	15 Å²	15	39.4 Å²	39.4	6%	0.059	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	165.5	-178.9	70.4	-90.5	0	0	0	112.4	S118 L123 T290 I295 G307 E308 I309	S118-Y165 WeakPolarHBondContact CB-OH 3.09Å; S118-Y165 PolarHBondContact OG-OH 3.32Å; L123-Y165 HydrophobicContact CD2-CE1 3.62Å; L123-Y165 HydrophobicContact CD2-CE2 4.37Å; L123-Y165 VanDerWaalsContact CD2-CZ 3.48Å; L123-Y165 WeakPolarHBondContact CD2-OH 3.41Å; Y165-T290 VanDerWaalsContact CA-O 3.27Å; Y165-T290 WeakPolarHBondContact CA-O 3.44Å; Y165-I295 HydrophobicContact CD1-CD1 3.75Å; Y165-I295 HydrophobicContact CD1-CG1 4.16Å; Y165-I295 HydrophobicContact CD2-CD1 3.31Å; Y165-I295 HydrophobicContact CD2-CG1 4.1Å; Y165-I295 HydrophobicContact CE1-CD1 4.02Å; Y165-I295 HydrophobicContact CE2-CD1 3.61Å; Y165-I295 HydrophobicContact CG-CD1 3.36Å; Y165-I295 HydrophobicContact CG-CG1 3.73Å; Y165-G307 PolarHBondContact N-O 2.76Å; Y165-E308 HydrophobicContact CD2-CG 4.21Å; Y165-E308 HydrophobicContact CE1-CB 4.11Å; Y165-E308 HydrophobicContact CE2-CB 3.78Å; Y165-E308 HydrophobicContact CE2-CG 3.56Å; Y165-I309 PolarHBondContact O-N 2.9Å
166	G	67.9	Low	78	Confident	1 Å²	1	36 Å²	36	1%	0.01	20%	0.202	C	C	.	.			trans	170.1	170	174.6	0	0	0	0	0	112.4	K172 T290	G166-K172 PolarHBondContact O-NZ 3.37Å; G166-T290 PolarHBondContact N-O 3.32Å
167	T	63.6	Low	78.7	Confident	67 Å²	67	37.5 Å²	37.5	41%	0.411	19%	0.19	S	C	.	.			trans	-69.3	169.6	-179.9	57.7	0	0	0	0	112.5	G169 T170 K172	T167-G169 PolarHBondContact O-N 3.22Å; T167-T170 PolarHBondContact O-N 3.36Å; T167-T170 PolarHBondContact O-OG1 2.96Å; T167-T170 WeakPolarHBondContact OG1-CG2 3.38Å; T167-K172 PolarHBondContact O-NZ 3.35Å
168	V	61.5	Low	79.4	Confident	96 Å²	96	30.4 Å²	30.4	58%	0.582	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	134.9	176.3	-179.1	0	0	0	0	109.3
169	G	57.2	Low	79.7	Confident	22 Å²	22	24.9 Å²	24.9	23%	0.227	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	-4.9	178.3	0	0	0	0	0	116.3	T167 G171 P368 S369	T167-G169 PolarHBondContact O-N 3.22Å; G169-G171 PolarHBondContact O-N 3.5Å; G169-P368 WeakPolarHBondContact O-CD 3.42Å; G169-S369 WeakPolarHBondContact CA-OG 3.45Å; G169-S369 PolarHBondContact O-N 3.08Å; G169-S369 PolarHBondContact O-OG 3.01Å
170	T	68.7	Low	79.8	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.006	14%	0.142	C	C	.	.	S	Bend	trans	-70.8	-6.2	178.5	59.6	0	0	0	0	115.1	T167 L367	T167-T170 PolarHBondContact O-N 3.36Å; T167-T170 PolarHBondContact O-OG1 2.96Å; T167-T170 WeakPolarHBondContact OG1-CG2 3.38Å; T170-L367 HydrophobicContact CG2-CD2 3.88Å
171	G	70.1	Confident	79.7	Confident	16 Å²	16	22.5 Å²	22.5	17%	0.165	13%	0.132	C	C	.	.			trans	95.9	15.3	174.6	0	0	0	0	0	115.9	G169 S173 T174 L175	G169-G171 PolarHBondContact O-N 3.5Å; G171-S173 VanDerWaalsContact C-N 3.35Å; G171-S173 PolarHBondContact O-N 2.96Å; G171-T174 WeakPolarHBondContact O-CA 3.5Å; G171-T174 WeakPolarHBondContact O-CB 3.42Å; G171-T174 PolarHBondContact O-N 2.85Å; G171-L175 PolarHBondContact O-N 3.36Å
172	K	80.5	Confident	79.5	Confident	22 Å²	22	23 Å²	23	10%	0.096	13%	0.134	C	C	.	.	H	α-helix	trans	-48	-49.2	179.2	-55.7	-171.3	-73.6	-75.7	0	114	G166 T167 L175 V176 T290 I309	G166-K172 PolarHBondContact O-NZ 3.37Å; T167-K172 PolarHBondContact O-NZ 3.35Å; K172-L175 WeakPolarHBondContact O-CB 3.33Å; K172-L175 PolarHBondContact O-N 2.95Å; K172-V176 PolarHBondContact O-N 3.36Å; K172-V176 VanDerWaalsContact O-N 3.12Å; K172-T290 WeakPolarHBondContact CD-O 3.44Å; K172-T290 WeakPolarHBondContact CE-O 3.38Å; K172-I309 HydrophobicContact CB-CD1 4.28Å; K172-I309 HydrophobicContact CG-CD1 3.79Å
173	S	75.7	Confident	79.4	Confident	48 Å²	48	23 Å²	23	34%	0.336	13%	0.134	S	C	.	.	H	α-helix	trans	-66.2	-38.9	178.5	-47.9	0	0	0	0	112.1	G171 L175 V176 R177 H242	G171-S173 VanDerWaalsContact C-N 3.35Å; G171-S173 PolarHBondContact O-N 2.96Å; S173-L175 VanDerWaalsContact C-N 3.3Å; S173-L175 PolarHBondContact O-N 3.23Å; S173-V176 PolarHBondContact O-N 2.78Å; S173-R177 VanDerWaalsContact O-CG 3.31Å; S173-R177 WeakPolarHBondContact O-CG 3.43Å; S173-R177 PolarHBondContact O-N 3.49Å; S173-H242 VanDerWaalsContact CA-CE1 3.45Å; S173-H242 WeakPolarHBondContact CA-CE1 3.37Å; S173-H242 WeakPolarHBondContact CB-NE2 3.48Å; S173-H242 PolarHBondContact OG-CE1 3.12Å; S173-H242 PolarHBondContact OG-NE2 3.29Å
174	T	78.6	Confident	79.2	Confident	49 Å²	49	23.6 Å²	23.6	30%	0.301	14%	0.138	S	C	.	.	H	α-helix	trans	-63.6	-38.7	176.7	-51.6	0	0	0	0	111.2	L106 G171 R177 K178	L106-T174 HydrophobicContact CD1-CG2 3.77Å; G171-T174 WeakPolarHBondContact O-CA 3.5Å; G171-T174 WeakPolarHBondContact O-CB 3.42Å; G171-T174 PolarHBondContact O-N 2.85Å; T174-R177 PolarHBondContact O-N 2.69Å; T174-K178 WeakPolarHBondContact O-CB 3.29Å; T174-K178 PolarHBondContact O-N 3.09Å
175	L	83.9	Confident	79	Confident	3 Å²	3	28.5 Å²	28.5	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-63	-48.4	175.4	-167.2	73.5	0	0	0	112	P113 I115 L146 L164 G171 K172 S173 R177 K178 M179 I309	P113-L175 HydrophobicContact CG-CD1 3.75Å; I115-L175 HydrophobicContact CD1-CD2 4.01Å; L146-L175 HydrophobicContact CD1-CD1 3.66Å; L146-L175 HydrophobicContact CD1-CG 4.39Å; L146-L175 HydrophobicContact CD2-CD1 3.71Å; L146-L175 HydrophobicContact CD2-CD2 3.95Å; L146-L175 HydrophobicContact CD2-CG 3.83Å; L146-L175 HydrophobicContact CG-CD1 3.93Å; L164-L175 HydrophobicContact CD1-CD2 3.68Å; G171-L175 PolarHBondContact O-N 3.36Å; K172-L175 WeakPolarHBondContact O-CB 3.33Å; K172-L175 PolarHBondContact O-N 2.95Å; S173-L175 VanDerWaalsContact C-N 3.3Å; S173-L175 PolarHBondContact O-N 3.23Å; L175-R177 VanDerWaalsContact C-N 3.31Å; L175-R177 PolarHBondContact O-N 3.28Å; L175-K178 PolarHBondContact O-N 3.12Å; L175-M179 WeakPolarHBondContact O-CB 3.28Å; L175-M179 PolarHBondContact O-N 2.95Å; L175-I309 HydrophobicContact CD2-CD1 3.65Å; L175-I309 HydrophobicContact CD2-CG1 4.18Å
176	V	84.8	Confident	79	Confident	8 Å²	8	29.6 Å²	29.6	5%	0.048	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-44.6	175.3	169	0	0	0	0	110.8	K172 S173 K178 M179 V180 V240 T289	K172-V176 PolarHBondContact O-N 3.36Å; K172-V176 VanDerWaalsContact O-N 3.12Å; S173-V176 PolarHBondContact O-N 2.78Å; V176-K178 PolarHBondContact O-N 3.19Å; V176-M179 PolarHBondContact O-N 2.98Å; V176-V180 HydrophobicContact CG1-CG2 4.44Å; V176-V180 VanDerWaalsContact O-CG2 3.32Å; V176-V180 WeakPolarHBondContact O-CG2 3.44Å; V176-V180 PolarHBondContact O-N 2.83Å; V176-V240 HydrophobicContact CG1-CG1 3.76Å; V176-V240 HydrophobicContact CG2-CG1 4.11Å; V176-T289 HydrophobicContact CG2-CG2 3.51Å
177	R	82.5	Confident	79.8	Confident	88 Å²	88	35.9 Å²	35.9	33%	0.332	20%	0.197	S	C	.	.	H	α-helix	trans	-60.7	-45.3	177.4	-71.1	177.2	177.1	147.6	0.3	112.1	F90 L106 S173 T174 L175 M179 V180 L181	F90-R177 HydrophobicContact CD1-CB 4.08Å; F90-R177 HydrophobicContact CD1-CG 3.78Å; F90-R177 HydrophobicContact CE1-CG 4.12Å; L106-R177 HydrophobicContact CD2-CB 3.63Å; S173-R177 VanDerWaalsContact O-CG 3.31Å; S173-R177 WeakPolarHBondContact O-CG 3.43Å; S173-R177 PolarHBondContact O-N 3.49Å; T174-R177 PolarHBondContact O-N 2.69Å; L175-R177 VanDerWaalsContact C-N 3.31Å; L175-R177 PolarHBondContact O-N 3.28Å; R177-M179 VanDerWaalsContact C-N 3.34Å; R177-M179 PolarHBondContact O-N 2.6Å; R177-V180 PolarHBondContact O-N 2.86Å; R177-L181 WeakPolarHBondContact O-CG 3.3Å; R177-L181 PolarHBondContact O-N 3.41Å
178	K	85.6	Confident	80.7	Confident	22 Å²	22	33.7 Å²	33.7	10%	0.096	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-44.6	177.1	179.9	62.5	163.9	63.2	0	111.4	L106 H110 T174 L175 V176 V180 L181 D182	L106-K178 HydrophobicContact CD2-CB 4.31Å; H110-K178 HydrophobicContact CB-CD 4.12Å; T174-K178 WeakPolarHBondContact O-CB 3.29Å; T174-K178 PolarHBondContact O-N 3.09Å; L175-K178 PolarHBondContact O-N 3.12Å; V176-K178 PolarHBondContact O-N 3.19Å; K178-V180 PolarHBondContact O-N 3.43Å; K178-L181 PolarHBondContact O-N 2.87Å; K178-D182 IonicContact NZ-OD1 2.67Å; K178-D182 PolarHBondContact NZ-OD1 3.21Å; K178-D182 IonicContact NZ-OD2 2.77Å; K178-D182 PolarHBondContact NZ-OD2 3.03Å; K178-D182 WeakPolarHBondContact O-CB 3.34Å; K178-D182 PolarHBondContact O-N 2.96Å
179	M	87.6	Confident	81.6	Confident	6 Å²	6	34.7 Å²	34.7	3%	0.03	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-44.3	178.5	-170.3	-172.5	-178	0	0	112.3	F150 L175 V176 R177 L181 D182 W183 L188 L238 L287	F150-M179 HydrophobicContact CE2-CE 4.22Å; L175-M179 WeakPolarHBondContact O-CB 3.28Å; L175-M179 PolarHBondContact O-N 2.95Å; V176-M179 PolarHBondContact O-N 2.98Å; R177-M179 VanDerWaalsContact C-N 3.34Å; R177-M179 PolarHBondContact O-N 2.6Å; M179-L181 VanDerWaalsContact C-N 3.33Å; M179-L181 PolarHBondContact O-N 2.75Å; M179-D182 PolarHBondContact O-N 2.79Å; M179-W183 PolarHBondContact O-N 2.87Å; M179-L188 HydrophobicContact CB-CD1 4.46Å; M179-L188 HydrophobicContact CE-CD1 4.33Å; M179-L188 HydrophobicContact CG-CD1 3.5Å; M179-L188 VanDerWaalsContact O-CD1 3.27Å; M179-L188 WeakPolarHBondContact O-CD1 3.47Å; M179-L238 HydrophobicContact CE-CD2 3.31Å; M179-L238 HydrophobicContact SD-CD2 4.5Å; M179-L287 HydrophobicContact CE-CD2 4.11Å; M179-L287 HydrophobicContact SD-CD2 3.32Å; M179-L287 WeakPolarHBondContact SD-CD2 3.35Å
180	V	86.8	Confident	82.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-43.9	176	174.7	0	0	0	0	110.7	L86 F90 V176 R177 K178 W183 C184 L194 P196	L86-V180 HydrophobicContact CB-CG1 4.38Å; L86-V180 HydrophobicContact CD1-CG1 4.29Å; F90-V180 HydrophobicContact CB-CG1 4.32Å; F90-V180 HydrophobicContact CD1-CB 3.96Å; F90-V180 HydrophobicContact CD1-CG1 4.01Å; F90-V180 HydrophobicContact CD1-CG2 4.27Å; F90-V180 HydrophobicContact CD2-CG1 3.69Å; F90-V180 HydrophobicContact CE1-CB 4.14Å; F90-V180 HydrophobicContact CE1-CG1 4.24Å; F90-V180 HydrophobicContact CE1-CG2 3.94Å; F90-V180 HydrophobicContact CE2-CG1 3.95Å; F90-V180 HydrophobicContact CG-CB 4.16Å; F90-V180 HydrophobicContact CG-CG1 3.73Å; F90-V180 HydrophobicContact CZ-CG1 4.22Å; F90-V180 HydrophobicContact CZ-CG2 4.17Å; V176-V180 HydrophobicContact CG1-CG2 4.44Å; V176-V180 VanDerWaalsContact O-CG2 3.32Å; V176-V180 WeakPolarHBondContact O-CG2 3.44Å; V176-V180 PolarHBondContact O-N 2.83Å; R177-V180 PolarHBondContact O-N 2.86Å; K178-V180 PolarHBondContact O-N 3.43Å; V180-W183 PolarHBondContact O-N 2.52Å; V180-C184 PolarHBondContact O-N 3.47Å; V180-C184 PolarHBondContact O-SG 3.21Å; V180-L194 HydrophobicContact CG2-CD2 3.86Å; V180-P196 HydrophobicContact CG2-CB 4.24Å; V180-P196 HydrophobicContact CG2-CG 4.32Å
181	L	86.8	Confident	83.7	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-44.4	176.7	-74.1	-178.7	0	0	0	112.7	F90 L106 R177 K178 M179 W183 C184 Y185	F90-L181 HydrophobicContact CB-CD2 3.83Å; F90-L181 HydrophobicContact CB-CG 4.05Å; L106-L181 HydrophobicContact CB-CD1 3.97Å; L106-L181 HydrophobicContact CD2-CD1 3.92Å; L106-L181 HydrophobicContact CG-CD1 4.4Å; R177-L181 WeakPolarHBondContact O-CG 3.3Å; R177-L181 PolarHBondContact O-N 3.41Å; K178-L181 PolarHBondContact O-N 2.87Å; M179-L181 VanDerWaalsContact C-N 3.33Å; M179-L181 PolarHBondContact O-N 2.75Å; L181-W183 VanDerWaalsContact C-N 3.27Å; L181-W183 PolarHBondContact O-N 2.84Å; L181-C184 WeakPolarHBondContact O-CB 3.25Å; L181-C184 PolarHBondContact O-N 3Å; L181-C184 VanDerWaalsContact O-N 3.09Å; L181-Y185 HydrophobicContact CB-CD2 4.27Å; L181-Y185 HydrophobicContact CB-CE2 3.96Å; L181-Y185 HydrophobicContact CD2-CE2 4.13Å; L181-Y185 HydrophobicContact CG-CE2 4.49Å; L181-Y185 WeakPolarHBondContact O-CD2 3.1Å; L181-Y185 PolarHBondContact O-N 2.91Å
182	D	87.3	Confident	84.5	Confident	15 Å²	15	40.5 Å²	40.5	8%	0.08	22%	0.218	C	C	.	.	H	α-helix	trans	-59	-39.9	176.5	-77.9	-22.7	0	0	0	111.7	K178 M179 Y185 G186 R187 L188	K178-D182 IonicContact NZ-OD1 2.67Å; K178-D182 PolarHBondContact NZ-OD1 3.21Å; K178-D182 IonicContact NZ-OD2 2.77Å; K178-D182 PolarHBondContact NZ-OD2 3.03Å; K178-D182 WeakPolarHBondContact O-CB 3.34Å; K178-D182 PolarHBondContact O-N 2.96Å; M179-D182 PolarHBondContact O-N 2.79Å; D182-Y185 PolarHBondContact O-N 3.08Å; D182-G186 PolarHBondContact O-N 3.11Å; D182-R187 HydrophobicContact CB-CB 4.03Å; D182-R187 WeakPolarHBondContact O-CA 3.37Å; D182-R187 PolarHBondContact O-N 2.89Å; D182-R187 WeakPolarHBondContact OD1-CD 2.96Å; D182-R187 IonicContact OD1-CZ 3.82Å; D182-R187 IonicContact OD1-NH1 3.37Å; D182-R187 PolarHBondContact OD1-NH1 2.77Å; D182-L188 HydrophobicContact CB-CD1 3.9Å; D182-L188 HydrophobicContact CB-CG 4.02Å; D182-L188 PolarHBondContact O-N 2.79Å
183	W	90.6	Very high	84.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64	-46.9	172.2	178.3	77.6	0	0	0	111.9	Y82 R83 L86 M179 V180 L181 Y185 G186 L188 F191 L193 L194	Y82-W183 AromaticContact CD1-CH2 3.87Å; Y82-W183 HydrophobicContact CD1-CH2 3.87Å; Y82-W183 HydrophobicContact CD1-CZ3 4.19Å; Y82-W183 AromaticContact CE1-CH2 3.9Å; Y82-W183 HydrophobicContact CE1-CH2 3.9Å; Y82-W183 HydrophobicContact CE1-CZ3 4.03Å; R83-W183 HydrophobicContact CB-CZ3 4.4Å; R83-W183 HydrophobicContact CG-CE3 4.15Å; R83-W183 HydrophobicContact CG-CH2 3.3Å; R83-W183 HydrophobicContact CG-CZ2 3.97Å; R83-W183 HydrophobicContact CG-CZ3 3.41Å; R83-W183 VanDerWaalsContact CG-CZ3 3.41Å; R83-W183 VanDerWaalsContact CZ-O 3.28Å; R83-W183 PolarHBondContact NH2-O 3.2Å; L86-W183 HydrophobicContact CD1-CE3 4.38Å; L86-W183 HydrophobicContact CD1-CZ3 3.81Å; M179-W183 PolarHBondContact O-N 2.87Å; V180-W183 PolarHBondContact O-N 2.52Å; L181-W183 VanDerWaalsContact C-N 3.27Å; L181-W183 PolarHBondContact O-N 2.84Å; W183-Y185 VanDerWaalsContact C-N 3.26Å; W183-Y185 PolarHBondContact O-N 2.93Å; W183-G186 PolarHBondContact O-N 2.66Å; W183-L188 HydrophobicContact CB-CB 4.19Å; W183-L188 HydrophobicContact CB-CD1 4.24Å; W183-F191 PolarHBondContact NE1-O 3.25Å; W183-L193 HydrophobicContact CH2-CD1 4.18Å; W183-L193 HydrophobicContact CZ2-CD1 4.39Å; W183-L194 HydrophobicContact CB-CB 4.49Å; W183-L194 HydrophobicContact CB-CD1 3.71Å; W183-L194 HydrophobicContact CD2-CB 3.53Å; W183-L194 HydrophobicContact CD2-CD1 4.38Å; W183-L194 HydrophobicContact CE3-CB 3.85Å; W183-L194 HydrophobicContact CG-CB 3.81Å; W183-L194 HydrophobicContact CG-CD1 3.9Å; W183-L194 HydrophobicContact CZ2-CB 4.31Å; W183-L194 HydrophobicContact CZ3-CB 4.32Å
184	C	88.3	Confident	85.7	Confident	13 Å²	13	37.2 Å²	37.2	9%	0.088	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-39.2	176.5	-71.1	0	0	0	0	112.6	R83 A87 V180 L181 G186	R83-C184 PolarHBondContact NE-O 3.44Å; R83-C184 PolarHBondContact NH2-O 3.34Å; R83-C184 PolarHBondContact O-SG 3.48Å; R83-C184 VanDerWaalsContact O-SG 3.37Å; A87-C184 HydrophobicContact CB-CB 3.9Å; V180-C184 PolarHBondContact O-N 3.47Å; V180-C184 PolarHBondContact O-SG 3.21Å; L181-C184 WeakPolarHBondContact O-CB 3.25Å; L181-C184 PolarHBondContact O-N 3Å; L181-C184 VanDerWaalsContact O-N 3.09Å; C184-G186 VanDerWaalsContact C-N 3.32Å
185	Y	87.4	Confident	86.3	Confident	104 Å²	104	34.9 Å²	34.9	41%	0.408	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-1.1	177.2	-59.3	-47.1	0	0	0	114.4	D107 L181 D182 W183	D107-Y185 WeakPolarHBondContact OD2-CE2 3.19Å; L181-Y185 HydrophobicContact CB-CD2 4.27Å; L181-Y185 HydrophobicContact CB-CE2 3.96Å; L181-Y185 HydrophobicContact CD2-CE2 4.13Å; L181-Y185 HydrophobicContact CG-CE2 4.49Å; L181-Y185 WeakPolarHBondContact O-CD2 3.1Å; L181-Y185 PolarHBondContact O-N 2.91Å; D182-Y185 PolarHBondContact O-N 3.08Å; W183-Y185 VanDerWaalsContact C-N 3.26Å; W183-Y185 PolarHBondContact O-N 2.93Å
186	G	84.5	Confident	86.5	Confident	38 Å²	38	35.1 Å²	35.1	39%	0.392	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	15	175.9	0	0	0	0	0	115.1	R83 D182 W183 C184 L188	R83-G186 VanDerWaalsContact NH2-N 3.2Å; D182-G186 PolarHBondContact O-N 3.11Å; W183-G186 PolarHBondContact O-N 2.66Å; C184-G186 VanDerWaalsContact C-N 3.32Å; G186-L188 VanDerWaalsContact C-N 3.31Å
187	R	84	Confident	86.6	Confident	134 Å²	134	35.3 Å²	35.3	51%	0.506	19%	0.186	S	C	.	.	S	Bend	trans	-80.5	-11.3	174.1	-54.6	-175.6	-164.3	134	-1.7	113.1	D107 D182 P189	D107-R187 IonicContact OD1-CZ 3.98Å; D107-R187 IonicContact OD1-NH1 3.84Å; D107-R187 PolarHBondContact OD1-NH1 3.18Å; D107-R187 IonicContact OD1-NH2 3.86Å; D182-R187 HydrophobicContact CB-CB 4.03Å; D182-R187 WeakPolarHBondContact O-CA 3.37Å; D182-R187 PolarHBondContact O-N 2.89Å; D182-R187 WeakPolarHBondContact OD1-CD 2.96Å; D182-R187 IonicContact OD1-CZ 3.82Å; D182-R187 IonicContact OD1-NH1 3.37Å; D182-R187 PolarHBondContact OD1-NH1 2.77Å; R187-P189 VanDerWaalsContact C-CD 3.43Å; R187-P189 WeakPolarHBondContact O-CD 3.46Å
188	L	83.3	Confident	86.6	Confident	21 Å²	21	32.6 Å²	32.6	11%	0.11	18%	0.18	C	C	.	.			trans	-116.3	73.9	171	-68.6	169.2	0	0	0	111	M179 D182 W183 G186 A190	M179-L188 HydrophobicContact CB-CD1 4.46Å; M179-L188 HydrophobicContact CE-CD1 4.33Å; M179-L188 HydrophobicContact CG-CD1 3.5Å; M179-L188 VanDerWaalsContact O-CD1 3.27Å; M179-L188 WeakPolarHBondContact O-CD1 3.47Å; D182-L188 HydrophobicContact CB-CD1 3.9Å; D182-L188 HydrophobicContact CB-CG 4.02Å; D182-L188 PolarHBondContact O-N 2.79Å; W183-L188 HydrophobicContact CB-CB 4.19Å; W183-L188 HydrophobicContact CB-CD1 4.24Å; G186-L188 VanDerWaalsContact C-N 3.31Å; L188-A190 PolarHBondContact O-N 3.31Å
189	P	79.9	Confident	86.3	Confident	116 Å²	116	31.5 Å²	31.5	75%	0.753	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-9.8	-176	31.7	-37	0	0	0	114	R187 F191	R187-P189 VanDerWaalsContact C-CD 3.43Å; R187-P189 WeakPolarHBondContact O-CD 3.46Å; P189-F191 PolarHBondContact O-N 3.49Å
190	A	81.6	Confident	85.4	Confident	66 Å²	66	32.7 Å²	32.7	55%	0.545	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-19	-177.8	0	0	0	0	0	113.9	L188	L188-A190 PolarHBondContact O-N 3.31Å
191	F	87.5	Confident	84.6	Confident	19 Å²	19	33.7 Å²	33.7	8%	0.083	19%	0.186	C	C	.	.			trans	-121.3	128	-177.8	-55.9	-71.6	0	0	0	111.1	F150 W183 P189 L238	F150-F191 HydrophobicContact CB-CZ 4.21Å; F150-F191 HydrophobicContact CD1-CZ 4.39Å; F150-F191 HydrophobicContact CD2-CE2 4.04Å; F150-F191 AromaticContact CD2-CZ 3.56Å; F150-F191 HydrophobicContact CD2-CZ 3.56Å; F150-F191 HydrophobicContact CE2-CE2 4.35Å; F150-F191 AromaticContact CE2-CZ 3.97Å; F150-F191 HydrophobicContact CE2-CZ 3.97Å; F150-F191 AromaticContact CG-CZ 3.79Å; F150-F191 HydrophobicContact CG-CZ 3.79Å; W183-F191 PolarHBondContact NE1-O 3.25Å; P189-F191 PolarHBondContact O-N 3.49Å; F191-L238 HydrophobicContact CB-CB 4.22Å; F191-L238 HydrophobicContact CD1-CB 3.7Å; F191-L238 HydrophobicContact CD2-CB 4.25Å; F191-L238 HydrophobicContact CD2-CD2 3.82Å; F191-L238 HydrophobicContact CE1-CB 4.1Å; F191-L238 HydrophobicContact CE2-CD2 3.85Å; F191-L238 HydrophobicContact CG-CB 3.78Å; F191-L238 HydrophobicContact CG-CD2 4.22Å; F191-L238 HydrophobicContact CZ-CD1 4.49Å; F191-L238 HydrophobicContact CZ-CD2 4.28Å
192	E	87	Confident	84.1	Confident	76 Å²	76	34 Å²	34	36%	0.355	19%	0.188	S	C	.	.	S	Bend	trans	-75.2	-31.6	178.1	-64.3	-175	175.3	0	0	111.5	M230 S235 H236	E192-M230 HydrophobicContact CB-CE 3.59Å; E192-M230 WeakPolarHBondContact OE2-CE 3.45Å; E192-S235 WeakPolarHBondContact OE2-CB 3.12Å; E192-S235 PolarHBondContact OE2-OG 3.46Å; E192-H236 PolarHBondContact N-O 2.91Å
193	L	90.1	Very high	83.5	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	129.8	177.9	-175.4	63.6	0	0	0	111	Y82 W183 I195 L223 L227 M230 L237 L238	Y82-L193 HydrophobicContact CD1-CD1 3.73Å; Y82-L193 HydrophobicContact CE1-CD1 3.67Å; W183-L193 HydrophobicContact CH2-CD1 4.18Å; W183-L193 HydrophobicContact CZ2-CD1 4.39Å; L193-I195 HydrophobicContact CD2-CD1 3.93Å; L193-I195 HydrophobicContact CD2-CG1 4.25Å; L193-I195 HydrophobicContact CG-CD1 4.28Å; L193-I195 HydrophobicContact CG-CG1 4.06Å; L193-L223 HydrophobicContact CD1-CD1 4.19Å; L193-L223 HydrophobicContact CD1-CD2 3.87Å; L193-L223 HydrophobicContact CD2-CD1 4.42Å; L193-L223 HydrophobicContact CD2-CD2 4.37Å; L193-L227 HydrophobicContact CD2-CD1 4.34Å; L193-M230 HydrophobicContact CB-CE 4Å; L193-M230 HydrophobicContact CB-SD 4.12Å; L193-M230 HydrophobicContact CD2-SD 4.03Å; L193-L237 HydrophobicContact CB-CD2 3.72Å; L193-L237 HydrophobicContact CD2-CD2 3.96Å; L193-L237 HydrophobicContact CG-CD2 4.32Å; L193-L238 PolarHBondContact O-N 3.43Å
194	L	92	Very high	82.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	125.1	175	-172.4	163.4	0	0	0	109.6	Y82 V180 W183 P196 L238 V240	Y82-L194 VanDerWaalsContact CE1-O 3.26Å; Y82-L194 WeakPolarHBondContact CE1-O 3.45Å; Y82-L194 PolarHBondContact OH-O 2.84Å; V180-L194 HydrophobicContact CG2-CD2 3.86Å; W183-L194 HydrophobicContact CB-CB 4.49Å; W183-L194 HydrophobicContact CB-CD1 3.71Å; W183-L194 HydrophobicContact CD2-CB 3.53Å; W183-L194 HydrophobicContact CD2-CD1 4.38Å; W183-L194 HydrophobicContact CE3-CB 3.85Å; W183-L194 HydrophobicContact CG-CB 3.81Å; W183-L194 HydrophobicContact CG-CD1 3.9Å; W183-L194 HydrophobicContact CZ2-CB 4.31Å; W183-L194 HydrophobicContact CZ3-CB 4.32Å; L194-P196 HydrophobicContact CD2-CB 4.47Å; L194-P196 HydrophobicContact CD2-CG 4.37Å; L194-L238 CarbonylContact C-O 3.58Å; L194-L238 WeakPolarHBondContact CA-O 3.15Å; L194-L238 HydrophobicContact CD1-CD2 3.72Å; L194-L238 HydrophobicContact CG-CB 4.38Å; L194-L238 HydrophobicContact CG-CD2 3.9Å; L194-L238 HydrophobicContact CG-CG 4.22Å; L194-V240 HydrophobicContact CD1-CG2 4.44Å; L194-V240 HydrophobicContact CD2-CG2 3.89Å; L194-V240 HydrophobicContact CG-CG2 4.14Å
195	I	91	Very high	81.6	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	106.1	-178.8	-56.5	176.7	0	0	0	109.6	L193 F197 V216 Y220 L223 L227 L238 F239 V240	L193-I195 HydrophobicContact CD2-CD1 3.93Å; L193-I195 HydrophobicContact CD2-CG1 4.25Å; L193-I195 HydrophobicContact CG-CD1 4.28Å; L193-I195 HydrophobicContact CG-CG1 4.06Å; I195-F197 HydrophobicContact CG2-CD2 4.5Å; I195-F197 HydrophobicContact CG2-CE1 4.23Å; I195-F197 HydrophobicContact CG2-CE2 3.89Å; I195-F197 HydrophobicContact CG2-CZ 3.74Å; I195-V216 HydrophobicContact CD1-CG1 4.37Å; I195-V216 HydrophobicContact CD1-CG2 4.27Å; I195-V216 HydrophobicContact CG2-CG2 4.23Å; I195-Y220 HydrophobicContact CG2-CD2 4.09Å; I195-Y220 HydrophobicContact CG2-CE2 3.79Å; I195-L223 HydrophobicContact CD1-CD1 4.32Å; I195-L223 HydrophobicContact CG1-CD1 4.28Å; I195-L227 HydrophobicContact CD1-CD1 3.81Å; I195-L238 PolarHBondContact N-O 3.21Å; I195-F239 HydrophobicContact CB-CD1 3.9Å; I195-F239 HydrophobicContact CB-CE1 4.02Å; I195-F239 HydrophobicContact CD1-CD1 4.49Å; I195-F239 HydrophobicContact CD1-CE1 3.77Å; I195-F239 HydrophobicContact CD1-CZ 4.19Å; I195-F239 HydrophobicContact CG1-CE1 4.43Å; I195-F239 HydrophobicContact CG2-CD1 4.16Å; I195-F239 HydrophobicContact CG2-CE1 4.18Å; I195-F239 WeakPolarHBondContact O-CA 3.25Å; I195-V240 PolarHBondContact O-N 2.82Å
196	P	89	Confident	80.7	Confident	7 Å²	7	36.7 Å²	36.7	5%	0.045	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	141.9	175.6	30.9	-27.6	0	0	0	111.9	Y82 L86 F90 V180 L194 Y220 V240	Y82-P196 WeakPolarHBondContact OH-CD 2.92Å; L86-P196 HydrophobicContact CD2-CG 4.13Å; F90-P196 HydrophobicContact CE2-CG 4.08Å; F90-P196 HydrophobicContact CZ-CB 4.22Å; F90-P196 HydrophobicContact CZ-CG 3.92Å; V180-P196 HydrophobicContact CG2-CB 4.24Å; V180-P196 HydrophobicContact CG2-CG 4.32Å; L194-P196 HydrophobicContact CD2-CB 4.47Å; L194-P196 HydrophobicContact CD2-CG 4.37Å; P196-Y220 PolarHBondContact O-OH 3.45Å; P196-V240 CarbonylContact C-O 3.49Å; P196-V240 WeakPolarHBondContact CA-O 3.3Å; P196-V240 HydrophobicContact CB-CB 4.35Å
197	F	86.3	Confident	80.2	Confident	13 Å²	13	39.8 Å²	39.8	6%	0.057	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	137.6	169.6	-70	-56.6	0	0	0	110.5	I195 L202 L212 L215 V216 Y220 F239 V240 L241 H242	I195-F197 HydrophobicContact CG2-CD2 4.5Å; I195-F197 HydrophobicContact CG2-CE1 4.23Å; I195-F197 HydrophobicContact CG2-CE2 3.89Å; I195-F197 HydrophobicContact CG2-CZ 3.74Å; F197-L202 HydrophobicContact CB-CD1 4.05Å; F197-L202 HydrophobicContact CD1-CD2 4.43Å; F197-L202 HydrophobicContact CG-CD1 4.43Å; F197-L212 HydrophobicContact CE2-CD1 4.46Å; F197-L215 HydrophobicContact CD1-CD2 3.85Å; F197-L215 HydrophobicContact CE1-CD2 3.05Å; F197-L215 HydrophobicContact CE2-CD2 4.22Å; F197-L215 HydrophobicContact CZ-CD2 3.26Å; F197-V216 HydrophobicContact CZ-CG2 3.74Å; F197-Y220 HydrophobicContact CE1-CE2 4.4Å; F197-F239 HydrophobicContact CD2-CD1 4.24Å; F197-F239 AromaticContact CE2-CD1 3.73Å; F197-F239 HydrophobicContact CE2-CD1 3.73Å; F197-F239 HydrophobicContact CE2-CE1 4.01Å; F197-V240 PolarHBondContact N-O 3.38Å; F197-L241 HydrophobicContact CB-CD2 3.96Å; F197-L241 HydrophobicContact CD2-CD2 3.97Å; F197-L241 HydrophobicContact CG-CD2 4.46Å; F197-H242 PolarHBondContact O-N 3.49Å
198	S	81.3	Confident	80	Confident	30 Å²	30	36.3 Å²	36.3	21%	0.21	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	122.6	162.7	175.5	0	0	0	0	108.4	E200 D201 L202	S198-E200 PolarHBondContact O-N 3.26Å; S198-E200 PolarHBondContact OG-N 3.49Å; S198-D201 WeakPolarHBondContact CB-OD2 3.44Å; S198-D201 WeakPolarHBondContact O-CB 3.05Å; S198-D201 PolarHBondContact O-N 3.17Å; S198-D201 PolarHBondContact OG-N 3.26Å; S198-L202 WeakPolarHBondContact O-CG 3.44Å; S198-L202 PolarHBondContact O-N 3.02Å; S198-L202 VanDerWaalsContact O-N 3.11Å
199	C	79.4	Confident	80.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-25.3	176.3	-73.8	0	0	0	0	111.9	S203 H242 G243 L247	C199-S203 PolarHBondContact O-N 3.5Å; C199-H242 WeakPolarHBondContact CB-O 3.49Å; C199-H242 PolarHBondContact N-O 2.83Å; C199-G243 VanDerWaalsContact CB-O 3.27Å; C199-G243 WeakPolarHBondContact CB-O 3.09Å; C199-L247 HydrophobicContact CB-CB 3.93Å; C199-L247 HydrophobicContact CB-CD2 4.48Å
200	E	69.5	Low	80.6	Confident	31 Å²	31	35 Å²	35	15%	0.145	23%	0.227	C	C	.	.	H	α-helix	trans	-69.3	-46.3	173	-173.5	150.1	-148.1	0	0	112.3	S198 L202 S203 S204 R246 Y440	S198-E200 PolarHBondContact O-N 3.26Å; S198-E200 PolarHBondContact OG-N 3.49Å; E200-L202 VanDerWaalsContact C-N 3.27Å; E200-L202 PolarHBondContact O-N 2.9Å; E200-S203 PolarHBondContact O-N 3.37Å; E200-S203 VanDerWaalsContact O-N 3.14Å; E200-S203 PolarHBondContact O-OG 3.46Å; E200-S204 PolarHBondContact O-N 3.03Å; E200-R246 HydrophobicContact CB-CB 4.09Å; E200-R246 HydrophobicContact CB-CG 4.12Å; E200-R246 IonicContact OE1-CZ 2.96Å; E200-R246 IonicContact OE1-NE 3.81Å; E200-R246 PolarHBondContact OE1-NE 3.37Å; E200-R246 IonicContact OE1-NH2 3.75Å; E200-R246 IonicContact OE2-NE 3.38Å; E200-Y440 WeakPolarHBondContact OE1-CE2 3.38Å; E200-Y440 PolarHBondContact OE1-OH 2.78Å; E200-Y440 PolarHBondContact OE2-OH 3.44Å
201	D	69.5	Low	81.1	Confident	22 Å²	22	32 Å²	32	12%	0.118	20%	0.202	C	C	.	.	H	α-helix	trans	-56	-44.4	173.1	-85.1	-50.3	0	0	0	111	S198 S204 R219 E480	S198-D201 WeakPolarHBondContact CB-OD2 3.44Å; S198-D201 WeakPolarHBondContact O-CB 3.05Å; S198-D201 PolarHBondContact O-N 3.17Å; S198-D201 PolarHBondContact OG-N 3.26Å; D201-S204 PolarHBondContact O-N 3.17Å; D201-S204 PolarHBondContact O-OG 3.25Å; D201-R219 IonicContact OD1-CZ 4Å; D201-R219 IonicContact OD1-NH1 2.76Å; D201-R219 PolarHBondContact OD1-NH1 3.01Å; D201-R219 IonicContact OD1-NH2 3.59Å; D201-R219 PolarHBondContact OD1-NH2 3.18Å; D201-R219 IonicContact OD2-CZ 3.23Å; D201-R219 IonicContact OD2-NH1 3.44Å; D201-R219 PolarHBondContact OD2-NH1 3.21Å; D201-R219 IonicContact OD2-NH2 2.76Å; D201-E480 VanDerWaalsContact OD1-CG 3.23Å; D201-E480 WeakPolarHBondContact OD1-CG 3.43Å
202	L	77.4	Confident	81.1	Confident	7 Å²	7	31.1 Å²	31.1	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-41.9	178.1	-64.9	176.2	0	0	0	112	F197 S198 E200 S204 L205 L215 L247 P268 I272	F197-L202 HydrophobicContact CB-CD1 4.05Å; F197-L202 HydrophobicContact CD1-CD2 4.43Å; F197-L202 HydrophobicContact CG-CD1 4.43Å; S198-L202 WeakPolarHBondContact O-CG 3.44Å; S198-L202 PolarHBondContact O-N 3.02Å; S198-L202 VanDerWaalsContact O-N 3.11Å; E200-L202 VanDerWaalsContact C-N 3.27Å; E200-L202 PolarHBondContact O-N 2.9Å; L202-S204 PolarHBondContact O-N 3.25Å; L202-L205 PolarHBondContact O-N 3.28Å; L202-L215 HydrophobicContact CD2-CD1 3.65Å; L202-L215 HydrophobicContact CD2-CD2 3.96Å; L202-L215 HydrophobicContact CD2-CG 4.31Å; L202-L247 HydrophobicContact CB-CD1 4.27Å; L202-L247 HydrophobicContact CD1-CD2 4.36Å; L202-P268 HydrophobicContact CB-CB 4.41Å; L202-I272 HydrophobicContact CD1-CD1 3.86Å; L202-I272 HydrophobicContact CD1-CG1 3.84Å
203	S	73.6	Confident	81.1	Confident	51 Å²	51	28.3 Å²	28.3	36%	0.357	19%	0.187	S	C	.	.	H	α-helix	trans	-64	-30.9	176.8	76.7	0	0	0	0	112.6	C199 E200 L205 G206	C199-S203 PolarHBondContact O-N 3.5Å; E200-S203 PolarHBondContact O-N 3.37Å; E200-S203 VanDerWaalsContact O-N 3.14Å; E200-S203 PolarHBondContact O-OG 3.46Å; S203-L205 VanDerWaalsContact C-N 3.32Å; S203-L205 PolarHBondContact O-N 3.44Å; S203-G206 PolarHBondContact O-N 2.97Å
204	S	69	Low	80.9	Confident	39 Å²	39	32.7 Å²	32.7	27%	0.273	21%	0.208	S	C	.	.	H	α-helix	trans	-74	-20	-177	78.7	0	0	0	0	114.1	E200 D201 L202 G206	E200-S204 PolarHBondContact O-N 3.03Å; D201-S204 PolarHBondContact O-N 3.17Å; D201-S204 PolarHBondContact O-OG 3.25Å; L202-S204 PolarHBondContact O-N 3.25Å; S204-G206 PolarHBondContact O-N 3.39Å
205	L	70	Confident	80.6	Confident	69 Å²	69	33 Å²	33	36%	0.361	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-11.9	177	-65.4	170.9	0	0	0	112.6	L202 S203 L215 P268	L202-L205 PolarHBondContact O-N 3.28Å; S203-L205 VanDerWaalsContact C-N 3.32Å; S203-L205 PolarHBondContact O-N 3.44Å; L205-L215 HydrophobicContact CD1-CD1 4.34Å; L205-P268 HydrophobicContact CB-CG 4.16Å; L205-P268 HydrophobicContact CD1-CG 4.38Å
206	G	68.3	Low	80.3	Confident	30 Å²	30	33 Å²	33	31%	0.309	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	-169.8	-177.6	0	0	0	0	0	113	S203 S204 A208	S203-G206 PolarHBondContact O-N 2.97Å; S204-G206 PolarHBondContact O-N 3.39Å; G206-A208 PolarHBondContact O-N 3.5Å; G206-A208 VanDerWaalsContact O-N 3.16Å
207	P	73.9	Confident	79.9	Confident	103 Å²	103	33.6 Å²	33.6	67%	0.669	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	11.7	-177.5	33.5	-36.3	0	0	0	113.5
208	A	81.2	Confident	79.5	Confident	60 Å²	60	39 Å²	39	50%	0.496	24%	0.24	S	C	.	.			trans	-68.2	127.6	-177.2	0	0	0	0	0	110.1	G206 V210	G206-A208 PolarHBondContact O-N 3.5Å; G206-A208 VanDerWaalsContact O-N 3.16Å; A208-V210 PolarHBondContact O-N 3.31Å
209	P	86.3	Confident	79	Confident	95 Å²	95	41.2 Å²	41.2	62%	0.617	24%	0.244	S	C	*	.			trans	-68.5	129.5	-175.6	26.7	-33.6	0	0	0	110.9	P265 E266	P209-P265 HydrophobicContact CB-CB 3.97Å; P209-E266 WeakPolarHBondContact CA-O 3.42Å
210	V	89.4	Confident	79.2	Confident	14 Å²	14	43.2 Å²	43.2	9%	0.085	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-141.2	145.9	177	70.6	0	0	0	0	108.6	A208 Q214 L215 E266 P268 I271	A208-V210 PolarHBondContact O-N 3.31Å; V210-Q214 HydrophobicContact CG2-CB 3.75Å; V210-L215 HydrophobicContact CG1-CB 4.39Å; V210-L215 HydrophobicContact CG1-CD1 3.88Å; V210-L215 HydrophobicContact CG2-CB 4.48Å; V210-E266 PolarHBondContact N-O 3.31Å; V210-E266 PolarHBondContact O-N 2.78Å; V210-P268 HydrophobicContact CG1-CG 4.14Å; V210-I271 HydrophobicContact CG1-CD1 4.14Å; V210-I271 WeakPolarHBondContact O-CD1 3.32Å
211	S	90.5	Very high	79.6	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.021	28%	0.275	C	S	.	.			trans	-86.1	157.8	176.4	72.1	0	0	0	0	112.1	C213 Q214 L215 P262 E263 Q264	S211-C213 VanDerWaalsContact C-N 3.27Å; S211-C213 PolarHBondContact O-N 3.43Å; S211-Q214 PolarHBondContact O-N 3.42Å; S211-Q214 VanDerWaalsContact O-N 3.1Å; S211-Q214 WeakPolarHBondContact OG-CB 3.2Å; S211-Q214 WeakPolarHBondContact OG-CG 3.28Å; S211-Q214 PolarHBondContact OG-N 2.91Å; S211-L215 WeakPolarHBondContact O-CB 3.11Å; S211-L215 PolarHBondContact O-N 3.03Å; S211-P262 WeakPolarHBondContact CB-O 3.32Å; S211-E263 WeakPolarHBondContact CB-O 3.42Å; S211-E263 PolarHBondContact OG-O 3.4Å; S211-Q264 WeakPolarHBondContact CA-O 3.48Å; S211-Q264 VanDerWaalsContact CB-O 3.26Å; S211-Q264 WeakPolarHBondContact CB-O 3.38Å
212	L	89.3	Confident	80.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-42.6	177.2	177.3	62.2	0	0	0	111.2	F197 Q214 L215 V216 L227 F239 P262 I271 L275 M280 L281	F197-L212 HydrophobicContact CE2-CD1 4.46Å; L212-Q214 VanDerWaalsContact C-N 3.35Å; L212-Q214 PolarHBondContact O-N 2.92Å; L212-L215 PolarHBondContact O-N 3.02Å; L212-V216 HydrophobicContact CD1-CG2 4.31Å; L212-V216 WeakPolarHBondContact O-CG2 3.45Å; L212-V216 PolarHBondContact O-N 2.67Å; L212-L227 HydrophobicContact CG-CD2 4.49Å; L212-F239 HydrophobicContact CD1-CE1 4.35Å; L212-F239 HydrophobicContact CD2-CZ 4.29Å; L212-P262 HydrophobicContact CB-CB 4.2Å; L212-P262 HydrophobicContact CD2-CB 4.12Å; L212-P262 PolarHBondContact N-O 3.32Å; L212-P262 VanDerWaalsContact N-O 3.09Å; L212-I271 HydrophobicContact CB-CG2 3.98Å; L212-I271 HydrophobicContact CD1-CG2 3.91Å; L212-I271 HydrophobicContact CG-CG2 4.39Å; L212-L275 HydrophobicContact CD1-CD1 4.29Å; L212-L275 HydrophobicContact CD2-CD1 4.41Å; L212-L275 HydrophobicContact CD2-CD2 4.07Å; L212-M280 HydrophobicContact CB-SD 4.03Å; L212-M280 HydrophobicContact CD2-CG 4.44Å; L212-M280 HydrophobicContact CD2-SD 3.72Å; L212-M280 HydrophobicContact CG-SD 4.49Å; L212-L281 HydrophobicContact CD2-CD1 3.63Å; L212-L281 HydrophobicContact CD2-CG 4.46Å
213	C	87.1	Confident	80.5	Confident	17 Å²	17	46.8 Å²	46.8	12%	0.115	28%	0.277	C	S	.	.	H	α-helix	trans	-62.2	-40.4	176.1	-72.9	0	0	0	0	112.3	S211 A217 P262 E263	S211-C213 VanDerWaalsContact C-N 3.27Å; S211-C213 PolarHBondContact O-N 3.43Å; C213-A217 WeakPolarHBondContact O-CB 3.45Å; C213-A217 PolarHBondContact O-N 2.8Å; C213-P262 PolarHBondContact N-O 3.43Å; C213-E263 HydrophobicContact CB-CG 4.37Å
214	Q	84.9	Confident	80.7	Confident	93 Å²	93	51.1 Å²	51.1	44%	0.435	29%	0.29	S	S	.	.	H	α-helix	trans	-68.1	-41.9	175.3	-74.5	173.3	6.3	0	0	111.7	V210 S211 L212 V216 A217 Q218	V210-Q214 HydrophobicContact CG2-CB 3.75Å; S211-Q214 PolarHBondContact O-N 3.42Å; S211-Q214 VanDerWaalsContact O-N 3.1Å; S211-Q214 WeakPolarHBondContact OG-CB 3.2Å; S211-Q214 WeakPolarHBondContact OG-CG 3.28Å; S211-Q214 PolarHBondContact OG-N 2.91Å; L212-Q214 VanDerWaalsContact C-N 3.35Å; L212-Q214 PolarHBondContact O-N 2.92Å; Q214-V216 PolarHBondContact O-N 3.15Å; Q214-A217 PolarHBondContact O-N 3.23Å; Q214-Q218 WeakPolarHBondContact O-CB 3.23Å; Q214-Q218 WeakPolarHBondContact O-CG 3.38Å; Q214-Q218 PolarHBondContact O-N 3.22Å
215	L	85.4	Confident	81	Confident	8 Å²	8	57.4 Å²	57.4	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-44.3	179.2	-167.3	149.6	0	0	0	110.9	F197 L202 L205 V210 S211 L212 R219 I271	F197-L215 HydrophobicContact CD1-CD2 3.85Å; F197-L215 HydrophobicContact CE1-CD2 3.05Å; F197-L215 HydrophobicContact CE2-CD2 4.22Å; F197-L215 HydrophobicContact CZ-CD2 3.26Å; L202-L215 HydrophobicContact CD2-CD1 3.65Å; L202-L215 HydrophobicContact CD2-CD2 3.96Å; L202-L215 HydrophobicContact CD2-CG 4.31Å; L205-L215 HydrophobicContact CD1-CD1 4.34Å; V210-L215 HydrophobicContact CG1-CB 4.39Å; V210-L215 HydrophobicContact CG1-CD1 3.88Å; V210-L215 HydrophobicContact CG2-CB 4.48Å; S211-L215 WeakPolarHBondContact O-CB 3.11Å; S211-L215 PolarHBondContact O-N 3.03Å; L212-L215 PolarHBondContact O-N 3.02Å; L215-R219 PolarHBondContact O-N 3.28Å; L215-I271 HydrophobicContact CD1-CD1 4.25Å
216	V	84.6	Confident	81.5	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-67.3	-42.5	172.7	172.2	0	0	0	0	111.5	I195 F197 L212 Q214 Q218 R219 Y220 L223 L227	I195-V216 HydrophobicContact CD1-CG1 4.37Å; I195-V216 HydrophobicContact CD1-CG2 4.27Å; I195-V216 HydrophobicContact CG2-CG2 4.23Å; F197-V216 HydrophobicContact CZ-CG2 3.74Å; L212-V216 HydrophobicContact CD1-CG2 4.31Å; L212-V216 WeakPolarHBondContact O-CG2 3.45Å; L212-V216 PolarHBondContact O-N 2.67Å; Q214-V216 PolarHBondContact O-N 3.15Å; V216-Q218 PolarHBondContact O-N 3.04Å; V216-R219 PolarHBondContact O-N 2.69Å; V216-Y220 HydrophobicContact CG1-CD2 4.31Å; V216-Y220 CarbonylContact O-C 3.44Å; V216-Y220 VanDerWaalsContact O-CA 3.29Å; V216-Y220 WeakPolarHBondContact O-CA 3.38Å; V216-Y220 WeakPolarHBondContact O-CB 3.43Å; V216-Y220 PolarHBondContact O-N 3.24Å; V216-L223 HydrophobicContact CG1-CB 3.78Å; V216-L223 HydrophobicContact CG1-CD1 3.89Å; V216-L227 HydrophobicContact CB-CD2 3.88Å; V216-L227 HydrophobicContact CG1-CD2 4.05Å; V216-L227 HydrophobicContact CG2-CD2 3.75Å
217	A	80.4	Confident	82.1	Confident	18 Å²	18	53.1 Å²	53.1	15%	0.149	28%	0.283	C	S	.	.	H	α-helix	trans	-67.7	-33.7	-178.7	0	0	0	0	0	113.3	C213 Q214 T221 K224	C213-A217 WeakPolarHBondContact O-CB 3.45Å; C213-A217 PolarHBondContact O-N 2.8Å; Q214-A217 PolarHBondContact O-N 3.23Å; A217-T221 WeakPolarHBondContact O-CA 3.45Å; A217-T221 PolarHBondContact O-N 2.67Å; A217-K224 HydrophobicContact CB-CB 3.83Å; A217-K224 HydrophobicContact CB-CD 4.3Å; A217-K224 HydrophobicContact CB-CG 3.77Å
218	Q	77.6	Confident	82.3	Confident	127 Å²	127	49.9 Å²	49.9	59%	0.593	26%	0.262	S	S	*	.	H	α-helix	trans	-67.7	-42.8	176.5	-76.3	174.2	7.4	0	0	111.3	Q214 V216	Q214-Q218 WeakPolarHBondContact O-CB 3.23Å; Q214-Q218 WeakPolarHBondContact O-CG 3.38Å; Q214-Q218 PolarHBondContact O-N 3.22Å; V216-Q218 PolarHBondContact O-N 3.04Å
219	R	72.6	Confident	82	Confident	77 Å²	77	52 Å²	52	29%	0.291	26%	0.264	S	S	.	.	H	α-helix	trans	-83.8	-35.6	-179.7	-73.7	-74.6	-178.4	136.8	-4.9	113.3	D201 L215 V216 P481	D201-R219 IonicContact OD1-CZ 4Å; D201-R219 IonicContact OD1-NH1 2.76Å; D201-R219 PolarHBondContact OD1-NH1 3.01Å; D201-R219 IonicContact OD1-NH2 3.59Å; D201-R219 PolarHBondContact OD1-NH2 3.18Å; D201-R219 IonicContact OD2-CZ 3.23Å; D201-R219 IonicContact OD2-NH1 3.44Å; D201-R219 PolarHBondContact OD2-NH1 3.21Å; D201-R219 IonicContact OD2-NH2 2.76Å; L215-R219 PolarHBondContact O-N 3.28Å; V216-R219 PolarHBondContact O-N 2.69Å; R219-P481 VanDerWaalsContact CZ-CD 3.48Å
220	Y	81.8	Confident	81.4	Confident	42 Å²	42	48.1 Å²	48.1	17%	0.165	24%	0.238	C	C	.	.			trans	-130.7	71.9	-171.6	-53.1	-54	0	0	0	110.3	Y82 L86 I195 P196 F197 V216 P222 L223	Y82-Y220 HydrophobicContact CD2-CD1 4.22Å; Y82-Y220 HydrophobicContact CD2-CG 4.31Å; Y82-Y220 AromaticContact CE2-CD1 3.41Å; Y82-Y220 HydrophobicContact CE2-CD1 3.41Å; Y82-Y220 VanDerWaalsContact CE2-CD1 3.41Å; Y82-Y220 HydrophobicContact CE2-CD2 4.16Å; Y82-Y220 AromaticContact CE2-CE1 3.95Å; Y82-Y220 HydrophobicContact CE2-CE1 3.95Å; Y82-Y220 AromaticContact CE2-CG 3.5Å; Y82-Y220 HydrophobicContact CE2-CG 3.5Å; L86-Y220 HydrophobicContact CD2-CE1 4.1Å; I195-Y220 HydrophobicContact CG2-CD2 4.09Å; I195-Y220 HydrophobicContact CG2-CE2 3.79Å; P196-Y220 PolarHBondContact O-OH 3.45Å; F197-Y220 HydrophobicContact CE1-CE2 4.4Å; V216-Y220 HydrophobicContact CG1-CD2 4.31Å; V216-Y220 CarbonylContact O-C 3.44Å; V216-Y220 VanDerWaalsContact O-CA 3.29Å; V216-Y220 WeakPolarHBondContact O-CA 3.38Å; V216-Y220 WeakPolarHBondContact O-CB 3.43Å; V216-Y220 PolarHBondContact O-N 3.24Å; Y220-P222 VanDerWaalsContact C-N 3.29Å; Y220-P222 WeakPolarHBondContact O-CD 3.43Å; Y220-P222 VanDerWaalsContact O-N 3.08Å; Y220-L223 HydrophobicContact CD2-CD1 4.47Å; Y220-L223 HydrophobicContact CG-CD1 4.41Å; Y220-L223 WeakPolarHBondContact O-CB 3.36Å; Y220-L223 PolarHBondContact O-N 2.84Å
221	T	78.7	Confident	80.5	Confident	103 Å²	103	48.9 Å²	48.9	63%	0.632	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-47.2	-39.7	-176	-40.3	0	0	0	0	115.1	A217 L223 K224	A217-T221 WeakPolarHBondContact O-CA 3.45Å; A217-T221 PolarHBondContact O-N 2.67Å; T221-L223 PolarHBondContact O-N 3.17Å; T221-K224 WeakPolarHBondContact O-CB 3.38Å; T221-K224 PolarHBondContact O-N 3.41Å
222	P	82.1	Confident	79.6	Confident	32 Å²	32	53.2 Å²	53.2	21%	0.208	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-60.6	-25.8	176.5	-23.8	35.2	0	0	0	114.3	R81 Y220	R81-P222 HydrophobicContact CG-CG 4.49Å; Y220-P222 VanDerWaalsContact C-N 3.29Å; Y220-P222 WeakPolarHBondContact O-CD 3.43Å; Y220-P222 VanDerWaalsContact O-N 3.08Å
223	L	83.1	Confident	78.7	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-85	-5.3	-176.3	-62.2	-175.6	0	0	0	114.2	Y82 L193 I195 V216 Y220 T221 K225 V226 L227	Y82-L223 HydrophobicContact CD1-CD1 3.93Å; Y82-L223 HydrophobicContact CD1-CD2 3.88Å; Y82-L223 HydrophobicContact CD1-CG 4.18Å; Y82-L223 HydrophobicContact CD2-CD1 4.02Å; Y82-L223 HydrophobicContact CD2-CG 4.07Å; Y82-L223 HydrophobicContact CE1-CD1 3.72Å; Y82-L223 HydrophobicContact CE1-CD2 4.47Å; Y82-L223 HydrophobicContact CE1-CG 4.46Å; Y82-L223 HydrophobicContact CE2-CD1 3.83Å; Y82-L223 HydrophobicContact CE2-CG 4.38Å; Y82-L223 HydrophobicContact CG-CD1 4.04Å; Y82-L223 HydrophobicContact CG-CD2 3.88Å; Y82-L223 HydrophobicContact CG-CG 3.94Å; L193-L223 HydrophobicContact CD1-CD1 4.19Å; L193-L223 HydrophobicContact CD1-CD2 3.87Å; L193-L223 HydrophobicContact CD2-CD1 4.42Å; L193-L223 HydrophobicContact CD2-CD2 4.37Å; I195-L223 HydrophobicContact CD1-CD1 4.32Å; I195-L223 HydrophobicContact CG1-CD1 4.28Å; V216-L223 HydrophobicContact CG1-CB 3.78Å; V216-L223 HydrophobicContact CG1-CD1 3.89Å; Y220-L223 HydrophobicContact CD2-CD1 4.47Å; Y220-L223 HydrophobicContact CG-CD1 4.41Å; Y220-L223 WeakPolarHBondContact O-CB 3.36Å; Y220-L223 PolarHBondContact O-N 2.84Å; T221-L223 PolarHBondContact O-N 3.17Å; L223-K225 PolarHBondContact O-N 3.47Å; L223-V226 HydrophobicContact CD2-CB 4.33Å; L223-V226 HydrophobicContact CD2-CG1 4.46Å; L223-V226 PolarHBondContact O-N 3.37Å; L223-L227 PolarHBondContact O-N 2.74Å; L223-L227 VanDerWaalsContact O-N 3.13Å
224	K	78.4	Confident	77.7	Confident	142 Å²	142	57.4 Å²	57.4	62%	0.617	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-37.1	-173.8	-178	173.8	-178.4	177.3	0	114.2	A217 T221	A217-K224 HydrophobicContact CB-CB 3.83Å; A217-K224 HydrophobicContact CB-CD 4.3Å; A217-K224 HydrophobicContact CB-CG 3.77Å; T221-K224 WeakPolarHBondContact O-CB 3.38Å; T221-K224 PolarHBondContact O-N 3.41Å
225	K	75.9	Confident	77.4	Confident	171 Å²	171	53.7 Å²	53.7	74%	0.743	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-7.4	178.9	-63.2	-174.1	178.8	-176.5	0	113.6	L223 L229	L223-K225 PolarHBondContact O-N 3.47Å; K225-L229 VanDerWaalsContact O-CD1 3.25Å; K225-L229 WeakPolarHBondContact O-CD1 3.47Å; K225-L229 WeakPolarHBondContact O-CG 3.35Å
226	V	80	Confident	77.3	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.03	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-42.3	-172	179.9	0	0	0	0	111	A78 I79 L223 L229 M230	A78-V226 HydrophobicContact CB-CG2 3.59Å; I79-V226 HydrophobicContact CD1-CG1 4.03Å; I79-V226 HydrophobicContact CG1-CG1 3.87Å; L223-V226 HydrophobicContact CD2-CB 4.33Å; L223-V226 HydrophobicContact CD2-CG1 4.46Å; L223-V226 PolarHBondContact O-N 3.37Å; V226-L229 PolarHBondContact O-N 3.24Å; V226-M230 HydrophobicContact CG1-CG 4Å; V226-M230 HydrophobicContact CG1-SD 3.76Å; V226-M230 WeakPolarHBondContact O-CG 3.49Å; V226-M230 PolarHBondContact O-N 3.48Å
227	L	79.9	Confident	77.6	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-59.4	-46.5	-177	-177.3	69.8	0	0	0	113.1	L193 I195 L212 V216 L223 L229 M230 A231 L237	L193-L227 HydrophobicContact CD2-CD1 4.34Å; I195-L227 HydrophobicContact CD1-CD1 3.81Å; L212-L227 HydrophobicContact CG-CD2 4.49Å; V216-L227 HydrophobicContact CB-CD2 3.88Å; V216-L227 HydrophobicContact CG1-CD2 4.05Å; V216-L227 HydrophobicContact CG2-CD2 3.75Å; L223-L227 PolarHBondContact O-N 2.74Å; L223-L227 VanDerWaalsContact O-N 3.13Å; L227-L229 VanDerWaalsContact C-N 3.3Å; L227-L229 PolarHBondContact O-N 3.43Å; L227-M230 PolarHBondContact O-N 2.92Å; L227-A231 VanDerWaalsContact O-CB 3.3Å; L227-A231 WeakPolarHBondContact O-CB 3.28Å; L227-A231 PolarHBondContact O-N 3.44Å; L227-L237 HydrophobicContact CD1-CD1 4.32Å
228	P	78.8	Confident	78.1	Confident	36 Å²	36	56.9 Å²	56.9	23%	0.234	32%	0.318	C	S	.	.	H	α-helix	trans	-62.2	-37.4	178	-21.9	33.6	0	0	0	112.7	A232	P228-A232 WeakPolarHBondContact O-CB 3.12Å; P228-A232 PolarHBondContact O-N 3.19Å; P228-A232 VanDerWaalsContact O-N 3.08Å
229	L	74.9	Confident	78.9	Confident	105 Å²	105	50.9 Å²	50.9	55%	0.55	29%	0.29	S	S	.	.	H	α-helix	trans	-68.3	-41.2	178.8	-65.2	176.6	0	0	0	112.1	K225 V226 L227 A233	K225-L229 VanDerWaalsContact O-CD1 3.25Å; K225-L229 WeakPolarHBondContact O-CD1 3.47Å; K225-L229 WeakPolarHBondContact O-CG 3.35Å; V226-L229 PolarHBondContact O-N 3.24Å; L227-L229 VanDerWaalsContact C-N 3.3Å; L227-L229 PolarHBondContact O-N 3.43Å; L229-A233 WeakPolarHBondContact O-CB 3.3Å; L229-A233 PolarHBondContact O-N 2.85Å; L229-A233 VanDerWaalsContact O-N 3.08Å
230	M	73.4	Confident	79.9	Confident	13 Å²	13	47.2 Å²	47.2	6%	0.064	28%	0.276	C	S	.	.	H	α-helix	trans	-74.2	-35.1	178.9	-71.2	-165.9	68.7	0	0	112.7	I79 E192 L193 V226 L227 A232 A233 G234 S235 L237	I79-M230 HydrophobicContact CD1-SD 3.72Å; E192-M230 HydrophobicContact CB-CE 3.59Å; E192-M230 WeakPolarHBondContact OE2-CE 3.45Å; L193-M230 HydrophobicContact CB-CE 4Å; L193-M230 HydrophobicContact CB-SD 4.12Å; L193-M230 HydrophobicContact CD2-SD 4.03Å; V226-M230 HydrophobicContact CG1-CG 4Å; V226-M230 HydrophobicContact CG1-SD 3.76Å; V226-M230 WeakPolarHBondContact O-CG 3.49Å; V226-M230 PolarHBondContact O-N 3.48Å; L227-M230 PolarHBondContact O-N 2.92Å; M230-A232 VanDerWaalsContact C-N 3.33Å; M230-A233 PolarHBondContact O-N 3.28Å; M230-G234 PolarHBondContact O-N 3.41Å; M230-S235 WeakPolarHBondContact CE-OG 3.39Å; M230-S235 PolarHBondContact O-N 2.95Å; M230-L237 HydrophobicContact CB-CD2 4.23Å; M230-L237 HydrophobicContact CE-CD2 4.09Å
231	A	72.1	Confident	80.4	Confident	30 Å²	30	45.3 Å²	45.3	25%	0.248	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-44.3	171.5	0	0	0	0	0	111.2	L227 A233 G234 L281	L227-A231 VanDerWaalsContact O-CB 3.3Å; L227-A231 WeakPolarHBondContact O-CB 3.28Å; L227-A231 PolarHBondContact O-N 3.44Å; A231-A233 VanDerWaalsContact C-N 3.31Å; A231-A233 PolarHBondContact O-N 3.4Å; A231-G234 PolarHBondContact O-N 3.46Å; A231-L281 HydrophobicContact CB-CD2 3.51Å
232	A	71.6	Confident	80.7	Confident	93 Å²	93	42.7 Å²	42.7	77%	0.769	25%	0.249	S	C	*	.	H	α-helix	trans	-68.6	-27	176.2	0	0	0	0	0	113.5	P228 M230	P228-A232 WeakPolarHBondContact O-CB 3.12Å; P228-A232 PolarHBondContact O-N 3.19Å; P228-A232 VanDerWaalsContact O-N 3.08Å; M230-A232 VanDerWaalsContact C-N 3.33Å
233	A	69.9	Low	80.4	Confident	60 Å²	60	41.6 Å²	41.6	50%	0.496	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-5.3	180	0	0	0	0	0	114.3	L229 M230 A231 S235	L229-A233 WeakPolarHBondContact O-CB 3.3Å; L229-A233 PolarHBondContact O-N 2.85Å; L229-A233 VanDerWaalsContact O-N 3.08Å; M230-A233 PolarHBondContact O-N 3.28Å; A231-A233 VanDerWaalsContact C-N 3.31Å; A231-A233 PolarHBondContact O-N 3.4Å; A233-S235 VanDerWaalsContact C-N 3.28Å; A233-S235 PolarHBondContact O-N 2.77Å
234	G	66.1	Low	80.4	Confident	46 Å²	46	41.6 Å²	41.6	47%	0.474	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	26.9	-177.1	0	0	0	0	0	113.8	M230 A231	M230-G234 PolarHBondContact O-N 3.41Å; A231-G234 PolarHBondContact O-N 3.46Å
235	S	77.7	Confident	80.3	Confident	16 Å²	16	36.6 Å²	36.6	11%	0.112	22%	0.223	C	C	.	.			trans	-62.5	153.9	-179.4	-76	0	0	0	0	113	E192 M230 A233 L237	E192-S235 WeakPolarHBondContact OE2-CB 3.12Å; E192-S235 PolarHBondContact OE2-OG 3.46Å; M230-S235 WeakPolarHBondContact CE-OG 3.39Å; M230-S235 PolarHBondContact O-N 2.95Å; A233-S235 VanDerWaalsContact C-N 3.28Å; A233-S235 PolarHBondContact O-N 2.77Å; S235-L237 PolarHBondContact O-N 3.35Å
236	H	83.2	Confident	80.1	Confident	85 Å²	85	33.1 Å²	33.1	39%	0.394	21%	0.205	S	C	.	.			trans	-73.1	90.4	174.4	-67.3	-62	0	0	0	111.4	R158 E192	R158-H236 PolarHBondContact NH2-ND1 3.13Å; E192-H236 PolarHBondContact N-O 2.91Å
237	L	90.7	Very high	79.7	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.037	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	142.2	176.2	-57.3	178.6	0	0	0	110.9	L193 L227 M230 S235 F239 L281 A284 S285	L193-L237 HydrophobicContact CB-CD2 3.72Å; L193-L237 HydrophobicContact CD2-CD2 3.96Å; L193-L237 HydrophobicContact CG-CD2 4.32Å; L227-L237 HydrophobicContact CD1-CD1 4.32Å; M230-L237 HydrophobicContact CB-CD2 4.23Å; M230-L237 HydrophobicContact CE-CD2 4.09Å; S235-L237 PolarHBondContact O-N 3.35Å; L237-F239 HydrophobicContact CB-CE2 4.49Å; L237-L281 HydrophobicContact CD1-CD1 4.33Å; L237-A284 HydrophobicContact CB-CB 4.17Å; L237-S285 PolarHBondContact O-N 3.04Å
238	L	92.6	Very high	79.6	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.5	169.9	174.7	63	0	0	0	110.8	F150 M179 F191 L193 L194 I195 V240 S285 L287	F150-L238 HydrophobicContact CE1-CD1 4.28Å; F150-L238 HydrophobicContact CE2-CD1 4.01Å; F150-L238 HydrophobicContact CZ-CD1 3.55Å; M179-L238 HydrophobicContact CE-CD2 3.31Å; M179-L238 HydrophobicContact SD-CD2 4.5Å; F191-L238 HydrophobicContact CB-CB 4.22Å; F191-L238 HydrophobicContact CD1-CB 3.7Å; F191-L238 HydrophobicContact CD2-CB 4.25Å; F191-L238 HydrophobicContact CD2-CD2 3.82Å; F191-L238 HydrophobicContact CE1-CB 4.1Å; F191-L238 HydrophobicContact CE2-CD2 3.85Å; F191-L238 HydrophobicContact CG-CB 3.78Å; F191-L238 HydrophobicContact CG-CD2 4.22Å; F191-L238 HydrophobicContact CZ-CD1 4.49Å; F191-L238 HydrophobicContact CZ-CD2 4.28Å; L193-L238 PolarHBondContact O-N 3.43Å; L194-L238 CarbonylContact C-O 3.58Å; L194-L238 WeakPolarHBondContact CA-O 3.15Å; L194-L238 HydrophobicContact CD1-CD2 3.72Å; L194-L238 HydrophobicContact CG-CB 4.38Å; L194-L238 HydrophobicContact CG-CD2 3.9Å; L194-L238 HydrophobicContact CG-CG 4.22Å; I195-L238 PolarHBondContact N-O 3.21Å; L238-V240 HydrophobicContact CD2-CG2 4.09Å; L238-V240 HydrophobicContact CG-CG2 4.01Å; L238-S285 CarbonylContact C-O 3.58Å; L238-S285 WeakPolarHBondContact CA-O 3.27Å; L238-L287 HydrophobicContact CD1-CB 4.23Å
239	F	94.1	Very high	79.7	Confident	1 Å²	1	38 Å²	38	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	129.9	167.3	-67.7	-83	0	0	0	110.2	I195 F197 L212 L237 L275 L281 A284 S285 I286 L287	I195-F239 HydrophobicContact CB-CD1 3.9Å; I195-F239 HydrophobicContact CB-CE1 4.02Å; I195-F239 HydrophobicContact CD1-CD1 4.49Å; I195-F239 HydrophobicContact CD1-CE1 3.77Å; I195-F239 HydrophobicContact CD1-CZ 4.19Å; I195-F239 HydrophobicContact CG1-CE1 4.43Å; I195-F239 HydrophobicContact CG2-CD1 4.16Å; I195-F239 HydrophobicContact CG2-CE1 4.18Å; I195-F239 WeakPolarHBondContact O-CA 3.25Å; F197-F239 HydrophobicContact CD2-CD1 4.24Å; F197-F239 AromaticContact CE2-CD1 3.73Å; F197-F239 HydrophobicContact CE2-CD1 3.73Å; F197-F239 HydrophobicContact CE2-CE1 4.01Å; L212-F239 HydrophobicContact CD1-CE1 4.35Å; L212-F239 HydrophobicContact CD2-CZ 4.29Å; L237-F239 HydrophobicContact CB-CE2 4.49Å; F239-L275 HydrophobicContact CE2-CD2 4.29Å; F239-L281 HydrophobicContact CE2-CD1 3.76Å; F239-L281 HydrophobicContact CZ-CD1 3.8Å; F239-A284 HydrophobicContact CD2-CB 3.92Å; F239-A284 HydrophobicContact CE2-CB 3.85Å; F239-S285 PolarHBondContact N-O 2.92Å; F239-I286 CarbonylContact O-C 3.6Å; F239-I286 WeakPolarHBondContact O-CA 3.46Å; F239-L287 PolarHBondContact O-N 3.37Å
240	V	92.7	Very high	79.7	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	109.8	176.8	-176	0	0	0	0	109.4	V176 L194 I195 P196 F197 L238 L287	V176-V240 HydrophobicContact CG1-CG1 3.76Å; V176-V240 HydrophobicContact CG2-CG1 4.11Å; L194-V240 HydrophobicContact CD1-CG2 4.44Å; L194-V240 HydrophobicContact CD2-CG2 3.89Å; L194-V240 HydrophobicContact CG-CG2 4.14Å; I195-V240 PolarHBondContact O-N 2.82Å; P196-V240 CarbonylContact C-O 3.49Å; P196-V240 WeakPolarHBondContact CA-O 3.3Å; P196-V240 HydrophobicContact CB-CB 4.35Å; F197-V240 PolarHBondContact N-O 3.38Å; L238-V240 HydrophobicContact CD2-CG2 4.09Å; L238-V240 HydrophobicContact CG-CG2 4.01Å; V240-L287 CarbonylContact C-O 3.55Å; V240-L287 WeakPolarHBondContact CA-O 3.43Å; V240-L287 HydrophobicContact CG1-CB 4.4Å; V240-L287 HydrophobicContact CG1-CD2 4.12Å; V240-L287 HydrophobicContact CG1-CG 4.45Å; V240-L287 HydrophobicContact CG2-CB 4.31Å; V240-L287 HydrophobicContact CG2-CD2 4.48Å
241	L	91.7	Very high	79.7	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	107.6	-179.9	-55.4	-177.3	0	0	0	110	F197 I272 I286 L287 V288 T289	F197-L241 HydrophobicContact CB-CD2 3.96Å; F197-L241 HydrophobicContact CD2-CD2 3.97Å; F197-L241 HydrophobicContact CG-CD2 4.46Å; L241-I272 HydrophobicContact CD1-CD1 4.25Å; L241-I272 HydrophobicContact CD1-CG2 3.63Å; L241-I272 HydrophobicContact CD2-CD1 3.76Å; L241-I286 HydrophobicContact CD1-CG2 4.01Å; L241-I286 HydrophobicContact CG-CG2 4.28Å; L241-L287 PolarHBondContact N-O 3.09Å; L241-V288 HydrophobicContact CB-CG2 4.32Å; L241-V288 HydrophobicContact CD1-CG2 4.19Å; L241-V288 CarbonylContact O-C 3.53Å; L241-V288 WeakPolarHBondContact O-CA 3.45Å; L241-T289 PolarHBondContact O-N 3.5Å; L241-T289 PolarHBondContact O-OG1 3.2Å
242	H	85.1	Confident	79.4	Confident	47 Å²	47	35.6 Å²	35.6	22%	0.218	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.4	-176.4	-173.9	51.2	0	0	0	112.9	S173 F197 C199 T289	S173-H242 VanDerWaalsContact CA-CE1 3.45Å; S173-H242 WeakPolarHBondContact CA-CE1 3.37Å; S173-H242 WeakPolarHBondContact CB-NE2 3.48Å; S173-H242 PolarHBondContact OG-CE1 3.12Å; S173-H242 PolarHBondContact OG-NE2 3.29Å; F197-H242 PolarHBondContact O-N 3.49Å; C199-H242 WeakPolarHBondContact CB-O 3.49Å; C199-H242 PolarHBondContact N-O 2.83Å; H242-T289 WeakPolarHBondContact CA-OG1 3.3Å; H242-T289 PolarHBondContact ND1-OG1 3.05Å
243	G	76.6	Confident	79.2	Confident	9 Å²	9	33.3 Å²	33.3	9%	0.093	18%	0.183	C	C	.	.			trans	80	50.6	172.2	0	0	0	0	0	114	C199 E245 R246 T289	C199-G243 VanDerWaalsContact CB-O 3.27Å; C199-G243 WeakPolarHBondContact CB-O 3.09Å; G243-E245 VanDerWaalsContact C-OE2 3.25Å; G243-E245 PolarHBondContact O-N 3.32Å; G243-R246 WeakPolarHBondContact O-CB 3.07Å; G243-R246 PolarHBondContact O-N 3Å; G243-T289 WeakPolarHBondContact CA-O 3.5Å; G243-T289 PolarHBondContact N-O 3.23Å; G243-T289 PolarHBondContact N-OG1 3.46Å
244	L	82.2	Confident	78.4	Confident	1 Å²	1	35 Å²	35	1%	0.005	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-52.8	-28.3	-175.2	-166.4	79.7	0	0	0	113.9	R246 L247 L249 V288 T289 R297 I298	L244-R246 PolarHBondContact O-N 3.23Å; L244-L247 PolarHBondContact O-N 3.46Å; L244-L249 HydrophobicContact CD1-CD1 3.85Å; L244-L249 HydrophobicContact CG-CD1 4.49Å; L244-V288 HydrophobicContact CB-CG1 3.83Å; L244-V288 HydrophobicContact CD1-CG1 3.92Å; L244-V288 HydrophobicContact CD2-CG1 4.01Å; L244-V288 HydrophobicContact CG-CG1 4.13Å; L244-T289 PolarHBondContact N-O 2.82Å; L244-T289 VanDerWaalsContact N-O 3.09Å; L244-R297 HydrophobicContact CD2-CB 4.24Å; L244-I298 HydrophobicContact CD1-CD1 4.35Å; L244-I298 HydrophobicContact CD2-CD1 3.56Å; L244-I298 HydrophobicContact CD2-CG1 3.57Å
245	E	76.1	Confident	78.3	Confident	37 Å²	37	34.8 Å²	34.8	17%	0.173	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-58.4	-17.1	179	64.1	-88.7	-158.1	0	0	113.9	G243 T290 R291 A294 R297	G243-E245 VanDerWaalsContact C-OE2 3.25Å; G243-E245 PolarHBondContact O-N 3.32Å; E245-T290 WeakPolarHBondContact OE2-CA 3.12Å; E245-T290 PolarHBondContact OE2-OG1 2.74Å; E245-R291 HydrophobicContact CG-CG 4.18Å; E245-R291 WeakPolarHBondContact OE1-CG 3.33Å; E245-R291 IonicContact OE1-NE 3.77Å; E245-R291 PolarHBondContact OE1-NE 2.88Å; E245-R291 PolarHBondContact OE2-N 2.79Å; E245-A294 HydrophobicContact CB-CB 3.7Å; E245-R297 VanDerWaalsContact CA-NH1 3.32Å; E245-R297 PolarHBondContact O-NH1 3.28Å; E245-R297 PolarHBondContact O-NH2 2.76Å
246	R	72.8	Confident	78.2	Confident	98 Å²	98	34.5 Å²	34.5	37%	0.37	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-87.4	-12.9	176.8	-62.1	-64.4	-157.7	-172.7	2.8	114	E200 G243 L244	E200-R246 HydrophobicContact CB-CB 4.09Å; E200-R246 HydrophobicContact CB-CG 4.12Å; E200-R246 IonicContact OE1-CZ 2.96Å; E200-R246 IonicContact OE1-NE 3.81Å; E200-R246 PolarHBondContact OE1-NE 3.37Å; E200-R246 IonicContact OE1-NH2 3.75Å; E200-R246 IonicContact OE2-NE 3.38Å; G243-R246 WeakPolarHBondContact O-CB 3.07Å; G243-R246 PolarHBondContact O-N 3Å; L244-R246 PolarHBondContact O-N 3.23Å
247	L	72.6	Confident	77.7	Confident	7 Å²	7	32.4 Å²	32.4	4%	0.037	19%	0.194	C	C	.	.	S	Bend	trans	-110.6	137.3	-177.3	-168.7	64.4	0	0	0	110.4	C199 L202 L244 L249 A269 I272 R297	C199-L247 HydrophobicContact CB-CB 3.93Å; C199-L247 HydrophobicContact CB-CD2 4.48Å; L202-L247 HydrophobicContact CB-CD1 4.27Å; L202-L247 HydrophobicContact CD1-CD2 4.36Å; L244-L247 PolarHBondContact O-N 3.46Å; L247-L249 HydrophobicContact CD2-CD2 3.72Å; L247-L249 HydrophobicContact CG-CD2 3.9Å; L247-A269 HydrophobicContact CD1-CB 4.4Å; L247-I272 HydrophobicContact CD2-CB 4.29Å; L247-I272 HydrophobicContact CD2-CG1 3.97Å; L247-I272 HydrophobicContact CD2-CG2 4.34Å; L247-R297 PolarHBondContact O-NH1 3.47Å
248	N	77.8	Confident	77.2	Confident	119 Å²	119	36 Å²	36	64%	0.636	21%	0.213	S	C	*	.			trans	-94.8	123.9	174.6	-167.4	25.2	0	0	0	108.9	A269	N248-A269 VanDerWaalsContact O-CB 3.29Å; N248-A269 WeakPolarHBondContact O-CB 3.12Å
249	L	80.7	Confident	76.7	Confident	21 Å²	21	36 Å²	36	11%	0.11	21%	0.213	C	C	.	.			trans	-118.9	130.4	-176.5	-61.7	-177.9	0	0	0	109.8	L244 L247 F251 A269 I272 V273 L276 I298	L244-L249 HydrophobicContact CD1-CD1 3.85Å; L244-L249 HydrophobicContact CG-CD1 4.49Å; L247-L249 HydrophobicContact CD2-CD2 3.72Å; L247-L249 HydrophobicContact CG-CD2 3.9Å; L249-F251 HydrophobicContact CB-CD2 4.26Å; L249-F251 HydrophobicContact CB-CE2 3.71Å; L249-F251 HydrophobicContact CB-CZ 4.49Å; L249-F251 HydrophobicContact CD1-CE2 3.97Å; L249-F251 HydrophobicContact CD1-CZ 4.12Å; L249-A269 HydrophobicContact CD2-CB 4.38Å; L249-I272 HydrophobicContact CD1-CG2 4.37Å; L249-I272 HydrophobicContact CD2-CB 4.14Å; L249-I272 HydrophobicContact CD2-CG2 3.96Å; L249-V273 HydrophobicContact CB-CG2 4.01Å; L249-V273 HydrophobicContact CD2-CG2 4.01Å; L249-L276 HydrophobicContact CD1-CD1 3.95Å; L249-I298 HydrophobicContact CD1-CG1 4.49Å
250	D	74.2	Confident	76.2	Confident	44 Å²	44	39.2 Å²	39.2	24%	0.235	24%	0.235	C	C	.	.			trans	-112.8	107.3	175.3	-167.5	-11.6	0	0	0	110.5	R252 G255 T256	D250-R252 VanDerWaalsContact C-N 3.33Å; D250-R252 VanDerWaalsContact OD1-CB 3.31Å; D250-R252 WeakPolarHBondContact OD1-CB 3.45Å; D250-R252 WeakPolarHBondContact OD1-CG 3.39Å; D250-R252 IonicContact OD1-CZ 3.2Å; D250-R252 PolarHBondContact OD1-N 3.06Å; D250-R252 IonicContact OD1-NE 3.72Å; D250-R252 PolarHBondContact OD1-NE 2.76Å; D250-R252 IonicContact OD1-NH2 3.72Å; D250-R252 IonicContact OD2-CZ 3.3Å; D250-R252 IonicContact OD2-NE 2.67Å; D250-R252 PolarHBondContact OD2-NE 3.28Å; D250-R252 IonicContact OD2-NH2 3.43Å; D250-R252 PolarHBondContact OD2-NH2 2.96Å; D250-G255 WeakPolarHBondContact OD2-CA 3.3Å; D250-T256 WeakPolarHBondContact O-CB 3.22Å; D250-T256 PolarHBondContact O-OG1 3.41Å
251	F	73.5	Confident	75.8	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.009	25%	0.253	C	S	.	.			trans	-87.2	0.7	-179.4	-73.4	-90.7	0	0	0	113.9	L249 V273 L276 R277 R297 I298 P299 Y302	L249-F251 HydrophobicContact CB-CD2 4.26Å; L249-F251 HydrophobicContact CB-CE2 3.71Å; L249-F251 HydrophobicContact CB-CZ 4.49Å; L249-F251 HydrophobicContact CD1-CE2 3.97Å; L249-F251 HydrophobicContact CD1-CZ 4.12Å; F251-V273 HydrophobicContact CD1-CG1 3.91Å; F251-V273 HydrophobicContact CE1-CG1 4.16Å; F251-V273 HydrophobicContact CE1-CG2 4.46Å; F251-V273 HydrophobicContact CE2-CG2 4.49Å; F251-V273 HydrophobicContact CG-CG1 4.43Å; F251-V273 HydrophobicContact CZ-CG2 4.4Å; F251-L276 HydrophobicContact CE1-CB 4.1Å; F251-L276 HydrophobicContact CE1-CD1 4.37Å; F251-L276 HydrophobicContact CZ-CB 4.35Å; F251-L276 HydrophobicContact CZ-CD1 3.8Å; F251-R277 PolarHBondContact O-NH2 3.1Å; F251-R297 WeakPolarHBondContact CE2-O 3.36Å; F251-I298 HydrophobicContact CZ-CG2 4.17Å; F251-P299 HydrophobicContact CB-CG 4.2Å; F251-P299 HydrophobicContact CD1-CG 4.33Å; F251-P299 HydrophobicContact CD2-CG 4.06Å; F251-P299 HydrophobicContact CG-CG 3.94Å; F251-Y302 AromaticContact CD1-CD2 3.76Å; F251-Y302 HydrophobicContact CD1-CD2 3.76Å; F251-Y302 AromaticContact CD1-CE2 3.42Å; F251-Y302 HydrophobicContact CD1-CE2 3.42Å; F251-Y302 VanDerWaalsContact CD1-CE2 3.42Å; F251-Y302 AromaticContact CE1-CD2 3.71Å; F251-Y302 HydrophobicContact CE1-CD2 3.71Å; F251-Y302 AromaticContact CE1-CE2 3.87Å; F251-Y302 HydrophobicContact CE1-CE2 3.87Å; F251-Y302 HydrophobicContact CE1-CG 4.47Å; F251-Y302 HydrophobicContact CG-CE2 4.25Å
252	R	66.5	Low	75.5	Confident	50 Å²	50	43.6 Å²	43.6	19%	0.189	26%	0.26	C	S	.	.	S	Bend	trans	-75.6	139.8	177.5	-58.5	171.8	-58.1	139.8	8.7	109.6	D250 A254 G255 T256 R277 E602 R605	D250-R252 VanDerWaalsContact C-N 3.33Å; D250-R252 VanDerWaalsContact OD1-CB 3.31Å; D250-R252 WeakPolarHBondContact OD1-CB 3.45Å; D250-R252 WeakPolarHBondContact OD1-CG 3.39Å; D250-R252 IonicContact OD1-CZ 3.2Å; D250-R252 PolarHBondContact OD1-N 3.06Å; D250-R252 IonicContact OD1-NE 3.72Å; D250-R252 PolarHBondContact OD1-NE 2.76Å; D250-R252 IonicContact OD1-NH2 3.72Å; D250-R252 IonicContact OD2-CZ 3.3Å; D250-R252 IonicContact OD2-NE 2.67Å; D250-R252 PolarHBondContact OD2-NE 3.28Å; D250-R252 IonicContact OD2-NH2 3.43Å; D250-R252 PolarHBondContact OD2-NH2 2.96Å; R252-A254 PolarHBondContact O-N 2.85Å; R252-G255 PolarHBondContact O-N 3.23Å; R252-T256 PolarHBondContact O-N 2.95Å; R252-R277 PolarHBondContact O-NH2 2.92Å; R252-E602 HydrophobicContact CG-CG 4.4Å; R252-R605 VanDerWaalsContact CZ-NE 3.3Å
253	L	65.7	Low	75.5	Confident	45 Å²	45	46.9 Å²	46.9	24%	0.236	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-28.7	179.7	-71.2	169.6	0	0	0	111.9	G255 L258 S597 I598 L599	L253-G255 VanDerWaalsContact C-N 3.32Å; L253-L258 HydrophobicContact CD2-CD1 3.85Å; L253-L258 HydrophobicContact CD2-CD2 3.76Å; L253-L258 HydrophobicContact CD2-CG 3.57Å; L253-S597 WeakPolarHBondContact CD1-O 3.25Å; L253-I598 WeakPolarHBondContact CD1-O 3.37Å; L253-L599 PolarHBondContact N-O 2.93Å; L253-L599 VanDerWaalsContact N-O 3.11Å
254	A	54.5	Low	76	Confident	96 Å²	96	50.5 Å²	50.5	79%	0.793	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.5	172.9	0	0	0	0	0	113.9	R252	R252-A254 PolarHBondContact O-N 2.85Å
255	G	63.6	Low	76.4	Confident	41 Å²	41	53.7 Å²	53.7	42%	0.423	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-46.4	180	0	0	0	0	0	112.8	D250 R252 L253	D250-G255 WeakPolarHBondContact OD2-CA 3.3Å; R252-G255 PolarHBondContact O-N 3.23Å; L253-G255 VanDerWaalsContact C-N 3.32Å
256	T	75.2	Confident	77	Confident	11 Å²	11	54 Å²	54	7%	0.067	31%	0.312	C	S	.	.	S	Bend	trans	-121.1	111.4	176.5	-58.7	0	0	0	0	110.2	D250 R252 A270 V273 R277	D250-T256 WeakPolarHBondContact O-CB 3.22Å; D250-T256 PolarHBondContact O-OG1 3.41Å; R252-T256 PolarHBondContact O-N 2.95Å; T256-A270 HydrophobicContact CG2-CB 3.61Å; T256-V273 HydrophobicContact CG2-CB 3.96Å; T256-V273 HydrophobicContact CG2-CG1 3.79Å; T256-R277 PolarHBondContact O-NH1 2.84Å; T256-R277 PolarHBondContact O-NH2 3.43Å
257	G	72.2	Confident	77.7	Confident	40 Å²	40	53.7 Å²	53.7	41%	0.412	32%	0.315	S	S	.	.			trans	-61.5	155.6	174.2	0	0	0	0	0	112.9	C259 N274	G257-C259 PolarHBondContact O-N 3.34Å; G257-N274 PolarHBondContact O-ND2 3.49Å; G257-N274 PolarHBondContact O-OD1 3.05Å
258	L	80.9	Confident	78.4	Confident	84 Å²	84	53.5 Å²	53.5	44%	0.44	31%	0.314	S	S	.	.			trans	-80	113.2	175.8	-70.3	175.3	0	0	0	109.6	L253 Y279	L253-L258 HydrophobicContact CD2-CD1 3.85Å; L253-L258 HydrophobicContact CD2-CD2 3.76Å; L253-L258 HydrophobicContact CD2-CG 3.57Å; L258-Y279 VanDerWaalsContact C-CE1 3.42Å; L258-Y279 HydrophobicContact CB-CD1 3.86Å; L258-Y279 HydrophobicContact CB-CE1 3.5Å; L258-Y279 VanDerWaalsContact CB-CE1 3.5Å; L258-Y279 HydrophobicContact CB-CE2 4.26Å; L258-Y279 HydrophobicContact CB-CG 4.4Å; L258-Y279 HydrophobicContact CD1-CE2 4.26Å; L258-Y279 HydrophobicContact CD2-CD1 4.18Å; L258-Y279 HydrophobicContact CD2-CD2 4.08Å; L258-Y279 HydrophobicContact CD2-CE2 4.42Å; L258-Y279 HydrophobicContact CD2-CG 3.95Å
259	C	82.4	Confident	78.8	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.007	29%	0.288	C	S	.	.			trans	-125.3	115.3	178.2	178	0	0	0	0	110.1	G257 E266 N274 Y279 M280	G257-C259 PolarHBondContact O-N 3.34Å; C259-E266 HydrophobicContact CB-CG 3.93Å; C259-N274 PolarHBondContact N-OD1 2.82Å; C259-Y279 WeakPolarHBondContact O-CD1 3.48Å; C259-M280 HydrophobicContact CB-CE 4.37Å; C259-M280 WeakPolarHBondContact O-CE 3.46Å
260	S	83.5	Confident	79.1	Confident	68 Å²	68	47.7 Å²	47.7	48%	0.476	29%	0.286	S	S	.	.			trans	-97.1	-20	-179.5	56.7	0	0	0	0	112.8	P262 Y279	S260-P262 WeakPolarHBondContact O-CD 3.42Å; S260-Y279 WeakPolarHBondContact CA-O 3.46Å; S260-Y279 WeakPolarHBondContact CB-O 3.08Å
261	D	83.2	Confident	79.9	Confident	71 Å²	71	45.8 Å²	45.8	38%	0.38	28%	0.275	S	S	.	.			trans	-85.1	114.8	-175.6	-175.6	-2.9	0	0	0	110.8	E263 Q264 M280	D261-E263 PolarHBondContact O-N 3.1Å; D261-E263 WeakPolarHBondContact OD1-CB 3.45Å; D261-E263 PolarHBondContact OD1-N 3.26Å; D261-Q264 HydrophobicContact CB-CB 4.03Å; D261-Q264 PolarHBondContact O-N 3.48Å; D261-M280 WeakPolarHBondContact O-CE 3.42Å
262	P	85.3	Confident	80.8	Confident	24 Å²	24	45.8 Å²	45.8	16%	0.156	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-10.6	178.1	31	-37	0	0	0	114	S211 L212 C213 S260 M280	S211-P262 WeakPolarHBondContact CB-O 3.32Å; L212-P262 HydrophobicContact CB-CB 4.2Å; L212-P262 HydrophobicContact CD2-CB 4.12Å; L212-P262 PolarHBondContact N-O 3.32Å; L212-P262 VanDerWaalsContact N-O 3.09Å; C213-P262 PolarHBondContact N-O 3.43Å; S260-P262 WeakPolarHBondContact O-CD 3.42Å; P262-M280 HydrophobicContact CB-SD 4.43Å
263	E	86.6	Confident	81.9	Confident	116 Å²	116	43.4 Å²	43.4	54%	0.542	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-14.1	175.6	-60.3	-164.4	161.1	0	0	113.6	S211 C213 D261	S211-E263 WeakPolarHBondContact CB-O 3.42Å; S211-E263 PolarHBondContact OG-O 3.4Å; C213-E263 HydrophobicContact CB-CG 4.37Å; D261-E263 PolarHBondContact O-N 3.1Å; D261-E263 WeakPolarHBondContact OD1-CB 3.45Å; D261-E263 PolarHBondContact OD1-N 3.26Å
264	Q	87.2	Confident	82.9	Confident	85 Å²	85	41.3 Å²	41.3	40%	0.397	26%	0.256	S	S	.	.	S	Bend	trans	-72.5	130.5	177.3	-178.8	173.9	-24.2	0	0	111.1	S211 D261 E266	S211-Q264 WeakPolarHBondContact CA-O 3.48Å; S211-Q264 VanDerWaalsContact CB-O 3.26Å; S211-Q264 WeakPolarHBondContact CB-O 3.38Å; D261-Q264 HydrophobicContact CB-CB 4.03Å; D261-Q264 PolarHBondContact O-N 3.48Å; Q264-E266 PolarHBondContact NE2-OE1 3.43Å; Q264-E266 PolarHBondContact O-N 2.86Å
265	P	89.4	Confident	84.6	Confident	68 Å²	68	36.8 Å²	36.8	44%	0.442	22%	0.218	S	C	.	.			trans	-70.7	125.7	176.9	-17.6	31.6	0	0	0	112.1	P209	P209-P265 HydrophobicContact CB-CB 3.97Å
266	E	88.3	Confident	85.8	Confident	42 Å²	42	34.9 Å²	34.9	20%	0.196	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-138.7	167	178.2	-70.6	-64.7	162.9	0	0	109.9	P209 V210 C259 Q264 A270 I271	P209-E266 WeakPolarHBondContact CA-O 3.42Å; V210-E266 PolarHBondContact N-O 3.31Å; V210-E266 PolarHBondContact O-N 2.78Å; C259-E266 HydrophobicContact CB-CG 3.93Å; Q264-E266 PolarHBondContact NE2-OE1 3.43Å; Q264-E266 PolarHBondContact O-N 2.86Å; E266-A270 HydrophobicContact CB-CB 4.29Å; E266-I271 HydrophobicContact CB-CG1 3.91Å
267	E	88.4	Confident	86.3	Confident	92 Å²	92	35.7 Å²	35.7	43%	0.43	20%	0.2	S	C	.	.			trans	-62	140.9	170.6	-175.5	174.7	174	0	0	110.3	A269 A270 I271	E267-A269 HydrophobicContact CG-CB 4.35Å; E267-A269 PolarHBondContact O-N 3.23Å; E267-A269 VanDerWaalsContact O-N 3.13Å; E267-A270 HydrophobicContact CB-CB 4.03Å; E267-A270 WeakPolarHBondContact O-CA 3.39Å; E267-A270 VanDerWaalsContact O-CB 3.31Å; E267-A270 WeakPolarHBondContact O-CB 3.41Å; E267-A270 PolarHBondContact O-N 2.8Å; E267-I271 WeakPolarHBondContact O-CG1 3.43Å; E267-I271 PolarHBondContact O-N 3.47Å
268	P	88.3	Confident	87	Confident	4 Å²	4	35.6 Å²	35.6	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-51.4	-39.8	178.3	-29.4	35.4	0	0	0	113.8	L202 L205 V210 I271 I272	L202-P268 HydrophobicContact CB-CB 4.41Å; L205-P268 HydrophobicContact CB-CG 4.16Å; L205-P268 HydrophobicContact CD1-CG 4.38Å; V210-P268 HydrophobicContact CG1-CG 4.14Å; P268-I271 PolarHBondContact O-N 3.28Å; P268-I272 WeakPolarHBondContact O-CG1 3.38Å; P268-I272 PolarHBondContact O-N 2.97Å
269	A	85.9	Confident	87.2	Confident	11 Å²	11	36.5 Å²	36.5	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-41.4	173.8	0	0	0	0	0	112.5	L247 N248 L249 E267 I271 I272 V273	L247-A269 HydrophobicContact CD1-CB 4.4Å; N248-A269 VanDerWaalsContact O-CB 3.29Å; N248-A269 WeakPolarHBondContact O-CB 3.12Å; L249-A269 HydrophobicContact CD2-CB 4.38Å; E267-A269 HydrophobicContact CG-CB 4.35Å; E267-A269 PolarHBondContact O-N 3.23Å; E267-A269 VanDerWaalsContact O-N 3.13Å; A269-I271 PolarHBondContact O-N 3.19Å; A269-I272 PolarHBondContact O-N 2.88Å; A269-V273 WeakPolarHBondContact O-CG2 3.38Å; A269-V273 PolarHBondContact O-N 3.06Å
270	A	86.8	Confident	87.2	Confident	7 Å²	7	36.4 Å²	36.4	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-65.3	-36.4	177.4	0	0	0	0	0	112.7	T256 E266 E267 V273 N274	T256-A270 HydrophobicContact CG2-CB 3.61Å; E266-A270 HydrophobicContact CB-CB 4.29Å; E267-A270 HydrophobicContact CB-CB 4.03Å; E267-A270 WeakPolarHBondContact O-CA 3.39Å; E267-A270 VanDerWaalsContact O-CB 3.31Å; E267-A270 WeakPolarHBondContact O-CB 3.41Å; E267-A270 PolarHBondContact O-N 2.8Å; A270-V273 PolarHBondContact O-N 3.29Å; A270-N274 WeakPolarHBondContact O-CB 3.42Å; A270-N274 PolarHBondContact O-N 3Å; A270-N274 PolarHBondContact O-ND2 3.01Å
271	I	91	Very high	87.4	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-48.3	172.8	-60.5	168.4	0	0	0	110	V210 L212 L215 E266 E267 P268 A269 V273 N274 L275 M280	V210-I271 HydrophobicContact CG1-CD1 4.14Å; V210-I271 WeakPolarHBondContact O-CD1 3.32Å; L212-I271 HydrophobicContact CB-CG2 3.98Å; L212-I271 HydrophobicContact CD1-CG2 3.91Å; L212-I271 HydrophobicContact CG-CG2 4.39Å; L215-I271 HydrophobicContact CD1-CD1 4.25Å; E266-I271 HydrophobicContact CB-CG1 3.91Å; E267-I271 WeakPolarHBondContact O-CG1 3.43Å; E267-I271 PolarHBondContact O-N 3.47Å; P268-I271 PolarHBondContact O-N 3.28Å; A269-I271 PolarHBondContact O-N 3.19Å; I271-V273 PolarHBondContact O-N 2.75Å; I271-N274 PolarHBondContact O-N 3.34Å; I271-L275 HydrophobicContact CG2-CD1 4.1Å; I271-L275 WeakPolarHBondContact O-CG 3.35Å; I271-L275 PolarHBondContact O-N 2.83Å; I271-M280 HydrophobicContact CG2-SD 4.14Å
272	I	92.1	Very high	87.4	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.015	17%	0.173	C	C	.	.	H	α-helix	trans	-62.9	-42.2	179	-62.6	-49.4	0	0	0	111.4	L202 L241 L247 L249 P268 A269 N274 L275 L276	L202-I272 HydrophobicContact CD1-CD1 3.86Å; L202-I272 HydrophobicContact CD1-CG1 3.84Å; L241-I272 HydrophobicContact CD1-CD1 4.25Å; L241-I272 HydrophobicContact CD1-CG2 3.63Å; L241-I272 HydrophobicContact CD2-CD1 3.76Å; L247-I272 HydrophobicContact CD2-CB 4.29Å; L247-I272 HydrophobicContact CD2-CG1 3.97Å; L247-I272 HydrophobicContact CD2-CG2 4.34Å; L249-I272 HydrophobicContact CD1-CG2 4.37Å; L249-I272 HydrophobicContact CD2-CB 4.14Å; L249-I272 HydrophobicContact CD2-CG2 3.96Å; P268-I272 WeakPolarHBondContact O-CG1 3.38Å; P268-I272 PolarHBondContact O-N 2.97Å; A269-I272 PolarHBondContact O-N 2.88Å; I272-N274 PolarHBondContact O-N 3.46Å; I272-L275 HydrophobicContact CD1-CD1 4.2Å; I272-L275 PolarHBondContact O-N 3.4Å; I272-L276 HydrophobicContact CG2-CD1 3.84Å; I272-L276 HydrophobicContact CG2-CG 4.34Å; I272-L276 WeakPolarHBondContact O-CB 3.49Å; I272-L276 VanDerWaalsContact O-CG 3.3Å; I272-L276 WeakPolarHBondContact O-CG 3.21Å; I272-L276 PolarHBondContact O-N 3.11Å
273	V	88.4	Confident	87.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-45.5	174.9	168.8	0	0	0	0	111.2	L249 F251 T256 A269 A270 I271 L275 L276 R277	L249-V273 HydrophobicContact CB-CG2 4.01Å; L249-V273 HydrophobicContact CD2-CG2 4.01Å; F251-V273 HydrophobicContact CD1-CG1 3.91Å; F251-V273 HydrophobicContact CE1-CG1 4.16Å; F251-V273 HydrophobicContact CE1-CG2 4.46Å; F251-V273 HydrophobicContact CE2-CG2 4.49Å; F251-V273 HydrophobicContact CG-CG1 4.43Å; F251-V273 HydrophobicContact CZ-CG2 4.4Å; T256-V273 HydrophobicContact CG2-CB 3.96Å; T256-V273 HydrophobicContact CG2-CG1 3.79Å; A269-V273 WeakPolarHBondContact O-CG2 3.38Å; A269-V273 PolarHBondContact O-N 3.06Å; A270-V273 PolarHBondContact O-N 3.29Å; I271-V273 PolarHBondContact O-N 2.75Å; V273-L275 PolarHBondContact O-N 3.41Å; V273-L276 PolarHBondContact O-N 2.98Å; V273-R277 HydrophobicContact CG1-CG 4.29Å; V273-R277 WeakPolarHBondContact O-CB 3.49Å; V273-R277 VanDerWaalsContact O-CG 3.28Å; V273-R277 WeakPolarHBondContact O-CG 3.32Å; V273-R277 PolarHBondContact O-N 3.04Å
274	N	87.8	Confident	87.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-68.9	-31.8	-179.9	-78.9	-61.6	0	0	0	113.1	G257 C259 A270 I271 I272 K278 Y279 M280	G257-N274 PolarHBondContact O-ND2 3.49Å; G257-N274 PolarHBondContact O-OD1 3.05Å; C259-N274 PolarHBondContact N-OD1 2.82Å; A270-N274 WeakPolarHBondContact O-CB 3.42Å; A270-N274 PolarHBondContact O-N 3Å; A270-N274 PolarHBondContact O-ND2 3.01Å; I271-N274 PolarHBondContact O-N 3.34Å; I272-N274 PolarHBondContact O-N 3.46Å; N274-K278 PolarHBondContact O-N 3.09Å; N274-Y279 PolarHBondContact O-N 3.45Å; N274-M280 HydrophobicContact CB-CB 4.04Å; N274-M280 PolarHBondContact O-N 3Å
275	L	90.6	Very high	87.8	Confident	2 Å²	2	28 Å²	28	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-45.9	168.7	-73.6	170.3	0	0	0	111.7	L212 F239 I271 I272 V273 R277 K278 M280 L281 I286	L212-L275 HydrophobicContact CD1-CD1 4.29Å; L212-L275 HydrophobicContact CD2-CD1 4.41Å; L212-L275 HydrophobicContact CD2-CD2 4.07Å; F239-L275 HydrophobicContact CE2-CD2 4.29Å; I271-L275 HydrophobicContact CG2-CD1 4.1Å; I271-L275 WeakPolarHBondContact O-CG 3.35Å; I271-L275 PolarHBondContact O-N 2.83Å; I272-L275 HydrophobicContact CD1-CD1 4.2Å; I272-L275 PolarHBondContact O-N 3.4Å; V273-L275 PolarHBondContact O-N 3.41Å; L275-R277 VanDerWaalsContact C-N 3.35Å; L275-R277 PolarHBondContact O-N 3.05Å; L275-K278 PolarHBondContact O-N 2.74Å; L275-M280 HydrophobicContact CD2-CB 4.25Å; L275-M280 HydrophobicContact CD2-CG 4.11Å; L275-M280 HydrophobicContact CD2-SD 4.34Å; L275-M280 HydrophobicContact CG-SD 4.4Å; L275-L281 HydrophobicContact CD2-CB 4.08Å; L275-L281 HydrophobicContact CD2-CD1 4.08Å; L275-L281 HydrophobicContact CD2-CG 4.31Å; L275-I286 HydrophobicContact CB-CD1 4.01Å; L275-I286 VanDerWaalsContact O-CD1 3.25Å; L275-I286 WeakPolarHBondContact O-CD1 3.36Å
276	L	88.2	Confident	88.1	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-66.6	-35.5	178.7	-72.4	170.1	0	0	0	112.4	T161 L249 F251 I272 V273 K278 I286 V288 I298	T161-L276 HydrophobicContact CG2-CD2 4.03Å; L249-L276 HydrophobicContact CD1-CD1 3.95Å; F251-L276 HydrophobicContact CE1-CB 4.1Å; F251-L276 HydrophobicContact CE1-CD1 4.37Å; F251-L276 HydrophobicContact CZ-CB 4.35Å; F251-L276 HydrophobicContact CZ-CD1 3.8Å; I272-L276 HydrophobicContact CG2-CD1 3.84Å; I272-L276 HydrophobicContact CG2-CG 4.34Å; I272-L276 WeakPolarHBondContact O-CB 3.49Å; I272-L276 VanDerWaalsContact O-CG 3.3Å; I272-L276 WeakPolarHBondContact O-CG 3.21Å; I272-L276 PolarHBondContact O-N 3.11Å; V273-L276 PolarHBondContact O-N 2.98Å; L276-K278 PolarHBondContact O-N 2.73Å; L276-I286 HydrophobicContact CD2-CD1 4.13Å; L276-I286 HydrophobicContact CD2-CG2 3.99Å; L276-V288 HydrophobicContact CD2-CG2 4.27Å; L276-I298 HydrophobicContact CD1-CD1 3.91Å; L276-I298 HydrophobicContact CD1-CG1 4.24Å; L276-I298 HydrophobicContact CD2-CD1 4.21Å
277	R	85.7	Confident	88.4	Confident	27 Å²	27	23 Å²	23	10%	0.102	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.3	170.9	-75.4	174	176.6	165.5	-2.4	113.2	F251 R252 T256 V273 L275 Y279 Y302	F251-R277 PolarHBondContact O-NH2 3.1Å; R252-R277 PolarHBondContact O-NH2 2.92Å; T256-R277 PolarHBondContact O-NH1 2.84Å; T256-R277 PolarHBondContact O-NH2 3.43Å; V273-R277 HydrophobicContact CG1-CG 4.29Å; V273-R277 WeakPolarHBondContact O-CB 3.49Å; V273-R277 VanDerWaalsContact O-CG 3.28Å; V273-R277 WeakPolarHBondContact O-CG 3.32Å; V273-R277 PolarHBondContact O-N 3.04Å; L275-R277 VanDerWaalsContact C-N 3.35Å; L275-R277 PolarHBondContact O-N 3.05Å; R277-Y279 PolarHBondContact O-N 2.91Å; R277-Y302 HydrophobicContact CB-CE1 4.19Å; R277-Y302 HydrophobicContact CG-CE1 3.8Å
278	K	87.1	Confident	88.6	Confident	39 Å²	39	18.7 Å²	18.7	17%	0.17	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	19.5	-167.6	-54.6	-60.5	-176.8	-171.1	0	113.2	Q160 T161 N274 L275 L276 P282 A284	Q160-K278 PolarHBondContact O-NZ 2.63Å; T161-K278 VanDerWaalsContact OG1-CE 3.26Å; T161-K278 WeakPolarHBondContact OG1-CE 3.33Å; T161-K278 PolarHBondContact OG1-NZ 3.43Å; N274-K278 PolarHBondContact O-N 3.09Å; L275-K278 PolarHBondContact O-N 2.74Å; L276-K278 PolarHBondContact O-N 2.73Å; K278-P282 HydrophobicContact CB-CB 4.44Å; K278-P282 WeakPolarHBondContact O-CB 3.42Å; K278-A284 PolarHBondContact NZ-O 3.3Å
279	Y	84.2	Confident	88.7	Confident	102 Å²	102	18.6 Å²	18.6	40%	0.4	9%	0.092	S	C	.	.	S	Bend	trans	-79.4	-34.7	175.9	-165.5	-100.8	0	0	0	110.7	L258 C259 S260 N274 R277	L258-Y279 VanDerWaalsContact C-CE1 3.42Å; L258-Y279 HydrophobicContact CB-CD1 3.86Å; L258-Y279 HydrophobicContact CB-CE1 3.5Å; L258-Y279 VanDerWaalsContact CB-CE1 3.5Å; L258-Y279 HydrophobicContact CB-CE2 4.26Å; L258-Y279 HydrophobicContact CB-CG 4.4Å; L258-Y279 HydrophobicContact CD1-CE2 4.26Å; L258-Y279 HydrophobicContact CD2-CD1 4.18Å; L258-Y279 HydrophobicContact CD2-CD2 4.08Å; L258-Y279 HydrophobicContact CD2-CE2 4.42Å; L258-Y279 HydrophobicContact CD2-CG 3.95Å; C259-Y279 WeakPolarHBondContact O-CD1 3.48Å; S260-Y279 WeakPolarHBondContact CA-O 3.46Å; S260-Y279 WeakPolarHBondContact CB-O 3.08Å; N274-Y279 PolarHBondContact O-N 3.45Å; R277-Y279 PolarHBondContact O-N 2.91Å
280	M	84.3	Confident	88.6	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.088	C	C	.	.	S	Bend	trans	-100.5	129.1	165.9	-172.1	178.7	-69.7	0	0	108.9	L212 C259 D261 P262 I271 N274 L275	L212-M280 HydrophobicContact CB-SD 4.03Å; L212-M280 HydrophobicContact CD2-CG 4.44Å; L212-M280 HydrophobicContact CD2-SD 3.72Å; L212-M280 HydrophobicContact CG-SD 4.49Å; C259-M280 HydrophobicContact CB-CE 4.37Å; C259-M280 WeakPolarHBondContact O-CE 3.46Å; D261-M280 WeakPolarHBondContact O-CE 3.42Å; P262-M280 HydrophobicContact CB-SD 4.43Å; I271-M280 HydrophobicContact CG2-SD 4.14Å; N274-M280 HydrophobicContact CB-CB 4.04Å; N274-M280 PolarHBondContact O-N 3Å; L275-M280 HydrophobicContact CD2-CB 4.25Å; L275-M280 HydrophobicContact CD2-CG 4.11Å; L275-M280 HydrophobicContact CD2-SD 4.34Å; L275-M280 HydrophobicContact CG-SD 4.4Å
281	L	86.3	Confident	88	Confident	22 Å²	22	20.8 Å²	20.8	12%	0.115	10%	0.097	C	C	.	.	S	Bend	trans	50.2	67.1	179.3	-57.3	179.6	0	0	0	114.3	L212 A231 L237 F239 L275 E283 A284	L212-L281 HydrophobicContact CD2-CD1 3.63Å; L212-L281 HydrophobicContact CD2-CG 4.46Å; A231-L281 HydrophobicContact CB-CD2 3.51Å; L237-L281 HydrophobicContact CD1-CD1 4.33Å; F239-L281 HydrophobicContact CE2-CD1 3.76Å; F239-L281 HydrophobicContact CZ-CD1 3.8Å; L275-L281 HydrophobicContact CD2-CB 4.08Å; L275-L281 HydrophobicContact CD2-CD1 4.08Å; L275-L281 HydrophobicContact CD2-CG 4.31Å; L281-E283 VanDerWaalsContact C-N 3.26Å; L281-E283 PolarHBondContact O-N 3.2Å; L281-E283 VanDerWaalsContact O-N 3.17Å; L281-A284 HydrophobicContact CB-CB 3.98Å; L281-A284 VanDerWaalsContact O-CB 3.3Å; L281-A284 WeakPolarHBondContact O-CB 3.28Å; L281-A284 PolarHBondContact O-N 2.78Å
282	P	84.2	Confident	87.1	Confident	71 Å²	71	22.5 Å²	22.5	46%	0.461	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.2	-173.6	21.9	-33.4	0	0	0	114.5	Q160 K278 A284	Q160-P282 PolarHBondContact NE2-O 2.93Å; Q160-P282 PolarHBondContact OE1-O 2.83Å; K278-P282 HydrophobicContact CB-CB 4.44Å; K278-P282 WeakPolarHBondContact O-CB 3.42Å; P282-A284 VanDerWaalsContact C-N 3.29Å; P282-A284 PolarHBondContact O-N 2.85Å
283	E	85.3	Confident	85.6	Confident	89 Å²	89	24.7 Å²	24.7	42%	0.416	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-8.1	-179.9	-67.3	-58.3	145.5	0	0	114	R158 L281	R158-E283 IonicContact CZ-OE2 2.64Å; R158-E283 IonicContact NH1-OE2 3.58Å; R158-E283 PolarHBondContact NH1-OE2 2.79Å; R158-E283 IonicContact NH2-OE2 2.75Å; L281-E283 VanDerWaalsContact C-N 3.26Å; L281-E283 PolarHBondContact O-N 3.2Å; L281-E283 VanDerWaalsContact O-N 3.17Å
284	A	88.9	Confident	84.6	Confident	2 Å²	2	24.7 Å²	24.7	2%	0.017	13%	0.125	C	C	.	.			trans	-73	134.7	-177.6	0	0	0	0	0	111.4	L237 F239 K278 L281 P282	L237-A284 HydrophobicContact CB-CB 4.17Å; F239-A284 HydrophobicContact CD2-CB 3.92Å; F239-A284 HydrophobicContact CE2-CB 3.85Å; K278-A284 PolarHBondContact NZ-O 3.3Å; L281-A284 HydrophobicContact CB-CB 3.98Å; L281-A284 VanDerWaalsContact O-CB 3.3Å; L281-A284 WeakPolarHBondContact O-CB 3.28Å; L281-A284 PolarHBondContact O-N 2.78Å; P282-A284 VanDerWaalsContact C-N 3.29Å; P282-A284 PolarHBondContact O-N 2.85Å
285	S	92.9	Very high	83.8	Confident	4 Å²	4	25.8 Å²	25.8	3%	0.028	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	142.4	169.2	-60.1	0	0	0	0	110	Q160 L237 L238 F239	Q160-S285 CarbonylContact O-C 3.59Å; Q160-S285 VanDerWaalsContact O-CA 3.24Å; Q160-S285 WeakPolarHBondContact O-CA 3.46Å; L237-S285 PolarHBondContact O-N 3.04Å; L238-S285 CarbonylContact C-O 3.58Å; L238-S285 WeakPolarHBondContact CA-O 3.27Å; F239-S285 PolarHBondContact N-O 2.92Å
286	I	94.6	Very high	82.8	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.3	-177.9	-56.6	174	0	0	0	108.4	Q160 T161 V162 F239 L241 L275 L276 V288	Q160-I286 PolarHBondContact O-N 3.42Å; T161-I286 CarbonylContact C-O 3.57Å; T161-I286 VanDerWaalsContact CA-O 3.32Å; T161-I286 WeakPolarHBondContact CA-O 3.42Å; T161-I286 HydrophobicContact CG2-CB 4.33Å; V162-I286 PolarHBondContact N-O 3.45Å; F239-I286 CarbonylContact O-C 3.6Å; F239-I286 WeakPolarHBondContact O-CA 3.46Å; L241-I286 HydrophobicContact CD1-CG2 4.01Å; L241-I286 HydrophobicContact CG-CG2 4.28Å; L275-I286 HydrophobicContact CB-CD1 4.01Å; L275-I286 VanDerWaalsContact O-CD1 3.25Å; L275-I286 WeakPolarHBondContact O-CD1 3.36Å; L276-I286 HydrophobicContact CD2-CD1 4.13Å; L276-I286 HydrophobicContact CD2-CG2 3.99Å; I286-V288 HydrophobicContact CG2-CG2 3.91Å
287	L	95	Very high	82	Confident	3 Å²	3	29.7 Å²	29.7	2%	0.016	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124.3	168.4	-179.2	64.7	0	0	0	108.7	L149 F150 V162 L164 M179 L238 F239 V240 L241	L149-L287 HydrophobicContact CD1-CD1 4.42Å; F150-L287 HydrophobicContact CZ-CB 4.07Å; V162-L287 HydrophobicContact CB-CD1 3.83Å; V162-L287 HydrophobicContact CG1-CD1 3.77Å; V162-L287 CarbonylContact O-C 3.48Å; V162-L287 WeakPolarHBondContact O-CA 3.49Å; L164-L287 HydrophobicContact CD1-CD1 3.81Å; L164-L287 HydrophobicContact CD1-CD2 4.49Å; L164-L287 HydrophobicContact CG-CD1 3.82Å; M179-L287 HydrophobicContact CE-CD2 4.11Å; M179-L287 HydrophobicContact SD-CD2 3.32Å; M179-L287 WeakPolarHBondContact SD-CD2 3.35Å; L238-L287 HydrophobicContact CD1-CB 4.23Å; F239-L287 PolarHBondContact O-N 3.37Å; V240-L287 CarbonylContact C-O 3.55Å; V240-L287 WeakPolarHBondContact CA-O 3.43Å; V240-L287 HydrophobicContact CG1-CB 4.4Å; V240-L287 HydrophobicContact CG1-CD2 4.12Å; V240-L287 HydrophobicContact CG1-CG 4.45Å; V240-L287 HydrophobicContact CG2-CB 4.31Å; V240-L287 HydrophobicContact CG2-CD2 4.48Å; L241-L287 PolarHBondContact N-O 3.09Å
288	V	94.1	Very high	81.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.7	175	-174.3	0	0	0	0	109	V162 V163 L164 L241 L244 L276 I286 I298	V162-V288 PolarHBondContact O-N 3.46Å; V163-V288 HydrophobicContact CG2-CB 4.14Å; V163-V288 HydrophobicContact CG2-CG2 4.46Å; L164-V288 PolarHBondContact N-O 2.91Å; L241-V288 HydrophobicContact CB-CG2 4.32Å; L241-V288 HydrophobicContact CD1-CG2 4.19Å; L241-V288 CarbonylContact O-C 3.53Å; L241-V288 WeakPolarHBondContact O-CA 3.45Å; L244-V288 HydrophobicContact CB-CG1 3.83Å; L244-V288 HydrophobicContact CD1-CG1 3.92Å; L244-V288 HydrophobicContact CD2-CG1 4.01Å; L244-V288 HydrophobicContact CG-CG1 4.13Å; L276-V288 HydrophobicContact CD2-CG2 4.27Å; I286-V288 HydrophobicContact CG2-CG2 3.91Å; V288-I298 HydrophobicContact CB-CD1 4.4Å; V288-I298 HydrophobicContact CG1-CD1 4.07Å; V288-I298 HydrophobicContact CG2-CD1 3.97Å
289	T	90.1	Very high	81.3	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.012	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	133.2	168	60.6	0	0	0	0	110.9	L164 V176 L241 H242 G243 L244	L164-T289 HydrophobicContact CB-CG2 4.25Å; L164-T289 CarbonylContact O-C 3.58Å; L164-T289 VanDerWaalsContact O-CA 3.23Å; L164-T289 WeakPolarHBondContact O-CA 3.36Å; V176-T289 HydrophobicContact CG2-CG2 3.51Å; L241-T289 PolarHBondContact O-N 3.5Å; L241-T289 PolarHBondContact O-OG1 3.2Å; H242-T289 WeakPolarHBondContact CA-OG1 3.3Å; H242-T289 PolarHBondContact ND1-OG1 3.05Å; G243-T289 WeakPolarHBondContact CA-O 3.5Å; G243-T289 PolarHBondContact N-O 3.23Å; G243-T289 PolarHBondContact N-OG1 3.46Å; L244-T289 PolarHBondContact N-O 2.82Å; L244-T289 VanDerWaalsContact N-O 3.09Å
290	T	82.3	Confident	81	Confident	1 Å²	1	25 Å²	25	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	174.1	-178.2	-162.9	0	0	0	0	114.1	V163 L164 Y165 G166 K172 E245 A294 I295	V163-T290 HydrophobicContact CG1-CG2 4.12Å; L164-T290 PolarHBondContact O-N 3.32Å; Y165-T290 VanDerWaalsContact CA-O 3.27Å; Y165-T290 WeakPolarHBondContact CA-O 3.44Å; G166-T290 PolarHBondContact N-O 3.32Å; K172-T290 WeakPolarHBondContact CD-O 3.44Å; K172-T290 WeakPolarHBondContact CE-O 3.38Å; E245-T290 WeakPolarHBondContact OE2-CA 3.12Å; E245-T290 PolarHBondContact OE2-OG1 2.74Å; T290-A294 VanDerWaalsContact OG1-CB 3.28Å; T290-A294 WeakPolarHBondContact OG1-CB 3.23Å; T290-I295 HydrophobicContact CG2-CG1 4.41Å
291	R	74.5	Confident	80.7	Confident	63 Å²	63	30 Å²	30	24%	0.238	17%	0.168	C	C	.	.			trans	-79.8	156.6	171.3	-68.6	178.3	-174.5	-151.1	-2.1	110.7	E245 S293 A294 I295	E245-R291 HydrophobicContact CG-CG 4.18Å; E245-R291 WeakPolarHBondContact OE1-CG 3.33Å; E245-R291 IonicContact OE1-NE 3.77Å; E245-R291 PolarHBondContact OE1-NE 2.88Å; E245-R291 PolarHBondContact OE2-N 2.79Å; R291-S293 PolarHBondContact O-N 3.39Å; R291-A294 PolarHBondContact O-N 3.46Å; R291-I295 PolarHBondContact O-N 2.83Å
292	S	71.4	Confident	80.6	Confident	40 Å²	40	31 Å²	31	28%	0.28	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-57	-34.8	176.3	-53.4	0	0	0	0	112.9	A294 I295	S292-A294 VanDerWaalsContact C-N 3.27Å; S292-A294 PolarHBondContact O-N 2.92Å; S292-I295 WeakPolarHBondContact O-CD1 3.36Å; S292-I295 VanDerWaalsContact O-CG1 3.31Å; S292-I295 WeakPolarHBondContact O-CG1 3.26Å
293	S	62	Low	80.8	Confident	49 Å²	49	28.4 Å²	28.4	34%	0.343	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-68.8	-22.8	176.7	64.9	0	0	0	0	114.1	R291 E613	R291-S293 PolarHBondContact O-N 3.39Å; S293-E613 WeakPolarHBondContact CB-OE1 3.5Å; S293-E613 WeakPolarHBondContact CB-OE2 3.44Å; S293-E613 PolarHBondContact OG-OE2 2.99Å
294	A	66.2	Low	80.7	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-104.8	8.7	-174.7	0	0	0	0	0	114	E245 T290 R291 S292 G296 R297	E245-A294 HydrophobicContact CB-CB 3.7Å; T290-A294 VanDerWaalsContact OG1-CB 3.28Å; T290-A294 WeakPolarHBondContact OG1-CB 3.23Å; R291-A294 PolarHBondContact O-N 3.46Å; S292-A294 VanDerWaalsContact C-N 3.27Å; S292-A294 PolarHBondContact O-N 2.92Å; A294-G296 VanDerWaalsContact C-N 3.32Å; A294-G296 PolarHBondContact O-N 3.32Å; A294-R297 HydrophobicContact CB-CG 4.38Å; A294-R297 WeakPolarHBondContact O-CB 3.36Å; A294-R297 WeakPolarHBondContact O-CG 3.34Å; A294-R297 PolarHBondContact O-N 3.46Å
295	I	72.2	Confident	80.7	Confident	22 Å²	22	26.9 Å²	26.9	11%	0.113	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-58.8	-43.9	178.6	-61.6	170.2	0	0	0	111.2	L123 Y165 T290 R291 S292 R297 Y306	L123-I295 HydrophobicContact CD1-CG2 4.42Å; L123-I295 HydrophobicContact CD2-CD1 4.01Å; Y165-I295 HydrophobicContact CD1-CD1 3.75Å; Y165-I295 HydrophobicContact CD1-CG1 4.16Å; Y165-I295 HydrophobicContact CD2-CD1 3.31Å; Y165-I295 HydrophobicContact CD2-CG1 4.1Å; Y165-I295 HydrophobicContact CE1-CD1 4.02Å; Y165-I295 HydrophobicContact CE2-CD1 3.61Å; Y165-I295 HydrophobicContact CG-CD1 3.36Å; Y165-I295 HydrophobicContact CG-CG1 3.73Å; T290-I295 HydrophobicContact CG2-CG1 4.41Å; R291-I295 PolarHBondContact O-N 2.83Å; S292-I295 WeakPolarHBondContact O-CD1 3.36Å; S292-I295 VanDerWaalsContact O-CG1 3.31Å; S292-I295 WeakPolarHBondContact O-CG1 3.26Å; I295-R297 PolarHBondContact O-N 2.89Å; I295-Y306 HydrophobicContact CG2-CD1 4.11Å; I295-Y306 HydrophobicContact CG2-CE1 3.77Å
296	G	68.9	Low	80.5	Confident	34 Å²	34	27.1 Å²	27.1	35%	0.351	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-68.4	-2.7	-176.5	0	0	0	0	0	115.2	A294 I298 P604	A294-G296 VanDerWaalsContact C-N 3.32Å; A294-G296 PolarHBondContact O-N 3.32Å; G296-I298 VanDerWaalsContact C-N 3.31Å; G296-I298 PolarHBondContact O-N 3.45Å; G296-P604 WeakPolarHBondContact O-CD 3.49Å
297	R	72.5	Confident	80.1	Confident	52 Å²	52	27.2 Å²	27.2	20%	0.196	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-72.2	-23	180	-66.8	-169.2	-174.7	-174.9	9.8	113.8	L244 E245 L247 F251 A294 I295	L244-R297 HydrophobicContact CD2-CB 4.24Å; E245-R297 VanDerWaalsContact CA-NH1 3.32Å; E245-R297 PolarHBondContact O-NH1 3.28Å; E245-R297 PolarHBondContact O-NH2 2.76Å; L247-R297 PolarHBondContact O-NH1 3.47Å; F251-R297 WeakPolarHBondContact CE2-O 3.36Å; A294-R297 HydrophobicContact CB-CG 4.38Å; A294-R297 WeakPolarHBondContact O-CB 3.36Å; A294-R297 WeakPolarHBondContact O-CG 3.34Å; A294-R297 PolarHBondContact O-N 3.46Å; I295-R297 PolarHBondContact O-N 2.89Å
298	I	79.3	Confident	79.7	Confident	3 Å²	3	29 Å²	29	2%	0.015	17%	0.166	C	C	.	.	S	Bend	trans	-104.4	119.6	172.5	-55.7	178.6	0	0	0	107.1	V163 L244 L249 F251 L276 V288 G296 S300 V303	V163-I298 HydrophobicContact CG2-CD1 4.26Å; L244-I298 HydrophobicContact CD1-CD1 4.35Å; L244-I298 HydrophobicContact CD2-CD1 3.56Å; L244-I298 HydrophobicContact CD2-CG1 3.57Å; L249-I298 HydrophobicContact CD1-CG1 4.49Å; F251-I298 HydrophobicContact CZ-CG2 4.17Å; L276-I298 HydrophobicContact CD1-CD1 3.91Å; L276-I298 HydrophobicContact CD1-CG1 4.24Å; L276-I298 HydrophobicContact CD2-CD1 4.21Å; V288-I298 HydrophobicContact CB-CD1 4.4Å; V288-I298 HydrophobicContact CG1-CD1 4.07Å; V288-I298 HydrophobicContact CG2-CD1 3.97Å; G296-I298 VanDerWaalsContact C-N 3.31Å; G296-I298 PolarHBondContact O-N 3.45Å; I298-S300 PolarHBondContact O-N 2.94Å; I298-V303 HydrophobicContact CB-CG2 4.17Å; I298-V303 HydrophobicContact CG2-CG2 3.64Å
299	P	78.1	Confident	79.1	Confident	14 Å²	14	29.1 Å²	29.1	9%	0.091	17%	0.167	C	C	.	.			trans	-54.2	132.8	173.8	-25.8	33.2	0	0	0	111	F251 K301 Y302 V601	F251-P299 HydrophobicContact CB-CG 4.2Å; F251-P299 HydrophobicContact CD1-CG 4.33Å; F251-P299 HydrophobicContact CD2-CG 4.06Å; F251-P299 HydrophobicContact CG-CG 3.94Å; P299-K301 HydrophobicContact CB-CG 4.12Å; P299-K301 PolarHBondContact O-N 2.99Å; P299-Y302 HydrophobicContact CB-CD2 3.77Å; P299-Y302 HydrophobicContact CB-CE2 4.01Å; P299-Y302 HydrophobicContact CG-CD2 3.94Å; P299-Y302 HydrophobicContact CG-CE2 3.97Å; P299-Y302 PolarHBondContact O-N 3.07Å; P299-V601 HydrophobicContact CB-CG1 4.31Å
300	S	78.6	Confident	78.4	Confident	51 Å²	51	29.6 Å²	29.6	36%	0.357	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-55.8	-29.7	-173.8	54.5	0	0	0	0	113.6	I298 Y302 V303 Y306	I298-S300 PolarHBondContact O-N 2.94Å; S300-Y302 PolarHBondContact O-N 3.23Å; S300-Y302 VanDerWaalsContact O-N 3.1Å; S300-V303 PolarHBondContact O-N 2.93Å; S300-V303 VanDerWaalsContact O-O 3.1Å; S300-Y306 WeakPolarHBondContact CA-OH 3.44Å
301	K	78.1	Confident	78.1	Confident	107 Å²	107	29.5 Å²	29.5	47%	0.465	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-58.9	-20.4	174.1	67.4	174.1	-176.6	166.6	0	115.2	P299 V601	P299-K301 HydrophobicContact CB-CG 4.12Å; P299-K301 PolarHBondContact O-N 2.99Å; K301-V601 HydrophobicContact CD-CG2 4.04Å; K301-V601 VanDerWaalsContact CE-CG2 3.41Å
302	Y	84	Confident	78.3	Confident	42 Å²	42	26.8 Å²	26.8	17%	0.165	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-97.2	-1.8	177.2	-59	-60	0	0	0	113	T161 F251 R277 P299 S300	T161-Y302 VanDerWaalsContact CB-O 3.23Å; T161-Y302 WeakPolarHBondContact CB-O 3.39Å; T161-Y302 WeakPolarHBondContact CG2-O 3.38Å; T161-Y302 PolarHBondContact OG1-O 3.49Å; F251-Y302 AromaticContact CD1-CD2 3.76Å; F251-Y302 HydrophobicContact CD1-CD2 3.76Å; F251-Y302 AromaticContact CD1-CE2 3.42Å; F251-Y302 HydrophobicContact CD1-CE2 3.42Å; F251-Y302 VanDerWaalsContact CD1-CE2 3.42Å; F251-Y302 AromaticContact CE1-CD2 3.71Å; F251-Y302 HydrophobicContact CE1-CD2 3.71Å; F251-Y302 AromaticContact CE1-CE2 3.87Å; F251-Y302 HydrophobicContact CE1-CE2 3.87Å; F251-Y302 HydrophobicContact CE1-CG 4.47Å; F251-Y302 HydrophobicContact CG-CE2 4.25Å; R277-Y302 HydrophobicContact CB-CE1 4.19Å; R277-Y302 HydrophobicContact CG-CE1 3.8Å; P299-Y302 HydrophobicContact CB-CD2 3.77Å; P299-Y302 HydrophobicContact CB-CE2 4.01Å; P299-Y302 HydrophobicContact CG-CD2 3.94Å; P299-Y302 HydrophobicContact CG-CE2 3.97Å; P299-Y302 PolarHBondContact O-N 3.07Å; S300-Y302 PolarHBondContact O-N 3.23Å; S300-Y302 VanDerWaalsContact O-N 3.1Å
303	V	86.9	Confident	78.1	Confident	17 Å²	17	28 Å²	28	10%	0.103	17%	0.168	C	C	.	.			trans	-110.5	125.3	-177.7	-176.1	0	0	0	0	109.2	V163 I298 S300 R305 Y306	V163-V303 HydrophobicContact CB-CG1 4.12Å; V163-V303 HydrophobicContact CG2-CB 4.3Å; V163-V303 HydrophobicContact CG2-CG1 3.63Å; V163-V303 HydrophobicContact CG2-CG2 3.64Å; I298-V303 HydrophobicContact CB-CG2 4.17Å; I298-V303 HydrophobicContact CG2-CG2 3.64Å; S300-V303 PolarHBondContact O-N 2.93Å; S300-V303 VanDerWaalsContact O-O 3.1Å; V303-R305 WeakPolarHBondContact CG1-O 3.24Å; V303-Y306 HydrophobicContact CB-CE1 4.24Å; V303-Y306 HydrophobicContact CB-CE2 3.74Å; V303-Y306 HydrophobicContact CG1-CD1 4.06Å; V303-Y306 HydrophobicContact CG1-CD2 3.78Å; V303-Y306 HydrophobicContact CG1-CE1 3.79Å; V303-Y306 HydrophobicContact CG1-CE2 3.48Å; V303-Y306 VanDerWaalsContact CG1-CE2 3.48Å; V303-Y306 HydrophobicContact CG1-CG 4.07Å; V303-Y306 VanDerWaalsContact CG1-CZ 3.5Å; V303-Y306 HydrophobicContact CG2-CE1 4.17Å; V303-Y306 HydrophobicContact CG2-CE2 4.44Å; V303-Y306 WeakPolarHBondContact CG2-OH 3.34Å
304	G	83.9	Confident	78.5	Confident	43 Å²	43	29 Å²	29	44%	0.443	17%	0.17	S	C	.	.	S	Bend	trans	-86.9	-30.8	176.8	0	0	0	0	0	113	T161	T161-G304 WeakPolarHBondContact O-CA 3.33Å; T161-G304 PolarHBondContact O-N 3.03Å
305	R	88.7	Confident	78.8	Confident	16 Å²	16	31.1 Å²	31.1	6%	0.06	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	141	-178.6	178.5	175.6	-79.6	147.1	-2.3	111.6	E117 Q148 L149 N151 P152 V159 T161 V162 V163 V303	E117-R305 HydrophobicContact CG-CG 4.15Å; E117-R305 IonicContact OE1-CZ 3.54Å; E117-R305 IonicContact OE1-NE 3.51Å; E117-R305 PolarHBondContact OE1-NE 2.77Å; E117-R305 IonicContact OE1-NH2 3.82Å; Q148-R305 PolarHBondContact O-NH1 3.44Å; L149-R305 PolarHBondContact O-NH1 3.03Å; N151-R305 PolarHBondContact O-NH1 3.39Å; N151-R305 PolarHBondContact O-NH2 2.82Å; P152-R305 PolarHBondContact O-NH2 2.74Å; V159-R305 HydrophobicContact CG1-CB 3.7Å; T161-R305 PolarHBondContact O-N 2.61Å; T161-R305 VanDerWaalsContact O-N 3.17Å; V162-R305 CarbonylContact C-O 3.56Å; V162-R305 WeakPolarHBondContact CA-O 3.26Å; V162-R305 HydrophobicContact CG2-CB 4.39Å; V163-R305 PolarHBondContact N-O 3.08Å; V303-R305 WeakPolarHBondContact CG1-O 3.24Å
306	Y	88.3	Confident	79.1	Confident	9 Å²	9	34.7 Å²	34.7	4%	0.035	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	142.4	169.8	-64.8	-92.6	0	0	0	110.8	S118 P120 L123 V163 I295 S300 V303	S118-Y306 PolarHBondContact N-O 3.49Å; P120-Y306 HydrophobicContact CB-CE2 4.44Å; P120-Y306 HydrophobicContact CG-CD2 4.38Å; P120-Y306 HydrophobicContact CG-CE2 4.19Å; L123-Y306 VanDerWaalsContact CD1-CB 3.43Å; L123-Y306 HydrophobicContact CD1-CD1 3.39Å; L123-Y306 HydrophobicContact CD1-CD2 3.47Å; L123-Y306 VanDerWaalsContact CD1-CD2 3.47Å; L123-Y306 HydrophobicContact CD1-CE1 3.9Å; L123-Y306 HydrophobicContact CD1-CE2 3.97Å; L123-Y306 HydrophobicContact CD1-CG 3.14Å; V163-Y306 HydrophobicContact CB-CD1 3.72Å; V163-Y306 HydrophobicContact CB-CE1 3.96Å; V163-Y306 HydrophobicContact CG1-CD1 4.03Å; V163-Y306 HydrophobicContact CG1-CE1 4.19Å; V163-Y306 HydrophobicContact CG2-CD1 4.45Å; V163-Y306 HydrophobicContact CG2-CE1 4.24Å; V163-Y306 CarbonylContact O-C 3.51Å; V163-Y306 WeakPolarHBondContact O-CA 3.45Å; I295-Y306 HydrophobicContact CG2-CD1 4.11Å; I295-Y306 HydrophobicContact CG2-CE1 3.77Å; S300-Y306 WeakPolarHBondContact CA-OH 3.44Å; V303-Y306 HydrophobicContact CB-CE1 4.24Å; V303-Y306 HydrophobicContact CB-CE2 3.74Å; V303-Y306 HydrophobicContact CG1-CD1 4.06Å; V303-Y306 HydrophobicContact CG1-CD2 3.78Å; V303-Y306 HydrophobicContact CG1-CE1 3.79Å; V303-Y306 HydrophobicContact CG1-CE2 3.48Å; V303-Y306 VanDerWaalsContact CG1-CE2 3.48Å; V303-Y306 HydrophobicContact CG1-CG 4.07Å; V303-Y306 VanDerWaalsContact CG1-CZ 3.5Å; V303-Y306 HydrophobicContact CG2-CE1 4.17Å; V303-Y306 HydrophobicContact CG2-CE2 4.44Å; V303-Y306 WeakPolarHBondContact CG2-OH 3.34Å
307	G	88.1	Confident	79.6	Confident	3 Å²	3	34.8 Å²	34.8	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	121.1	175.1	0	0	0	0	0	112.7	R116 V163 L164 Y165	R116-G307 CarbonylContact O-C 3.55Å; R116-G307 VanDerWaalsContact O-CA 3.28Å; R116-G307 WeakPolarHBondContact O-CA 3.13Å; V163-G307 PolarHBondContact O-N 2.72Å; L164-G307 CarbonylContact C-O 3.5Å; L164-G307 VanDerWaalsContact CA-O 3.26Å; L164-G307 WeakPolarHBondContact CA-O 3.48Å; Y165-G307 PolarHBondContact N-O 2.76Å
308	E	85.9	Confident	80	Confident	41 Å²	41	32.6 Å²	32.6	19%	0.192	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	125.3	170.8	-168	173.7	-163.7	0	0	110.1	I115 R116 Y165 C310 R704	I115-E308 CarbonylContact C-O 3.55Å; I115-E308 VanDerWaalsContact CA-O 3.29Å; I115-E308 WeakPolarHBondContact CA-O 3.38Å; R116-E308 PolarHBondContact N-O 2.93Å; R116-E308 PolarHBondContact O-N 3.25Å; Y165-E308 HydrophobicContact CD2-CG 4.21Å; Y165-E308 HydrophobicContact CE1-CB 4.11Å; Y165-E308 HydrophobicContact CE2-CB 3.78Å; Y165-E308 HydrophobicContact CE2-CG 3.56Å; E308-C310 PolarHBondContact O-N 3.08Å; E308-R704 IonicContact OE1-NH1 2.84Å; E308-R704 IonicContact OE1-NH2 3.69Å
309	I	81.8	Confident	79.9	Confident	2 Å²	2	34 Å²	34	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	101.5	171.1	-62	166	0	0	0	108	P113 I115 L164 Y165 K172 L175 G311	P113-I309 HydrophobicContact CB-CG2 3.92Å; P113-I309 HydrophobicContact CG-CG2 3.94Å; I115-I309 HydrophobicContact CG1-CG1 4.45Å; L164-I309 HydrophobicContact CB-CD1 3.87Å; L164-I309 HydrophobicContact CB-CG1 4.35Å; L164-I309 HydrophobicContact CD1-CD1 4.34Å; Y165-I309 PolarHBondContact O-N 2.9Å; K172-I309 HydrophobicContact CB-CD1 4.28Å; K172-I309 HydrophobicContact CG-CD1 3.79Å; L175-I309 HydrophobicContact CD2-CD1 3.65Å; L175-I309 HydrophobicContact CD2-CG1 4.18Å; I309-G311 VanDerWaalsContact C-N 3.29Å; I309-G311 PolarHBondContact O-N 3.43Å
310	C	75.6	Confident	80	Confident	12 Å²	12	36.7 Å²	36.7	8%	0.081	21%	0.206	C	C	.	.			trans	-89.1	22	-172.9	-60.4	0	0	0	0	113.9	V114 E308 F366	V114-C310 HydrophobicContact CB-CB 4.29Å; V114-C310 WeakPolarHBondContact O-CB 3.34Å; V114-C310 PolarHBondContact O-N 2.89Å; E308-C310 PolarHBondContact O-N 3.08Å; C310-F366 WeakPolarHBondContact O-CE2 3.31Å; C310-F366 WeakPolarHBondContact O-CZ 3.39Å
311	G	75.6	Confident	80.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.			trans	53.4	-142.5	-179.2	0	0	0	0	0	113.3	V114 I309 S313 F366	V114-G311 PolarHBondContact N-O 3.44Å; I309-G311 VanDerWaalsContact C-N 3.29Å; I309-G311 PolarHBondContact O-N 3.43Å; G311-S313 PolarHBondContact O-N 3.3Å; G311-F366 WeakPolarHBondContact CA-O 3.16Å
312	F	78.3	Confident	80.1	Confident	5 Å²	5	30.1 Å²	30.1	2%	0.022	17%	0.17	C	C	.	.	S	Bend	trans	-96.5	72.4	173.7	-58.1	-30.6	0	0	0	110.3	V111 D314 L317 Q318 Y321 F366 P368 C371	V111-F312 HydrophobicContact CB-CE1 3.76Å; V111-F312 HydrophobicContact CB-CZ 3.97Å; V111-F312 HydrophobicContact CG1-CD1 4.25Å; V111-F312 HydrophobicContact CG1-CE1 3.75Å; V111-F312 HydrophobicContact CG1-CZ 4.36Å; F312-D314 PolarHBondContact O-N 3.5Å; F312-L317 HydrophobicContact CB-CB 4.14Å; F312-L317 HydrophobicContact CD1-CB 4.16Å; F312-L317 HydrophobicContact CG-CB 4.34Å; F312-Q318 HydrophobicContact CB-CG 3.57Å; F312-Q318 HydrophobicContact CD2-CG 4.41Å; F312-Q318 HydrophobicContact CG-CG 4.43Å; F312-Q318 PolarHBondContact O-NE2 3.15Å; F312-Y321 HydrophobicContact CE2-CD1 4.22Å; F312-Y321 AromaticContact CE2-CD2 3.73Å; F312-Y321 HydrophobicContact CE2-CD2 3.73Å; F312-Y321 HydrophobicContact CE2-CE2 4.44Å; F312-Y321 AromaticContact CE2-CG 3.59Å; F312-Y321 HydrophobicContact CE2-CG 3.59Å; F312-Y321 AromaticContact CZ-CD2 3.62Å; F312-Y321 HydrophobicContact CZ-CD2 3.62Å; F312-Y321 HydrophobicContact CZ-CE2 4.38Å; F312-Y321 AromaticContact CZ-CG 3.92Å; F312-Y321 HydrophobicContact CZ-CG 3.92Å; F312-F366 PolarHBondContact N-O 2.98Å; F312-P368 HydrophobicContact CD1-CG 4.09Å; F312-P368 HydrophobicContact CD2-CB 4.27Å; F312-P368 HydrophobicContact CD2-CG 4.01Å; F312-P368 HydrophobicContact CE1-CB 4.37Å; F312-P368 HydrophobicContact CE1-CG 3.87Å; F312-P368 HydrophobicContact CE2-CB 3.68Å; F312-P368 HydrophobicContact CE2-CG 3.81Å; F312-P368 HydrophobicContact CG-CG 4.15Å; F312-P368 HydrophobicContact CZ-CB 3.73Å; F312-P368 HydrophobicContact CZ-CG 3.73Å; F312-C371 HydrophobicContact CD2-CB 4.34Å; F312-C371 HydrophobicContact CE2-CB 4.11Å
313	S	67.1	Low	79.8	Confident	65 Å²	65	32 Å²	32	46%	0.455	18%	0.18	S	C	.	.			trans	-63.9	-22.4	-176.3	59.8	0	0	0	0	114.5	V114 G311	V114-S313 VanDerWaalsContact CG2-OG 3.29Å; V114-S313 WeakPolarHBondContact CG2-OG 3.39Å; G311-S313 PolarHBondContact O-N 3.3Å
314	D	71.6	Confident	79.4	Confident	71 Å²	71	33.8 Å²	33.8	38%	0.38	19%	0.189	S	C	.	.	S	Bend	trans	-111	137.3	173.8	-176.1	-2.8	0	0	0	110.4	F312 N316 L317 Q318	F312-D314 PolarHBondContact O-N 3.5Å; D314-N316 PolarHBondContact O-N 3.36Å; D314-N316 VanDerWaalsContact O-N 3.12Å; D314-N316 PolarHBondContact OD1-N 2.79Å; D314-N316 PolarHBondContact OD1-ND2 3.35Å; D314-N316 PolarHBondContact OD2-ND2 3.24Å; D314-L317 WeakPolarHBondContact O-CB 3.46Å; D314-L317 PolarHBondContact O-N 3.4Å; D314-Q318 PolarHBondContact O-N 2.8Å
315	T	70.8	Confident	78.9	Confident	45 Å²	45	32.9 Å²	32.9	28%	0.276	17%	0.172	S	C	.	.	H	α-helix	trans	-49.7	-31.7	170.2	-37.9	0	0	0	0	112.4	Q318 K319 L355	T315-Q318 WeakPolarHBondContact O-CB 2.95Å; T315-Q318 PolarHBondContact O-N 3.14Å; T315-K319 VanDerWaalsContact O-CG 3.31Å; T315-K319 WeakPolarHBondContact O-CG 3.49Å; T315-K319 PolarHBondContact O-N 3.09Å; T315-L355 HydrophobicContact CG2-CB 3.8Å; T315-L355 HydrophobicContact CG2-CD1 4.13Å
316	N	79.8	Confident	78	Confident	96 Å²	96	32.8 Å²	32.8	51%	0.513	17%	0.173	S	C	.	.	H	α-helix	trans	-63.9	-40.3	176.5	-66	-44.8	0	0	0	112.8	D314 Q318 K319 L320	D314-N316 PolarHBondContact O-N 3.36Å; D314-N316 VanDerWaalsContact O-N 3.12Å; D314-N316 PolarHBondContact OD1-N 2.79Å; D314-N316 PolarHBondContact OD1-ND2 3.35Å; D314-N316 PolarHBondContact OD2-ND2 3.24Å; N316-Q318 VanDerWaalsContact C-N 3.34Å; N316-K319 PolarHBondContact O-N 3.14Å; N316-L320 WeakPolarHBondContact O-CB 3.42Å; N316-L320 PolarHBondContact O-N 2.99Å
317	L	79.8	Confident	77.1	Confident	37 Å²	37	36.3 Å²	36.3	19%	0.194	19%	0.192	C	C	.	.	H	α-helix	trans	-68.1	-37.2	175.7	-64.6	174	0	0	0	111.2	V111 V114 F312 D314 L320 Y321	V111-L317 HydrophobicContact CG1-CB 4.26Å; V111-L317 HydrophobicContact CG1-CD2 3.93Å; V114-L317 HydrophobicContact CG2-CD1 3.44Å; V114-L317 VanDerWaalsContact CG2-CD1 3.44Å; F312-L317 HydrophobicContact CB-CB 4.14Å; F312-L317 HydrophobicContact CD1-CB 4.16Å; F312-L317 HydrophobicContact CG-CB 4.34Å; D314-L317 WeakPolarHBondContact O-CB 3.46Å; D314-L317 PolarHBondContact O-N 3.4Å; L317-L320 PolarHBondContact O-N 3.24Å; L317-Y321 WeakPolarHBondContact O-CB 3.2Å; L317-Y321 PolarHBondContact O-N 3.45Å
318	Q	79.8	Confident	76	Confident	6 Å²	6	37.5 Å²	37.5	3%	0.028	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-45.6	174.9	-57.2	175.1	9.8	0	0	111	F312 D314 T315 N316 Y321 F322 L355 A362 C365	F312-Q318 HydrophobicContact CB-CG 3.57Å; F312-Q318 HydrophobicContact CD2-CG 4.41Å; F312-Q318 HydrophobicContact CG-CG 4.43Å; F312-Q318 PolarHBondContact O-NE2 3.15Å; D314-Q318 PolarHBondContact O-N 2.8Å; T315-Q318 WeakPolarHBondContact O-CB 2.95Å; T315-Q318 PolarHBondContact O-N 3.14Å; N316-Q318 VanDerWaalsContact C-N 3.34Å; Q318-Y321 PolarHBondContact O-N 3.22Å; Q318-F322 WeakPolarHBondContact O-CD2 3.42Å; Q318-F322 WeakPolarHBondContact O-CG 3.38Å; Q318-F322 PolarHBondContact O-N 3.3Å; Q318-F322 VanDerWaalsContact O-N 3.09Å; Q318-L355 HydrophobicContact CB-CD1 3.77Å; Q318-L355 VanDerWaalsContact OE1-CD2 3.3Å; Q318-A362 PolarHBondContact NE2-O 3.33Å; Q318-A362 VanDerWaalsContact NE2-O 3.1Å; Q318-C365 HydrophobicContact CG-CB 4.16Å
319	K	77.2	Confident	74.4	Confident	33 Å²	33	40.2 Å²	40.2	14%	0.143	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-43.8	174.7	-70.4	174.7	-166.3	171	0	112	T315 N316 Y321 F322 Q323 L355 E356	T315-K319 VanDerWaalsContact O-CG 3.31Å; T315-K319 WeakPolarHBondContact O-CG 3.49Å; T315-K319 PolarHBondContact O-N 3.09Å; N316-K319 PolarHBondContact O-N 3.14Å; K319-Y321 VanDerWaalsContact C-N 3.32Å; K319-Y321 PolarHBondContact O-N 3.12Å; K319-F322 PolarHBondContact O-N 3.48Å; K319-Q323 WeakPolarHBondContact O-CG 3.35Å; K319-Q323 PolarHBondContact O-N 3.19Å; K319-L355 HydrophobicContact CG-CD1 3.92Å; K319-E356 WeakPolarHBondContact CE-OE1 3.48Å; K319-E356 IonicContact NZ-OE1 3.66Å; K319-E356 PolarHBondContact NZ-OE1 3.48Å
320	L	81.4	Confident	72.8	Confident	70 Å²	70	44.8 Å²	44.8	37%	0.366	24%	0.243	S	C	.	.	H	α-helix	trans	-60.3	-43.8	177.5	179.7	61.7	0	0	0	110.9	V111 N316 L317 F322 Q323 L324	V111-L320 HydrophobicContact CG1-CD2 4.25Å; V111-L320 HydrophobicContact CG2-CD2 4.28Å; V111-L320 HydrophobicContact CG2-CG 4.05Å; N316-L320 WeakPolarHBondContact O-CB 3.42Å; N316-L320 PolarHBondContact O-N 2.99Å; L317-L320 PolarHBondContact O-N 3.24Å; L320-F322 VanDerWaalsContact C-N 3.34Å; L320-F322 PolarHBondContact O-N 2.93Å; L320-Q323 PolarHBondContact O-N 2.87Å; L320-L324 HydrophobicContact CD1-CD1 4.17Å; L320-L324 HydrophobicContact CD1-CG 4.1Å; L320-L324 HydrophobicContact CG-CD1 4.09Å; L320-L324 HydrophobicContact CG-CG 4.41Å; L320-L324 WeakPolarHBondContact O-CB 3.11Å; L320-L324 WeakPolarHBondContact O-CG 3.19Å; L320-L324 PolarHBondContact O-N 2.8Å
321	Y	80.4	Confident	71.1	Confident	20 Å²	20	48.4 Å²	48.4	8%	0.078	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-46.5	175.6	178.4	-92.7	0	0	0	111.4	V109 V111 F312 L317 Q318 K319 Q323 L324 R325 C371 W372	V109-Y321 HydrophobicContact CG1-CE2 4.35Å; V111-Y321 HydrophobicContact CG2-CD2 4.19Å; F312-Y321 HydrophobicContact CE2-CD1 4.22Å; F312-Y321 AromaticContact CE2-CD2 3.73Å; F312-Y321 HydrophobicContact CE2-CD2 3.73Å; F312-Y321 HydrophobicContact CE2-CE2 4.44Å; F312-Y321 AromaticContact CE2-CG 3.59Å; F312-Y321 HydrophobicContact CE2-CG 3.59Å; F312-Y321 AromaticContact CZ-CD2 3.62Å; F312-Y321 HydrophobicContact CZ-CD2 3.62Å; F312-Y321 HydrophobicContact CZ-CE2 4.38Å; F312-Y321 AromaticContact CZ-CG 3.92Å; F312-Y321 HydrophobicContact CZ-CG 3.92Å; L317-Y321 WeakPolarHBondContact O-CB 3.2Å; L317-Y321 PolarHBondContact O-N 3.45Å; Q318-Y321 PolarHBondContact O-N 3.22Å; K319-Y321 VanDerWaalsContact C-N 3.32Å; K319-Y321 PolarHBondContact O-N 3.12Å; Y321-Q323 PolarHBondContact O-N 3.39Å; Y321-L324 PolarHBondContact O-N 3.49Å; Y321-R325 WeakPolarHBondContact O-CB 3.26Å; Y321-R325 PolarHBondContact O-N 3.16Å; Y321-C371 HydrophobicContact CD1-CB 3.48Å; Y321-C371 VanDerWaalsContact CD1-CB 3.48Å; Y321-C371 HydrophobicContact CE1-CB 3.54Å; Y321-C371 HydrophobicContact CG-CB 4.33Å; Y321-W372 WeakPolarHBondContact OH-CA 3.37Å; Y321-W372 WeakPolarHBondContact OH-CB 3.09Å
322	F	76.9	Confident	69.3	Low	0 Å²	0	52.2 Å²	52.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.3	-41.2	177.2	-64.7	-31.4	0	0	0	112.9	Q318 K319 L320 R325 L326 L351 L355 C371 V374 C375	Q318-F322 WeakPolarHBondContact O-CD2 3.42Å; Q318-F322 WeakPolarHBondContact O-CG 3.38Å; Q318-F322 PolarHBondContact O-N 3.3Å; Q318-F322 VanDerWaalsContact O-N 3.09Å; K319-F322 PolarHBondContact O-N 3.48Å; L320-F322 VanDerWaalsContact C-N 3.34Å; L320-F322 PolarHBondContact O-N 2.93Å; F322-R325 PolarHBondContact O-N 3.39Å; F322-L326 VanDerWaalsContact O-CB 3.26Å; F322-L326 WeakPolarHBondContact O-CB 3.5Å; F322-L326 VanDerWaalsContact O-CG 3.25Å; F322-L326 WeakPolarHBondContact O-CG 3.48Å; F322-L326 PolarHBondContact O-N 3.46Å; F322-L351 HydrophobicContact CB-CD1 4.25Å; F322-L351 HydrophobicContact CD1-CD1 4.39Å; F322-L351 HydrophobicContact CD2-CB 4.1Å; F322-L351 HydrophobicContact CD2-CD1 4.11Å; F322-L351 HydrophobicContact CD2-CD2 4.42Å; F322-L351 HydrophobicContact CD2-CG 4.46Å; F322-L351 HydrophobicContact CE2-CB 4.47Å; F322-L351 HydrophobicContact CE2-CD2 4.09Å; F322-L351 HydrophobicContact CG-CD1 4.03Å; F322-L351 HydrophobicContact CZ-CD2 4.42Å; F322-L355 HydrophobicContact CD2-CD1 3.88Å; F322-L355 HydrophobicContact CE2-CD1 3.58Å; F322-L355 HydrophobicContact CE2-CD2 4.13Å; F322-L355 HydrophobicContact CE2-CG 3.98Å; F322-C371 HydrophobicContact CE1-CB 3.77Å; F322-C371 HydrophobicContact CZ-CB 4.25Å; F322-V374 HydrophobicContact CE1-CB 4.36Å; F322-V374 HydrophobicContact CE1-CG1 4.13Å; F322-V374 HydrophobicContact CZ-CB 4.34Å; F322-V374 HydrophobicContact CZ-CG1 3.9Å; F322-C375 WeakPolarHBondContact CD1-SG 3.27Å
323	Q	78.2	Confident	67	Low	80 Å²	80	58.2 Å²	58.2	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-60.9	-52.2	175.2	-75.6	170.9	1.5	0	0	111.6	K319 L320 Y321 R325 L326 N327 V348	K319-Q323 WeakPolarHBondContact O-CG 3.35Å; K319-Q323 PolarHBondContact O-N 3.19Å; L320-Q323 PolarHBondContact O-N 2.87Å; Y321-Q323 PolarHBondContact O-N 3.39Å; Q323-R325 VanDerWaalsContact C-N 3.29Å; Q323-R325 PolarHBondContact O-N 3.3Å; Q323-L326 PolarHBondContact O-N 2.8Å; Q323-N327 WeakPolarHBondContact O-CB 3.5Å; Q323-N327 VanDerWaalsContact O-CG 3.24Å; Q323-N327 PolarHBondContact O-N 3.42Å; Q323-N327 PolarHBondContact O-ND2 2.89Å; Q323-V348 HydrophobicContact CG-CG1 3.53Å; Q323-V348 HydrophobicContact CG-CG2 4.49Å
324	L	77.8	Confident	65.4	Low	55 Å²	55	58.1 Å²	58.1	29%	0.288	36%	0.357	S	S	.	.	H	α-helix	trans	-62.6	-37.5	-179.1	-69.3	176.9	0	0	0	111.9	V111 L320 Y321 Q328	V111-L324 HydrophobicContact CG2-CD1 3.76Å; L320-L324 HydrophobicContact CD1-CD1 4.17Å; L320-L324 HydrophobicContact CD1-CG 4.1Å; L320-L324 HydrophobicContact CG-CD1 4.09Å; L320-L324 HydrophobicContact CG-CG 4.41Å; L320-L324 WeakPolarHBondContact O-CB 3.11Å; L320-L324 WeakPolarHBondContact O-CG 3.19Å; L320-L324 PolarHBondContact O-N 2.8Å; Y321-L324 PolarHBondContact O-N 3.49Å; L324-Q328 WeakPolarHBondContact O-CG 3.48Å; L324-Q328 PolarHBondContact O-NE2 2.93Å
325	R	73	Confident	63.7	Low	25 Å²	25	60.9 Å²	60.9	9%	0.094	38%	0.382	C	S	.	.	H	α-helix	trans	-73.3	-40.3	179.4	-162.7	74.4	-176.3	-161	6.5	112.4	E97 F104 V109 Y321 F322 Q323 C375	E97-R325 IonicContact OE2-CZ 3.52Å; E97-R325 IonicContact OE2-NH1 2.8Å; E97-R325 PolarHBondContact OE2-NH1 3.47Å; E97-R325 IonicContact OE2-NH2 3.45Å; E97-R325 PolarHBondContact OE2-NH2 2.85Å; F104-R325 VanDerWaalsContact CD1-CZ 3.43Å; V109-R325 HydrophobicContact CG1-CB 4.29Å; V109-R325 HydrophobicContact CG1-CG 4.41Å; Y321-R325 WeakPolarHBondContact O-CB 3.26Å; Y321-R325 PolarHBondContact O-N 3.16Å; F322-R325 PolarHBondContact O-N 3.39Å; Q323-R325 VanDerWaalsContact C-N 3.29Å; Q323-R325 PolarHBondContact O-N 3.3Å; R325-C375 HydrophobicContact CG-CB 4.13Å
326	L	70.8	Confident	62.1	Low	13 Å²	13	61.5 Å²	61.5	7%	0.068	40%	0.397	C	S	.	.	H	α-helix	trans	-82.1	-23.3	-175.7	-67.9	171.7	0	0	0	113.5	F322 Q323 R344 L347 V348 L351	F322-L326 VanDerWaalsContact O-CB 3.26Å; F322-L326 WeakPolarHBondContact O-CB 3.5Å; F322-L326 VanDerWaalsContact O-CG 3.25Å; F322-L326 WeakPolarHBondContact O-CG 3.48Å; F322-L326 PolarHBondContact O-N 3.46Å; Q323-L326 PolarHBondContact O-N 2.8Å; L326-R344 VanDerWaalsContact O-CD 3.29Å; L326-R344 WeakPolarHBondContact O-CD 3.35Å; L326-L347 HydrophobicContact CD1-CB 4.43Å; L326-V348 HydrophobicContact CB-CG2 4.01Å; L326-V348 HydrophobicContact CD1-CG2 3.61Å; L326-V348 HydrophobicContact CG-CG2 4.43Å; L326-L351 HydrophobicContact CD1-CD1 3.86Å
327	N	70.3	Confident	60.1	Low	83 Å²	83	63.5 Å²	63.5	44%	0.444	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	10.6	-176.9	-67.2	-16.1	0	0	0	114.7	Q323	Q323-N327 WeakPolarHBondContact O-CB 3.5Å; Q323-N327 VanDerWaalsContact O-CG 3.24Å; Q323-N327 PolarHBondContact O-N 3.42Å; Q323-N327 PolarHBondContact O-ND2 2.89Å
328	Q	63.1	Low	58.4	Low	29 Å²	29	65.7 Å²	65.7	14%	0.136	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-66.7	137.6	177.3	-66.3	-62.3	-51.6	0	0	111.5	T108 V109 L324	T108-Q328 PolarHBondContact O-NE2 2.98Å; T108-Q328 PolarHBondContact OG1-NE2 2.59Å; T108-Q328 PolarHBondContact OG1-OE1 3.38Å; V109-Q328 HydrophobicContact CG2-CG 4.01Å; L324-Q328 WeakPolarHBondContact O-CG 3.48Å; L324-Q328 PolarHBondContact O-NE2 2.93Å
329	P	52.9	Low	56.8	Low	97 Å²	97	66.2 Å²	66.2	63%	0.63	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-71.2	132.7	176.3	27.3	-31.7	0	0	0	111.3	C331	P329-C331 PolarHBondContact O-N 3.15Å
330	D	49.4	Very low	55.8	Low	98 Å²	98	66.6 Å²	66.6	52%	0.524	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-69.7	116.3	172.7	-62.2	-42.6	0	0	0	109.2	G332 R344	D330-G332 PolarHBondContact O-N 2.9Å; D330-R344 IonicContact OD1-NH2 3.55Å; D330-R344 IonicContact OD2-CZ 3.58Å; D330-R344 IonicContact OD2-NH2 2.63Å; D330-R344 PolarHBondContact OD2-NH2 3.28Å
331	C	38.6	Very low	54.7	Low	89 Å²	89	67.7 Å²	67.7	60%	0.601	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-76.8	121.3	167.4	-72.1	0	0	0	0	108.8	T103 P329 C333	T103-C331 HydrophobicContact CG2-CB 3.41Å; T103-C331 VanDerWaalsContact CG2-CB 3.41Å; T103-C331 WeakPolarHBondContact CG2-SG 3.29Å; P329-C331 PolarHBondContact O-N 3.15Å; C331-C333 PolarHBondContact O-N 3.02Å
332	G	38.1	Very low	53.5	Low	79 Å²	79	69.7 Å²	69.7	81%	0.814	48%	0.478	S	S	*	.	S	Bend	trans	-58.4	108.8	-177	0	0	0	0	0	112.6	D330	D330-G332 PolarHBondContact O-N 2.9Å
333	C	29.5	Very low	52.5	Low	131 Å²	131	73.9 Å²	73.9	89%	0.885	50%	0.497	S	S	*	.			trans	-171.5	106.3	145.1	-102	0	0	0	0	109	C331	C331-C333 PolarHBondContact O-N 3.02Å
334	G	33.8	Very low	51.8	Low	64 Å²	64	72 Å²	72	66%	0.66	49%	0.487	S	S	*	.	S	Bend	trans	101	83.5	157.8	0	0	0	0	0	118.4	G336	G334-G336 PolarHBondContact O-N 3.33Å; G334-G336 VanDerWaalsContact O-N 3.12Å
335	S	37.2	Very low	51.2	Low	128 Å²	128	73.2 Å²	73.2	90%	0.895	49%	0.494	S	S	*	.			trans	46	38.1	146.5	87.1	0	0	0	0	121.9
336	G	35.8	Very low	50.6	Low	59 Å²	59	76.7 Å²	76.7	61%	0.608	51%	0.514	S	S	*	.			trans	-86.9	135.8	157.6	0	0	0	0	0	111.1	G334 S338	G334-G336 PolarHBondContact O-N 3.33Å; G334-G336 VanDerWaalsContact O-N 3.12Å; G336-S338 PolarHBondContact O-N 3.42Å
337	V	39	Very low	50.2	Low	138 Å²	138	77.1 Å²	77.1	84%	0.836	52%	0.516	S	S	*	.			trans	-57.9	110.8	173.9	176.8	0	0	0	0	108.6	A339	V337-A339 PolarHBondContact O-N 2.89Å
338	S	42.7	Very low	50	Low	83 Å²	83	73.7 Å²	73.7	58%	0.58	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-62.9	118.5	177.2	175.7	0	0	0	0	109.9	G336	G336-S338 PolarHBondContact O-N 3.42Å
339	A	47.4	Very low	50.1	Low	16 Å²	16	77.1 Å²	77.1	13%	0.132	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-72.5	129.3	164.2	0	0	0	0	0	108	V337 Q343 R344	V337-A339 PolarHBondContact O-N 2.89Å; A339-Q343 VanDerWaalsContact CA-OE1 3.28Å; A339-Q343 HydrophobicContact CB-CB 4.33Å; A339-R344 HydrophobicContact CB-CG 4.3Å; A339-R344 VanDerWaalsContact O-CZ 3.31Å; A339-R344 PolarHBondContact O-NH1 3.44Å
340	A	56	Low	50.4	Low	41 Å²	41	74.7 Å²	74.7	34%	0.339	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-63.1	152.1	175.1	0	0	0	0	0	110.4	A342 Q343 R344	A340-A342 PolarHBondContact O-N 3.32Å; A340-A342 VanDerWaalsContact O-N 3.16Å; A340-Q343 HydrophobicContact CB-CG 4.17Å; A340-Q343 WeakPolarHBondContact O-CA 3.27Å; A340-Q343 WeakPolarHBondContact O-CB 3.46Å; A340-Q343 PolarHBondContact O-N 3.44Å; A340-R344 PolarHBondContact O-N 2.95Å; A340-R344 VanDerWaalsContact O-N 3.16Å
341	P	57.8	Low	51.2	Low	93 Å²	93	70.3 Å²	70.3	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-49.2	-42.5	176.1	-26.5	33.3	0	0	0	113	Q343 R344 D345	P341-Q343 VanDerWaalsContact C-N 3.26Å; P341-Q343 PolarHBondContact O-N 3.03Å; P341-R344 WeakPolarHBondContact O-CB 3.3Å; P341-R344 PolarHBondContact O-N 3.44Å; P341-R344 VanDerWaalsContact O-N 3.12Å; P341-D345 PolarHBondContact O-N 3.2Å
342	A	55.3	Low	52.4	Low	63 Å²	63	66.9 Å²	66.9	52%	0.521	45%	0.449	S	S	.	.	H	α-helix	trans	-61.9	-28.4	175	0	0	0	0	0	114.2	A340 N346	A340-A342 PolarHBondContact O-N 3.32Å; A340-A342 VanDerWaalsContact O-N 3.16Å; A342-N346 WeakPolarHBondContact O-CB 3.29Å; A342-N346 PolarHBondContact O-N 2.91Å; A342-N346 VanDerWaalsContact O-N 3.13Å; A342-N346 PolarHBondContact O-ND2 3.49Å
343	Q	55.8	Low	53.4	Low	87 Å²	87	71.4 Å²	71.4	41%	0.407	44%	0.441	S	S	.	.	H	α-helix	trans	-77.4	-35.3	175.6	-66	172.7	-11.5	0	0	111.6	A339 A340 P341 N346 L347	A339-Q343 VanDerWaalsContact CA-OE1 3.28Å; A339-Q343 HydrophobicContact CB-CB 4.33Å; A340-Q343 HydrophobicContact CB-CG 4.17Å; A340-Q343 WeakPolarHBondContact O-CA 3.27Å; A340-Q343 WeakPolarHBondContact O-CB 3.46Å; A340-Q343 PolarHBondContact O-N 3.44Å; P341-Q343 VanDerWaalsContact C-N 3.26Å; P341-Q343 PolarHBondContact O-N 3.03Å; Q343-N346 PolarHBondContact O-N 3.23Å; Q343-L347 WeakPolarHBondContact O-CG 3.17Å; Q343-L347 PolarHBondContact O-N 3.48Å
344	R	63.6	Low	54.7	Low	42 Å²	42	66.4 Å²	66.4	16%	0.158	41%	0.406	C	S	.	.	H	α-helix	trans	-64.3	-45.1	173	-66	179.3	171.5	98.6	2.6	110.8	L326 D330 A339 A340 P341 N346 L347 V348	L326-R344 VanDerWaalsContact O-CD 3.29Å; L326-R344 WeakPolarHBondContact O-CD 3.35Å; D330-R344 IonicContact OD1-NH2 3.55Å; D330-R344 IonicContact OD2-CZ 3.58Å; D330-R344 IonicContact OD2-NH2 2.63Å; D330-R344 PolarHBondContact OD2-NH2 3.28Å; A339-R344 HydrophobicContact CB-CG 4.3Å; A339-R344 VanDerWaalsContact O-CZ 3.31Å; A339-R344 PolarHBondContact O-NH1 3.44Å; A340-R344 PolarHBondContact O-N 2.95Å; A340-R344 VanDerWaalsContact O-N 3.16Å; P341-R344 WeakPolarHBondContact O-CB 3.3Å; P341-R344 PolarHBondContact O-N 3.44Å; P341-R344 VanDerWaalsContact O-N 3.12Å; R344-N346 VanDerWaalsContact C-N 3.33Å; R344-N346 PolarHBondContact O-N 2.76Å; R344-L347 PolarHBondContact O-N 2.86Å; R344-L347 VanDerWaalsContact O-N 3.15Å; R344-V348 WeakPolarHBondContact O-CG2 3.42Å; R344-V348 PolarHBondContact O-N 3.44Å
345	D	64.4	Low	55.9	Low	80 Å²	80	63.5 Å²	63.5	43%	0.428	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-41.3	176	-67.7	-27	0	0	0	111.8	P341 L347 V348 Q349	P341-D345 PolarHBondContact O-N 3.2Å; D345-L347 PolarHBondContact O-N 3.3Å; D345-V348 PolarHBondContact O-N 2.85Å; D345-Q349 WeakPolarHBondContact O-CB 3.29Å; D345-Q349 VanDerWaalsContact O-CG 3.31Å; D345-Q349 WeakPolarHBondContact O-CG 3.21Å; D345-Q349 PolarHBondContact O-N 3.4Å
346	N	61.5	Low	56.8	Low	98 Å²	98	63.1 Å²	63.1	52%	0.524	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-38.1	174.3	-78.7	-23.5	0	0	0	112.9	A342 Q343 R344 Q349 M350	A342-N346 WeakPolarHBondContact O-CB 3.29Å; A342-N346 PolarHBondContact O-N 2.91Å; A342-N346 VanDerWaalsContact O-N 3.13Å; A342-N346 PolarHBondContact O-ND2 3.49Å; Q343-N346 PolarHBondContact O-N 3.23Å; R344-N346 VanDerWaalsContact C-N 3.33Å; R344-N346 PolarHBondContact O-N 2.76Å; N346-Q349 PolarHBondContact O-N 3.09Å; N346-M350 VanDerWaalsContact O-CB 3.31Å; N346-M350 WeakPolarHBondContact O-CB 3.34Å; N346-M350 PolarHBondContact O-N 3.43Å
347	L	61	Low	57.1	Low	22 Å²	22	63 Å²	63	12%	0.115	36%	0.357	C	S	.	.	H	α-helix	trans	-67.9	-43.3	176.1	-76.1	166.3	0	0	0	111.7	L326 Q343 R344 D345 Q349 M350 L351	L326-L347 HydrophobicContact CD1-CB 4.43Å; Q343-L347 WeakPolarHBondContact O-CG 3.17Å; Q343-L347 PolarHBondContact O-N 3.48Å; R344-L347 PolarHBondContact O-N 2.86Å; R344-L347 VanDerWaalsContact O-N 3.15Å; D345-L347 PolarHBondContact O-N 3.3Å; L347-Q349 VanDerWaalsContact C-N 3.33Å; L347-Q349 PolarHBondContact O-N 2.93Å; L347-M350 HydrophobicContact CD2-CE 4.08Å; L347-M350 PolarHBondContact O-N 3.28Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 PolarHBondContact O-N 3.21Å
348	V	67.2	Low	57.6	Low	10 Å²	10	59.5 Å²	59.5	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-60.8	-43.8	174	170.2	0	0	0	0	110.6	Q323 L326 R344 D345 L351 S352	Q323-V348 HydrophobicContact CG-CG1 3.53Å; Q323-V348 HydrophobicContact CG-CG2 4.49Å; L326-V348 HydrophobicContact CB-CG2 4.01Å; L326-V348 HydrophobicContact CD1-CG2 3.61Å; L326-V348 HydrophobicContact CG-CG2 4.43Å; R344-V348 WeakPolarHBondContact O-CG2 3.42Å; R344-V348 PolarHBondContact O-N 3.44Å; D345-V348 PolarHBondContact O-N 2.85Å; V348-L351 PolarHBondContact O-N 2.92Å; V348-S352 WeakPolarHBondContact O-CB 3.25Å; V348-S352 PolarHBondContact O-N 3.26Å; V348-S352 PolarHBondContact O-OG 3.3Å
349	Q	64.6	Low	57.9	Low	101 Å²	101	61.9 Å²	61.9	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-66.6	-41.4	177.2	-76	-177.4	13.7	0	0	112.3	D345 N346 L347 S352 R353	D345-Q349 WeakPolarHBondContact O-CB 3.29Å; D345-Q349 VanDerWaalsContact O-CG 3.31Å; D345-Q349 WeakPolarHBondContact O-CG 3.21Å; D345-Q349 PolarHBondContact O-N 3.4Å; N346-Q349 PolarHBondContact O-N 3.09Å; L347-Q349 VanDerWaalsContact C-N 3.33Å; L347-Q349 PolarHBondContact O-N 2.93Å; Q349-S352 PolarHBondContact O-N 3.17Å; Q349-R353 WeakPolarHBondContact O-CB 3.36Å; Q349-R353 WeakPolarHBondContact O-CG 3.12Å; Q349-R353 PolarHBondContact O-N 2.95Å
350	M	60.2	Low	58	Low	47 Å²	47	63.6 Å²	63.6	23%	0.232	34%	0.339	C	S	.	.	H	α-helix	trans	-60.2	-47.4	174.4	-174.9	-151.8	-59.2	0	0	110.9	N346 L347 S352 R353 N354	N346-M350 VanDerWaalsContact O-CB 3.31Å; N346-M350 WeakPolarHBondContact O-CB 3.34Å; N346-M350 PolarHBondContact O-N 3.43Å; L347-M350 HydrophobicContact CD2-CE 4.08Å; L347-M350 PolarHBondContact O-N 3.28Å; M350-S352 PolarHBondContact O-N 3.46Å; M350-R353 PolarHBondContact O-N 3.2Å; M350-N354 WeakPolarHBondContact O-CB 3.06Å; M350-N354 VanDerWaalsContact O-CG 3.28Å; M350-N354 PolarHBondContact O-N 2.92Å
351	L	65.6	Low	57.9	Low	5 Å²	5	62.8 Å²	62.8	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-44.2	176.2	-88.4	172.6	0	0	0	112.3	F322 L326 L347 V348 R353 N354 L355 V374 L378	F322-L351 HydrophobicContact CB-CD1 4.25Å; F322-L351 HydrophobicContact CD1-CD1 4.39Å; F322-L351 HydrophobicContact CD2-CB 4.1Å; F322-L351 HydrophobicContact CD2-CD1 4.11Å; F322-L351 HydrophobicContact CD2-CD2 4.42Å; F322-L351 HydrophobicContact CD2-CG 4.46Å; F322-L351 HydrophobicContact CE2-CB 4.47Å; F322-L351 HydrophobicContact CE2-CD2 4.09Å; F322-L351 HydrophobicContact CG-CD1 4.03Å; F322-L351 HydrophobicContact CZ-CD2 4.42Å; L326-L351 HydrophobicContact CD1-CD1 3.86Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 PolarHBondContact O-N 3.21Å; V348-L351 PolarHBondContact O-N 2.92Å; L351-R353 VanDerWaalsContact C-N 3.35Å; L351-R353 PolarHBondContact O-N 3.31Å; L351-N354 PolarHBondContact O-N 2.92Å; L351-L355 WeakPolarHBondContact O-CG 3.28Å; L351-L355 PolarHBondContact O-N 3.38Å; L351-V374 HydrophobicContact CD2-CG1 3.83Å; L351-L378 HydrophobicContact CD1-CD1 3.71Å; L351-L378 HydrophobicContact CD2-CD1 3.1Å; L351-L378 HydrophobicContact CG-CD1 3.57Å
352	S	64.6	Low	57.7	Low	18 Å²	18	59.1 Å²	59.1	13%	0.126	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-43.4	178	-59.1	0	0	0	0	111.3	V348 Q349 M350 L355 E356	V348-S352 WeakPolarHBondContact O-CB 3.25Å; V348-S352 PolarHBondContact O-N 3.26Å; V348-S352 PolarHBondContact O-OG 3.3Å; Q349-S352 PolarHBondContact O-N 3.17Å; M350-S352 PolarHBondContact O-N 3.46Å; S352-L355 PolarHBondContact O-N 3.01Å; S352-E356 WeakPolarHBondContact O-CB 3.16Å; S352-E356 VanDerWaalsContact O-CG 3.26Å; S352-E356 WeakPolarHBondContact O-CG 3.47Å; S352-E356 PolarHBondContact O-N 2.67Å
353	R	59.1	Low	57.7	Low	173 Å²	173	56.9 Å²	56.9	65%	0.653	29%	0.288	S	S	*	.	H	α-helix	trans	-64.8	-38.2	174	-73.9	177.7	-178.6	172.2	3.2	112.5	Q349 M350 L351 E356 G357	Q349-R353 WeakPolarHBondContact O-CB 3.36Å; Q349-R353 WeakPolarHBondContact O-CG 3.12Å; Q349-R353 PolarHBondContact O-N 2.95Å; M350-R353 PolarHBondContact O-N 3.2Å; L351-R353 VanDerWaalsContact C-N 3.35Å; L351-R353 PolarHBondContact O-N 3.31Å; R353-E356 PolarHBondContact O-N 3.43Å; R353-G357 PolarHBondContact O-N 3.5Å
354	N	55	Low	57.7	Low	26 Å²	26	53.5 Å²	53.5	14%	0.139	28%	0.275	C	S	.	.	H	α-helix	trans	-69.7	-36.4	177.4	-74.4	-16.3	0	0	0	112	M350 L351 H358 I361 T385	M350-N354 WeakPolarHBondContact O-CB 3.06Å; M350-N354 VanDerWaalsContact O-CG 3.28Å; M350-N354 PolarHBondContact O-N 2.92Å; L351-N354 PolarHBondContact O-N 2.92Å; N354-H358 WeakPolarHBondContact O-CA 3.5Å; N354-H358 VanDerWaalsContact O-CB 3.29Å; N354-H358 WeakPolarHBondContact O-CB 3.32Å; N354-H358 PolarHBondContact O-N 2.79Å; N354-I361 HydrophobicContact CB-CD1 4.41Å; N354-T385 PolarHBondContact ND2-OG1 2.97Å
355	L	59.6	Low	57.8	Low	4 Å²	4	51.5 Å²	51.5	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-63.7	-42.8	171.1	-73.6	-179.3	0	0	0	111.5	T315 Q318 K319 F322 L351 S352 I361 A362 C365	T315-L355 HydrophobicContact CG2-CB 3.8Å; T315-L355 HydrophobicContact CG2-CD1 4.13Å; Q318-L355 HydrophobicContact CB-CD1 3.77Å; Q318-L355 VanDerWaalsContact OE1-CD2 3.3Å; K319-L355 HydrophobicContact CG-CD1 3.92Å; F322-L355 HydrophobicContact CD2-CD1 3.88Å; F322-L355 HydrophobicContact CE2-CD1 3.58Å; F322-L355 HydrophobicContact CE2-CD2 4.13Å; F322-L355 HydrophobicContact CE2-CG 3.98Å; L351-L355 WeakPolarHBondContact O-CG 3.28Å; L351-L355 PolarHBondContact O-N 3.38Å; S352-L355 PolarHBondContact O-N 3.01Å; L355-I361 HydrophobicContact CD2-CG2 3.99Å; L355-A362 HydrophobicContact CD2-CB 4.22Å; L355-A362 WeakPolarHBondContact O-CB 3.29Å; L355-C365 HydrophobicContact CD2-CB 3.99Å
356	E	56.5	Low	57.8	Low	119 Å²	119	51 Å²	51	56%	0.556	26%	0.261	S	S	*	.	H	α-helix	trans	-72.5	-35.1	179.6	-71.4	168.1	178	0	0	113	K319 S352 R353	K319-E356 WeakPolarHBondContact CE-OE1 3.48Å; K319-E356 IonicContact NZ-OE1 3.66Å; K319-E356 PolarHBondContact NZ-OE1 3.48Å; S352-E356 WeakPolarHBondContact O-CB 3.16Å; S352-E356 VanDerWaalsContact O-CG 3.26Å; S352-E356 WeakPolarHBondContact O-CG 3.47Å; S352-E356 PolarHBondContact O-N 2.67Å; R353-E356 PolarHBondContact O-N 3.43Å
357	G	42.5	Very low	57.8	Low	56 Å²	56	48.8 Å²	48.8	58%	0.577	25%	0.249	S	C	*	.	H	α-helix	trans	-96	-18.8	-173.8	0	0	0	0	0	115.5	R353	R353-G357 PolarHBondContact O-N 3.5Å
358	H	48.5	Very low	58.2	Low	66 Å²	66	48.6 Å²	48.6	31%	0.306	25%	0.25	S	C	.	.			trans	-124.4	101	-179.4	-64.8	-67.6	0	0	0	111.5	N354 Q360 I361 A362	N354-H358 WeakPolarHBondContact O-CA 3.5Å; N354-H358 VanDerWaalsContact O-CB 3.29Å; N354-H358 WeakPolarHBondContact O-CB 3.32Å; N354-H358 PolarHBondContact O-N 2.79Å; H358-Q360 PolarHBondContact O-N 2.83Å; H358-I361 PolarHBondContact O-N 2.83Å; H358-A362 PolarHBondContact O-N 2.94Å
359	H	48.8	Very low	58.1	Low	133 Å²	133	50.8 Å²	50.8	62%	0.616	27%	0.265	S	S	*	.	H	α-helix	trans	-53.6	-26.7	178.5	-63.1	176.2	0	0	0	113.4	A363	H359-A363 WeakPolarHBondContact O-CB 3.46Å; H359-A363 PolarHBondContact O-N 3.41Å
360	Q	50.2	Low	58.1	Low	52 Å²	52	47 Å²	47	24%	0.243	25%	0.247	C	C	.	.	H	α-helix	trans	-68	-48.7	179.2	-73.5	170.8	2.8	0	0	113.7	H358 A363 A364 Y680 T711	H358-Q360 PolarHBondContact O-N 2.83Å; Q360-A363 PolarHBondContact O-N 3.47Å; Q360-A364 WeakPolarHBondContact O-CB 3.39Å; Q360-A364 PolarHBondContact O-N 3.49Å; Q360-Y680 PolarHBondContact NE2-OH 3.47Å; Q360-Y680 PolarHBondContact OE1-OH 2.89Å; Q360-T711 HydrophobicContact CG-CG2 3.45Å; Q360-T711 VanDerWaalsContact CG-CG2 3.45Å
361	I	53.6	Low	58.5	Low	23 Å²	23	44.8 Å²	44.8	12%	0.118	24%	0.236	C	C	.	.	H	α-helix	trans	-69.7	-42.4	-179.1	-60.3	175.6	0	0	0	108.6	N354 L355 H358 A363 A364 C365	N354-I361 HydrophobicContact CB-CD1 4.41Å; L355-I361 HydrophobicContact CD2-CG2 3.99Å; H358-I361 PolarHBondContact O-N 2.83Å; I361-A363 PolarHBondContact O-N 2.99Å; I361-A364 PolarHBondContact O-N 3Å; I361-C365 WeakPolarHBondContact O-CB 3.41Å; I361-C365 PolarHBondContact O-N 2.96Å; I361-C365 PolarHBondContact O-SG 3.15Å
362	A	54.9	Low	58.7	Low	17 Å²	17	46.2 Å²	46.2	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-41.3	175.3	0	0	0	0	0	113.2	Q318 L355 H358 F366	Q318-A362 PolarHBondContact NE2-O 3.33Å; Q318-A362 VanDerWaalsContact NE2-O 3.1Å; L355-A362 HydrophobicContact CD2-CB 4.22Å; L355-A362 WeakPolarHBondContact O-CB 3.29Å; H358-A362 PolarHBondContact O-N 2.94Å; A362-F366 PolarHBondContact O-N 3.37Å
363	A	53.9	Low	58.7	Low	15 Å²	15	45.5 Å²	45.5	12%	0.124	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-37.9	176.3	0	0	0	0	0	112.5	H359 Q360 I361 F366 P707 V708	H359-A363 WeakPolarHBondContact O-CB 3.46Å; H359-A363 PolarHBondContact O-N 3.41Å; Q360-A363 PolarHBondContact O-N 3.47Å; I361-A363 PolarHBondContact O-N 2.99Å; A363-F366 WeakPolarHBondContact O-CB 3.32Å; A363-P707 HydrophobicContact CB-CB 3.98Å; A363-V708 HydrophobicContact CB-CG2 4.11Å
364	A	56.6	Low	58.9	Low	17 Å²	17	37.8 Å²	37.8	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-77.2	-36.1	178	0	0	0	0	0	112.5	Q360 I361 F366 L367 Y370	Q360-A364 WeakPolarHBondContact O-CB 3.39Å; Q360-A364 PolarHBondContact O-N 3.49Å; I361-A364 PolarHBondContact O-N 3Å; A364-F366 PolarHBondContact O-N 2.99Å; A364-F366 VanDerWaalsContact O-N 3.11Å; A364-L367 PolarHBondContact O-N 3.22Å; A364-Y370 VanDerWaalsContact C-CD1 3.45Å; A364-Y370 HydrophobicContact CB-CD1 3.62Å; A364-Y370 HydrophobicContact CB-CD2 4.05Å; A364-Y370 HydrophobicContact CB-CE1 3.29Å; A364-Y370 HydrophobicContact CB-CE2 3.76Å; A364-Y370 HydrophobicContact CB-CG 3.95Å; A364-Y370 WeakPolarHBondContact O-CB 3.31Å
365	C	64.6	Low	59.3	Low	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-4.2	172.8	-74.5	0	0	0	0	113.8	Q318 L355 I361 L367 Y370 C371	Q318-C365 HydrophobicContact CG-CB 4.16Å; L355-C365 HydrophobicContact CD2-CB 3.99Å; I361-C365 WeakPolarHBondContact O-CB 3.41Å; I361-C365 PolarHBondContact O-N 2.96Å; I361-C365 PolarHBondContact O-SG 3.15Å; C365-L367 PolarHBondContact O-N 3.39Å; C365-Y370 HydrophobicContact CB-CD1 4.44Å; C365-C371 VanDerWaalsContact CA-SG 3.59Å; C365-C371 WeakPolarHBondContact CB-SG 3.49Å; C365-C371 PolarHBondContact O-SG 3.42Å
366	F	66.2	Low	59.2	Low	69 Å²	69	37.1 Å²	37.1	30%	0.303	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-36.9	160.3	173.9	-97.2	0	0	0	111.7	C310 G311 F312 A362 A363 A364 P368	C310-F366 WeakPolarHBondContact O-CE2 3.31Å; C310-F366 WeakPolarHBondContact O-CZ 3.39Å; G311-F366 WeakPolarHBondContact CA-O 3.16Å; F312-F366 PolarHBondContact N-O 2.98Å; A362-F366 PolarHBondContact O-N 3.37Å; A363-F366 WeakPolarHBondContact O-CB 3.32Å; A364-F366 PolarHBondContact O-N 2.99Å; A364-F366 VanDerWaalsContact O-N 3.11Å; F366-P368 WeakPolarHBondContact O-CD 3.48Å
367	L	60.8	Low	59.1	Low	51 Å²	51	31.8 Å²	31.8	27%	0.267	18%	0.182	S	C	.	.	S	Bend	trans	-87.1	119.1	176.6	-62.8	176.1	0	0	0	110.5	T170 A364 C365 S369 Y370 C371	T170-L367 HydrophobicContact CG2-CD2 3.88Å; A364-L367 PolarHBondContact O-N 3.22Å; C365-L367 PolarHBondContact O-N 3.39Å; L367-S369 PolarHBondContact O-N 3.03Å; L367-S369 VanDerWaalsContact O-N 3.14Å; L367-Y370 WeakPolarHBondContact O-CA 3.44Å; L367-Y370 WeakPolarHBondContact O-CB 3.37Å; L367-Y370 PolarHBondContact O-N 3.29Å; L367-C371 PolarHBondContact O-N 2.84Å; L367-C371 VanDerWaalsContact O-N 3.15Å
368	P	70.2	Confident	59.6	Low	19 Å²	19	29.6 Å²	29.6	12%	0.123	16%	0.157	C	C	.	.	H	α-helix	trans	-53.9	-33.2	174.6	-29.7	36	0	0	0	114.2	G169 F312 F366 Y370 C371 W372	G169-P368 WeakPolarHBondContact O-CD 3.42Å; F312-P368 HydrophobicContact CD1-CG 4.09Å; F312-P368 HydrophobicContact CD2-CB 4.27Å; F312-P368 HydrophobicContact CD2-CG 4.01Å; F312-P368 HydrophobicContact CE1-CB 4.37Å; F312-P368 HydrophobicContact CE1-CG 3.87Å; F312-P368 HydrophobicContact CE2-CB 3.68Å; F312-P368 HydrophobicContact CE2-CG 3.81Å; F312-P368 HydrophobicContact CG-CG 4.15Å; F312-P368 HydrophobicContact CZ-CB 3.73Å; F312-P368 HydrophobicContact CZ-CG 3.73Å; F366-P368 WeakPolarHBondContact O-CD 3.48Å; P368-Y370 PolarHBondContact O-N 3.01Å; P368-C371 PolarHBondContact O-N 3.5Å; P368-W372 PolarHBondContact O-N 3.36Å
369	S	63.7	Low	59.4	Low	56 Å²	56	31 Å²	31	39%	0.392	16%	0.163	S	C	.	.	H	α-helix	trans	-62.1	-32.6	174.5	56.6	0	0	0	0	113	G169 L367 L373	G169-S369 WeakPolarHBondContact CA-OG 3.45Å; G169-S369 PolarHBondContact O-N 3.08Å; G169-S369 PolarHBondContact O-OG 3.01Å; L367-S369 PolarHBondContact O-N 3.03Å; L367-S369 VanDerWaalsContact O-N 3.14Å; S369-L373 PolarHBondContact O-N 2.83Å; S369-L373 VanDerWaalsContact O-N 3.13Å
370	Y	65.1	Low	59	Low	22 Å²	22	28.3 Å²	28.3	9%	0.086	15%	0.15	C	C	.	.	H	α-helix	trans	-76.4	-41.4	175.7	-170.5	-92.1	0	0	0	111.1	A364 C365 L367 P368 W372 L373 V374 L391 I394	A364-Y370 VanDerWaalsContact C-CD1 3.45Å; A364-Y370 HydrophobicContact CB-CD1 3.62Å; A364-Y370 HydrophobicContact CB-CD2 4.05Å; A364-Y370 HydrophobicContact CB-CE1 3.29Å; A364-Y370 HydrophobicContact CB-CE2 3.76Å; A364-Y370 HydrophobicContact CB-CG 3.95Å; A364-Y370 WeakPolarHBondContact O-CB 3.31Å; C365-Y370 HydrophobicContact CB-CD1 4.44Å; L367-Y370 WeakPolarHBondContact O-CA 3.44Å; L367-Y370 WeakPolarHBondContact O-CB 3.37Å; L367-Y370 PolarHBondContact O-N 3.29Å; P368-Y370 PolarHBondContact O-N 3.01Å; Y370-W372 VanDerWaalsContact C-N 3.25Å; Y370-W372 PolarHBondContact O-N 3.2Å; Y370-L373 WeakPolarHBondContact O-CB 3.12Å; Y370-L373 PolarHBondContact O-N 2.94Å; Y370-V374 HydrophobicContact CD1-CG2 3.72Å; Y370-V374 HydrophobicContact CE1-CG2 3.51Å; Y370-V374 WeakPolarHBondContact O-CG2 3.23Å; Y370-V374 PolarHBondContact O-N 2.86Å; Y370-L391 HydrophobicContact CD2-CD1 4.15Å; Y370-L391 HydrophobicContact CE2-CD1 3.95Å; Y370-I394 HydrophobicContact CE1-CD1 4.32Å; Y370-I394 HydrophobicContact CE2-CD1 3.56Å; Y370-I394 WeakPolarHBondContact OH-CD1 3.43Å
371	C	68.3	Low	58.4	Low	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.8	-41.5	171	-68.2	0	0	0	0	111.9	F312 Y321 F322 C365 L367 P368 V374 C375	F312-C371 HydrophobicContact CD2-CB 4.34Å; F312-C371 HydrophobicContact CE2-CB 4.11Å; Y321-C371 HydrophobicContact CD1-CB 3.48Å; Y321-C371 VanDerWaalsContact CD1-CB 3.48Å; Y321-C371 HydrophobicContact CE1-CB 3.54Å; Y321-C371 HydrophobicContact CG-CB 4.33Å; F322-C371 HydrophobicContact CE1-CB 3.77Å; F322-C371 HydrophobicContact CZ-CB 4.25Å; C365-C371 VanDerWaalsContact CA-SG 3.59Å; C365-C371 WeakPolarHBondContact CB-SG 3.49Å; C365-C371 PolarHBondContact O-SG 3.42Å; L367-C371 PolarHBondContact O-N 2.84Å; L367-C371 VanDerWaalsContact O-N 3.15Å; P368-C371 PolarHBondContact O-N 3.5Å; C371-V374 PolarHBondContact O-N 2.89Å; C371-C375 WeakPolarHBondContact O-CB 3.1Å; C371-C375 PolarHBondContact O-N 3.47Å
372	W	70.5	Confident	57.9	Low	34 Å²	34	33 Å²	33	13%	0.129	17%	0.172	C	C	.	.	H	α-helix	trans	-58.8	-47.3	172.8	174.2	85.9	0	0	0	112.1	F100 Y321 P368 Y370 V374 C375 A376 V491	F100-W372 AromaticContact CD2-CZ2 3.97Å; F100-W372 HydrophobicContact CD2-CZ2 3.97Å; F100-W372 HydrophobicContact CE2-CH2 4.14Å; F100-W372 AromaticContact CE2-CZ2 3.75Å; F100-W372 HydrophobicContact CE2-CZ2 3.75Å; Y321-W372 WeakPolarHBondContact OH-CA 3.37Å; Y321-W372 WeakPolarHBondContact OH-CB 3.09Å; P368-W372 PolarHBondContact O-N 3.36Å; Y370-W372 VanDerWaalsContact C-N 3.25Å; Y370-W372 PolarHBondContact O-N 3.2Å; W372-V374 PolarHBondContact O-N 2.78Å; W372-C375 WeakPolarHBondContact O-CB 3.32Å; W372-C375 PolarHBondContact O-N 2.98Å; W372-A376 WeakPolarHBondContact O-CB 3.31Å; W372-A376 PolarHBondContact O-N 3.38Å; W372-V491 HydrophobicContact CH2-CG2 4.06Å; W372-V491 HydrophobicContact CZ3-CG2 4.25Å
373	L	63.5	Low	56.9	Low	4 Å²	4	34.3 Å²	34.3	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-39.8	179.3	-171	70	0	0	0	112.1	S369 Y370 A376 T377 I394 Y395	S369-L373 PolarHBondContact O-N 2.83Å; S369-L373 VanDerWaalsContact O-N 3.13Å; Y370-L373 WeakPolarHBondContact O-CB 3.12Å; Y370-L373 PolarHBondContact O-N 2.94Å; L373-A376 PolarHBondContact O-N 3.28Å; L373-T377 WeakPolarHBondContact O-CB 3.38Å; L373-T377 WeakPolarHBondContact O-CG2 3.36Å; L373-T377 PolarHBondContact O-N 2.97Å; L373-T377 PolarHBondContact O-OG1 3.27Å; L373-I394 HydrophobicContact CD2-CB 4.39Å; L373-I394 HydrophobicContact CD2-CG2 3.46Å; L373-I394 VanDerWaalsContact CD2-CG2 3.46Å; L373-I394 HydrophobicContact CG-CG2 3.67Å; L373-Y395 HydrophobicContact CD2-CD2 3.83Å; L373-Y395 HydrophobicContact CD2-CE2 3.36Å
374	V	63.6	Low	56	Low	11 Å²	11	38.8 Å²	38.8	7%	0.067	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-44	174.5	170.1	0	0	0	0	110.7	F322 L351 Y370 C371 W372 T377 L378	F322-V374 HydrophobicContact CE1-CB 4.36Å; F322-V374 HydrophobicContact CE1-CG1 4.13Å; F322-V374 HydrophobicContact CZ-CB 4.34Å; F322-V374 HydrophobicContact CZ-CG1 3.9Å; L351-V374 HydrophobicContact CD2-CG1 3.83Å; Y370-V374 HydrophobicContact CD1-CG2 3.72Å; Y370-V374 HydrophobicContact CE1-CG2 3.51Å; Y370-V374 WeakPolarHBondContact O-CG2 3.23Å; Y370-V374 PolarHBondContact O-N 2.86Å; C371-V374 PolarHBondContact O-N 2.89Å; W372-V374 PolarHBondContact O-N 2.78Å; V374-T377 WeakPolarHBondContact CA-OG1 3.05Å; V374-T377 PolarHBondContact O-N 2.85Å; V374-T377 PolarHBondContact O-OG1 3.17Å; V374-L378 HydrophobicContact CG1-CD1 3.5Å; V374-L378 VanDerWaalsContact CG1-CD1 3.5Å; V374-L378 HydrophobicContact CG1-CG 4.43Å; V374-L378 VanDerWaalsContact O-CB 3.24Å; V374-L378 WeakPolarHBondContact O-CB 3.37Å; V374-L378 WeakPolarHBondContact O-CG 3.49Å; V374-L378 PolarHBondContact O-N 2.8Å
375	C	63	Low	55.3	Low	5 Å²	5	39.1 Å²	39.1	3%	0.034	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-45.7	172.3	-86.1	0	0	0	0	112.3	F322 R325 C371 W372 T377 L378 H379	F322-C375 WeakPolarHBondContact CD1-SG 3.27Å; R325-C375 HydrophobicContact CG-CB 4.13Å; C371-C375 WeakPolarHBondContact O-CB 3.1Å; C371-C375 PolarHBondContact O-N 3.47Å; W372-C375 WeakPolarHBondContact O-CB 3.32Å; W372-C375 PolarHBondContact O-N 2.98Å; C375-T377 VanDerWaalsContact C-N 3.26Å; C375-T377 PolarHBondContact O-N 2.81Å; C375-L378 PolarHBondContact O-N 3.3Å; C375-H379 WeakPolarHBondContact O-CB 3.16Å; C375-H379 PolarHBondContact O-N 3.25Å
376	A	58.3	Low	54.2	Low	10 Å²	10	43.4 Å²	43.4	8%	0.083	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-34.5	-179.5	0	0	0	0	0	112	W372 L373 F380 F398	W372-A376 WeakPolarHBondContact O-CB 3.31Å; W372-A376 PolarHBondContact O-N 3.38Å; L373-A376 PolarHBondContact O-N 3.28Å; A376-F380 WeakPolarHBondContact O-CD2 2.82Å; A376-F398 HydrophobicContact CB-CE2 4.22Å
377	T	53.5	Low	52.9	Low	8 Å²	8	44 Å²	44	5%	0.049	26%	0.257	C	S	.	.	H	α-helix	trans	-79.4	-39.8	176.9	47	0	0	0	0	112.8	L373 V374 C375 F380 L381 I394 F398	L373-T377 WeakPolarHBondContact O-CB 3.38Å; L373-T377 WeakPolarHBondContact O-CG2 3.36Å; L373-T377 PolarHBondContact O-N 2.97Å; L373-T377 PolarHBondContact O-OG1 3.27Å; V374-T377 WeakPolarHBondContact CA-OG1 3.05Å; V374-T377 PolarHBondContact O-N 2.85Å; V374-T377 PolarHBondContact O-OG1 3.17Å; C375-T377 VanDerWaalsContact C-N 3.26Å; C375-T377 PolarHBondContact O-N 2.81Å; T377-F380 PolarHBondContact O-N 3.2Å; T377-L381 PolarHBondContact O-N 2.92Å; T377-I394 HydrophobicContact CG2-CG2 4.07Å; T377-F398 HydrophobicContact CG2-CB 3.64Å; T377-F398 HydrophobicContact CG2-CD2 3.83Å; T377-F398 HydrophobicContact CG2-CG 4.2Å
378	L	53.9	Low	52.4	Low	10 Å²	10	43.2 Å²	43.2	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-78.4	-24.1	179.6	-74	167.2	0	0	0	114.4	L351 V374 C375 F380 L381 T385	L351-L378 HydrophobicContact CD1-CD1 3.71Å; L351-L378 HydrophobicContact CD2-CD1 3.1Å; L351-L378 HydrophobicContact CG-CD1 3.57Å; V374-L378 HydrophobicContact CG1-CD1 3.5Å; V374-L378 VanDerWaalsContact CG1-CD1 3.5Å; V374-L378 HydrophobicContact CG1-CG 4.43Å; V374-L378 VanDerWaalsContact O-CB 3.24Å; V374-L378 WeakPolarHBondContact O-CB 3.37Å; V374-L378 WeakPolarHBondContact O-CG 3.49Å; V374-L378 PolarHBondContact O-N 2.8Å; C375-L378 PolarHBondContact O-N 3.3Å; L378-F380 PolarHBondContact O-N 2.85Å; L378-L381 PolarHBondContact O-N 2.85Å; L378-T385 HydrophobicContact CD2-CG2 4.14Å
379	H	44.4	Very low	51.9	Low	94 Å²	94	44 Å²	44	44%	0.435	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-14.8	170.3	-162.5	75.5	0	0	0	112.2	C375	C375-H379 WeakPolarHBondContact O-CB 3.16Å; C375-H379 PolarHBondContact O-N 3.25Å
380	F	39.3	Very low	52	Low	78 Å²	78	41.6 Å²	41.6	34%	0.342	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-14.1	177.5	-70.2	-66.2	0	0	0	115.2	M1 A376 T377 L378 L401	M1-F380 VanDerWaalsContact N-CE1 3.27Å; A376-F380 WeakPolarHBondContact O-CD2 2.82Å; T377-F380 PolarHBondContact O-N 3.2Å; L378-F380 PolarHBondContact O-N 2.85Å; F380-L401 HydrophobicContact CB-CB 4.49Å; F380-L401 HydrophobicContact CB-CD1 4.06Å; F380-L401 HydrophobicContact CB-CD2 4.1Å; F380-L401 HydrophobicContact CB-CG 4.44Å
381	L	38.9	Very low	52.2	Low	42 Å²	42	42.3 Å²	42.3	22%	0.22	25%	0.251	C	S	.	.			trans	-102.9	89.7	178.1	-71.8	165.7	0	0	0	110.4	T377 L378 A383 L401	T377-L381 PolarHBondContact O-N 2.92Å; L378-L381 PolarHBondContact O-N 2.85Å; L381-A383 PolarHBondContact O-N 3.28Å; L381-L401 HydrophobicContact CD1-CD1 3.8Å; L381-L401 HydrophobicContact CD2-CD1 4.19Å; L381-L401 HydrophobicContact CD2-CD2 3.69Å; L381-L401 HydrophobicContact CD2-CG 4.33Å; L381-L401 HydrophobicContact CG-CD1 3.61Å; L381-L401 HydrophobicContact CG-CD2 3.93Å; L381-L401 HydrophobicContact CG-CG 4.28Å
382	H	42	Very low	52.4	Low	132 Å²	132	42.3 Å²	42.3	61%	0.611	25%	0.251	S	S	*	.			trans	-67.6	52.4	161.8	-72.5	-95.4	0	0	0	111.5
383	A	35.6	Very low	52.5	Low	44 Å²	44	41 Å²	41	36%	0.364	25%	0.247	S	C	.	.	S	Bend	trans	-147.7	140.4	179	0	0	0	0	0	111.9	L381 T385	L381-A383 PolarHBondContact O-N 3.28Å; A383-T385 PolarHBondContact O-N 3.37Å
384	P	34.5	Very low	52.7	Low	108 Å²	108	41 Å²	41	70%	0.701	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-61.4	126.6	172.9	25.8	-32.1	0	0	0	109.8
385	T	42.3	Very low	53.1	Low	25 Å²	25	41.3 Å²	41.3	15%	0.153	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-68.1	126.3	178.2	41.3	0	0	0	0	110.4	N354 L378 A383	N354-T385 PolarHBondContact ND2-OG1 2.97Å; L378-T385 HydrophobicContact CD2-CG2 4.14Å; A383-T385 PolarHBondContact O-N 3.37Å
386	P	41.5	Very low	53.7	Low	90 Å²	90	41.1 Å²	41.1	58%	0.584	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-66	147	173.7	26.2	-31.5	0	0	0	110.8
387	A	37.3	Very low	54.2	Low	82 Å²	82	41.2 Å²	41.2	68%	0.678	25%	0.245	S	C	*	.	S	Bend	trans	-57.3	134.6	176.7	0	0	0	0	0	111.6
388	G	50.1	Low	54.9	Low	34 Å²	34	41.1 Å²	41.1	35%	0.351	24%	0.244	S	C	.	.			trans	99.1	28.4	174.3	0	0	0	0	0	116.7	T390	G388-T390 PolarHBondContact O-N 3.37Å
389	Q	60	Low	55.8	Low	36 Å²	36	40.6 Å²	40.6	17%	0.168	24%	0.242	C	C	.	.			trans	-66.8	117.4	172.4	-76.6	-169.3	-7.3	0	0	111	I394	Q389-I394 HydrophobicContact CB-CG1 4.31Å
390	T	67.2	Low	57	Low	4 Å²	4	40.8 Å²	40.8	3%	0.025	24%	0.238	C	C	.	.			trans	-82.6	166.7	171.9	79.7	0	0	0	0	111	G388 T392 S393 I394 Y680 E681 Q683	G388-T390 PolarHBondContact O-N 3.37Å; T390-T392 PolarHBondContact O-N 3.14Å; T390-S393 WeakPolarHBondContact O-CB 3.47Å; T390-S393 PolarHBondContact O-N 3.46Å; T390-S393 PolarHBondContact OG1-N 2.87Å; T390-I394 PolarHBondContact O-N 3.4Å; T390-Y680 HydrophobicContact CG2-CE1 4.41Å; T390-E681 VanDerWaalsContact CB-CD 3.42Å; T390-E681 WeakPolarHBondContact CB-OE1 3.47Å; T390-E681 WeakPolarHBondContact CB-OE2 3.43Å; T390-E681 PolarHBondContact OG1-OE2 2.84Å; T390-Q683 HydrophobicContact CG2-CG 3.49Å; T390-Q683 VanDerWaalsContact CG2-CG 3.49Å; T390-Q683 VanDerWaalsContact CG2-NE2 3.31Å
391	L	67.4	Low	58.2	Low	38 Å²	38	39.1 Å²	39.1	20%	0.199	23%	0.233	C	C	.	.	H	α-helix	trans	-56.6	-43.4	178.9	-179.6	64.7	0	0	0	110.4	Y370 S393 I394 Y395 L619 I622 F623 E681	Y370-L391 HydrophobicContact CD2-CD1 4.15Å; Y370-L391 HydrophobicContact CE2-CD1 3.95Å; L391-S393 VanDerWaalsContact C-N 3.31Å; L391-S393 PolarHBondContact O-N 3.31Å; L391-I394 PolarHBondContact O-N 3.25Å; L391-Y395 HydrophobicContact CD1-CD2 4.3Å; L391-Y395 HydrophobicContact CD1-CE2 3.97Å; L391-Y395 HydrophobicContact CG-CD2 4.48Å; L391-Y395 HydrophobicContact CG-CE2 4.45Å; L391-Y395 WeakPolarHBondContact O-CD2 3.35Å; L391-Y395 PolarHBondContact O-N 2.83Å; L391-L619 HydrophobicContact CD2-CD1 4.46Å; L391-L619 HydrophobicContact CD2-CD2 3.81Å; L391-I622 HydrophobicContact CD2-CG2 4.39Å; L391-F623 HydrophobicContact CD2-CE1 4.02Å; L391-F623 HydrophobicContact CD2-CZ 4.1Å; L391-F623 HydrophobicContact CG-CE1 3.87Å; L391-F623 HydrophobicContact CG-CZ 4.28Å; L391-E681 WeakPolarHBondContact CB-OE1 2.97Å; L391-E681 PolarHBondContact N-OE1 3.44Å
392	T	73.3	Confident	59.4	Low	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-35	178	-46.6	0	0	0	0	112.5	T390 I394 Y395 T396 Y497 F623 G626 L627 E681	T390-T392 PolarHBondContact O-N 3.14Å; T392-I394 VanDerWaalsContact C-N 3.29Å; T392-I394 PolarHBondContact O-N 3.29Å; T392-Y395 PolarHBondContact O-N 2.9Å; T392-T396 VanDerWaalsContact O-CB 3.28Å; T392-T396 WeakPolarHBondContact O-CB 3.46Å; T392-T396 PolarHBondContact O-N 3.36Å; T392-T396 PolarHBondContact O-OG1 3.31Å; T392-Y497 HydrophobicContact CG2-CD2 4.37Å; T392-Y497 HydrophobicContact CG2-CE2 3.85Å; T392-F623 HydrophobicContact CG2-CD1 4.09Å; T392-F623 WeakPolarHBondContact OG1-CD1 3.23Å; T392-G626 WeakPolarHBondContact OG1-CA 3.45Å; T392-L627 HydrophobicContact CG2-CD2 4Å; T392-L627 HydrophobicContact CG2-CG 3.82Å; T392-E681 WeakPolarHBondContact CB-OE2 3.41Å; T392-E681 PolarHBondContact N-OE2 3.35Å; T392-E681 VanDerWaalsContact N-OE2 3.16Å; T392-E681 PolarHBondContact OG1-OE2 2.96Å
393	S	72.4	Confident	60.7	Low	6 Å²	6	33 Å²	33	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-35.9	178.2	-176.9	0	0	0	0	112.4	T390 L391 T396 S397 N632	T390-S393 WeakPolarHBondContact O-CB 3.47Å; T390-S393 PolarHBondContact O-N 3.46Å; T390-S393 PolarHBondContact OG1-N 2.87Å; L391-S393 VanDerWaalsContact C-N 3.31Å; L391-S393 PolarHBondContact O-N 3.31Å; S393-T396 PolarHBondContact O-N 2.92Å; S393-S397 VanDerWaalsContact O-CB 3.25Å; S393-S397 WeakPolarHBondContact O-CB 3.45Å; S393-S397 PolarHBondContact O-N 2.98Å; S393-S397 PolarHBondContact O-OG 2.79Å; S393-N632 VanDerWaalsContact CA-OD1 3.28Å; S393-N632 WeakPolarHBondContact CA-OD1 3.17Å
394	I	67.9	Low	61.7	Low	3 Å²	3	34.1 Å²	34.1	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-68.3	-47.8	178.2	-64.1	169.8	0	0	0	110.4	Y370 L373 T377 Q389 T390 L391 T392 T396 S397 F398	Y370-I394 HydrophobicContact CE1-CD1 4.32Å; Y370-I394 HydrophobicContact CE2-CD1 3.56Å; Y370-I394 WeakPolarHBondContact OH-CD1 3.43Å; L373-I394 HydrophobicContact CD2-CB 4.39Å; L373-I394 HydrophobicContact CD2-CG2 3.46Å; L373-I394 VanDerWaalsContact CD2-CG2 3.46Å; L373-I394 HydrophobicContact CG-CG2 3.67Å; T377-I394 HydrophobicContact CG2-CG2 4.07Å; Q389-I394 HydrophobicContact CB-CG1 4.31Å; T390-I394 PolarHBondContact O-N 3.4Å; L391-I394 PolarHBondContact O-N 3.25Å; T392-I394 VanDerWaalsContact C-N 3.29Å; T392-I394 PolarHBondContact O-N 3.29Å; I394-T396 VanDerWaalsContact C-N 3.33Å; I394-T396 PolarHBondContact O-N 3.26Å; I394-S397 PolarHBondContact O-N 2.99Å; I394-F398 VanDerWaalsContact O-CB 3.26Å; I394-F398 WeakPolarHBondContact O-CB 3.31Å; I394-F398 PolarHBondContact O-N 3.29Å
395	Y	72	Confident	62.5	Low	19 Å²	19	30.9 Å²	30.9	8%	0.075	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-40.9	175.4	-84.2	-97.1	0	0	0	112.1	L373 L391 T392 F398 L399 V491 A493 M494 Y497 F623	L373-Y395 HydrophobicContact CD2-CD2 3.83Å; L373-Y395 HydrophobicContact CD2-CE2 3.36Å; L391-Y395 HydrophobicContact CD1-CD2 4.3Å; L391-Y395 HydrophobicContact CD1-CE2 3.97Å; L391-Y395 HydrophobicContact CG-CD2 4.48Å; L391-Y395 HydrophobicContact CG-CE2 4.45Å; L391-Y395 WeakPolarHBondContact O-CD2 3.35Å; L391-Y395 PolarHBondContact O-N 2.83Å; T392-Y395 PolarHBondContact O-N 2.9Å; Y395-F398 WeakPolarHBondContact O-CB 3.36Å; Y395-F398 PolarHBondContact O-N 3.22Å; Y395-L399 WeakPolarHBondContact O-CG 3.42Å; Y395-L399 PolarHBondContact O-N 3.2Å; Y395-V491 HydrophobicContact CE1-CG1 4.33Å; Y395-A493 HydrophobicContact CE1-CB 4.31Å; Y395-A493 VanDerWaalsContact OH-CB 3.25Å; Y395-A493 WeakPolarHBondContact OH-CB 3.26Å; Y395-M494 HydrophobicContact CD1-CE 3.74Å; Y395-M494 HydrophobicContact CD1-SD 4.11Å; Y395-M494 HydrophobicContact CE1-CE 4Å; Y395-Y497 VanDerWaalsContact CB-CD2 3.47Å; Y395-Y497 HydrophobicContact CD1-CD2 4.42Å; Y395-Y497 HydrophobicContact CD1-CG 4.36Å; Y395-Y497 HydrophobicContact CG-CD2 4.09Å; Y395-Y497 HydrophobicContact CG-CG 4.48Å; Y395-F623 AromaticContact CD2-CE1 3.84Å; Y395-F623 HydrophobicContact CD2-CE1 3.84Å; Y395-F623 HydrophobicContact CD2-CZ 4Å; Y395-F623 HydrophobicContact CE2-CE1 4.28Å; Y395-F623 HydrophobicContact CE2-CZ 4.02Å; Y395-F623 HydrophobicContact CG-CE1 4.18Å; Y395-F623 HydrophobicContact CG-CZ 4.36Å
396	T	75.6	Confident	62.7	Low	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-41.7	178.5	-53.8	0	0	0	0	111.6	T392 S393 I394 L399 R400 Y497 N632 V635 L636	T392-T396 VanDerWaalsContact O-CB 3.28Å; T392-T396 WeakPolarHBondContact O-CB 3.46Å; T392-T396 PolarHBondContact O-N 3.36Å; T392-T396 PolarHBondContact O-OG1 3.31Å; S393-T396 PolarHBondContact O-N 2.92Å; I394-T396 VanDerWaalsContact C-N 3.33Å; I394-T396 PolarHBondContact O-N 3.26Å; T396-L399 PolarHBondContact O-N 3.31Å; T396-R400 PolarHBondContact O-N 2.87Å; T396-Y497 WeakPolarHBondContact CA-OH 3.28Å; T396-Y497 WeakPolarHBondContact CB-OH 3.33Å; T396-Y497 PolarHBondContact OG1-OH 3.34Å; T396-N632 HydrophobicContact CG2-CB 4.16Å; T396-V635 HydrophobicContact CG2-CB 3.91Å; T396-V635 HydrophobicContact CG2-CG1 3.72Å; T396-L636 HydrophobicContact CG2-CD1 4.39Å; T396-L636 HydrophobicContact CG2-CD2 4.01Å; T396-L636 HydrophobicContact CG2-CG 3.78Å
397	S	68.2	Low	62.6	Low	13 Å²	13	32 Å²	32	9%	0.091	20%	0.199	C	C	.	.	H	α-helix	trans	-67.8	-38	175.4	-60.8	0	0	0	0	111.9	S393 I394 R400 L401	S393-S397 VanDerWaalsContact O-CB 3.25Å; S393-S397 WeakPolarHBondContact O-CB 3.45Å; S393-S397 PolarHBondContact O-N 2.98Å; S393-S397 PolarHBondContact O-OG 2.79Å; I394-S397 PolarHBondContact O-N 2.99Å; S397-R400 WeakPolarHBondContact O-CB 3.4Å; S397-R400 PolarHBondContact O-N 3.38Å; S397-L401 VanDerWaalsContact O-CG 3.31Å; S397-L401 WeakPolarHBondContact O-CG 3.32Å; S397-L401 PolarHBondContact O-N 2.98Å
398	F	69.3	Low	62.6	Low	5 Å²	5	34.7 Å²	34.7	2%	0.022	20%	0.201	C	C	.	.	H	α-helix	trans	-59.5	-47.5	174.2	177.7	-106.6	0	0	0	111.5	F100 A376 T377 I394 Y395 R400 L401 N402 F473 M494	F100-F398 AromaticContact CE1-CE2 3.79Å; F100-F398 HydrophobicContact CE1-CE2 3.79Å; F100-F398 AromaticContact CE1-CZ 3.81Å; F100-F398 HydrophobicContact CE1-CZ 3.81Å; F100-F398 HydrophobicContact CZ-CE2 4.06Å; F100-F398 AromaticContact CZ-CZ 3.65Å; F100-F398 HydrophobicContact CZ-CZ 3.65Å; A376-F398 HydrophobicContact CB-CE2 4.22Å; T377-F398 HydrophobicContact CG2-CB 3.64Å; T377-F398 HydrophobicContact CG2-CD2 3.83Å; T377-F398 HydrophobicContact CG2-CG 4.2Å; I394-F398 VanDerWaalsContact O-CB 3.26Å; I394-F398 WeakPolarHBondContact O-CB 3.31Å; I394-F398 PolarHBondContact O-N 3.29Å; Y395-F398 WeakPolarHBondContact O-CB 3.36Å; Y395-F398 PolarHBondContact O-N 3.22Å; F398-R400 VanDerWaalsContact C-N 3.34Å; F398-R400 PolarHBondContact O-N 2.74Å; F398-L401 PolarHBondContact O-N 2.96Å; F398-N402 WeakPolarHBondContact CE2-ND2 3.32Å; F398-N402 PolarHBondContact O-N 3.18Å; F398-N402 PolarHBondContact O-ND2 2.94Å; F398-F473 HydrophobicContact CD1-CZ 4.09Å; F398-F473 HydrophobicContact CE1-CE1 4.13Å; F398-F473 AromaticContact CE1-CE2 3.88Å; F398-F473 HydrophobicContact CE1-CE2 3.88Å; F398-F473 AromaticContact CE1-CZ 3.25Å; F398-F473 HydrophobicContact CE1-CZ 3.25Å; F398-F473 AromaticContact CZ-CE2 3.81Å; F398-F473 HydrophobicContact CZ-CE2 3.81Å; F398-F473 AromaticContact CZ-CZ 3.69Å; F398-F473 HydrophobicContact CZ-CZ 3.69Å; F398-M494 HydrophobicContact CD1-CE 3.84Å; F398-M494 HydrophobicContact CE1-CE 3.82Å
399	L	72.6	Confident	61.9	Low	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-39.1	175.2	-68.3	174.2	0	0	0	112	Y395 T396 L401 N402 F403 M419 F473 F474 M494 Y497 L639	Y395-L399 WeakPolarHBondContact O-CG 3.42Å; Y395-L399 PolarHBondContact O-N 3.2Å; T396-L399 PolarHBondContact O-N 3.31Å; L399-L401 VanDerWaalsContact C-N 3.31Å; L399-L401 PolarHBondContact O-N 3.41Å; L399-N402 PolarHBondContact O-N 3.02Å; L399-F403 HydrophobicContact CD2-CD2 4.16Å; L399-F403 HydrophobicContact CD2-CE2 3.88Å; L399-F403 WeakPolarHBondContact O-CD2 3.36Å; L399-F403 PolarHBondContact O-N 3.1Å; L399-M419 HydrophobicContact CB-SD 4.31Å; L399-M419 HydrophobicContact CD1-CE 3.8Å; L399-M419 HydrophobicContact CD1-SD 4.31Å; L399-M419 HydrophobicContact CD2-CE 4.38Å; L399-M419 HydrophobicContact CD2-SD 4.11Å; L399-M419 HydrophobicContact CG-SD 4.49Å; L399-F473 HydrophobicContact CD2-CE1 3.9Å; L399-F473 HydrophobicContact CD2-CZ 4.29Å; L399-F474 HydrophobicContact CD2-CE1 4.15Å; L399-F474 HydrophobicContact CD2-CZ 4.36Å; L399-M494 HydrophobicContact CD1-SD 4.43Å; L399-M494 HydrophobicContact CD2-CE 4.19Å; L399-M494 HydrophobicContact CD2-SD 4.2Å; L399-Y497 HydrophobicContact CD1-CD1 3.9Å; L399-Y497 HydrophobicContact CD1-CE1 3.19Å; L399-L639 HydrophobicContact CB-CD1 4.17Å
400	R	70.4	Confident	60.7	Low	97 Å²	97	43.9 Å²	43.9	37%	0.366	25%	0.253	S	S	.	.	H	α-helix	trans	-53.8	-50.3	174.4	-170.6	-161.8	-177.1	-168.3	-7.7	111	T396 S397 F398 N402 F403 S404 V635 L639	T396-R400 PolarHBondContact O-N 2.87Å; S397-R400 WeakPolarHBondContact O-CB 3.4Å; S397-R400 PolarHBondContact O-N 3.38Å; F398-R400 VanDerWaalsContact C-N 3.34Å; F398-R400 PolarHBondContact O-N 2.74Å; R400-N402 VanDerWaalsContact C-N 3.31Å; R400-N402 PolarHBondContact O-N 3.04Å; R400-F403 PolarHBondContact O-N 2.61Å; R400-S404 WeakPolarHBondContact O-CA 3.24Å; R400-S404 WeakPolarHBondContact O-CB 3.06Å; R400-S404 PolarHBondContact O-N 3.46Å; R400-S404 PolarHBondContact O-OG 3.31Å; R400-V635 HydrophobicContact CB-CG1 3.67Å; R400-V635 HydrophobicContact CG-CG1 3.87Å; R400-L639 HydrophobicContact CB-CD1 4.18Å; R400-L639 HydrophobicContact CB-CD2 4.44Å; R400-L639 HydrophobicContact CB-CG 4.47Å
401	L	62.8	Low	59.3	Low	43 Å²	43	49.4 Å²	49.4	23%	0.225	29%	0.287	C	S	.	.	H	α-helix	trans	-63.3	-35.8	-177.4	-68.9	162.6	0	0	0	113.6	F380 L381 S397 F398 L399	F380-L401 HydrophobicContact CB-CB 4.49Å; F380-L401 HydrophobicContact CB-CD1 4.06Å; F380-L401 HydrophobicContact CB-CD2 4.1Å; F380-L401 HydrophobicContact CB-CG 4.44Å; L381-L401 HydrophobicContact CD1-CD1 3.8Å; L381-L401 HydrophobicContact CD2-CD1 4.19Å; L381-L401 HydrophobicContact CD2-CD2 3.69Å; L381-L401 HydrophobicContact CD2-CG 4.33Å; L381-L401 HydrophobicContact CG-CD1 3.61Å; L381-L401 HydrophobicContact CG-CD2 3.93Å; L381-L401 HydrophobicContact CG-CG 4.28Å; S397-L401 VanDerWaalsContact O-CG 3.31Å; S397-L401 WeakPolarHBondContact O-CG 3.32Å; S397-L401 PolarHBondContact O-N 2.98Å; F398-L401 PolarHBondContact O-N 2.96Å; L399-L401 VanDerWaalsContact C-N 3.31Å; L399-L401 PolarHBondContact O-N 3.41Å
402	N	64.1	Low	57.9	Low	33 Å²	33	53.7 Å²	53.7	18%	0.176	31%	0.31	C	S	.	.	H	α-helix	trans	-81.2	-26.9	-177.6	-72.6	-77.4	0	0	0	112.8	F398 L399 R400 F473	F398-N402 WeakPolarHBondContact CE2-ND2 3.32Å; F398-N402 PolarHBondContact O-N 3.18Å; F398-N402 PolarHBondContact O-ND2 2.94Å; L399-N402 PolarHBondContact O-N 3.02Å; R400-N402 VanDerWaalsContact C-N 3.31Å; R400-N402 PolarHBondContact O-N 3.04Å; N402-F473 HydrophobicContact CB-CE2 4.04Å; N402-F473 HydrophobicContact CB-CZ 4.09Å
403	F	69.6	Low	56.1	Low	14 Å²	14	59 Å²	59	6%	0.061	35%	0.354	C	S	.	.	H	α-helix	trans	-123.6	3.8	-171.4	-61	-80.7	0	0	0	115.1	L399 R400 G405 L418 M419 A470 F473 F474 L639	L399-F403 HydrophobicContact CD2-CD2 4.16Å; L399-F403 HydrophobicContact CD2-CE2 3.88Å; L399-F403 WeakPolarHBondContact O-CD2 3.36Å; L399-F403 PolarHBondContact O-N 3.1Å; R400-F403 PolarHBondContact O-N 2.61Å; F403-G405 PolarHBondContact O-N 3.16Å; F403-L418 HydrophobicContact CD1-CD2 4.24Å; F403-L418 HydrophobicContact CE1-CD2 4.21Å; F403-M419 HydrophobicContact CB-CB 3.89Å; F403-M419 HydrophobicContact CB-CG 4.46Å; F403-M419 HydrophobicContact CD2-SD 3.76Å; F403-M419 HydrophobicContact CE2-SD 4.17Å; F403-M419 HydrophobicContact CG-CB 4.21Å; F403-M419 HydrophobicContact CG-SD 4.11Å; F403-A470 HydrophobicContact CE1-CB 4.03Å; F403-F473 AromaticContact CE2-CD1 3.96Å; F403-F473 HydrophobicContact CE2-CD1 3.96Å; F403-F473 AromaticContact CE2-CE1 3.6Å; F403-F473 HydrophobicContact CE2-CE1 3.6Å; F403-F473 AromaticContact CE2-CZ 3.92Å; F403-F473 HydrophobicContact CE2-CZ 3.92Å; F403-F473 AromaticContact CZ-CD1 3.8Å; F403-F473 HydrophobicContact CZ-CD1 3.8Å; F403-F473 AromaticContact CZ-CE1 3.95Å; F403-F473 HydrophobicContact CZ-CE1 3.95Å; F403-F473 HydrophobicContact CZ-CG 4.21Å; F403-F473 HydrophobicContact CZ-CZ 4.46Å; F403-F474 HydrophobicContact CE1-CE2 4.19Å; F403-F474 HydrophobicContact CE1-CZ 4.43Å; F403-F474 HydrophobicContact CE2-CE2 4.18Å; F403-F474 AromaticContact CE2-CZ 3.69Å; F403-F474 HydrophobicContact CE2-CZ 3.69Å; F403-F474 AromaticContact CZ-CE2 3.49Å; F403-F474 HydrophobicContact CZ-CE2 3.49Å; F403-F474 VanDerWaalsContact CZ-CE2 3.49Å; F403-F474 AromaticContact CZ-CZ 3.5Å; F403-F474 HydrophobicContact CZ-CZ 3.5Å; F403-L639 HydrophobicContact CB-CD2 3.95Å
404	S	57.8	Low	54.9	Low	66 Å²	66	62.1 Å²	62.1	46%	0.462	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-4.6	-179.4	60.2	0	0	0	0	115.4	R400	R400-S404 WeakPolarHBondContact O-CA 3.24Å; R400-S404 WeakPolarHBondContact O-CB 3.06Å; R400-S404 PolarHBondContact O-N 3.46Å; R400-S404 PolarHBondContact O-OG 3.31Å
405	G	49.9	Very low	54.2	Low	40 Å²	40	69 Å²	69	41%	0.412	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-1.4	-176.8	0	0	0	0	0	115.4	F403	F403-G405 PolarHBondContact O-N 3.16Å
406	E	47.7	Very low	53.6	Low	35 Å²	35	70.8 Å²	70.8	16%	0.164	42%	0.423	C	S	.	.			trans	-114.8	26.9	-166.2	-63.7	177.3	147.3	0	0	113.8	L408 L418	E406-L408 VanDerWaalsContact C-N 3.28Å; E406-L408 PolarHBondContact O-N 3.23Å; E406-L408 VanDerWaalsContact O-N 3.12Å; E406-L418 WeakPolarHBondContact OE1-CD2 3.32Å; E406-L418 WeakPolarHBondContact OE2-CB 3.28Å; E406-L418 WeakPolarHBondContact OE2-CD2 3.28Å
407	T	39.9	Very low	53.6	Low	104 Å²	104	71.4 Å²	71.4	64%	0.638	43%	0.427	S	S	*	.			trans	-76.8	91.9	155.4	52.9	0	0	0	0	106.6	D409	T407-D409 PolarHBondContact O-N 3.36Å
408	L	37.6	Very low	54.1	Low	138 Å²	138	71 Å²	71	72%	0.723	42%	0.424	S	S	*	.			trans	-45.8	138.2	168.2	-76.2	153	0	0	0	109.1	E406 S410	E406-L408 VanDerWaalsContact C-N 3.28Å; E406-L408 PolarHBondContact O-N 3.23Å; E406-L408 VanDerWaalsContact O-N 3.12Å; L408-S410 PolarHBondContact O-N 2.76Å
409	D	33.4	Very low	54.7	Low	142 Å²	142	70.7 Å²	70.7	76%	0.759	42%	0.423	S	S	*	.			trans	-33.3	130.4	-168.7	-71.8	-47.9	0	0	0	115	T407 T411	T407-D409 PolarHBondContact O-N 3.36Å; D409-T411 PolarHBondContact O-N 3.1Å
410	S	35.4	Very low	55.1	Low	122 Å²	122	71.9 Å²	71.9	85%	0.853	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	45.7	-169	62.9	0	0	0	0	115.4	L408	L408-S410 PolarHBondContact O-N 2.76Å
411	T	39.1	Very low	55.8	Low	120 Å²	120	67.9 Å²	67.9	74%	0.736	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-11.5	175.9	48.1	0	0	0	0	115.5	D409	D409-T411 PolarHBondContact O-N 3.1Å
412	D	37.7	Very low	56.8	Low	127 Å²	127	65.9 Å²	65.9	68%	0.679	41%	0.407	S	S	*	.	S	Bend	trans	-121.9	140	179.7	-73.6	-41	0	0	0	113.3	S414	D412-S414 PolarHBondContact O-N 2.94Å
413	A	35.3	Very low	57.8	Low	113 Å²	113	64.3 Å²	64.3	93%	0.934	40%	0.398	S	S	*	.	S	Bend	trans	-71.5	12.3	-169.5	0	0	0	0	0	115.6
414	S	46.6	Very low	58.5	Low	71 Å²	71	68.8 Å²	68.8	50%	0.497	42%	0.415	S	S	.	.			trans	-104.6	72.3	175.1	51.4	0	0	0	0	110.5	D412 L416	D412-S414 PolarHBondContact O-N 2.94Å; S414-L416 PolarHBondContact O-N 3.47Å
415	N	52.4	Low	59.9	Low	148 Å²	148	65.9 Å²	65.9	79%	0.791	39%	0.394	S	S	*	.			trans	-63.3	71.4	171.9	-82	-29.9	0	0	0	111.8
416	L	61.3	Low	61.7	Low	55 Å²	55	64 Å²	64	29%	0.288	37%	0.374	S	S	.	.			trans	-88.3	106.6	171.7	-82.1	91.5	0	0	0	109.3	S414 E458 E459 L462	S414-L416 PolarHBondContact O-N 3.47Å; L416-E458 HydrophobicContact CD1-CB 4.33Å; L416-E458 HydrophobicContact CD2-CB 4.36Å; L416-E459 HydrophobicContact CD2-CG 4.05Å; L416-L462 HydrophobicContact CB-CD2 4.23Å; L416-L462 HydrophobicContact CD2-CB 4.43Å; L416-L462 HydrophobicContact CD2-CD2 3.92Å
417	S	74.7	Confident	63.6	Low	14 Å²	14	62.3 Å²	62.3	10%	0.098	37%	0.367	C	S	.	.			trans	-86.3	131.1	171.2	158.2	0	0	0	0	110.4	M419 A420 Y421 L639	S417-M419 PolarHBondContact O-N 2.83Å; S417-M419 PolarHBondContact OG-N 3.23Å; S417-M419 VanDerWaalsContact OG-N 3.16Å; S417-A420 WeakPolarHBondContact O-CB 3.47Å; S417-A420 PolarHBondContact O-N 3.49Å; S417-A420 VanDerWaalsContact O-N 3.1Å; S417-A420 PolarHBondContact OG-N 3.19Å; S417-Y421 PolarHBondContact O-N 3.2Å; S417-L639 WeakPolarHBondContact CB-O 3.41Å; S417-L639 PolarHBondContact OG-O 3.26Å
418	L	77.9	Confident	65.9	Low	3 Å²	3	60.1 Å²	60.1	2%	0.016	35%	0.348	C	S	.	.	H	α-helix	trans	-59.5	-37.4	172.9	-166.4	68.1	0	0	0	111.3	F403 E406 Y421 A422 L462 I465 F466 A470	F403-L418 HydrophobicContact CD1-CD2 4.24Å; F403-L418 HydrophobicContact CE1-CD2 4.21Å; E406-L418 WeakPolarHBondContact OE1-CD2 3.32Å; E406-L418 WeakPolarHBondContact OE2-CB 3.28Å; E406-L418 WeakPolarHBondContact OE2-CD2 3.28Å; L418-Y421 PolarHBondContact O-N 2.98Å; L418-A422 WeakPolarHBondContact O-CB 3.34Å; L418-A422 PolarHBondContact O-N 3.4Å; L418-L462 HydrophobicContact CD1-CD1 3.88Å; L418-L462 HydrophobicContact CD1-CG 4.05Å; L418-I465 HydrophobicContact CD1-CG2 4.18Å; L418-I465 HydrophobicContact CD2-CG2 4.48Å; L418-F466 HydrophobicContact CD1-CB 3.86Å; L418-F466 HydrophobicContact CD1-CD2 3.89Å; L418-F466 HydrophobicContact CD1-CG 4.39Å; L418-F466 HydrophobicContact CG-CD2 4.12Å; L418-A470 HydrophobicContact CD2-CB 3.72Å; L418-A470 HydrophobicContact CG-CB 4.49Å
419	M	82.8	Confident	68.3	Low	0 Å²	0	53.6 Å²	53.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-37.4	175.4	-174.4	62.4	-137.9	0	0	111.8	L399 F403 S417 Y421 A422 A423 F474 L498 L501 L639	L399-M419 HydrophobicContact CB-SD 4.31Å; L399-M419 HydrophobicContact CD1-CE 3.8Å; L399-M419 HydrophobicContact CD1-SD 4.31Å; L399-M419 HydrophobicContact CD2-CE 4.38Å; L399-M419 HydrophobicContact CD2-SD 4.11Å; L399-M419 HydrophobicContact CG-SD 4.49Å; F403-M419 HydrophobicContact CB-CB 3.89Å; F403-M419 HydrophobicContact CB-CG 4.46Å; F403-M419 HydrophobicContact CD2-SD 3.76Å; F403-M419 HydrophobicContact CE2-SD 4.17Å; F403-M419 HydrophobicContact CG-CB 4.21Å; F403-M419 HydrophobicContact CG-SD 4.11Å; S417-M419 PolarHBondContact O-N 2.83Å; S417-M419 PolarHBondContact OG-N 3.23Å; S417-M419 VanDerWaalsContact OG-N 3.16Å; M419-Y421 VanDerWaalsContact C-N 3.29Å; M419-Y421 PolarHBondContact O-N 3.27Å; M419-A422 HydrophobicContact CE-CB 4.49Å; M419-A422 PolarHBondContact O-N 3.41Å; M419-A422 HydrophobicContact SD-CB 4.46Å; M419-A423 HydrophobicContact CE-CB 4.23Å; M419-A423 VanDerWaalsContact O-CB 3.3Å; M419-A423 WeakPolarHBondContact O-CB 2.81Å; M419-A423 PolarHBondContact O-N 3.05Å; M419-F474 HydrophobicContact SD-CZ 4.41Å; M419-L498 HydrophobicContact CE-CD2 4.01Å; M419-L501 HydrophobicContact CE-CD2 3.93Å; M419-L639 HydrophobicContact CB-CB 4.22Å; M419-L639 HydrophobicContact CB-CD2 4.5Å; M419-L639 HydrophobicContact CG-CB 3.98Å; M419-L639 HydrophobicContact CG-CD1 4.27Å; M419-L639 HydrophobicContact CG-CD2 4.49Å; M419-L639 HydrophobicContact CG-CG 4.48Å
420	A	81.5	Confident	70.7	Confident	24 Å²	24	46.8 Å²	46.8	20%	0.198	28%	0.278	C	S	.	.	H	α-helix	trans	-65.3	-36.3	175.4	0	0	0	0	0	111.8	S417 R424 G640 C641	S417-A420 WeakPolarHBondContact O-CB 3.47Å; S417-A420 PolarHBondContact O-N 3.49Å; S417-A420 VanDerWaalsContact O-N 3.1Å; S417-A420 PolarHBondContact OG-N 3.19Å; A420-R424 WeakPolarHBondContact O-CB 3.34Å; A420-R424 PolarHBondContact O-N 3.28Å; A420-R424 VanDerWaalsContact O-N 3.14Å; A420-G640 WeakPolarHBondContact CB-O 3.49Å; A420-C641 VanDerWaalsContact CA-SG 3.6Å
421	Y	83.6	Confident	73	Confident	14 Å²	14	42.4 Å²	42.4	6%	0.055	24%	0.243	C	C	.	.	H	α-helix	trans	-68	-44.1	172.2	179.5	-94.3	0	0	0	112.2	S417 L418 M419 A423 R424 T425 L450 L462 L463 F466	S417-Y421 PolarHBondContact O-N 3.2Å; L418-Y421 PolarHBondContact O-N 2.98Å; M419-Y421 VanDerWaalsContact C-N 3.29Å; M419-Y421 PolarHBondContact O-N 3.27Å; Y421-A423 PolarHBondContact O-N 2.96Å; Y421-R424 PolarHBondContact O-N 2.88Å; Y421-R424 VanDerWaalsContact O-N 3.15Å; Y421-T425 HydrophobicContact CD1-CG2 4.4Å; Y421-T425 HydrophobicContact CD2-CG2 4.25Å; Y421-T425 HydrophobicContact CE1-CG2 3.95Å; Y421-T425 HydrophobicContact CE2-CG2 3.79Å; Y421-T425 PolarHBondContact O-N 3.47Å; Y421-T425 PolarHBondContact O-OG1 3.31Å; Y421-L450 HydrophobicContact CE1-CD2 4.43Å; Y421-L450 PolarHBondContact OH-O 3.32Å; Y421-L462 HydrophobicContact CD1-CD2 4.44Å; Y421-L462 HydrophobicContact CD2-CD2 3.83Å; Y421-L462 HydrophobicContact CG-CD2 3.61Å; Y421-L462 HydrophobicContact CG-CG 4.23Å; Y421-L463 WeakPolarHBondContact OH-CD1 3.24Å; Y421-F466 HydrophobicContact CD1-CB 3.94Å; Y421-F466 HydrophobicContact CD1-CD1 4.31Å; Y421-F466 AromaticContact CD1-CD2 3.9Å; Y421-F466 HydrophobicContact CD1-CD2 3.9Å; Y421-F466 AromaticContact CD1-CG 3.77Å; Y421-F466 HydrophobicContact CD1-CG 3.77Å; Y421-F466 HydrophobicContact CE1-CB 3.73Å; Y421-F466 AromaticContact CE1-CD1 3.83Å; Y421-F466 HydrophobicContact CE1-CD1 3.83Å; Y421-F466 HydrophobicContact CE1-CD2 4.24Å; Y421-F466 AromaticContact CE1-CG 3.64Å; Y421-F466 HydrophobicContact CE1-CG 3.64Å
422	A	84.3	Confident	75.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-46	174.4	0	0	0	0	0	111.9	L418 M419 R424 T425 M426 G427 F466 F474	L418-A422 WeakPolarHBondContact O-CB 3.34Å; L418-A422 PolarHBondContact O-N 3.4Å; M419-A422 HydrophobicContact CE-CB 4.49Å; M419-A422 PolarHBondContact O-N 3.41Å; M419-A422 HydrophobicContact SD-CB 4.46Å; A422-R424 PolarHBondContact O-N 2.91Å; A422-T425 PolarHBondContact O-N 3.44Å; A422-M426 WeakPolarHBondContact O-CA 3.39Å; A422-M426 VanDerWaalsContact O-CB 3.29Å; A422-M426 WeakPolarHBondContact O-CB 3.48Å; A422-M426 PolarHBondContact O-N 3.3Å; A422-G427 PolarHBondContact O-N 3.31Å; A422-F466 HydrophobicContact CB-CD2 4.44Å; A422-F466 HydrophobicContact CB-CE2 3.58Å; A422-F466 HydrophobicContact CB-CZ 4.17Å; A422-F474 HydrophobicContact CB-CE2 3.7Å; A422-F474 HydrophobicContact CB-CZ 3.84Å
423	A	85.2	Confident	76.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-32.5	176.6	0	0	0	0	0	112.1	M419 Y421 G427 L501 Y502 L505	M419-A423 HydrophobicContact CE-CB 4.23Å; M419-A423 VanDerWaalsContact O-CB 3.3Å; M419-A423 WeakPolarHBondContact O-CB 2.81Å; M419-A423 PolarHBondContact O-N 3.05Å; Y421-A423 PolarHBondContact O-N 2.96Å; A423-G427 VanDerWaalsContact O-CA 3.29Å; A423-G427 WeakPolarHBondContact O-CA 3.35Å; A423-G427 PolarHBondContact O-N 2.94Å; A423-L501 HydrophobicContact CB-CD2 3.77Å; A423-L501 HydrophobicContact CB-CG 4.24Å; A423-Y502 WeakPolarHBondContact O-CD2 3.27Å; A423-L505 HydrophobicContact CB-CD1 3.84Å
424	R	84.4	Confident	78.3	Confident	109 Å²	109	29.9 Å²	29.9	41%	0.411	15%	0.154	S	C	.	.	H	α-helix	trans	-77.3	-46.2	176.5	-171.4	-171.2	-62.4	170.3	2.1	112.9	A420 Y421 A422 K428 E459 L507	A420-R424 WeakPolarHBondContact O-CB 3.34Å; A420-R424 PolarHBondContact O-N 3.28Å; A420-R424 VanDerWaalsContact O-N 3.14Å; Y421-R424 PolarHBondContact O-N 2.88Å; Y421-R424 VanDerWaalsContact O-N 3.15Å; A422-R424 PolarHBondContact O-N 2.91Å; R424-K428 VanDerWaalsContact O-CB 3.22Å; R424-K428 WeakPolarHBondContact O-CB 3.45Å; R424-K428 PolarHBondContact O-N 3.39Å; R424-E459 IonicContact NH1-OE1 2.87Å; R424-E459 PolarHBondContact NH1-OE1 3.48Å; R424-L507 HydrophobicContact CB-CD1 4.05Å; R424-L507 HydrophobicContact CG-CD1 4.33Å
425	T	86.9	Confident	79.3	Confident	4 Å²	4	29.7 Å²	29.7	3%	0.025	15%	0.152	C	C	.	.	H	α-helix	trans	-86.7	-60.5	-173.1	56	0	0	0	0	111.5	Y421 A422 G427 K428 L429 C449	Y421-T425 HydrophobicContact CD1-CG2 4.4Å; Y421-T425 HydrophobicContact CD2-CG2 4.25Å; Y421-T425 HydrophobicContact CE1-CG2 3.95Å; Y421-T425 HydrophobicContact CE2-CG2 3.79Å; Y421-T425 PolarHBondContact O-N 3.47Å; Y421-T425 PolarHBondContact O-OG1 3.31Å; A422-T425 PolarHBondContact O-N 3.44Å; T425-G427 VanDerWaalsContact C-N 3.32Å; T425-G427 PolarHBondContact O-N 2.83Å; T425-K428 WeakPolarHBondContact O-CB 3.41Å; T425-K428 PolarHBondContact O-N 3.46Å; T425-L429 PolarHBondContact O-N 2.98Å; T425-L429 VanDerWaalsContact O-N 3.09Å; T425-C449 WeakPolarHBondContact CG2-O 3.47Å
426	M	88.8	Confident	80.1	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.8	-35.1	177.5	-59	-62	96.1	0	0	111.6	A422 K428 L429 A430 L450 F466 L471 F474 L475 F489 L498	A422-M426 WeakPolarHBondContact O-CA 3.39Å; A422-M426 VanDerWaalsContact O-CB 3.29Å; A422-M426 WeakPolarHBondContact O-CB 3.48Å; A422-M426 PolarHBondContact O-N 3.3Å; M426-K428 VanDerWaalsContact C-N 3.33Å; M426-K428 PolarHBondContact O-N 2.92Å; M426-L429 PolarHBondContact O-N 2.76Å; M426-A430 WeakPolarHBondContact O-CB 3.38Å; M426-A430 PolarHBondContact O-N 2.97Å; M426-L450 HydrophobicContact CE-CD2 3.47Å; M426-L450 VanDerWaalsContact CE-CD2 3.47Å; M426-L450 HydrophobicContact CE-CG 3.94Å; M426-F466 HydrophobicContact CE-CE1 4.03Å; M426-F466 HydrophobicContact CE-CZ 4.48Å; M426-F466 HydrophobicContact CG-CE1 4.09Å; M426-F466 HydrophobicContact CG-CZ 3.58Å; M426-F466 HydrophobicContact SD-CE1 4.17Å; M426-F466 HydrophobicContact SD-CZ 4.18Å; M426-L471 HydrophobicContact CE-CD1 4.24Å; M426-L471 HydrophobicContact SD-CD1 4.06Å; M426-F474 HydrophobicContact CG-CB 4.05Å; M426-F474 HydrophobicContact CG-CD2 4.15Å; M426-F474 HydrophobicContact CG-CG 4.07Å; M426-F474 HydrophobicContact SD-CB 4.24Å; M426-L475 HydrophobicContact SD-CD1 3.74Å; M426-L475 HydrophobicContact SD-CG 4.11Å; M426-F489 HydrophobicContact CB-CE1 4.5Å; M426-L498 HydrophobicContact CB-CD1 4.04Å
427	G	87.4	Confident	80.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.5	-35.3	173.9	0	0	0	0	0	113.5	A422 A423 T425 Y431 L498	A422-G427 PolarHBondContact O-N 3.31Å; A423-G427 VanDerWaalsContact O-CA 3.29Å; A423-G427 WeakPolarHBondContact O-CA 3.35Å; A423-G427 PolarHBondContact O-N 2.94Å; T425-G427 VanDerWaalsContact C-N 3.32Å; T425-G427 PolarHBondContact O-N 2.83Å; G427-Y431 VanDerWaalsContact O-CB 3.3Å; G427-Y431 WeakPolarHBondContact O-CB 3.47Å; G427-Y431 PolarHBondContact O-N 3.34Å; G427-L498 WeakPolarHBondContact CA-O 3.49Å
428	K	87	Confident	80.1	Confident	58 Å²	58	33.1 Å²	33.1	25%	0.252	16%	0.164	S	C	.	.	H	α-helix	trans	-65.3	-50.3	172.1	-178.6	-174	170.2	-163.4	0	111.2	R424 T425 M426 A430 Y431 E432 Y502	R424-K428 VanDerWaalsContact O-CB 3.22Å; R424-K428 WeakPolarHBondContact O-CB 3.45Å; R424-K428 PolarHBondContact O-N 3.39Å; T425-K428 WeakPolarHBondContact O-CB 3.41Å; T425-K428 PolarHBondContact O-N 3.46Å; M426-K428 VanDerWaalsContact C-N 3.33Å; M426-K428 PolarHBondContact O-N 2.92Å; K428-A430 VanDerWaalsContact C-N 3.27Å; K428-A430 PolarHBondContact O-N 3.26Å; K428-Y431 PolarHBondContact O-N 2.98Å; K428-E432 WeakPolarHBondContact CE-OE1 3.4Å; K428-E432 IonicContact NZ-OE1 3.83Å; K428-E432 WeakPolarHBondContact O-CG 3.46Å; K428-E432 PolarHBondContact O-N 3Å; K428-Y502 HydrophobicContact CB-CD2 4.21Å; K428-Y502 HydrophobicContact CB-CE1 4.46Å; K428-Y502 HydrophobicContact CB-CE2 3.73Å; K428-Y502 HydrophobicContact CG-CE2 4.45Å
429	L	88.4	Confident	79.5	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-56.7	-44.5	177	-174.9	70.4	0	0	0	111	T425 M426 E432 G433 F441 D445 V446 C449 L475 F489	T425-L429 PolarHBondContact O-N 2.98Å; T425-L429 VanDerWaalsContact O-N 3.09Å; M426-L429 PolarHBondContact O-N 2.76Å; L429-E432 PolarHBondContact O-N 2.94Å; L429-G433 PolarHBondContact O-N 3.3Å; L429-F441 HydrophobicContact CD1-CB 4.32Å; L429-F441 HydrophobicContact CD1-CD1 3.34Å; L429-F441 HydrophobicContact CD1-CE1 3.82Å; L429-F441 HydrophobicContact CD1-CG 3.94Å; L429-F441 HydrophobicContact CD2-CB 4.43Å; L429-F441 HydrophobicContact CD2-CD1 4.21Å; L429-F441 HydrophobicContact CD2-CD2 4.4Å; L429-F441 HydrophobicContact CD2-CG 4.06Å; L429-F441 HydrophobicContact CG-CD1 3.65Å; L429-F441 HydrophobicContact CG-CE1 3.79Å; L429-F441 HydrophobicContact CG-CG 4.03Å; L429-F441 HydrophobicContact CG-CZ 4.32Å; L429-F441 WeakPolarHBondContact O-CE1 3.3Å; L429-D445 HydrophobicContact CD1-CB 4.06Å; L429-V446 HydrophobicContact CD2-CG2 4.08Å; L429-C449 HydrophobicContact CB-CB 4.18Å; L429-C449 HydrophobicContact CD1-CB 4.4Å; L429-L475 HydrophobicContact CD2-CD1 3.9Å; L429-L475 HydrophobicContact CD2-CD2 4.31Å; L429-F489 HydrophobicContact CD2-CE2 4.49Å; L429-F489 HydrophobicContact CD2-CZ 4.33Å
430	A	84.2	Confident	78.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-45.1	178.3	0	0	0	0	0	112.1	M426 K428 G433 V434 F489 Q495 L498 A499	M426-A430 WeakPolarHBondContact O-CB 3.38Å; M426-A430 PolarHBondContact O-N 2.97Å; K428-A430 VanDerWaalsContact C-N 3.27Å; K428-A430 PolarHBondContact O-N 3.26Å; A430-G433 WeakPolarHBondContact O-CA 3.46Å; A430-G433 PolarHBondContact O-N 3.49Å; A430-V434 WeakPolarHBondContact O-CG2 3.32Å; A430-V434 PolarHBondContact O-N 3.44Å; A430-F489 HydrophobicContact CB-CE1 4.18Å; A430-F489 HydrophobicContact CB-CE2 3.99Å; A430-F489 HydrophobicContact CB-CZ 3.52Å; A430-Q495 HydrophobicContact CB-CG 3.91Å; A430-Q495 VanDerWaalsContact CB-O 3.28Å; A430-Q495 WeakPolarHBondContact CB-O 2.99Å; A430-L498 HydrophobicContact CB-CB 4.06Å; A430-A499 HydrophobicContact CB-CB 4.04Å
431	Y	82.7	Confident	78.6	Confident	29 Å²	29	35.9 Å²	35.9	11%	0.114	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-42.6	177.7	170.5	-108	0	0	0	112.7	G427 K428 G433 V434 S435 Y502 I503 R508 E518	G427-Y431 VanDerWaalsContact O-CB 3.3Å; G427-Y431 WeakPolarHBondContact O-CB 3.47Å; G427-Y431 PolarHBondContact O-N 3.34Å; K428-Y431 PolarHBondContact O-N 2.98Å; Y431-G433 VanDerWaalsContact C-N 3.25Å; Y431-G433 PolarHBondContact O-N 2.78Å; Y431-V434 PolarHBondContact O-N 3.37Å; Y431-S435 WeakPolarHBondContact CE2-OG 3.34Å; Y431-S435 VanDerWaalsContact CZ-OG 3.32Å; Y431-S435 VanDerWaalsContact O-CB 3.25Å; Y431-S435 WeakPolarHBondContact O-CB 3.41Å; Y431-S435 PolarHBondContact O-N 3.02Å; Y431-S435 PolarHBondContact O-OG 3.43Å; Y431-Y502 HydrophobicContact CD1-CD1 4.25Å; Y431-Y502 HydrophobicContact CD1-CE1 4.18Å; Y431-Y502 HydrophobicContact CG-CD1 4.16Å; Y431-I503 HydrophobicContact CD2-CD1 3.85Å; Y431-I503 HydrophobicContact CD2-CG1 4Å; Y431-I503 HydrophobicContact CE2-CD1 3.5Å; Y431-I503 HydrophobicContact CE2-CG1 4.11Å; Y431-R508 PolarHBondContact OH-NH1 3.1Å; Y431-R508 VanDerWaalsContact OH-NH1 3.17Å; Y431-E518 PolarHBondContact OH-OE2 3.5Å
432	E	82.9	Confident	78.6	Confident	83 Å²	83	37 Å²	37	39%	0.388	18%	0.183	S	C	.	.	H	α-helix	trans	-61.5	-38.5	173.7	-73.1	175.6	-179.8	0	0	110.8	K428 L429 S436	K428-E432 WeakPolarHBondContact CE-OE1 3.4Å; K428-E432 IonicContact NZ-OE1 3.83Å; K428-E432 WeakPolarHBondContact O-CG 3.46Å; K428-E432 PolarHBondContact O-N 3Å; L429-E432 PolarHBondContact O-N 2.94Å; E432-S436 WeakPolarHBondContact O-CB 3.27Å; E432-S436 PolarHBondContact O-N 3.41Å; E432-S436 PolarHBondContact O-OG 2.82Å
433	G	75.1	Confident	78.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.2	-52.8	172.3	0	0	0	0	0	113.3	L429 A430 Y431 S435 S436 R437 K438	L429-G433 PolarHBondContact O-N 3.3Å; A430-G433 WeakPolarHBondContact O-CA 3.46Å; A430-G433 PolarHBondContact O-N 3.49Å; Y431-G433 VanDerWaalsContact C-N 3.25Å; Y431-G433 PolarHBondContact O-N 2.78Å; G433-S435 PolarHBondContact O-N 3.28Å; G433-S436 CarbonylContact O-C 3.51Å; G433-S436 PolarHBondContact O-N 2.8Å; G433-R437 CarbonylContact O-C 3.59Å; G433-R437 WeakPolarHBondContact O-CA 3.22Å; G433-R437 PolarHBondContact O-N 3.25Å; G433-K438 CarbonylContact C-O 3.56Å; G433-K438 WeakPolarHBondContact CA-O 3.31Å; G433-K438 PolarHBondContact O-N 3.16Å
434	V	66	Low	78.2	Confident	15 Å²	15	47.8 Å²	47.8	9%	0.091	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-46.3	178.1	173.1	0	0	0	0	110.8	A430 Y431 S436 R437 Q495 E496 A499 F617 F620	A430-V434 WeakPolarHBondContact O-CG2 3.32Å; A430-V434 PolarHBondContact O-N 3.44Å; Y431-V434 PolarHBondContact O-N 3.37Å; V434-S436 VanDerWaalsContact C-N 3.31Å; V434-S436 PolarHBondContact O-N 2.88Å; V434-R437 PolarHBondContact O-N 2.86Å; V434-Q495 HydrophobicContact CG2-CG 4.35Å; V434-E496 HydrophobicContact CG2-CG 4.48Å; V434-A499 HydrophobicContact CB-CB 4.44Å; V434-A499 HydrophobicContact CG2-CB 3.85Å; V434-F617 HydrophobicContact CB-CD1 4.46Å; V434-F617 HydrophobicContact CB-CG 4.42Å; V434-F617 HydrophobicContact CG1-CB 4.15Å; V434-F617 HydrophobicContact CG1-CD1 4.46Å; V434-F617 HydrophobicContact CG1-CD2 4.2Å; V434-F617 HydrophobicContact CG1-CG 4Å; V434-F617 HydrophobicContact CG2-CD1 3.74Å; V434-F617 HydrophobicContact CG2-CE1 3.86Å; V434-F617 HydrophobicContact CG2-CG 4.13Å; V434-F617 HydrophobicContact CG2-CZ 4.42Å; V434-F620 HydrophobicContact CG1-CD2 4.2Å; V434-F620 HydrophobicContact CG1-CG 4.24Å
435	S	68.4	Low	78.2	Confident	67 Å²	67	45 Å²	45	47%	0.469	23%	0.227	S	C	.	.	H	α-helix	trans	-65	-33.8	-178.4	-57.2	0	0	0	0	113	Y431 G433	Y431-S435 WeakPolarHBondContact CE2-OG 3.34Å; Y431-S435 VanDerWaalsContact CZ-OG 3.32Å; Y431-S435 VanDerWaalsContact O-CB 3.25Å; Y431-S435 WeakPolarHBondContact O-CB 3.41Å; Y431-S435 PolarHBondContact O-N 3.02Å; Y431-S435 PolarHBondContact O-OG 3.43Å; G433-S435 PolarHBondContact O-N 3.28Å
436	S	69.5	Low	78	Confident	88 Å²	88	45 Å²	45	62%	0.615	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100	9.5	-178.6	-44.2	0	0	0	0	113	E432 G433 V434 K438	E432-S436 WeakPolarHBondContact O-CB 3.27Å; E432-S436 PolarHBondContact O-N 3.41Å; E432-S436 PolarHBondContact O-OG 2.82Å; G433-S436 CarbonylContact O-C 3.51Å; G433-S436 PolarHBondContact O-N 2.8Å; V434-S436 VanDerWaalsContact C-N 3.31Å; V434-S436 PolarHBondContact O-N 2.88Å; S436-K438 VanDerWaalsContact C-N 3.27Å; S436-K438 PolarHBondContact O-N 3.11Å
437	R	66.1	Low	77.7	Confident	116 Å²	116	46.2 Å²	46.2	44%	0.438	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	38.7	-174.6	-58.8	-175.7	177.2	-163.7	-1.2	114.9	G433 V434 P612 D614 F617	G433-R437 CarbonylContact O-C 3.59Å; G433-R437 WeakPolarHBondContact O-CA 3.22Å; G433-R437 PolarHBondContact O-N 3.25Å; V434-R437 PolarHBondContact O-N 2.86Å; R437-P612 PolarHBondContact NH1-O 3.12Å; R437-D614 IonicContact CZ-OD1 3.96Å; R437-D614 IonicContact NH1-OD1 3.22Å; R437-D614 IonicContact NH2-OD1 3.32Å; R437-D614 PolarHBondContact NH2-OD1 3.24Å; R437-F617 HydrophobicContact CB-CE2 4.44Å
438	K	69.1	Low	77.4	Confident	85 Å²	85	48.2 Å²	48.2	37%	0.37	26%	0.256	S	S	.	.			trans	-107.4	133.2	-176.5	-158.8	-168.4	-165.8	-176.2	0	111.6	G433 S436 Y440 F441 D445 Q495	G433-K438 CarbonylContact C-O 3.56Å; G433-K438 WeakPolarHBondContact CA-O 3.31Å; G433-K438 PolarHBondContact O-N 3.16Å; S436-K438 VanDerWaalsContact C-N 3.27Å; S436-K438 PolarHBondContact O-N 3.11Å; K438-Y440 WeakPolarHBondContact CD-O 3.43Å; K438-Y440 WeakPolarHBondContact CE-O 3.42Å; K438-Y440 WeakPolarHBondContact CG-O 3.33Å; K438-F441 HydrophobicContact CD-CD1 4.45Å; K438-F441 HydrophobicContact CD-CE1 4.48Å; K438-D445 IonicContact NZ-OD1 3.93Å; K438-D445 IonicContact NZ-OD2 3.5Å; K438-D445 PolarHBondContact NZ-OD2 3.11Å; K438-Q495 PolarHBondContact O-NE2 3.41Å
439	T	64.4	Low	77.2	Confident	31 Å²	31	45.7 Å²	45.7	19%	0.19	25%	0.245	C	C	.	.			trans	-112.9	-5.8	175.9	56.2	0	0	0	0	114	V616 F617	T439-V616 HydrophobicContact CG2-CG1 4.3Å; T439-F617 HydrophobicContact CG2-CZ 4.15Å
440	Y	70.4	Confident	76.9	Confident	48 Å²	48	45.6 Å²	45.6	19%	0.188	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	144.2	179.7	-62	-84.7	0	0	0	109.8	E200 K438 F487 V488	E200-Y440 WeakPolarHBondContact OE1-CE2 3.38Å; E200-Y440 PolarHBondContact OE1-OH 2.78Å; E200-Y440 PolarHBondContact OE2-OH 3.44Å; K438-Y440 WeakPolarHBondContact CD-O 3.43Å; K438-Y440 WeakPolarHBondContact CE-O 3.42Å; K438-Y440 WeakPolarHBondContact CG-O 3.33Å; Y440-F487 CarbonylContact C-O 3.48Å; Y440-F487 WeakPolarHBondContact CA-O 3.49Å; Y440-V488 HydrophobicContact CD1-CG1 3.26Å; Y440-V488 HydrophobicContact CE1-CG1 3.3Å; Y440-V488 HydrophobicContact CG-CG1 4.18Å
441	F	76.7	Confident	76.6	Confident	5 Å²	5	50.2 Å²	50.2	2%	0.022	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.4	-177.6	-57.4	-83.4	0	0	0	109.4	L429 K438 D445 V446 T486 F487 F489	L429-F441 HydrophobicContact CD1-CB 4.32Å; L429-F441 HydrophobicContact CD1-CD1 3.34Å; L429-F441 HydrophobicContact CD1-CE1 3.82Å; L429-F441 HydrophobicContact CD1-CG 3.94Å; L429-F441 HydrophobicContact CD2-CB 4.43Å; L429-F441 HydrophobicContact CD2-CD1 4.21Å; L429-F441 HydrophobicContact CD2-CD2 4.4Å; L429-F441 HydrophobicContact CD2-CG 4.06Å; L429-F441 HydrophobicContact CG-CD1 3.65Å; L429-F441 HydrophobicContact CG-CE1 3.79Å; L429-F441 HydrophobicContact CG-CG 4.03Å; L429-F441 HydrophobicContact CG-CZ 4.32Å; L429-F441 WeakPolarHBondContact O-CE1 3.3Å; K438-F441 HydrophobicContact CD-CD1 4.45Å; K438-F441 HydrophobicContact CD-CE1 4.48Å; F441-D445 WeakPolarHBondContact CA-OD2 3Å; F441-D445 HydrophobicContact CB-CB 4.17Å; F441-V446 HydrophobicContact CB-CG2 4.06Å; F441-T486 CarbonylContact O-C 3.46Å; F441-T486 VanDerWaalsContact O-CA 3.28Å; F441-T486 WeakPolarHBondContact O-CA 3.44Å; F441-F487 PolarHBondContact N-O 3.02Å; F441-F487 PolarHBondContact O-N 2.82Å; F441-F489 HydrophobicContact CD2-CD2 4.37Å; F441-F489 HydrophobicContact CD2-CE2 4.2Å; F441-F489 AromaticContact CE2-CD2 3.59Å; F441-F489 HydrophobicContact CE2-CD2 3.59Å; F441-F489 AromaticContact CE2-CE2 3.44Å; F441-F489 HydrophobicContact CE2-CE2 3.44Å; F441-F489 VanDerWaalsContact CE2-CE2 3.44Å; F441-F489 HydrophobicContact CZ-CD2 4.25Å; F441-F489 AromaticContact CZ-CE2 3.75Å; F441-F489 HydrophobicContact CZ-CE2 3.75Å
442	S	82	Confident	75.8	Confident	37 Å²	37	51 Å²	51	26%	0.259	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	163	172.7	68	0	0	0	0	110.3	E444 D445 V446 G485	S442-E444 PolarHBondContact O-N 3.33Å; S442-E444 PolarHBondContact OG-N 3.2Å; S442-D445 PolarHBondContact N-OD2 2.69Å; S442-D445 WeakPolarHBondContact O-CB 3.44Å; S442-D445 PolarHBondContact O-N 3.44Å; S442-D445 VanDerWaalsContact O-N 3.11Å; S442-D445 PolarHBondContact OG-N 2.96Å; S442-D445 PolarHBondContact OG-OD1 3.17Å; S442-D445 PolarHBondContact OG-OD2 3.47Å; S442-V446 WeakPolarHBondContact O-CG2 3.37Å; S442-V446 PolarHBondContact O-N 3.09Å; S442-V446 VanDerWaalsContact O-N 3.09Å; S442-G485 CarbonylContact C-O 3.54Å
443	E	80.3	Confident	74.8	Confident	66 Å²	66	49.4 Å²	49.4	31%	0.308	29%	0.285	S	S	.	.	H	α-helix	trans	-57.2	-35.1	171.9	-168.8	168.2	-171.8	0	0	111.6	V446 C447 G485 F487	E443-V446 PolarHBondContact O-N 2.78Å; E443-C447 WeakPolarHBondContact O-CB 3.32Å; E443-C447 PolarHBondContact O-N 3.24Å; E443-C447 PolarHBondContact O-SG 2.85Å; E443-G485 WeakPolarHBondContact CB-O 3.22Å; E443-G485 PolarHBondContact N-O 3.49Å; E443-F487 HydrophobicContact CB-CE2 4.06Å; E443-F487 HydrophobicContact CG-CE2 4.25Å
444	E	81.6	Confident	74.6	Confident	161 Å²	161	51.8 Å²	51.8	75%	0.752	30%	0.297	S	S	*	.	H	α-helix	trans	-64.4	-43.1	174.1	-63.1	-179.7	177	0	0	112.3	S442 V446 C447 G448	S442-E444 PolarHBondContact O-N 3.33Å; S442-E444 PolarHBondContact OG-N 3.2Å; E444-V446 VanDerWaalsContact C-N 3.32Å; E444-V446 PolarHBondContact O-N 3.47Å; E444-C447 PolarHBondContact O-N 2.84Å; E444-G448 PolarHBondContact O-N 2.77Å
445	D	84	Confident	74.6	Confident	51 Å²	51	59.7 Å²	59.7	27%	0.273	33%	0.33	S	S	.	.	H	α-helix	trans	-60.5	-44.4	176.6	-61.9	-33.2	0	0	0	110.9	L429 K438 F441 S442 C449	L429-D445 HydrophobicContact CD1-CB 4.06Å; K438-D445 IonicContact NZ-OD1 3.93Å; K438-D445 IonicContact NZ-OD2 3.5Å; K438-D445 PolarHBondContact NZ-OD2 3.11Å; F441-D445 WeakPolarHBondContact CA-OD2 3Å; F441-D445 HydrophobicContact CB-CB 4.17Å; S442-D445 PolarHBondContact N-OD2 2.69Å; S442-D445 WeakPolarHBondContact O-CB 3.44Å; S442-D445 PolarHBondContact O-N 3.44Å; S442-D445 VanDerWaalsContact O-N 3.11Å; S442-D445 PolarHBondContact OG-N 2.96Å; S442-D445 PolarHBondContact OG-OD1 3.17Å; S442-D445 PolarHBondContact OG-OD2 3.47Å; D445-C449 PolarHBondContact O-N 3.04Å; D445-C449 VanDerWaalsContact O-N 3.12Å; D445-C449 PolarHBondContact O-SG 3.42Å
446	V	83.2	Confident	75	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.03	33%	0.326	C	S	.	.	H	α-helix	trans	-67.7	-46.2	-179.7	177.9	0	0	0	0	110.7	L429 F441 S442 E443 E444 C449 L450 L471 L475 F487	L429-V446 HydrophobicContact CD2-CG2 4.08Å; F441-V446 HydrophobicContact CB-CG2 4.06Å; S442-V446 WeakPolarHBondContact O-CG2 3.37Å; S442-V446 PolarHBondContact O-N 3.09Å; S442-V446 VanDerWaalsContact O-N 3.09Å; E443-V446 PolarHBondContact O-N 2.78Å; E444-V446 VanDerWaalsContact C-N 3.32Å; E444-V446 PolarHBondContact O-N 3.47Å; V446-C449 PolarHBondContact O-N 3.47Å; V446-L450 HydrophobicContact CG1-CD1 3.79Å; V446-L450 HydrophobicContact CG1-CG 4.35Å; V446-L450 WeakPolarHBondContact O-CB 3.35Å; V446-L450 VanDerWaalsContact O-CG 3.32Å; V446-L450 WeakPolarHBondContact O-CG 3.32Å; V446-L450 PolarHBondContact O-N 3.04Å; V446-L471 HydrophobicContact CG1-CD1 4.48Å; V446-L475 HydrophobicContact CG1-CD1 3.92Å; V446-L475 HydrophobicContact CG2-CD1 3.86Å; V446-F487 HydrophobicContact CG2-CB 4.17Å; V446-F487 HydrophobicContact CG2-CD2 3.81Å; V446-F487 HydrophobicContact CG2-CG 4.12Å
447	C	81.3	Confident	75.2	Confident	24 Å²	24	60.9 Å²	60.9	16%	0.162	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-46.8	177.1	-69.2	0	0	0	0	111.3	F29 E443 E444 C449 L450 E451	F29-C447 VanDerWaalsContact CE1-SG 3.55Å; F29-C447 WeakPolarHBondContact CZ-SG 3.25Å; E443-C447 WeakPolarHBondContact O-CB 3.32Å; E443-C447 PolarHBondContact O-N 3.24Å; E443-C447 PolarHBondContact O-SG 2.85Å; E444-C447 PolarHBondContact O-N 2.84Å; C447-C449 PolarHBondContact O-N 2.84Å; C447-L450 PolarHBondContact O-N 3.48Å; C447-E451 WeakPolarHBondContact O-CB 3.43Å; C447-E451 PolarHBondContact O-N 3.39Å
448	G	81.9	Confident	75.4	Confident	43 Å²	43	60.2 Å²	60.2	44%	0.443	32%	0.324	S	S	.	.	H	α-helix	trans	-57.7	-34.1	177.8	0	0	0	0	0	112.8	E444 A452	E444-G448 PolarHBondContact O-N 2.77Å; G448-A452 WeakPolarHBondContact O-CB 3.14Å; G448-A452 PolarHBondContact O-N 3.11Å
449	C	83	Confident	75.6	Confident	4 Å²	4	57.7 Å²	57.7	3%	0.027	31%	0.314	C	S	.	.	H	α-helix	trans	-81.6	-35.5	176.3	-74.5	0	0	0	0	114.2	T425 L429 D445 V446 C447	T425-C449 WeakPolarHBondContact CG2-O 3.47Å; L429-C449 HydrophobicContact CB-CB 4.18Å; L429-C449 HydrophobicContact CD1-CB 4.4Å; D445-C449 PolarHBondContact O-N 3.04Å; D445-C449 VanDerWaalsContact O-N 3.12Å; D445-C449 PolarHBondContact O-SG 3.42Å; V446-C449 PolarHBondContact O-N 3.47Å; C447-C449 PolarHBondContact O-N 2.84Å
450	L	81.8	Confident	76.2	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-70.5	-39.4	179	-75.8	173.8	0	0	0	112.6	Y421 M426 V446 C447 L463 F466 R467 L471	Y421-L450 HydrophobicContact CE1-CD2 4.43Å; Y421-L450 PolarHBondContact OH-O 3.32Å; M426-L450 HydrophobicContact CE-CD2 3.47Å; M426-L450 VanDerWaalsContact CE-CD2 3.47Å; M426-L450 HydrophobicContact CE-CG 3.94Å; V446-L450 HydrophobicContact CG1-CD1 3.79Å; V446-L450 HydrophobicContact CG1-CG 4.35Å; V446-L450 WeakPolarHBondContact O-CB 3.35Å; V446-L450 VanDerWaalsContact O-CG 3.32Å; V446-L450 WeakPolarHBondContact O-CG 3.32Å; V446-L450 PolarHBondContact O-N 3.04Å; C447-L450 PolarHBondContact O-N 3.48Å; L450-L463 HydrophobicContact CB-CD1 3.85Å; L450-L463 HydrophobicContact CD2-CD1 4.26Å; L450-L463 HydrophobicContact CG-CD1 4.49Å; L450-F466 HydrophobicContact CD2-CD1 3.65Å; L450-F466 HydrophobicContact CD2-CE1 3.64Å; L450-R467 HydrophobicContact CD1-CG 4.43Å; L450-L471 HydrophobicContact CD1-CD1 4.14Å; L450-L471 HydrophobicContact CD1-CD2 4.33Å; L450-L471 HydrophobicContact CD2-CD1 4.43Å
451	E	77.8	Confident	76.4	Confident	97 Å²	97	63.6 Å²	63.6	45%	0.453	34%	0.34	S	S	.	.	H	α-helix	trans	-91.3	-11.4	-175.3	-61.8	179.9	172.9	0	0	112.4	C447 G453 L463 R467	C447-E451 WeakPolarHBondContact O-CB 3.43Å; C447-E451 PolarHBondContact O-N 3.39Å; E451-G453 PolarHBondContact O-N 3.39Å; E451-L463 HydrophobicContact CG-CD2 4.45Å; E451-R467 VanDerWaalsContact CG-NH2 3.32Å; E451-R467 IonicContact OE1-CZ 3.43Å; E451-R467 IonicContact OE1-NH1 3.43Å; E451-R467 IonicContact OE1-NH2 3.57Å; E451-R467 PolarHBondContact OE1-NH2 3.39Å
452	A	67.2	Low	76.4	Confident	46 Å²	46	64 Å²	64	38%	0.38	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	105.3	178	0	0	0	0	0	112	G448	G448-A452 WeakPolarHBondContact O-CB 3.14Å; G448-A452 PolarHBondContact O-N 3.11Å
453	G	60.9	Low	76.3	Confident	49 Å²	49	62.5 Å²	62.5	51%	0.505	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	14.8	167.2	0	0	0	0	0	115.7	E451 K455	E451-G453 PolarHBondContact O-N 3.39Å; G453-K455 PolarHBondContact O-N 3.37Å
454	I	70.2	Confident	76.1	Confident	50 Å²	50	65.8 Å²	65.8	26%	0.256	34%	0.342	S	S	.	.			trans	-66.2	119.8	169.1	-59.7	175.6	0	0	0	108.8	E459 F460 L463	I454-E459 WeakPolarHBondContact CA-OE2 3.26Å; I454-E459 HydrophobicContact CG2-CB 4.12Å; I454-F460 HydrophobicContact CG2-CB 4.2Å; I454-L463 HydrophobicContact CD1-CB 4.06Å; I454-L463 HydrophobicContact CD1-CD2 3.42Å; I454-L463 VanDerWaalsContact CD1-CD2 3.42Å; I454-L463 HydrophobicContact CD1-CG 4.2Å
455	K	67.6	Low	75.6	Confident	180 Å²	180	60.6 Å²	60.6	78%	0.783	32%	0.318	S	S	*	.			trans	-126.3	-18.8	-179.8	-66.7	-178.9	-177.8	-172.4	0	113.5	G453 E459	G453-K455 PolarHBondContact O-N 3.37Å; K455-E459 PolarHBondContact N-OE2 3.22Å
456	T	75.6	Confident	75.4	Confident	64 Å²	64	58.1 Å²	58.1	39%	0.393	31%	0.305	S	S	.	.	S	Bend	trans	-124.8	159.1	-176	82.7	0	0	0	0	111.3	E458 E459 F460	T456-E458 WeakPolarHBondContact CB-OE2 3.32Å; T456-E458 PolarHBondContact O-N 2.94Å; T456-E458 PolarHBondContact OG1-OE2 3.1Å; T456-E459 PolarHBondContact O-N 3.12Å; T456-E459 PolarHBondContact OG1-N 3.15Å; T456-F460 PolarHBondContact O-N 2.98Å
457	E	73.4	Confident	75	Confident	117 Å²	117	61.1 Å²	61.1	55%	0.547	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-34.3	178.9	-174.2	59.5	-152.5	0	0	111.1	E459 F460 Q461	E457-E459 PolarHBondContact O-N 3.34Å; E457-F460 WeakPolarHBondContact O-CB 3.43Å; E457-F460 PolarHBondContact O-N 3.39Å; E457-Q461 WeakPolarHBondContact O-CG 3.31Å; E457-Q461 PolarHBondContact O-N 3.46Å; E457-Q461 PolarHBondContact OE1-NE2 3.17Å
458	E	71.4	Confident	74.3	Confident	101 Å²	101	66.8 Å²	66.8	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-66.2	-37.1	177.8	-54.5	76.2	-163.6	0	0	112.1	L416 T456 F460 Q461 L462	L416-E458 HydrophobicContact CD1-CB 4.33Å; L416-E458 HydrophobicContact CD2-CB 4.36Å; T456-E458 WeakPolarHBondContact CB-OE2 3.32Å; T456-E458 PolarHBondContact O-N 2.94Å; T456-E458 PolarHBondContact OG1-OE2 3.1Å; E458-F460 VanDerWaalsContact C-N 3.32Å; E458-Q461 PolarHBondContact O-N 2.79Å; E458-L462 WeakPolarHBondContact O-CB 3.42Å; E458-L462 PolarHBondContact O-N 3.26Å
459	E	72.8	Confident	73.1	Confident	33 Å²	33	67.2 Å²	67.2	15%	0.154	33%	0.326	C	S	.	.	H	α-helix	trans	-68.7	-32.4	174.2	-71.1	-177.8	144.9	0	0	111.8	L416 R424 I454 K455 T456 E457 L462 L463	L416-E459 HydrophobicContact CD2-CG 4.05Å; R424-E459 IonicContact NH1-OE1 2.87Å; R424-E459 PolarHBondContact NH1-OE1 3.48Å; I454-E459 WeakPolarHBondContact CA-OE2 3.26Å; I454-E459 HydrophobicContact CG2-CB 4.12Å; K455-E459 PolarHBondContact N-OE2 3.22Å; T456-E459 PolarHBondContact O-N 3.12Å; T456-E459 PolarHBondContact OG1-N 3.15Å; E457-E459 PolarHBondContact O-N 3.34Å; E459-L462 PolarHBondContact O-N 2.88Å; E459-L463 PolarHBondContact O-N 3.01Å
460	F	78.1	Confident	72.5	Confident	108 Å²	108	67.2 Å²	67.2	47%	0.474	33%	0.327	S	S	.	.	H	α-helix	trans	-69.7	-41.4	174.5	-169.9	-97.3	0	0	0	111.9	I454 T456 E457 E458 L462 L463 Y464	I454-F460 HydrophobicContact CG2-CB 4.2Å; T456-F460 PolarHBondContact O-N 2.98Å; E457-F460 WeakPolarHBondContact O-CB 3.43Å; E457-F460 PolarHBondContact O-N 3.39Å; E458-F460 VanDerWaalsContact C-N 3.32Å; F460-L462 VanDerWaalsContact C-N 3.31Å; F460-L462 PolarHBondContact O-N 2.93Å; F460-L463 HydrophobicContact CD2-CD2 4.48Å; F460-L463 WeakPolarHBondContact O-CB 3.45Å; F460-L463 PolarHBondContact O-N 2.94Å; F460-Y464 PolarHBondContact O-N 3.38Å
461	Q	74.2	Confident	72	Confident	94 Å²	94	68.6 Å²	68.6	44%	0.439	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-41.1	171.8	-67.4	-63.3	-29	0	0	111.4	E457 E458 Y464 I465	E457-Q461 WeakPolarHBondContact O-CG 3.31Å; E457-Q461 PolarHBondContact O-N 3.46Å; E457-Q461 PolarHBondContact OE1-NE2 3.17Å; E458-Q461 PolarHBondContact O-N 2.79Å; Q461-Y464 WeakPolarHBondContact O-CB 2.95Å; Q461-Y464 PolarHBondContact O-N 2.92Å; Q461-I465 WeakPolarHBondContact O-CG1 3.42Å; Q461-I465 PolarHBondContact O-N 2.91Å
462	L	76	Confident	71.2	Confident	15 Å²	15	69.8 Å²	69.8	8%	0.079	33%	0.334	C	S	.	.	H	α-helix	trans	-67.2	-39.1	177.1	-160.3	75.6	0	0	0	112.3	L416 L418 Y421 E458 E459 F460 Y464 I465 F466	L416-L462 HydrophobicContact CB-CD2 4.23Å; L416-L462 HydrophobicContact CD2-CB 4.43Å; L416-L462 HydrophobicContact CD2-CD2 3.92Å; L418-L462 HydrophobicContact CD1-CD1 3.88Å; L418-L462 HydrophobicContact CD1-CG 4.05Å; Y421-L462 HydrophobicContact CD1-CD2 4.44Å; Y421-L462 HydrophobicContact CD2-CD2 3.83Å; Y421-L462 HydrophobicContact CG-CD2 3.61Å; Y421-L462 HydrophobicContact CG-CG 4.23Å; E458-L462 WeakPolarHBondContact O-CB 3.42Å; E458-L462 PolarHBondContact O-N 3.26Å; E459-L462 PolarHBondContact O-N 2.88Å; F460-L462 VanDerWaalsContact C-N 3.31Å; F460-L462 PolarHBondContact O-N 2.93Å; L462-Y464 VanDerWaalsContact C-N 3.3Å; L462-Y464 PolarHBondContact O-N 3.03Å; L462-I465 PolarHBondContact O-N 3.07Å; L462-F466 WeakPolarHBondContact O-CB 3.25Å; L462-F466 PolarHBondContact O-N 3.23Å
463	L	80.3	Confident	71	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-57.4	-45.2	170.8	169	70.2	0	0	0	110.8	Y421 L450 E451 I454 E459 F460 F466 R467	Y421-L463 WeakPolarHBondContact OH-CD1 3.24Å; L450-L463 HydrophobicContact CB-CD1 3.85Å; L450-L463 HydrophobicContact CD2-CD1 4.26Å; L450-L463 HydrophobicContact CG-CD1 4.49Å; E451-L463 HydrophobicContact CG-CD2 4.45Å; I454-L463 HydrophobicContact CD1-CB 4.06Å; I454-L463 HydrophobicContact CD1-CD2 3.42Å; I454-L463 VanDerWaalsContact CD1-CD2 3.42Å; I454-L463 HydrophobicContact CD1-CG 4.2Å; E459-L463 PolarHBondContact O-N 3.01Å; F460-L463 HydrophobicContact CD2-CD2 4.48Å; F460-L463 WeakPolarHBondContact O-CB 3.45Å; F460-L463 PolarHBondContact O-N 2.94Å; L463-F466 PolarHBondContact O-N 3.4Å; L463-R467 HydrophobicContact CD1-CG 4.01Å; L463-R467 HydrophobicContact CG-CG 4.46Å; L463-R467 WeakPolarHBondContact O-CB 3.42Å; L463-R467 WeakPolarHBondContact O-CG 3.26Å; L463-R467 PolarHBondContact O-N 3.37Å
464	Y	75.4	Confident	71.3	Confident	136 Å²	136	66.5 Å²	66.5	53%	0.533	30%	0.297	S	S	.	.	H	α-helix	trans	-62.5	-47.9	-180	-178.8	-98.2	0	0	0	111.7	F460 Q461 L462 F466 R467 R468	F460-Y464 PolarHBondContact O-N 3.38Å; Q461-Y464 WeakPolarHBondContact O-CB 2.95Å; Q461-Y464 PolarHBondContact O-N 2.92Å; L462-Y464 VanDerWaalsContact C-N 3.3Å; L462-Y464 PolarHBondContact O-N 3.03Å; Y464-F466 VanDerWaalsContact C-N 3.35Å; Y464-F466 PolarHBondContact O-N 3.38Å; Y464-R467 PolarHBondContact O-N 3.46Å; Y464-R468 WeakPolarHBondContact O-CB 3.44Å; Y464-R468 PolarHBondContact O-N 3.49Å
465	I	72.5	Confident	71	Confident	51 Å²	51	64.4 Å²	64.4	26%	0.262	29%	0.286	S	S	.	.	H	α-helix	trans	-59.2	-47.8	174.6	-65.5	165.3	0	0	0	109.9	L418 Q461 L462 R467 R468 D469	L418-I465 HydrophobicContact CD1-CG2 4.18Å; L418-I465 HydrophobicContact CD2-CG2 4.48Å; Q461-I465 WeakPolarHBondContact O-CG1 3.42Å; Q461-I465 PolarHBondContact O-N 2.91Å; L462-I465 PolarHBondContact O-N 3.07Å; I465-R467 PolarHBondContact O-N 2.84Å; I465-R468 PolarHBondContact O-N 2.59Å; I465-D469 WeakPolarHBondContact O-CB 3.25Å; I465-D469 PolarHBondContact O-N 2.76Å
466	F	78.1	Confident	70.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-59.4	-47.4	179.8	-172.4	-97.7	0	0	0	112.1	L418 Y421 A422 M426 L450 L462 L463 Y464 R468 A470 L471 F474	L418-F466 HydrophobicContact CD1-CB 3.86Å; L418-F466 HydrophobicContact CD1-CD2 3.89Å; L418-F466 HydrophobicContact CD1-CG 4.39Å; L418-F466 HydrophobicContact CG-CD2 4.12Å; Y421-F466 HydrophobicContact CD1-CB 3.94Å; Y421-F466 HydrophobicContact CD1-CD1 4.31Å; Y421-F466 AromaticContact CD1-CD2 3.9Å; Y421-F466 HydrophobicContact CD1-CD2 3.9Å; Y421-F466 AromaticContact CD1-CG 3.77Å; Y421-F466 HydrophobicContact CD1-CG 3.77Å; Y421-F466 HydrophobicContact CE1-CB 3.73Å; Y421-F466 AromaticContact CE1-CD1 3.83Å; Y421-F466 HydrophobicContact CE1-CD1 3.83Å; Y421-F466 HydrophobicContact CE1-CD2 4.24Å; Y421-F466 AromaticContact CE1-CG 3.64Å; Y421-F466 HydrophobicContact CE1-CG 3.64Å; A422-F466 HydrophobicContact CB-CD2 4.44Å; A422-F466 HydrophobicContact CB-CE2 3.58Å; A422-F466 HydrophobicContact CB-CZ 4.17Å; M426-F466 HydrophobicContact CE-CE1 4.03Å; M426-F466 HydrophobicContact CE-CZ 4.48Å; M426-F466 HydrophobicContact CG-CE1 4.09Å; M426-F466 HydrophobicContact CG-CZ 3.58Å; M426-F466 HydrophobicContact SD-CE1 4.17Å; M426-F466 HydrophobicContact SD-CZ 4.18Å; L450-F466 HydrophobicContact CD2-CD1 3.65Å; L450-F466 HydrophobicContact CD2-CE1 3.64Å; L462-F466 WeakPolarHBondContact O-CB 3.25Å; L462-F466 PolarHBondContact O-N 3.23Å; L463-F466 PolarHBondContact O-N 3.4Å; Y464-F466 VanDerWaalsContact C-N 3.35Å; Y464-F466 PolarHBondContact O-N 3.38Å; F466-R468 VanDerWaalsContact C-N 3.34Å; F466-R468 PolarHBondContact O-N 2.78Å; F466-A470 HydrophobicContact CD2-CB 3.67Å; F466-A470 HydrophobicContact CE2-CB 3.8Å; F466-A470 HydrophobicContact CG-CB 4.41Å; F466-A470 CarbonylContact O-C 3.52Å; F466-A470 PolarHBondContact O-N 3.49Å; F466-L471 HydrophobicContact CD1-CB 4.3Å; F466-L471 HydrophobicContact CD1-CD1 4.43Å; F466-L471 HydrophobicContact CE1-CB 4.11Å; F466-L471 HydrophobicContact CE1-CD1 3.75Å; F466-L471 WeakPolarHBondContact O-CB 3.14Å; F466-L471 PolarHBondContact O-N 3.02Å; F466-F474 AromaticContact CE2-CD2 3.95Å; F466-F474 HydrophobicContact CE2-CD2 3.95Å; F466-F474 AromaticContact CE2-CE2 3.85Å; F466-F474 HydrophobicContact CE2-CE2 3.85Å; F466-F474 AromaticContact CZ-CD2 3.73Å; F466-F474 HydrophobicContact CZ-CD2 3.73Å; F466-F474 HydrophobicContact CZ-CE2 4.1Å
467	R	75.3	Confident	69.7	Low	67 Å²	67	54.4 Å²	54.4	25%	0.253	24%	0.242	S	C	.	.	I	π-helix	trans	-60.7	-42.4	178.2	-79.5	-176.9	177.1	165.4	7.8	112.5	F29 L450 E451 L463 Y464 I465	F29-R467 VanDerWaalsContact CE2-NH2 3.27Å; L450-R467 HydrophobicContact CD1-CG 4.43Å; E451-R467 VanDerWaalsContact CG-NH2 3.32Å; E451-R467 IonicContact OE1-CZ 3.43Å; E451-R467 IonicContact OE1-NH1 3.43Å; E451-R467 IonicContact OE1-NH2 3.57Å; E451-R467 PolarHBondContact OE1-NH2 3.39Å; L463-R467 HydrophobicContact CD1-CG 4.01Å; L463-R467 HydrophobicContact CG-CG 4.46Å; L463-R467 WeakPolarHBondContact O-CB 3.42Å; L463-R467 WeakPolarHBondContact O-CG 3.26Å; L463-R467 PolarHBondContact O-N 3.37Å; Y464-R467 PolarHBondContact O-N 3.46Å; I465-R467 PolarHBondContact O-N 2.84Å
468	R	66.3	Low	68.7	Low	144 Å²	144	50.1 Å²	50.1	54%	0.543	23%	0.225	S	C	.	.	I	π-helix	trans	-73	-44.2	-177.4	-165.8	-174.4	68.4	-172.8	-6.9	111.8	Y464 I465 F466	Y464-R468 WeakPolarHBondContact O-CB 3.44Å; Y464-R468 PolarHBondContact O-N 3.49Å; I465-R468 PolarHBondContact O-N 2.59Å; F466-R468 VanDerWaalsContact C-N 3.34Å; F466-R468 PolarHBondContact O-N 2.78Å
469	D	57.9	Low	67.4	Low	52 Å²	52	48.9 Å²	48.9	28%	0.278	22%	0.224	S	C	.	.	I	π-helix	trans	-114.3	-28.6	-159.3	-60.4	-22.3	0	0	0	114	W3 I465	W3-D469 HydrophobicContact CH2-CB 3.94Å; I465-D469 WeakPolarHBondContact O-CB 3.25Å; I465-D469 PolarHBondContact O-N 2.76Å
470	A	69.2	Low	65.8	Low	4 Å²	4	48.6 Å²	48.6	3%	0.033	22%	0.222	C	C	.	.	I	π-helix	trans	-122.3	-21.7	-171.8	0	0	0	0	0	115.5	F403 L418 F466 R472 F473 F474	F403-A470 HydrophobicContact CE1-CB 4.03Å; L418-A470 HydrophobicContact CD2-CB 3.72Å; L418-A470 HydrophobicContact CG-CB 4.49Å; F466-A470 HydrophobicContact CD2-CB 3.67Å; F466-A470 HydrophobicContact CE2-CB 3.8Å; F466-A470 HydrophobicContact CG-CB 4.41Å; F466-A470 CarbonylContact O-C 3.52Å; F466-A470 PolarHBondContact O-N 3.49Å; A470-R472 PolarHBondContact O-N 3.26Å; A470-F473 WeakPolarHBondContact O-CB 3.37Å; A470-F473 PolarHBondContact O-N 3.09Å; A470-F474 WeakPolarHBondContact O-CD2 3.42Å
471	L	72.4	Confident	63.6	Low	29 Å²	29	47 Å²	47	15%	0.152	22%	0.222	C	C	.	.	H	α-helix	trans	-57.8	-39.5	-176.9	179.7	66.2	0	0	0	111.8	M426 V446 L450 F466 F473 F474 L475	M426-L471 HydrophobicContact CE-CD1 4.24Å; M426-L471 HydrophobicContact SD-CD1 4.06Å; V446-L471 HydrophobicContact CG1-CD1 4.48Å; L450-L471 HydrophobicContact CD1-CD1 4.14Å; L450-L471 HydrophobicContact CD1-CD2 4.33Å; L450-L471 HydrophobicContact CD2-CD1 4.43Å; F466-L471 HydrophobicContact CD1-CB 4.3Å; F466-L471 HydrophobicContact CD1-CD1 4.43Å; F466-L471 HydrophobicContact CE1-CB 4.11Å; F466-L471 HydrophobicContact CE1-CD1 3.75Å; F466-L471 WeakPolarHBondContact O-CB 3.14Å; F466-L471 PolarHBondContact O-N 3.02Å; L471-F473 PolarHBondContact O-N 3.35Å; L471-F474 PolarHBondContact O-N 3.02Å; L471-F474 VanDerWaalsContact O-N 3.17Å; L471-L475 HydrophobicContact CD1-CD1 4.04Å; L471-L475 PolarHBondContact O-N 2.93Å
472	R	61.3	Low	62.2	Low	121 Å²	121	46.4 Å²	46.4	46%	0.457	24%	0.242	S	C	.	.	H	α-helix	trans	-66.8	-21.2	178.3	-69.3	179.8	172.5	160.5	-1	113.5	Q99 A470 T490	Q99-R472 PolarHBondContact NE2-O 2.86Å; A470-R472 PolarHBondContact O-N 3.26Å; R472-T490 PolarHBondContact O-OG1 3.38Å
473	F	62.4	Low	60.8	Low	25 Å²	25	49.7 Å²	49.7	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-68.3	-39.8	173.9	178.7	-90.5	0	0	0	110.9	F100 F398 L399 N402 F403 A470 L471 T490	F100-F473 HydrophobicContact CZ-CE2 4.39Å; F398-F473 HydrophobicContact CD1-CZ 4.09Å; F398-F473 HydrophobicContact CE1-CE1 4.13Å; F398-F473 AromaticContact CE1-CE2 3.88Å; F398-F473 HydrophobicContact CE1-CE2 3.88Å; F398-F473 AromaticContact CE1-CZ 3.25Å; F398-F473 HydrophobicContact CE1-CZ 3.25Å; F398-F473 AromaticContact CZ-CE2 3.81Å; F398-F473 HydrophobicContact CZ-CE2 3.81Å; F398-F473 AromaticContact CZ-CZ 3.69Å; F398-F473 HydrophobicContact CZ-CZ 3.69Å; L399-F473 HydrophobicContact CD2-CE1 3.9Å; L399-F473 HydrophobicContact CD2-CZ 4.29Å; N402-F473 HydrophobicContact CB-CE2 4.04Å; N402-F473 HydrophobicContact CB-CZ 4.09Å; F403-F473 AromaticContact CE2-CD1 3.96Å; F403-F473 HydrophobicContact CE2-CD1 3.96Å; F403-F473 AromaticContact CE2-CE1 3.6Å; F403-F473 HydrophobicContact CE2-CE1 3.6Å; F403-F473 AromaticContact CE2-CZ 3.92Å; F403-F473 HydrophobicContact CE2-CZ 3.92Å; F403-F473 AromaticContact CZ-CD1 3.8Å; F403-F473 HydrophobicContact CZ-CD1 3.8Å; F403-F473 AromaticContact CZ-CE1 3.95Å; F403-F473 HydrophobicContact CZ-CE1 3.95Å; F403-F473 HydrophobicContact CZ-CG 4.21Å; F403-F473 HydrophobicContact CZ-CZ 4.46Å; A470-F473 WeakPolarHBondContact O-CB 3.37Å; A470-F473 PolarHBondContact O-N 3.09Å; L471-F473 PolarHBondContact O-N 3.35Å; F473-T490 VanDerWaalsContact O-CB 3.26Å; F473-T490 WeakPolarHBondContact O-CB 3.31Å; F473-T490 WeakPolarHBondContact O-CG2 3.42Å; F473-T490 PolarHBondContact O-OG1 3.12Å
474	F	66.4	Low	59.3	Low	2 Å²	2	54.5 Å²	54.5	1%	0.009	29%	0.294	C	S	.	.	H	α-helix	trans	-90.8	-37.8	-176.2	-65.2	-71.9	0	0	0	113.6	L399 F403 M419 A422 M426 F466 A470 L471 F489 T490 M494 L498	L399-F474 HydrophobicContact CD2-CE1 4.15Å; L399-F474 HydrophobicContact CD2-CZ 4.36Å; F403-F474 HydrophobicContact CE1-CE2 4.19Å; F403-F474 HydrophobicContact CE1-CZ 4.43Å; F403-F474 HydrophobicContact CE2-CE2 4.18Å; F403-F474 AromaticContact CE2-CZ 3.69Å; F403-F474 HydrophobicContact CE2-CZ 3.69Å; F403-F474 AromaticContact CZ-CE2 3.49Å; F403-F474 HydrophobicContact CZ-CE2 3.49Å; F403-F474 VanDerWaalsContact CZ-CE2 3.49Å; F403-F474 AromaticContact CZ-CZ 3.5Å; F403-F474 HydrophobicContact CZ-CZ 3.5Å; M419-F474 HydrophobicContact SD-CZ 4.41Å; A422-F474 HydrophobicContact CB-CE2 3.7Å; A422-F474 HydrophobicContact CB-CZ 3.84Å; M426-F474 HydrophobicContact CG-CB 4.05Å; M426-F474 HydrophobicContact CG-CD2 4.15Å; M426-F474 HydrophobicContact CG-CG 4.07Å; M426-F474 HydrophobicContact SD-CB 4.24Å; F466-F474 AromaticContact CE2-CD2 3.95Å; F466-F474 HydrophobicContact CE2-CD2 3.95Å; F466-F474 AromaticContact CE2-CE2 3.85Å; F466-F474 HydrophobicContact CE2-CE2 3.85Å; F466-F474 AromaticContact CZ-CD2 3.73Å; F466-F474 HydrophobicContact CZ-CD2 3.73Å; F466-F474 HydrophobicContact CZ-CE2 4.1Å; A470-F474 WeakPolarHBondContact O-CD2 3.42Å; L471-F474 PolarHBondContact O-N 3.02Å; L471-F474 VanDerWaalsContact O-N 3.17Å; F474-F489 VanDerWaalsContact O-CA 3.32Å; F474-F489 WeakPolarHBondContact O-CA 3.32Å; F474-F489 WeakPolarHBondContact O-CD1 3.18Å; F474-T490 VanDerWaalsContact C-OG1 3.22Å; F474-T490 PolarHBondContact O-N 3.31Å; F474-T490 PolarHBondContact O-OG1 2.59Å; F474-M494 HydrophobicContact CD1-CG 4.31Å; F474-L498 HydrophobicContact CD1-CD1 3.56Å; F474-L498 HydrophobicContact CE1-CD1 3.81Å; F474-L498 HydrophobicContact CE1-CD2 4.23Å
475	L	65.3	Low	58.6	Low	5 Å²	5	49.5 Å²	49.5	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.5	-174.7	-66.6	174.6	0	0	0	111.9	M426 L429 V446 L471 F487 V488 F489 T490	M426-L475 HydrophobicContact SD-CD1 3.74Å; M426-L475 HydrophobicContact SD-CG 4.11Å; L429-L475 HydrophobicContact CD2-CD1 3.9Å; L429-L475 HydrophobicContact CD2-CD2 4.31Å; V446-L475 HydrophobicContact CG1-CD1 3.92Å; V446-L475 HydrophobicContact CG2-CD1 3.86Å; L471-L475 HydrophobicContact CD1-CD1 4.04Å; L471-L475 PolarHBondContact O-N 2.93Å; L475-F487 HydrophobicContact CB-CB 4.47Å; L475-F487 HydrophobicContact CB-CD1 4.45Å; L475-V488 CarbonylContact C-O 3.47Å; L475-V488 VanDerWaalsContact CA-O 3.32Å; L475-V488 WeakPolarHBondContact CA-O 3.06Å; L475-V488 WeakPolarHBondContact CD2-O 3.32Å; L475-F489 HydrophobicContact CD2-CD1 4.15Å; L475-F489 HydrophobicContact CD2-CD2 4.15Å; L475-F489 HydrophobicContact CD2-CE1 4.22Å; L475-F489 HydrophobicContact CD2-CE2 4.21Å; L475-F489 HydrophobicContact CD2-CG 4.11Å; L475-F489 HydrophobicContact CD2-CZ 4.24Å; L475-T490 PolarHBondContact N-OG1 2.81Å
476	A	57.9	Low	58.3	Low	7 Å²	7	48.3 Å²	48.3	6%	0.058	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.4	169.7	0	0	0	0	0	109.2	E96 F487 V488 T490	E96-A476 VanDerWaalsContact OE1-CB 3.23Å; E96-A476 WeakPolarHBondContact OE1-CB 3.34Å; A476-F487 CarbonylContact O-C 3.57Å; A476-F487 WeakPolarHBondContact O-CA 3.2Å; A476-V488 HydrophobicContact CB-CG2 4.35Å; A476-V488 PolarHBondContact N-O 3.44Å; A476-V488 PolarHBondContact O-N 3.03Å; A476-T490 PolarHBondContact N-OG1 3.36Å
477	P	56.8	Low	57.8	Low	28 Å²	28	49.3 Å²	49.3	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	137.7	172.3	30.8	-35.9	0	0	0	109.6	W33 T486 F487	W33-P477 HydrophobicContact CH2-CG 3.84Å; W33-P477 HydrophobicContact CZ3-CG 3.75Å; P477-T486 WeakPolarHBondContact CA-O 3.39Å; P477-F487 HydrophobicContact CB-CD1 4.1Å; P477-F487 HydrophobicContact CB-CE1 3.98Å
478	C	53.8	Low	57.2	Low	27 Å²	27	47.6 Å²	47.6	18%	0.182	28%	0.28	C	S	.	.			trans	-71.4	129.6	175.8	-155.8	0	0	0	0	109	E480 T486	C478-E480 VanDerWaalsContact C-N 3.27Å; C478-E480 PolarHBondContact O-N 2.98Å; C478-E480 VanDerWaalsContact SG-CG 3.55Å; C478-T486 WeakPolarHBondContact CB-OG1 3.37Å; C478-T486 PolarHBondContact N-O 2.76Å
479	V	43.4	Very low	57.1	Low	75 Å²	75	41 Å²	41	46%	0.455	26%	0.255	S	S	.	.			trans	-96.2	24.2	-177.9	-157.6	0	0	0	0	111.1	W89 P481	W89-V479 HydrophobicContact CH2-CB 4.37Å; W89-V479 HydrophobicContact CH2-CG1 3.63Å; W89-V479 HydrophobicContact CZ2-CG1 4.25Å; W89-V479 HydrophobicContact CZ3-CG1 4.47Å; V479-P481 WeakPolarHBondContact O-CD 3.11Å
480	E	38.3	Very low	57.1	Low	27 Å²	27	39.2 Å²	39.2	13%	0.126	25%	0.246	C	C	.	.			trans	-79.4	124.9	-178.8	-67.9	-175.5	166.6	0	0	111.2	D201 C478 G482 R483	D201-E480 VanDerWaalsContact OD1-CG 3.23Å; D201-E480 WeakPolarHBondContact OD1-CG 3.43Å; C478-E480 VanDerWaalsContact C-N 3.27Å; C478-E480 PolarHBondContact O-N 2.98Å; C478-E480 VanDerWaalsContact SG-CG 3.55Å; E480-G482 PolarHBondContact O-N 3.05Å; E480-R483 PolarHBondContact O-N 2.84Å; E480-R483 IonicContact OE2-NH1 2.89Å; E480-R483 PolarHBondContact OE2-NH1 2.99Å
481	P	33.3	Very low	56.7	Low	73 Å²	73	40.2 Å²	40.2	47%	0.474	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	119.1	172	-23.1	31.3	0	0	0	111.5	R219 V479	R219-P481 VanDerWaalsContact CZ-CD 3.48Å; V479-P481 WeakPolarHBondContact O-CD 3.11Å
482	G	43.7	Very low	56.2	Low	83 Å²	83	43.5 Å²	43.5	86%	0.856	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.9	-11.9	178.8	0	0	0	0	0	115.1	E480	E480-G482 PolarHBondContact O-N 3.05Å
483	R	45.9	Very low	56.4	Low	83 Å²	83	38.4 Å²	38.4	31%	0.313	26%	0.259	S	S	.	.			trans	-118.3	50.1	176.3	-67.1	-177.4	171.2	175.4	-3.3	112.4	E480 G485 T486	E480-R483 PolarHBondContact O-N 2.84Å; E480-R483 IonicContact OE2-NH1 2.89Å; E480-R483 PolarHBondContact OE2-NH1 2.99Å; R483-G485 PolarHBondContact O-N 3.11Å; R483-T486 HydrophobicContact CB-CG2 4.06Å; R483-T486 WeakPolarHBondContact CB-OG1 3.25Å; R483-T486 PolarHBondContact O-N 3.19Å; R483-T486 PolarHBondContact O-OG1 3.28Å
484	A	49.8	Very low	56.9	Low	106 Å²	106	37.5 Å²	37.5	88%	0.876	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	127.7	172.2	0	0	0	0	0	109.5
485	G	60.3	Low	57.6	Low	30 Å²	30	37.7 Å²	37.7	31%	0.309	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	23.4	-179.9	0	0	0	0	0	115.7	S442 E443 R483	S442-G485 CarbonylContact C-O 3.54Å; E443-G485 WeakPolarHBondContact CB-O 3.22Å; E443-G485 PolarHBondContact N-O 3.49Å; R483-G485 PolarHBondContact O-N 3.11Å
486	T	66.8	Low	58.2	Low	26 Å²	26	38.2 Å²	38.2	16%	0.16	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	149.7	172.2	58.4	0	0	0	0	112.8	F441 P477 C478 R483	F441-T486 CarbonylContact O-C 3.46Å; F441-T486 VanDerWaalsContact O-CA 3.28Å; F441-T486 WeakPolarHBondContact O-CA 3.44Å; P477-T486 WeakPolarHBondContact CA-O 3.39Å; C478-T486 WeakPolarHBondContact CB-OG1 3.37Å; C478-T486 PolarHBondContact N-O 2.76Å; R483-T486 HydrophobicContact CB-CG2 4.06Å; R483-T486 WeakPolarHBondContact CB-OG1 3.25Å; R483-T486 PolarHBondContact O-N 3.19Å; R483-T486 PolarHBondContact O-OG1 3.28Å
487	F	67.9	Low	59.3	Low	22 Å²	22	37.9 Å²	37.9	10%	0.096	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	149	-173.6	-61.8	-90.8	0	0	0	111.3	Y440 F441 E443 V446 L475 A476 P477	Y440-F487 CarbonylContact C-O 3.48Å; Y440-F487 WeakPolarHBondContact CA-O 3.49Å; F441-F487 PolarHBondContact N-O 3.02Å; F441-F487 PolarHBondContact O-N 2.82Å; E443-F487 HydrophobicContact CB-CE2 4.06Å; E443-F487 HydrophobicContact CG-CE2 4.25Å; V446-F487 HydrophobicContact CG2-CB 4.17Å; V446-F487 HydrophobicContact CG2-CD2 3.81Å; V446-F487 HydrophobicContact CG2-CG 4.12Å; L475-F487 HydrophobicContact CB-CB 4.47Å; L475-F487 HydrophobicContact CB-CD1 4.45Å; A476-F487 CarbonylContact O-C 3.57Å; A476-F487 WeakPolarHBondContact O-CA 3.2Å; P477-F487 HydrophobicContact CB-CD1 4.1Å; P477-F487 HydrophobicContact CB-CE1 3.98Å
488	V	62.2	Low	60.7	Low	30 Å²	30	36.6 Å²	36.6	18%	0.182	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	156.8	172	-64.5	0	0	0	0	109.6	Y440 L475 A476 T490	Y440-V488 HydrophobicContact CD1-CG1 3.26Å; Y440-V488 HydrophobicContact CE1-CG1 3.3Å; Y440-V488 HydrophobicContact CG-CG1 4.18Å; L475-V488 CarbonylContact C-O 3.47Å; L475-V488 VanDerWaalsContact CA-O 3.32Å; L475-V488 WeakPolarHBondContact CA-O 3.06Å; L475-V488 WeakPolarHBondContact CD2-O 3.32Å; A476-V488 HydrophobicContact CB-CG2 4.35Å; A476-V488 PolarHBondContact N-O 3.44Å; A476-V488 PolarHBondContact O-N 3.03Å; V488-T490 PolarHBondContact O-N 3.42Å
489	F	64.3	Low	62	Low	7 Å²	7	35.3 Å²	35.3	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	125.2	169.6	-80.1	-88.8	0	0	0	110.2	M426 L429 A430 F441 F474 L475 V491 Q495 L498	M426-F489 HydrophobicContact CB-CE1 4.5Å; L429-F489 HydrophobicContact CD2-CE2 4.49Å; L429-F489 HydrophobicContact CD2-CZ 4.33Å; A430-F489 HydrophobicContact CB-CE1 4.18Å; A430-F489 HydrophobicContact CB-CE2 3.99Å; A430-F489 HydrophobicContact CB-CZ 3.52Å; F441-F489 HydrophobicContact CD2-CD2 4.37Å; F441-F489 HydrophobicContact CD2-CE2 4.2Å; F441-F489 AromaticContact CE2-CD2 3.59Å; F441-F489 HydrophobicContact CE2-CD2 3.59Å; F441-F489 AromaticContact CE2-CE2 3.44Å; F441-F489 HydrophobicContact CE2-CE2 3.44Å; F441-F489 VanDerWaalsContact CE2-CE2 3.44Å; F441-F489 HydrophobicContact CZ-CD2 4.25Å; F441-F489 AromaticContact CZ-CE2 3.75Å; F441-F489 HydrophobicContact CZ-CE2 3.75Å; F474-F489 VanDerWaalsContact O-CA 3.32Å; F474-F489 WeakPolarHBondContact O-CA 3.32Å; F474-F489 WeakPolarHBondContact O-CD1 3.18Å; L475-F489 HydrophobicContact CD2-CD1 4.15Å; L475-F489 HydrophobicContact CD2-CD2 4.15Å; L475-F489 HydrophobicContact CD2-CE1 4.22Å; L475-F489 HydrophobicContact CD2-CE2 4.21Å; L475-F489 HydrophobicContact CD2-CG 4.11Å; L475-F489 HydrophobicContact CD2-CZ 4.24Å; F489-V491 PolarHBondContact O-N 3.07Å; F489-V491 VanDerWaalsContact O-N 3.12Å; F489-Q495 HydrophobicContact CB-CB 4.07Å; F489-Q495 HydrophobicContact CD1-CB 4.28Å; F489-Q495 HydrophobicContact CD2-CB 3.57Å; F489-Q495 HydrophobicContact CD2-CG 3.52Å; F489-Q495 HydrophobicContact CE2-CB 4.08Å; F489-Q495 HydrophobicContact CE2-CG 3.64Å; F489-Q495 HydrophobicContact CG-CB 3.7Å; F489-Q495 HydrophobicContact CG-CG 4.18Å; F489-Q495 HydrophobicContact CZ-CG 4.38Å; F489-L498 HydrophobicContact CD1-CD1 4.46Å; F489-L498 HydrophobicContact CE1-CD1 3.89Å
490	T	58.6	Low	63.6	Low	14 Å²	14	31.7 Å²	31.7	9%	0.086	22%	0.217	C	C	.	.	S	Bend	trans	-47.9	-40.4	178.4	-61	0	0	0	0	111.5	E96 R472 F473 F474 L475 A476 V488	E96-T490 HydrophobicContact CB-CG2 3.63Å; E96-T490 HydrophobicContact CG-CG2 3.42Å; E96-T490 VanDerWaalsContact CG-CG2 3.42Å; E96-T490 WeakPolarHBondContact CG-O 3.45Å; R472-T490 PolarHBondContact O-OG1 3.38Å; F473-T490 VanDerWaalsContact O-CB 3.26Å; F473-T490 WeakPolarHBondContact O-CB 3.31Å; F473-T490 WeakPolarHBondContact O-CG2 3.42Å; F473-T490 PolarHBondContact O-OG1 3.12Å; F474-T490 VanDerWaalsContact C-OG1 3.22Å; F474-T490 PolarHBondContact O-N 3.31Å; F474-T490 PolarHBondContact O-OG1 2.59Å; L475-T490 PolarHBondContact N-OG1 2.81Å; A476-T490 PolarHBondContact N-OG1 3.36Å; V488-T490 PolarHBondContact O-N 3.42Å
491	V	61.1	Low	65.7	Low	25 Å²	25	30.4 Å²	30.4	15%	0.152	21%	0.21	C	C	.	.	S	Bend	trans	-121	115.8	171.6	177.4	0	0	0	0	107.2	W372 Y395 F489 A493 M494	W372-V491 HydrophobicContact CH2-CG2 4.06Å; W372-V491 HydrophobicContact CZ3-CG2 4.25Å; Y395-V491 HydrophobicContact CE1-CG1 4.33Å; F489-V491 PolarHBondContact O-N 3.07Å; F489-V491 VanDerWaalsContact O-N 3.12Å; V491-A493 VanDerWaalsContact C-N 3.31Å; V491-A493 HydrophobicContact CG1-CB 4.46Å; V491-A493 PolarHBondContact O-N 3.41Å; V491-M494 HydrophobicContact CB-CB 3.89Å; V491-M494 HydrophobicContact CG1-CB 4.31Å; V491-M494 WeakPolarHBondContact O-CA 3.4Å; V491-M494 WeakPolarHBondContact O-CB 3.36Å; V491-M494 PolarHBondContact O-N 3.39Å
492	P	61.7	Low	68	Low	97 Å²	97	28.1 Å²	28.1	63%	0.63	19%	0.193	S	C	*	.	H	α-helix	trans	-54.1	-43.8	-176.7	-30.5	36	0	0	0	113.7	M494 Q495	P492-M494 PolarHBondContact O-N 2.82Å; P492-Q495 WeakPolarHBondContact O-CB 3.46Å; P492-Q495 PolarHBondContact O-N 3.12Å
493	A	64	Low	69.5	Low	15 Å²	15	25 Å²	25	12%	0.124	16%	0.156	C	C	.	.	H	α-helix	trans	-65.4	-20.3	176.4	0	0	0	0	0	113.8	Y395 V491 Q495 E496 Y497 L619 F623	Y395-A493 HydrophobicContact CE1-CB 4.31Å; Y395-A493 VanDerWaalsContact OH-CB 3.25Å; Y395-A493 WeakPolarHBondContact OH-CB 3.26Å; V491-A493 VanDerWaalsContact C-N 3.31Å; V491-A493 HydrophobicContact CG1-CB 4.46Å; V491-A493 PolarHBondContact O-N 3.41Å; A493-Q495 VanDerWaalsContact C-N 3.27Å; A493-Q495 PolarHBondContact O-N 3.36Å; A493-E496 PolarHBondContact O-N 3.38Å; A493-Y497 PolarHBondContact O-N 2.87Å; A493-L619 HydrophobicContact CB-CD1 3.69Å; A493-F623 WeakPolarHBondContact O-CE2 3.45Å
494	M	74.3	Confident	70.6	Confident	6 Å²	6	21.3 Å²	21.3	3%	0.03	14%	0.143	C	C	.	.	H	α-helix	trans	-69.2	-28	173.2	-169	66	71.9	0	0	111.5	Y395 F398 L399 F474 V491 P492 Y497 L498	Y395-M494 HydrophobicContact CD1-CE 3.74Å; Y395-M494 HydrophobicContact CD1-SD 4.11Å; Y395-M494 HydrophobicContact CE1-CE 4Å; F398-M494 HydrophobicContact CD1-CE 3.84Å; F398-M494 HydrophobicContact CE1-CE 3.82Å; L399-M494 HydrophobicContact CD1-SD 4.43Å; L399-M494 HydrophobicContact CD2-CE 4.19Å; L399-M494 HydrophobicContact CD2-SD 4.2Å; F474-M494 HydrophobicContact CD1-CG 4.31Å; V491-M494 HydrophobicContact CB-CB 3.89Å; V491-M494 HydrophobicContact CG1-CB 4.31Å; V491-M494 WeakPolarHBondContact O-CA 3.4Å; V491-M494 WeakPolarHBondContact O-CB 3.36Å; V491-M494 PolarHBondContact O-N 3.39Å; P492-M494 PolarHBondContact O-N 2.82Å; M494-Y497 HydrophobicContact SD-CD1 4.12Å; M494-L498 HydrophobicContact CG-CD1 3.87Å; M494-L498 HydrophobicContact CG-CG 4.1Å; M494-L498 VanDerWaalsContact O-CB 3.3Å; M494-L498 WeakPolarHBondContact O-CB 3.35Å; M494-L498 VanDerWaalsContact O-CG 3.26Å; M494-L498 WeakPolarHBondContact O-CG 3.49Å; M494-L498 PolarHBondContact O-N 2.86Å; M494-L498 HydrophobicContact SD-CG 4.24Å
495	Q	79.7	Confident	71.6	Confident	6 Å²	6	18 Å²	18	3%	0.028	11%	0.11	C	C	.	.	H	α-helix	trans	-58.6	-52.7	170.3	-174.1	176.6	-20.8	0	0	109.8	A430 V434 K438 F489 P492 A493 Y497 L498 A499	A430-Q495 HydrophobicContact CB-CG 3.91Å; A430-Q495 VanDerWaalsContact CB-O 3.28Å; A430-Q495 WeakPolarHBondContact CB-O 2.99Å; V434-Q495 HydrophobicContact CG2-CG 4.35Å; K438-Q495 PolarHBondContact O-NE2 3.41Å; F489-Q495 HydrophobicContact CB-CB 4.07Å; F489-Q495 HydrophobicContact CD1-CB 4.28Å; F489-Q495 HydrophobicContact CD2-CB 3.57Å; F489-Q495 HydrophobicContact CD2-CG 3.52Å; F489-Q495 HydrophobicContact CE2-CB 4.08Å; F489-Q495 HydrophobicContact CE2-CG 3.64Å; F489-Q495 HydrophobicContact CG-CB 3.7Å; F489-Q495 HydrophobicContact CG-CG 4.18Å; F489-Q495 HydrophobicContact CZ-CG 4.38Å; P492-Q495 WeakPolarHBondContact O-CB 3.46Å; P492-Q495 PolarHBondContact O-N 3.12Å; A493-Q495 VanDerWaalsContact C-N 3.27Å; A493-Q495 PolarHBondContact O-N 3.36Å; Q495-Y497 PolarHBondContact O-N 2.85Å; Q495-L498 PolarHBondContact O-N 3.5Å; Q495-A499 VanDerWaalsContact O-CB 3.27Å; Q495-A499 WeakPolarHBondContact O-CB 3.45Å; Q495-A499 PolarHBondContact O-N 2.81Å
496	E	78.1	Confident	71.7	Confident	16 Å²	16	18.8 Å²	18.8	8%	0.075	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-42.2	-179.9	-66.6	176.2	-94.9	0	0	112.5	V434 A493 A499 A500 F617 E618 L619 F620 F623	V434-E496 HydrophobicContact CG2-CG 4.48Å; A493-E496 PolarHBondContact O-N 3.38Å; E496-A499 PolarHBondContact O-N 3.43Å; E496-A500 WeakPolarHBondContact O-CB 3Å; E496-A500 PolarHBondContact O-N 2.96Å; E496-F617 HydrophobicContact CG-CB 4.14Å; E496-F617 HydrophobicContact CG-CD1 3.54Å; E496-F617 HydrophobicContact CG-CE1 4.46Å; E496-F617 HydrophobicContact CG-CG 4.31Å; E496-F617 WeakPolarHBondContact OE2-CA 3.47Å; E496-E618 PolarHBondContact OE2-N 3.28Å; E496-L619 HydrophobicContact CB-CB 4.4Å; E496-L619 VanDerWaalsContact OE2-CA 3.31Å; E496-L619 WeakPolarHBondContact OE2-CA 3.24Å; E496-L619 VanDerWaalsContact OE2-CB 3.32Å; E496-L619 WeakPolarHBondContact OE2-CB 3.41Å; E496-L619 PolarHBondContact OE2-N 2.89Å; E496-F620 HydrophobicContact CB-CB 4.22Å; E496-F620 HydrophobicContact CG-CB 4.37Å; E496-F620 PolarHBondContact OE2-N 3.28Å; E496-F623 HydrophobicContact CB-CD2 3.9Å; E496-F623 HydrophobicContact CB-CE2 3.95Å
497	Y	81.7	Confident	71.5	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-48.6	176.9	179	-83.1	0	0	0	112.1	T392 Y395 T396 L399 A493 M494 Q495 A500 L501 F623 L627	T392-Y497 HydrophobicContact CG2-CD2 4.37Å; T392-Y497 HydrophobicContact CG2-CE2 3.85Å; Y395-Y497 VanDerWaalsContact CB-CD2 3.47Å; Y395-Y497 HydrophobicContact CD1-CD2 4.42Å; Y395-Y497 HydrophobicContact CD1-CG 4.36Å; Y395-Y497 HydrophobicContact CG-CD2 4.09Å; Y395-Y497 HydrophobicContact CG-CG 4.48Å; T396-Y497 WeakPolarHBondContact CA-OH 3.28Å; T396-Y497 WeakPolarHBondContact CB-OH 3.33Å; T396-Y497 PolarHBondContact OG1-OH 3.34Å; L399-Y497 HydrophobicContact CD1-CD1 3.9Å; L399-Y497 HydrophobicContact CD1-CE1 3.19Å; A493-Y497 PolarHBondContact O-N 2.87Å; M494-Y497 HydrophobicContact SD-CD1 4.12Å; Q495-Y497 PolarHBondContact O-N 2.85Å; Y497-A500 PolarHBondContact O-N 3.48Å; Y497-L501 HydrophobicContact CE1-CB 4.48Å; Y497-L501 HydrophobicContact CE1-CD2 4.19Å; Y497-L501 WeakPolarHBondContact O-CB 3.48Å; Y497-L501 PolarHBondContact O-N 3.39Å; Y497-F623 HydrophobicContact CD2-CB 4.5Å; Y497-F623 AromaticContact CD2-CD1 3.66Å; Y497-F623 HydrophobicContact CD2-CD1 3.66Å; Y497-F623 AromaticContact CD2-CE1 3.91Å; Y497-F623 HydrophobicContact CD2-CE1 3.91Å; Y497-F623 HydrophobicContact CD2-CG 4.03Å; Y497-F623 HydrophobicContact CD2-CZ 4.49Å; Y497-L627 HydrophobicContact CE1-CD2 4.46Å; Y497-L627 HydrophobicContact CE2-CD2 3.79Å; Y497-L627 HydrophobicContact CE2-CG 4.49Å; Y497-L627 WeakPolarHBondContact OH-CD2 3.17Å
498	L	85.1	Confident	70.8	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-69.5	-35.7	-178.9	-72.6	173.1	0	0	0	112.2	M419 M426 G427 A430 F474 F489 M494 Q495 A500 L501 Y502	M419-L498 HydrophobicContact CE-CD2 4.01Å; M426-L498 HydrophobicContact CB-CD1 4.04Å; G427-L498 WeakPolarHBondContact CA-O 3.49Å; A430-L498 HydrophobicContact CB-CB 4.06Å; F474-L498 HydrophobicContact CD1-CD1 3.56Å; F474-L498 HydrophobicContact CE1-CD1 3.81Å; F474-L498 HydrophobicContact CE1-CD2 4.23Å; F489-L498 HydrophobicContact CD1-CD1 4.46Å; F489-L498 HydrophobicContact CE1-CD1 3.89Å; M494-L498 HydrophobicContact CG-CD1 3.87Å; M494-L498 HydrophobicContact CG-CG 4.1Å; M494-L498 VanDerWaalsContact O-CB 3.3Å; M494-L498 WeakPolarHBondContact O-CB 3.35Å; M494-L498 VanDerWaalsContact O-CG 3.26Å; M494-L498 WeakPolarHBondContact O-CG 3.49Å; M494-L498 PolarHBondContact O-N 2.86Å; M494-L498 HydrophobicContact SD-CG 4.24Å; Q495-L498 PolarHBondContact O-N 3.5Å; L498-A500 VanDerWaalsContact C-N 3.34Å; L498-L501 HydrophobicContact CD2-CD2 4.44Å; L498-L501 PolarHBondContact O-N 3.37Å; L498-Y502 WeakPolarHBondContact O-CB 3.47Å; L498-Y502 PolarHBondContact O-N 3.09Å
499	A	80.9	Confident	69.9	Low	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.2	-45.9	171.7	0	0	0	0	0	110.8	A430 V434 Q495 E496 Y502 I503 F620	A430-A499 HydrophobicContact CB-CB 4.04Å; V434-A499 HydrophobicContact CB-CB 4.44Å; V434-A499 HydrophobicContact CG2-CB 3.85Å; Q495-A499 VanDerWaalsContact O-CB 3.27Å; Q495-A499 WeakPolarHBondContact O-CB 3.45Å; Q495-A499 PolarHBondContact O-N 2.81Å; E496-A499 PolarHBondContact O-N 3.43Å; A499-Y502 PolarHBondContact O-N 3.07Å; A499-I503 PolarHBondContact O-N 2.97Å; A499-F620 HydrophobicContact CB-CD2 3.87Å; A499-F620 HydrophobicContact CB-CE2 3.7Å
500	A	77	Confident	68.9	Low	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-44.8	177	0	0	0	0	0	111.1	E496 Y497 L498 Y502 I503 V504 F620 F623 M624 L627	E496-A500 WeakPolarHBondContact O-CB 3Å; E496-A500 PolarHBondContact O-N 2.96Å; Y497-A500 PolarHBondContact O-N 3.48Å; L498-A500 VanDerWaalsContact C-N 3.34Å; A500-Y502 VanDerWaalsContact C-N 3.34Å; A500-Y502 PolarHBondContact O-N 2.86Å; A500-I503 PolarHBondContact O-N 3.37Å; A500-V504 WeakPolarHBondContact O-CG2 3.07Å; A500-V504 PolarHBondContact O-N 3.3Å; A500-F620 HydrophobicContact CB-CD2 4.1Å; A500-F620 HydrophobicContact CB-CE2 4.08Å; A500-F623 HydrophobicContact CB-CB 3.79Å; A500-M624 VanDerWaalsContact CA-SD 3.56Å; A500-M624 HydrophobicContact CB-CG 3.78Å; A500-M624 HydrophobicContact CB-SD 3.7Å; A500-M624 VanDerWaalsContact O-SD 3.4Å; A500-L627 HydrophobicContact CB-CD1 3.71Å
501	L	83.2	Confident	67.7	Low	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-42.7	176.6	-178.2	62.4	0	0	0	112.2	M419 A423 Y497 L498 I503 V504 L505 L627 L636	M419-L501 HydrophobicContact CE-CD2 3.93Å; A423-L501 HydrophobicContact CB-CD2 3.77Å; A423-L501 HydrophobicContact CB-CG 4.24Å; Y497-L501 HydrophobicContact CE1-CB 4.48Å; Y497-L501 HydrophobicContact CE1-CD2 4.19Å; Y497-L501 WeakPolarHBondContact O-CB 3.48Å; Y497-L501 PolarHBondContact O-N 3.39Å; L498-L501 HydrophobicContact CD2-CD2 4.44Å; L498-L501 PolarHBondContact O-N 3.37Å; L501-I503 VanDerWaalsContact C-N 3.32Å; L501-I503 PolarHBondContact O-N 3.28Å; L501-V504 PolarHBondContact O-N 2.97Å; L501-L505 HydrophobicContact CD1-CD1 3.89Å; L501-L505 HydrophobicContact CD1-CG 3.96Å; L501-L505 HydrophobicContact CG-CD1 3.83Å; L501-L505 HydrophobicContact CG-CG 4.33Å; L501-L505 WeakPolarHBondContact O-CB 3.41Å; L501-L505 VanDerWaalsContact O-CG 3.27Å; L501-L505 WeakPolarHBondContact O-CG 3.43Å; L501-L505 PolarHBondContact O-N 3.4Å; L501-L627 HydrophobicContact CB-CD1 4.03Å; L501-L627 HydrophobicContact CD1-CD2 4.13Å; L501-L627 VanDerWaalsContact N-CD1 3.35Å; L501-L636 HydrophobicContact CD1-CD1 3.97Å; L501-L636 HydrophobicContact CD1-CD2 3.93Å; L501-L636 HydrophobicContact CD2-CD2 4.35Å
502	Y	82.7	Confident	66.7	Low	25 Å²	25	40.8 Å²	40.8	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-42.6	177.2	179.8	-103	0	0	0	112.4	A423 K428 Y431 L498 A499 A500 L507	A423-Y502 WeakPolarHBondContact O-CD2 3.27Å; K428-Y502 HydrophobicContact CB-CD2 4.21Å; K428-Y502 HydrophobicContact CB-CE1 4.46Å; K428-Y502 HydrophobicContact CB-CE2 3.73Å; K428-Y502 HydrophobicContact CG-CE2 4.45Å; Y431-Y502 HydrophobicContact CD1-CD1 4.25Å; Y431-Y502 HydrophobicContact CD1-CE1 4.18Å; Y431-Y502 HydrophobicContact CG-CD1 4.16Å; L498-Y502 WeakPolarHBondContact O-CB 3.47Å; L498-Y502 PolarHBondContact O-N 3.09Å; A499-Y502 PolarHBondContact O-N 3.07Å; A500-Y502 VanDerWaalsContact C-N 3.34Å; A500-Y502 PolarHBondContact O-N 2.86Å; Y502-L507 HydrophobicContact CD2-CB 3.83Å; Y502-L507 HydrophobicContact CD2-CD1 3.93Å; Y502-L507 HydrophobicContact CE2-CB 3.52Å; Y502-L507 HydrophobicContact CE2-CD1 4.24Å; Y502-L507 PolarHBondContact OH-O 2.82Å
503	I	73.6	Confident	65.6	Low	18 Å²	18	44.3 Å²	44.3	9%	0.092	23%	0.231	C	C	.	.	H	α-helix	trans	-67.4	-50.8	175.3	-66.9	-150.5	0	0	0	111.3	Y431 A499 A500 L501 L505 G506 V515 F620 M624	Y431-I503 HydrophobicContact CD2-CD1 3.85Å; Y431-I503 HydrophobicContact CD2-CG1 4Å; Y431-I503 HydrophobicContact CE2-CD1 3.5Å; Y431-I503 HydrophobicContact CE2-CG1 4.11Å; A499-I503 PolarHBondContact O-N 2.97Å; A500-I503 PolarHBondContact O-N 3.37Å; L501-I503 VanDerWaalsContact C-N 3.32Å; L501-I503 PolarHBondContact O-N 3.28Å; I503-L505 PolarHBondContact O-N 3.1Å; I503-G506 PolarHBondContact O-N 3.36Å; I503-V515 HydrophobicContact CG2-CG1 4.04Å; I503-V515 HydrophobicContact CG2-CG2 3.85Å; I503-F620 HydrophobicContact CD1-CZ 4.05Å; I503-M624 HydrophobicContact CB-CE 4.29Å; I503-M624 HydrophobicContact CB-SD 4.08Å; I503-M624 HydrophobicContact CG2-CE 3.69Å; I503-M624 HydrophobicContact CG2-SD 4.16Å
504	V	70	Confident	64.6	Low	5 Å²	5	48 Å²	48	3%	0.03	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-31.2	-174.4	175.1	0	0	0	0	111.9	A500 L501 G506 M624 L627 L628 I643	A500-V504 WeakPolarHBondContact O-CG2 3.07Å; A500-V504 PolarHBondContact O-N 3.3Å; L501-V504 PolarHBondContact O-N 2.97Å; V504-G506 PolarHBondContact O-N 3.16Å; V504-M624 HydrophobicContact CG2-CE 3.6Å; V504-M624 HydrophobicContact CG2-SD 3.59Å; V504-M624 VanDerWaalsContact CG2-SD 3.59Å; V504-L627 HydrophobicContact CG2-CB 4.32Å; V504-L627 HydrophobicContact CG2-CD1 4.33Å; V504-L628 HydrophobicContact CG1-CD2 3.62Å; V504-L628 HydrophobicContact CG1-CG 4.44Å; V504-L628 HydrophobicContact CG2-CD2 4.39Å; V504-I643 HydrophobicContact CB-CD1 4.49Å; V504-I643 HydrophobicContact CG1-CB 4.47Å; V504-I643 HydrophobicContact CG1-CD1 3.45Å; V504-I643 VanDerWaalsContact CG1-CD1 3.45Å; V504-I643 HydrophobicContact CG1-CG1 3.85Å; V504-I643 HydrophobicContact CG1-CG2 3.78Å
505	L	71.5	Confident	63.1	Low	36 Å²	36	49 Å²	49	19%	0.188	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-5.5	174.2	-70.7	172.5	0	0	0	114.1	A423 L501 I503 L507 C641 I643	A423-L505 HydrophobicContact CB-CD1 3.84Å; L501-L505 HydrophobicContact CD1-CD1 3.89Å; L501-L505 HydrophobicContact CD1-CG 3.96Å; L501-L505 HydrophobicContact CG-CD1 3.83Å; L501-L505 HydrophobicContact CG-CG 4.33Å; L501-L505 WeakPolarHBondContact O-CB 3.41Å; L501-L505 VanDerWaalsContact O-CG 3.27Å; L501-L505 WeakPolarHBondContact O-CG 3.43Å; L501-L505 PolarHBondContact O-N 3.4Å; I503-L505 PolarHBondContact O-N 3.1Å; L505-L507 HydrophobicContact CB-CD1 3.92Å; L505-L507 HydrophobicContact CB-CG 3.83Å; L505-L507 HydrophobicContact CD1-CD1 3.99Å; L505-L507 PolarHBondContact O-N 2.85Å; L505-C641 HydrophobicContact CD1-CB 4.19Å; L505-C641 HydrophobicContact CD2-CB 4.03Å; L505-I643 HydrophobicContact CD2-CG1 3.81Å
506	G	61.1	Low	61.3	Low	47 Å²	47	50 Å²	50	49%	0.485	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	22	179.1	0	0	0	0	0	113.7	I503 V504 R508	I503-G506 PolarHBondContact O-N 3.36Å; V504-G506 PolarHBondContact O-N 3.16Å; G506-R508 PolarHBondContact O-N 2.95Å; G506-R508 VanDerWaalsContact O-N 3.08Å
507	L	62.5	Low	59.5	Low	58 Å²	58	55.6 Å²	55.6	30%	0.304	29%	0.287	S	S	.	.			trans	-70.8	-3.2	-176.9	-66.7	171.9	0	0	0	113.4	R424 Y502 L505	R424-L507 HydrophobicContact CB-CD1 4.05Å; R424-L507 HydrophobicContact CG-CD1 4.33Å; Y502-L507 HydrophobicContact CD2-CB 3.83Å; Y502-L507 HydrophobicContact CD2-CD1 3.93Å; Y502-L507 HydrophobicContact CE2-CB 3.52Å; Y502-L507 HydrophobicContact CE2-CD1 4.24Å; Y502-L507 PolarHBondContact OH-O 2.82Å; L505-L507 HydrophobicContact CB-CD1 3.92Å; L505-L507 HydrophobicContact CB-CG 3.83Å; L505-L507 HydrophobicContact CD1-CD1 3.99Å; L505-L507 PolarHBondContact O-N 2.85Å
508	R	53.1	Low	57.7	Low	89 Å²	89	57.6 Å²	57.6	34%	0.336	30%	0.296	S	S	.	.	S	Bend	trans	-95.8	113.9	167.3	-164.1	178.4	-176.8	-153.9	5.4	110.1	Y431 G506 T510 E518	Y431-R508 PolarHBondContact OH-NH1 3.1Å; Y431-R508 VanDerWaalsContact OH-NH1 3.17Å; G506-R508 PolarHBondContact O-N 2.95Å; G506-R508 VanDerWaalsContact O-N 3.08Å; R508-T510 PolarHBondContact O-N 2.99Å; R508-E518 IonicContact CZ-OE1 2.99Å; R508-E518 IonicContact NH1-OE1 2.69Å; R508-E518 PolarHBondContact NH1-OE1 3.11Å; R508-E518 IonicContact NH1-OE2 2.96Å; R508-E518 PolarHBondContact NH1-OE2 3.04Å; R508-E518 IonicContact NH2-OE1 3.17Å; R508-E518 PolarHBondContact NH2-OE1 3.36Å
509	K	44.1	Very low	55.7	Low	204 Å²	204	59.5 Å²	59.5	89%	0.887	31%	0.308	S	S	*	.	S	Bend	trans	-64.6	-7.1	-173	-75.2	-175.5	175.3	-179.6	0	116.6	T511	K509-T511 PolarHBondContact O-N 2.9Å
510	T	42.4	Very low	53.7	Low	68 Å²	68	60.4 Å²	60.4	42%	0.417	32%	0.315	S	S	.	.	S	Bend	trans	-95	76	173.6	58.9	0	0	0	0	110	R508	R508-T510 PolarHBondContact O-N 2.99Å
511	T	34.6	Very low	52	Low	97 Å²	97	63.8 Å²	63.8	60%	0.595	33%	0.331	S	S	*	.			trans	30.9	113.2	149.5	38.1	0	0	0	0	117.2	K509 Q513 K514	K509-T511 PolarHBondContact O-N 2.9Å; T511-Q513 WeakPolarHBondContact O-CA 3.05Å; T511-Q513 PolarHBondContact O-N 3.08Å; T511-K514 PolarHBondContact O-N 3.34Å
512	L	39.2	Very low	50	Low	69 Å²	69	68.4 Å²	68.4	36%	0.361	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	12.2	-34	142.5	-108.3	86.8	0	0	0	120.9	K514 E650	L512-K514 VanDerWaalsContact C-N 3.29Å; L512-K514 PolarHBondContact O-N 2.77Å; L512-E650 HydrophobicContact CD2-CB 3.88Å; L512-E650 HydrophobicContact CD2-CG 4.4Å; L512-E650 WeakPolarHBondContact CD2-OE2 3.27Å
513	Q	39.1	Very low	47.9	Very low	171 Å²	171	68.6 Å²	68.6	80%	0.799	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-23	170.2	-69.9	-179.7	-14.7	0	0	113.6	T511	T511-Q513 WeakPolarHBondContact O-CA 3.05Å; T511-Q513 PolarHBondContact O-N 3.08Å
514	K	42.1	Very low	46	Very low	93 Å²	93	68.9 Å²	68.9	40%	0.404	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-28.5	175.8	-87.1	-173.2	179.2	-178.7	0	114.5	T511 L512 G516 K517 E518	T511-K514 PolarHBondContact O-N 3.34Å; L512-K514 VanDerWaalsContact C-N 3.29Å; L512-K514 PolarHBondContact O-N 2.77Å; K514-G516 VanDerWaalsContact C-N 3.32Å; K514-G516 PolarHBondContact O-N 3.27Å; K514-K517 CarbonylContact O-C 3.52Å; K514-K517 WeakPolarHBondContact O-CA 3.24Å; K514-K517 PolarHBondContact O-N 3.1Å; K514-E518 WeakPolarHBondContact O-CB 3.49Å; K514-E518 PolarHBondContact O-N 3.29Å
515	V	44.4	Very low	44.4	Very low	26 Å²	26	75.7 Å²	75.7	16%	0.158	39%	0.392	C	S	.	.	H	α-helix	trans	-62.8	-43.4	178.2	179.5	0	0	0	0	110.2	I503 K517 E518 V519 M624	I503-V515 HydrophobicContact CG2-CG1 4.04Å; I503-V515 HydrophobicContact CG2-CG2 3.85Å; V515-K517 PolarHBondContact O-N 3.46Å; V515-E518 PolarHBondContact O-N 3.19Å; V515-V519 HydrophobicContact CG1-CG2 4.05Å; V515-V519 WeakPolarHBondContact O-CB 3.44Å; V515-V519 WeakPolarHBondContact O-CG2 3.32Å; V515-V519 PolarHBondContact O-N 3.37Å; V515-M624 HydrophobicContact CG1-CE 4.3Å
516	G	41	Very low	42.8	Very low	28 Å²	28	78.4 Å²	78.4	29%	0.289	41%	0.41	S	S	.	.	H	α-helix	trans	-66.4	-17.4	171.8	0	0	0	0	0	114.6	K514 A520	K514-G516 VanDerWaalsContact C-N 3.32Å; K514-G516 PolarHBondContact O-N 3.27Å; G516-A520 WeakPolarHBondContact O-CB 3.32Å
517	K	39.7	Very low	41.5	Very low	134 Å²	134	79 Å²	79	58%	0.583	42%	0.416	S	S	*	.	H	α-helix	trans	-94.4	-34.9	178	-158.2	-177.2	-179.1	-170.9	0	112.4	K514 V515 A520 E521	K514-K517 CarbonylContact O-C 3.52Å; K514-K517 WeakPolarHBondContact O-CA 3.24Å; K514-K517 PolarHBondContact O-N 3.1Å; V515-K517 PolarHBondContact O-N 3.46Å; K517-A520 CarbonylContact O-C 3.48Å; K517-A520 WeakPolarHBondContact O-CB 3.35Å; K517-A520 PolarHBondContact O-N 3.25Å; K517-E521 WeakPolarHBondContact O-CB 3.36Å; K517-E521 PolarHBondContact O-N 2.94Å
518	E	43.7	Very low	40.1	Very low	41 Å²	41	80.8 Å²	80.8	19%	0.192	42%	0.422	C	S	.	.	H	α-helix	trans	-83.6	-38.9	178.9	-73.5	179.3	180	0	0	111.6	Y431 R508 K514 V515 A520 E521 L522	Y431-E518 PolarHBondContact OH-OE2 3.5Å; R508-E518 IonicContact CZ-OE1 2.99Å; R508-E518 IonicContact NH1-OE1 2.69Å; R508-E518 PolarHBondContact NH1-OE1 3.11Å; R508-E518 IonicContact NH1-OE2 2.96Å; R508-E518 PolarHBondContact NH1-OE2 3.04Å; R508-E518 IonicContact NH2-OE1 3.17Å; R508-E518 PolarHBondContact NH2-OE1 3.36Å; K514-E518 WeakPolarHBondContact O-CB 3.49Å; K514-E518 PolarHBondContact O-N 3.29Å; V515-E518 PolarHBondContact O-N 3.19Å; E518-A520 PolarHBondContact O-N 3.2Å; E518-E521 PolarHBondContact O-N 3.35Å; E518-L522 WeakPolarHBondContact O-CB 3.19Å; E518-L522 PolarHBondContact O-N 3.24Å
519	V	43	Very low	39.3	Very low	41 Å²	41	82.8 Å²	82.8	25%	0.248	44%	0.44	C	S	.	.	H	α-helix	trans	-63.2	-32	165.1	176.3	0	0	0	0	109.6	V515 V523	V515-V519 HydrophobicContact CG1-CG2 4.05Å; V515-V519 WeakPolarHBondContact O-CB 3.44Å; V515-V519 WeakPolarHBondContact O-CG2 3.32Å; V515-V519 PolarHBondContact O-N 3.37Å; V519-V523 HydrophobicContact CG1-CG2 4.42Å; V519-V523 VanDerWaalsContact O-CB 3.26Å; V519-V523 WeakPolarHBondContact O-CB 3.45Å; V519-V523 WeakPolarHBondContact O-CG2 3.36Å; V519-V523 PolarHBondContact O-N 3.44Å; V519-V523 VanDerWaalsContact O-N 3.09Å
520	A	40.1	Very low	38.9	Very low	19 Å²	19	78.4 Å²	78.4	16%	0.157	43%	0.43	C	S	.	.	H	α-helix	trans	-76	-33.1	175.3	0	0	0	0	0	114.9	G516 K517 E518 G524 K658	G516-A520 WeakPolarHBondContact O-CB 3.32Å; K517-A520 CarbonylContact O-C 3.48Å; K517-A520 WeakPolarHBondContact O-CB 3.35Å; K517-A520 PolarHBondContact O-N 3.25Å; E518-A520 PolarHBondContact O-N 3.2Å; A520-G524 PolarHBondContact O-N 2.89Å; A520-G524 VanDerWaalsContact O-N 3.14Å; A520-K658 HydrophobicContact CB-CD 3.58Å; A520-K658 VanDerWaalsContact CB-CE 3.46Å; A520-K658 PolarHBondContact O-NZ 3.3Å
521	E	41.8	Very low	38.3	Very low	70 Å²	70	78.2 Å²	78.2	33%	0.327	43%	0.431	S	S	.	.	H	α-helix	trans	-76.9	-38.4	172.8	-88.3	178.7	144.8	0	0	110.6	K517 E518 G524 R525	K517-E521 WeakPolarHBondContact O-CB 3.36Å; K517-E521 PolarHBondContact O-N 2.94Å; E518-E521 PolarHBondContact O-N 3.35Å; E521-G524 PolarHBondContact O-N 3.02Å; E521-R525 HydrophobicContact CB-CG 4.41Å; E521-R525 WeakPolarHBondContact O-CA 3.3Å; E521-R525 WeakPolarHBondContact O-CB 3.27Å; E521-R525 WeakPolarHBondContact O-CG 3.24Å; E521-R525 PolarHBondContact O-N 3.4Å; E521-R525 IonicContact OE1-CZ 3.57Å; E521-R525 IonicContact OE1-NE 3.48Å; E521-R525 IonicContact OE1-NH2 3.98Å; E521-R525 PolarHBondContact OE1-NH2 3.31Å; E521-R525 IonicContact OE2-NH2 3.12Å
522	L	40.5	Very low	38.4	Very low	98 Å²	98	78 Å²	78	51%	0.513	43%	0.426	S	S	.	.	H	α-helix	trans	-64.9	-40.7	175.2	-113.7	83.3	0	0	0	112.1	E518 G524 F620	E518-L522 WeakPolarHBondContact O-CB 3.19Å; E518-L522 PolarHBondContact O-N 3.24Å; L522-G524 VanDerWaalsContact C-N 3.31Å; L522-F620 HydrophobicContact CD2-CD1 4.01Å; L522-F620 HydrophobicContact CD2-CE1 4.16Å
523	V	38	Very low	38.1	Very low	28 Å²	28	79.2 Å²	79.2	17%	0.17	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.8	176.5	174	0	0	0	0	112	V519	V519-V523 HydrophobicContact CG1-CG2 4.42Å; V519-V523 VanDerWaalsContact O-CB 3.26Å; V519-V523 WeakPolarHBondContact O-CB 3.45Å; V519-V523 WeakPolarHBondContact O-CG2 3.36Å; V519-V523 PolarHBondContact O-N 3.44Å; V519-V523 VanDerWaalsContact O-N 3.09Å
524	G	34.8	Very low	37.6	Very low	25 Å²	25	77 Å²	77	26%	0.258	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-14.6	-178.4	0	0	0	0	0	115.8	A520 E521 L522 V526 G527	A520-G524 PolarHBondContact O-N 2.89Å; A520-G524 VanDerWaalsContact O-N 3.14Å; E521-G524 PolarHBondContact O-N 3.02Å; L522-G524 VanDerWaalsContact C-N 3.31Å; G524-V526 VanDerWaalsContact C-N 3.3Å; G524-V526 PolarHBondContact O-N 3.39Å; G524-G527 PolarHBondContact O-N 2.89Å
525	R	36.1	Very low	37.2	Very low	148 Å²	148	74.3 Å²	74.3	56%	0.558	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	24.5	-174	-77.1	-179.2	180	-172.9	2.9	114.4	E521	E521-R525 HydrophobicContact CB-CG 4.41Å; E521-R525 WeakPolarHBondContact O-CA 3.3Å; E521-R525 WeakPolarHBondContact O-CB 3.27Å; E521-R525 WeakPolarHBondContact O-CG 3.24Å; E521-R525 PolarHBondContact O-N 3.4Å; E521-R525 IonicContact OE1-CZ 3.57Å; E521-R525 IonicContact OE1-NE 3.48Å; E521-R525 IonicContact OE1-NH2 3.98Å; E521-R525 PolarHBondContact OE1-NH2 3.31Å; E521-R525 IonicContact OE2-NH2 3.12Å
526	V	38.3	Very low	36.6	Very low	93 Å²	93	78 Å²	78	56%	0.564	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	7.4	163.1	-174.1	0	0	0	0	110.8	G524	G524-V526 VanDerWaalsContact C-N 3.3Å; G524-V526 PolarHBondContact O-N 3.39Å
527	G	32.8	Very low	36.1	Very low	59 Å²	59	83.6 Å²	83.6	61%	0.608	47%	0.466	S	S	*	.	S	Bend	trans	-132.7	16.5	177.8	0	0	0	0	0	115.4	G524	G524-G527 PolarHBondContact O-N 2.89Å
528	E	33.9	Very low	35.9	Very low	95 Å²	95	81 Å²	81	44%	0.444	47%	0.47	S	S	.	.			trans	-114.9	82.4	-179	-72.3	-165.1	148.8	0	0	112.4
529	D	36.1	Very low	35.5	Very low	132 Å²	132	88.2 Å²	88.2	71%	0.706	50%	0.5	S	S	*	.	S	Bend	trans	-134.5	17.8	156.8	-101.8	-19.6	0	0	0	114.8
530	V	35.2	Very low	35.3	Very low	112 Å²	112	93 Å²	93	68%	0.679	52%	0.524	S	S	*	.	S	Bend	trans	-114.1	-26.1	168.6	-175.4	0	0	0	0	112.3	L534	V530-L534 HydrophobicContact CG1-CD1 4.4Å
531	S	30.8	Very low	34.9	Very low	63 Å²	63	98.4 Å²	98.4	44%	0.441	55%	0.549	S	S	.	.	H	α-helix	trans	-85.9	-25.6	-179.6	31	0	0	0	0	114	G535	S531-G535 PolarHBondContact O-N 3.31Å
532	L	35.3	Very low	34.7	Very low	93 Å²	93	100.6 Å²	100.6	49%	0.487	57%	0.57	S	S	.	*	H	α-helix	trans	-78.2	-31.4	178.4	-127.9	117	0	0	0	112.2	I536	L532-I536 HydrophobicContact CD2-CD1 3.84Å; L532-I536 WeakPolarHBondContact O-CB 3.34Å; L532-I536 VanDerWaalsContact O-CG1 3.29Å; L532-I536 WeakPolarHBondContact O-CG1 3.45Å; L532-I536 PolarHBondContact O-N 3.15Å; L532-I536 VanDerWaalsContact O-N 3.14Å
533	V	34.3	Very low	34.7	Very low	95 Å²	95	103.4 Å²	103.4	58%	0.576	58%	0.584	S	S	*	*	H	α-helix	trans	-70.6	-37	172.1	-179.4	0	0	0	0	111.3	M537	V533-M537 WeakPolarHBondContact O-CG 3.46Å; V533-M537 PolarHBondContact O-N 3.12Å
534	L	28.7	Very low	35	Very low	123 Å²	123	113.7 Å²	113.7	64%	0.644	62%	0.62	S	S	*	*	H	α-helix	trans	-75.9	-29.7	175.4	-87.7	155.8	0	0	0	113.2	V530 A538	V530-L534 HydrophobicContact CG1-CD1 4.4Å; L534-A538 WeakPolarHBondContact O-CB 3.37Å; L534-A538 PolarHBondContact O-N 3.47Å
535	G	32.7	Very low	35.3	Very low	37 Å²	37	115 Å²	115	38%	0.381	63%	0.629	S	S	.	*	H	α-helix	trans	-78.9	-30	179.2	0	0	0	0	0	114.7	S531	S531-G535 PolarHBondContact O-N 3.31Å
536	I	32.1	Very low	35.5	Very low	103 Å²	103	113.9 Å²	113.9	53%	0.528	63%	0.633	S	S	.	*	H	α-helix	trans	-80.8	-32.3	177.7	-67	172.4	0	0	0	110.9	L532 A538	L532-I536 HydrophobicContact CD2-CD1 3.84Å; L532-I536 WeakPolarHBondContact O-CB 3.34Å; L532-I536 VanDerWaalsContact O-CG1 3.29Å; L532-I536 WeakPolarHBondContact O-CG1 3.45Å; L532-I536 PolarHBondContact O-N 3.15Å; L532-I536 VanDerWaalsContact O-N 3.14Å; I536-A538 VanDerWaalsContact C-N 3.29Å; I536-A538 PolarHBondContact O-N 3.48Å
537	M	31.1	Very low	35.4	Very low	147 Å²	147	114.6 Å²	114.6	72%	0.724	64%	0.64	S	S	*	*	H	α-helix	trans	-74.2	-16.4	173.6	-72.4	-67.3	-78.7	0	0	113.9	V533	V533-M537 WeakPolarHBondContact O-CG 3.46Å; V533-M537 PolarHBondContact O-N 3.12Å
538	A	34.3	Very low	35.7	Very low	80 Å²	80	118.5 Å²	118.5	66%	0.661	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-7.9	179.6	0	0	0	0	0	114.7	L534 I536	L534-A538 WeakPolarHBondContact O-CB 3.37Å; L534-A538 PolarHBondContact O-N 3.47Å; I536-A538 VanDerWaalsContact C-N 3.29Å; I536-A538 PolarHBondContact O-N 3.48Å
539	K	35	Very low	35.8	Very low	191 Å²	191	119.6 Å²	119.6	83%	0.83	65%	0.654	S	S	*	*	S	Bend	trans	-114.4	3.1	-176.1	-77.9	-173.4	178.1	176.3	0	115.6
540	L	38.5	Very low	35.8	Very low	141 Å²	141	121.8 Å²	121.8	74%	0.738	66%	0.658	S	S	*	*	S	Bend	trans	-118.9	21.2	-178	-97.6	159.6	0	0	0	115.2
541	L	32.3	Very low	35.8	Very low	134 Å²	134	122.5 Å²	122.5	70%	0.702	66%	0.658	S	S	*	*			trans	-129.4	117.5	169.1	-97.4	93.4	0	0	0	112.6	L543	L541-L543 PolarHBondContact O-N 3Å
542	P	37.5	Very low	36	Very low	116 Å²	116	126.3 Å²	126.3	75%	0.753	67%	0.672	S	S	*	*			trans	-70.4	125.9	166.7	25.5	-28.4	0	0	0	110.8	R544	P542-R544 PolarHBondContact O-N 3.35Å
543	L	41.8	Very low	36	Very low	157 Å²	157	128.7 Å²	128.7	82%	0.822	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	46.2	-179.3	-83.8	159.3	0	0	0	115.3	L541 L546	L541-L543 PolarHBondContact O-N 3Å; L543-L546 HydrophobicContact CD2-CD1 4.34Å
544	R	43.3	Very low	36.1	Very low	243 Å²	243	132.7 Å²	132.7	92%	0.917	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.8	14.8	177.8	-78.9	-167.3	176.1	170.4	-0.6	117	P542	P542-R544 PolarHBondContact O-N 3.35Å
545	A	41.5	Very low	36.6	Very low	54 Å²	54	132.3 Å²	132.3	45%	0.446	70%	0.696	S	S	.	*			trans	-126.9	14.8	176.6	0	0	0	0	0	115.3	P547 L548	A545-P547 VanDerWaalsContact C-CD 3.44Å; A545-L548 PolarHBondContact O-N 2.88Å
546	L	39.6	Very low	36.7	Very low	124 Å²	124	136.9 Å²	136.9	65%	0.649	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-12.7	-178.1	-97.4	149.2	0	0	0	117.3	L543	L543-L546 HydrophobicContact CD2-CD1 4.34Å
547	P	36.2	Very low	36.8	Very low	108 Å²	108	137.4 Å²	137.4	70%	0.701	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-10.8	171.6	-10.5	28.5	0	0	0	115.4	A545	A545-P547 VanDerWaalsContact C-CD 3.44Å
548	L	39.7	Very low	37.1	Very low	140 Å²	140	141.5 Å²	141.5	73%	0.733	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-19.1	-174	-89.2	152.8	0	0	0	114	A545	A545-L548 PolarHBondContact O-N 2.88Å
549	L	35	Very low	37.3	Very low	119 Å²	119	143.6 Å²	143.6	62%	0.623	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-13.4	179.8	-107.1	132.2	0	0	0	114.3	N551	L549-N551 VanDerWaalsContact C-N 3.32Å; L549-N551 PolarHBondContact O-N 3.26Å
550	F	36.9	Very low	37	Very low	178 Å²	178	145 Å²	145	78%	0.781	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-8.9	178.7	-113.5	-90.1	0	0	0	114.3
551	N	36.2	Very low	36.7	Very low	127 Å²	127	141.2 Å²	141.2	68%	0.679	74%	0.74	S	S	*	*	S	Bend	trans	-104.1	-7.3	178.4	-81.1	-21.1	0	0	0	114.7	L549	L549-N551 VanDerWaalsContact C-N 3.32Å; L549-N551 PolarHBondContact O-N 3.26Å
552	L	33.8	Very low	36.6	Very low	142 Å²	142	146.1 Å²	146.1	74%	0.743	75%	0.749	S	S	*	*	S	Bend	trans	-91	-11.1	176.2	-114.2	100.5	0	0	0	114.5	K554	L552-K554 VanDerWaalsContact C-N 3.3Å
553	I	34.9	Very low	36.3	Very low	144 Å²	144	149.4 Å²	149.4	74%	0.738	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-2.6	178	-66.2	174.1	0	0	0	112.2
554	K	36.2	Very low	35.7	Very low	179 Å²	179	149.1 Å²	149.1	78%	0.778	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	6.6	179.1	-82	-171.8	175.1	178.6	0	115.9	L552	L552-K554 VanDerWaalsContact C-N 3.3Å
555	V	40	Very low	35.6	Very low	114 Å²	114	140.9 Å²	140.9	69%	0.691	75%	0.751	S	S	*	*	S	Bend	trans	-122.1	-0.2	-173	-177.3	0	0	0	0	115.2
556	V	35.2	Very low	35.5	Very low	133 Å²	133	148.3 Å²	148.3	81%	0.806	77%	0.774	S	S	*	*			trans	-121.4	75.7	177.5	-168.4	0	0	0	0	112.1
557	P	34.6	Very low	35.8	Very low	114 Å²	114	146.5 Å²	146.5	74%	0.74	77%	0.772	S	S	*	*	S	Bend	trans	-138.4	57.8	136.7	36.5	-22.6	0	0	0	112.1
558	R	36.4	Very low	35.8	Very low	234 Å²	234	151.9 Å²	151.9	88%	0.883	78%	0.778	S	S	*	*	S	Bend	trans	-142.7	4	179.4	-81	-164.6	179	142.1	1.2	119.2
559	V	39	Very low	35.6	Very low	124 Å²	124	152.8 Å²	152.8	75%	0.752	78%	0.778	S	S	*	*	S	Bend	trans	-126.8	-10.4	-173.8	-178	0	0	0	0	117.2
560	F	28.5	Very low	35.7	Very low	220 Å²	220	150.4 Å²	150.4	97%	0.965	78%	0.776	S	S	*	*	S	Bend	trans	-115.7	62.4	174.1	-87.7	-87.9	0	0	0	113
561	G	32.5	Very low	35.8	Very low	61 Å²	61	145.8 Å²	145.8	63%	0.629	76%	0.762	S	S	*	*			trans	-136.9	95.7	156.5	0	0	0	0	0	108.3
562	R	30.3	Very low	35.7	Very low	237 Å²	237	142.1 Å²	142.1	89%	0.894	75%	0.749	S	S	*	*			trans	177.5	129.3	153.7	-98.4	154.8	-167.9	170.4	4.5	110.9
563	M	30.8	Very low	35.6	Very low	186 Å²	186	142 Å²	142	92%	0.916	75%	0.745	S	S	*	*	S	Bend	trans	79.2	102.9	178	-53.4	-173	-95.7	0	0	112.4
564	V	30.1	Very low	35.5	Very low	150 Å²	150	137.8 Å²	137.8	91%	0.909	73%	0.732	S	S	*	*			cis	-147.4	107.9	38.8	171.8	0	0	0	0	108.3
565	G	39.7	Very low	35.3	Very low	70 Å²	70	134.5 Å²	134.5	72%	0.722	72%	0.72	S	S	*	*			trans	-138.3	105.5	176.3	0	0	0	0	0	108.3
566	K	40.9	Very low	34.9	Very low	210 Å²	210	133 Å²	133	91%	0.913	71%	0.711	S	S	*	*	S	Bend	trans	-179.2	71	161.8	-101.2	169.5	-171.6	-169.3	0	108.8
567	S	44.3	Very low	34.8	Very low	87 Å²	87	133.5 Å²	133.5	61%	0.608	71%	0.709	S	S	*	*	S	Bend	trans	-177.8	-12.2	154.7	62.3	0	0	0	0	112.7	V571	S567-V571 WeakPolarHBondContact O-CB 3.29Å; S567-V571 WeakPolarHBondContact O-CG2 3.32Å
568	R	37	Very low	34.8	Very low	221 Å²	221	134 Å²	134	83%	0.834	70%	0.701	S	S	*	*	H	α-helix	trans	-82	-31	179	-84.1	-178.1	166.2	176.6	-5	114.7	A572	R568-A572 WeakPolarHBondContact O-CB 3.15Å; R568-A572 PolarHBondContact O-N 3.48Å
569	E	36.3	Very low	34.3	Very low	158 Å²	158	129.2 Å²	129.2	74%	0.738	69%	0.69	S	S	*	*	H	α-helix	trans	-79.9	-33	-174.3	-143.3	160.5	-159.8	0	0	112.5	Q573	E569-Q573 WeakPolarHBondContact O-CB 3.47Å; E569-Q573 WeakPolarHBondContact O-CG 3.36Å; E569-Q573 PolarHBondContact O-N 3.21Å
570	A	36.7	Very low	33.9	Very low	70 Å²	70	130.9 Å²	130.9	58%	0.579	69%	0.688	S	S	*	*	H	α-helix	trans	-73.1	-33.5	172.1	0	0	0	0	0	112.4	A574	A570-A574 VanDerWaalsContact O-CB 3.27Å; A570-A574 WeakPolarHBondContact O-CB 2.74Å; A570-A574 PolarHBondContact O-N 3.09Å
571	V	38.1	Very low	33.9	Very low	81 Å²	81	129.3 Å²	129.3	49%	0.491	68%	0.676	S	S	.	*	H	α-helix	trans	-74.8	-39	174.1	173.7	0	0	0	0	110.7	S567 A574 M575	S567-V571 WeakPolarHBondContact O-CB 3.29Å; S567-V571 WeakPolarHBondContact O-CG2 3.32Å; V571-A574 PolarHBondContact O-N 3.06Å; V571-M575 HydrophobicContact CG1-CG 4.29Å; V571-M575 HydrophobicContact CG1-SD 3.86Å; V571-M575 VanDerWaalsContact O-CB 3.24Å; V571-M575 WeakPolarHBondContact O-CB 3.48Å; V571-M575 VanDerWaalsContact O-CG 3.23Å; V571-M575 WeakPolarHBondContact O-CG 3.47Å; V571-M575 PolarHBondContact O-N 2.99Å
572	A	33.6	Very low	34.1	Very low	49 Å²	49	135.1 Å²	135.1	41%	0.405	69%	0.686	S	S	.	*	H	α-helix	trans	-66.4	-39.8	174.2	0	0	0	0	0	111.6	R568 M575 V576	R568-A572 WeakPolarHBondContact O-CB 3.15Å; R568-A572 PolarHBondContact O-N 3.48Å; A572-M575 PolarHBondContact O-N 3.37Å; A572-V576 VanDerWaalsContact O-CB 3.27Å; A572-V576 WeakPolarHBondContact O-CB 3.47Å; A572-V576 WeakPolarHBondContact O-CG2 3.48Å; A572-V576 PolarHBondContact O-N 3.11Å
573	Q	32.3	Very low	34.1	Very low	139 Å²	139	132.5 Å²	132.5	65%	0.65	68%	0.684	S	S	*	*	H	α-helix	trans	-69.3	-38.2	174.1	-80.4	-178.6	-15.9	0	0	112.4	E569 V576 L577	E569-Q573 WeakPolarHBondContact O-CB 3.47Å; E569-Q573 WeakPolarHBondContact O-CG 3.36Å; E569-Q573 PolarHBondContact O-N 3.21Å; Q573-V576 PolarHBondContact O-N 3.29Å; Q573-L577 WeakPolarHBondContact O-CB 3.48Å; Q573-L577 PolarHBondContact O-N 3.34Å
574	A	33.4	Very low	33.8	Very low	56 Å²	56	131 Å²	131	46%	0.463	68%	0.68	S	S	.	*	H	α-helix	trans	-68.2	-36.3	173.8	0	0	0	0	0	112.7	A570 V571 L577 E578	A570-A574 VanDerWaalsContact O-CB 3.27Å; A570-A574 WeakPolarHBondContact O-CB 2.74Å; A570-A574 PolarHBondContact O-N 3.09Å; V571-A574 PolarHBondContact O-N 3.06Å; A574-L577 PolarHBondContact O-N 3.35Å; A574-E578 WeakPolarHBondContact O-CB 3.42Å; A574-E578 PolarHBondContact O-N 3.01Å
575	M	31.5	Very low	33.8	Very low	110 Å²	110	134.7 Å²	134.7	54%	0.542	68%	0.679	S	S	.	*	H	α-helix	trans	-70.7	-39.1	174.5	-77.3	177.4	68.6	0	0	111.8	V571 A572 E578 M579	V571-M575 HydrophobicContact CG1-CG 4.29Å; V571-M575 HydrophobicContact CG1-SD 3.86Å; V571-M575 VanDerWaalsContact O-CB 3.24Å; V571-M575 WeakPolarHBondContact O-CB 3.48Å; V571-M575 VanDerWaalsContact O-CG 3.23Å; V571-M575 WeakPolarHBondContact O-CG 3.47Å; V571-M575 PolarHBondContact O-N 2.99Å; A572-M575 PolarHBondContact O-N 3.37Å; M575-E578 PolarHBondContact O-N 2.93Å; M575-M579 WeakPolarHBondContact O-CB 3.41Å; M575-M579 WeakPolarHBondContact O-CG 3.25Å; M575-M579 PolarHBondContact O-N 3.46Å
576	V	32.5	Very low	33.4	Very low	83 Å²	83	141.7 Å²	141.7	50%	0.503	69%	0.685	S	S	.	*	H	α-helix	trans	-69.3	-35.1	175	170.8	0	0	0	0	110.5	A572 Q573 F580	A572-V576 VanDerWaalsContact O-CB 3.27Å; A572-V576 WeakPolarHBondContact O-CB 3.47Å; A572-V576 WeakPolarHBondContact O-CG2 3.48Å; A572-V576 PolarHBondContact O-N 3.11Å; Q573-V576 PolarHBondContact O-N 3.29Å; V576-F580 HydrophobicContact CG1-CD2 4.24Å; V576-F580 HydrophobicContact CG1-CE2 4.45Å; V576-F580 WeakPolarHBondContact O-CD2 3.45Å
577	L	32.1	Very low	32.8	Very low	143 Å²	143	136.5 Å²	136.5	75%	0.749	67%	0.668	S	S	*	*	H	α-helix	trans	-72.9	-29.8	176.3	-131.8	87.7	0	0	0	113.6	Q573 A574	Q573-L577 WeakPolarHBondContact O-CB 3.48Å; Q573-L577 PolarHBondContact O-N 3.34Å; A574-L577 PolarHBondContact O-N 3.35Å
578	E	34.4	Very low	32.2	Very low	124 Å²	124	138.5 Å²	138.5	58%	0.579	67%	0.672	S	S	*	*	H	α-helix	trans	-90.8	-22.8	176.2	-74.3	-68.2	164.8	0	0	113.3	A574 M575 F580 R581	A574-E578 WeakPolarHBondContact O-CB 3.42Å; A574-E578 PolarHBondContact O-N 3.01Å; M575-E578 PolarHBondContact O-N 2.93Å; E578-F580 VanDerWaalsContact C-N 3.28Å; E578-F580 PolarHBondContact O-N 3.09Å; E578-R581 IonicContact OE1-NH1 3.37Å; E578-R581 PolarHBondContact OE1-NH1 2.91Å; E578-R581 IonicContact OE2-NH1 3.64Å
579	M	27.1	Very low	32	Very low	134 Å²	134	133.9 Å²	133.9	66%	0.66	66%	0.664	S	S	*	*	H	α-helix	trans	-73.9	-16.8	173.7	-82.7	179	60.2	0	0	113.6	M575	M575-M579 WeakPolarHBondContact O-CB 3.41Å; M575-M579 WeakPolarHBondContact O-CG 3.25Å; M575-M579 PolarHBondContact O-N 3.46Å
580	F	30.8	Very low	31.7	Very low	160 Å²	160	129 Å²	129	70%	0.702	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	38	179.9	-69.1	-74.3	0	0	0	112.4	V576 E578 E582	V576-F580 HydrophobicContact CG1-CD2 4.24Å; V576-F580 HydrophobicContact CG1-CE2 4.45Å; V576-F580 WeakPolarHBondContact O-CD2 3.45Å; E578-F580 VanDerWaalsContact C-N 3.28Å; E578-F580 PolarHBondContact O-N 3.09Å; F580-E582 PolarHBondContact O-N 3.09Å
581	R	28	Very low	31.4	Very low	187 Å²	187	131.2 Å²	131.2	71%	0.706	65%	0.646	S	S	*	*			trans	-82.9	100.5	154.9	-100.2	-179.9	158.7	148.3	-5.3	108	E578	E578-R581 IonicContact OE1-NH1 3.37Å; E578-R581 PolarHBondContact OE1-NH1 2.91Å; E578-R581 IonicContact OE2-NH1 3.64Å
582	E	35.7	Very low	31.2	Very low	182 Å²	182	133.3 Å²	133.3	85%	0.85	65%	0.654	S	S	*	*			trans	-53.4	133.5	168.4	-67.4	177.5	155.6	0	0	109.9	F580	F580-E582 PolarHBondContact O-N 3.09Å
583	E	31.1	Very low	31.2	Very low	182 Å²	182	137.2 Å²	137.2	85%	0.85	66%	0.664	S	S	*	*			trans	124.8	79.8	166.4	-69.4	175.2	-169.1	0	0	112.1
584	D	24.5	Very low	30.9	Very low	155 Å²	155	135.8 Å²	135.8	83%	0.829	66%	0.659	S	S	*	*			trans	-176.1	100.2	135	-91.8	-22.6	0	0	0	111.1	Y586	D584-Y586 PolarHBondContact O-N 3.31Å
585	Y	28.9	Very low	30.8	Very low	228 Å²	228	134.9 Å²	134.9	89%	0.894	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	36	-172.3	-152.5	-94.9	0	0	0	114
586	Y	32.1	Very low	31	Very low	216 Å²	216	132.3 Å²	132.3	85%	0.847	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.1	20.8	-172.8	-89.3	-73.2	0	0	0	116.8	D584	D584-Y586 PolarHBondContact O-N 3.31Å
587	N	28.8	Very low	31	Very low	101 Å²	101	132.6 Å²	132.6	54%	0.54	66%	0.657	S	S	.	*			trans	-124.8	6.8	-177.9	-91.5	-24.8	0	0	0	117.3	D589 V590 L591	N587-D589 VanDerWaalsContact C-N 3.27Å; N587-D589 PolarHBondContact O-N 2.86Å; N587-V590 WeakPolarHBondContact O-CB 3.45Å; N587-V590 PolarHBondContact O-N 3.08Å; N587-V590 VanDerWaalsContact OD1-CG2 3.28Å; N587-V590 WeakPolarHBondContact OD1-CG2 3.42Å; N587-L591 PolarHBondContact O-N 3.43Å
588	D	31.3	Very low	31.2	Very low	130 Å²	130	131.5 Å²	131.5	70%	0.695	65%	0.65	S	S	*	*	H	α-helix	trans	-63.6	-33.7	175	-78.3	-30.9	0	0	0	112.4	V590 L591 D592	D588-V590 PolarHBondContact O-N 3.14Å; D588-L591 PolarHBondContact O-N 3.21Å; D588-D592 PolarHBondContact O-N 2.76Å; D588-D592 VanDerWaalsContact O-N 3.1Å
589	D	32.3	Very low	31.2	Very low	124 Å²	124	131.2 Å²	131.2	66%	0.663	65%	0.652	S	S	*	*	H	α-helix	trans	-64.2	-26.6	173.1	-77.5	-24.3	0	0	0	112.9	N587 Q593	N587-D589 VanDerWaalsContact C-N 3.27Å; N587-D589 PolarHBondContact O-N 2.86Å; D589-Q593 WeakPolarHBondContact O-CB 3.33Å; D589-Q593 WeakPolarHBondContact O-CG 3.45Å; D589-Q593 PolarHBondContact O-N 3.47Å
590	V	29.6	Very low	31.6	Very low	55 Å²	55	125.5 Å²	125.5	33%	0.333	63%	0.628	S	S	.	*	H	α-helix	trans	-80.8	-33.5	-179.5	-179.1	0	0	0	0	110.9	N587 D588 M594	N587-V590 WeakPolarHBondContact O-CB 3.45Å; N587-V590 PolarHBondContact O-N 3.08Å; N587-V590 VanDerWaalsContact OD1-CG2 3.28Å; N587-V590 WeakPolarHBondContact OD1-CG2 3.42Å; D588-V590 PolarHBondContact O-N 3.14Å; V590-M594 HydrophobicContact CG1-CE 4.02Å; V590-M594 HydrophobicContact CG1-CG 4.41Å; V590-M594 HydrophobicContact CG1-SD 4.29Å; V590-M594 WeakPolarHBondContact O-CB 3.47Å; V590-M594 WeakPolarHBondContact O-CG 3.44Å; V590-M594 PolarHBondContact O-N 3.21Å
591	L	30.5	Very low	31.9	Very low	117 Å²	117	120.6 Å²	120.6	61%	0.613	61%	0.611	S	S	*	*	H	α-helix	trans	-75.3	-37.6	176.3	-69.9	174.2	0	0	0	112.1	N587 D588 M594 G595	N587-L591 PolarHBondContact O-N 3.43Å; D588-L591 PolarHBondContact O-N 3.21Å; L591-M594 PolarHBondContact O-N 2.6Å; L591-G595 PolarHBondContact O-N 3.45Å
592	D	34.3	Very low	32.4	Very low	124 Å²	124	118.8 Å²	118.8	66%	0.663	61%	0.61	S	S	*	*	H	α-helix	trans	-70.4	-36.8	172.1	-83.6	-18.9	0	0	0	111.9	D588 A596	D588-D592 PolarHBondContact O-N 2.76Å; D588-D592 VanDerWaalsContact O-N 3.1Å; D592-A596 WeakPolarHBondContact O-CB 3.48Å; D592-A596 PolarHBondContact O-N 2.86Å
593	Q	33.2	Very low	32.4	Very low	131 Å²	131	110.9 Å²	110.9	61%	0.612	58%	0.578	S	S	*	*	H	α-helix	trans	-69.2	-35.1	171.5	-77.6	178.6	5.1	0	0	113	D589 S597	D589-Q593 WeakPolarHBondContact O-CB 3.33Å; D589-Q593 WeakPolarHBondContact O-CG 3.45Å; D589-Q593 PolarHBondContact O-N 3.47Å; Q593-S597 WeakPolarHBondContact O-CB 3.37Å; Q593-S597 PolarHBondContact O-N 3.27Å; Q593-S597 PolarHBondContact O-OG 2.93Å
594	M	27.7	Very low	32.4	Very low	109 Å²	109	107 Å²	107	54%	0.537	57%	0.569	S	S	.	*	H	α-helix	trans	-72.1	-39.2	174.5	-79.8	-173.4	177.5	0	0	111.7	V590 L591 S597 I598	V590-M594 HydrophobicContact CG1-CE 4.02Å; V590-M594 HydrophobicContact CG1-CG 4.41Å; V590-M594 HydrophobicContact CG1-SD 4.29Å; V590-M594 WeakPolarHBondContact O-CB 3.47Å; V590-M594 WeakPolarHBondContact O-CG 3.44Å; V590-M594 PolarHBondContact O-N 3.21Å; L591-M594 PolarHBondContact O-N 2.6Å; M594-S597 PolarHBondContact O-N 3.32Å; M594-I598 HydrophobicContact CB-CD1 4.48Å; M594-I598 VanDerWaalsContact O-CB 3.29Å; M594-I598 WeakPolarHBondContact O-CB 3.4Å; M594-I598 WeakPolarHBondContact O-CD1 3.49Å; M594-I598 WeakPolarHBondContact O-CG1 3.43Å; M594-I598 PolarHBondContact O-N 2.93Å
595	G	31.1	Very low	32.9	Very low	38 Å²	38	107.4 Å²	107.4	39%	0.392	56%	0.559	S	S	.	*	H	α-helix	trans	-64.2	-45	172.9	0	0	0	0	0	112.6	L591 L599	L591-G595 PolarHBondContact O-N 3.45Å; G595-L599 PolarHBondContact O-N 3.41Å
596	A	34.2	Very low	33.3	Very low	55 Å²	55	101.4 Å²	101.4	46%	0.455	53%	0.534	S	S	.	.	H	α-helix	trans	-70.6	-28	177.7	0	0	0	0	0	113.7	D592	D592-A596 WeakPolarHBondContact O-CB 3.48Å; D592-A596 PolarHBondContact O-N 2.86Å
597	S	34.2	Very low	33.4	Very low	89 Å²	89	96.4 Å²	96.4	62%	0.622	52%	0.519	S	S	*	.	H	α-helix	trans	-84.9	-25.8	178.2	-64.2	0	0	0	0	113.8	L253 Q593 M594	L253-S597 WeakPolarHBondContact CD1-O 3.25Å; Q593-S597 WeakPolarHBondContact O-CB 3.37Å; Q593-S597 PolarHBondContact O-N 3.27Å; Q593-S597 PolarHBondContact O-OG 2.93Å; M594-S597 PolarHBondContact O-N 3.32Å
598	I	35.3	Very low	33.7	Very low	120 Å²	120	97.4 Å²	97.4	62%	0.615	53%	0.531	S	S	*	.	H	α-helix	trans	-95.9	-29.4	-174.5	-64.3	171.2	0	0	0	113.2	L253 M594	L253-I598 WeakPolarHBondContact CD1-O 3.37Å; M594-I598 HydrophobicContact CB-CD1 4.48Å; M594-I598 VanDerWaalsContact O-CB 3.29Å; M594-I598 WeakPolarHBondContact O-CB 3.4Å; M594-I598 WeakPolarHBondContact O-CD1 3.49Å; M594-I598 WeakPolarHBondContact O-CG1 3.43Å; M594-I598 PolarHBondContact O-N 2.93Å
599	L	34.8	Very low	33.8	Very low	118 Å²	118	97.7 Å²	97.7	62%	0.618	53%	0.532	S	S	*	.	H	α-helix	trans	-110.6	-17.6	-172.2	-76.2	159.5	0	0	0	116	L253 G595	L253-L599 PolarHBondContact N-O 2.93Å; L253-L599 VanDerWaalsContact N-O 3.11Å; G595-L599 PolarHBondContact O-N 3.41Å
600	G	34.8	Very low	33.9	Very low	15 Å²	15	96.9 Å²	96.9	16%	0.155	52%	0.524	C	S	.	.			trans	72.9	146.3	-174.3	0	0	0	0	0	111.7	E602	G600-E602 PolarHBondContact O-N 2.98Å
601	V	38.2	Very low	34.2	Very low	56 Å²	56	98 Å²	98	34%	0.339	53%	0.533	S	S	.	.			trans	-75.6	128	-176.5	170.3	0	0	0	0	109	P299 K301 G603	P299-V601 HydrophobicContact CB-CG1 4.31Å; K301-V601 HydrophobicContact CD-CG2 4.04Å; K301-V601 VanDerWaalsContact CE-CG2 3.41Å; V601-G603 PolarHBondContact O-N 2.94Å; V601-G603 VanDerWaalsContact O-N 3.08Å
602	E	36.9	Very low	34.6	Very low	149 Å²	149	95.2 Å²	95.2	70%	0.696	52%	0.522	S	S	*	.			trans	-60.9	108.3	170.7	-68.2	-170.1	145.1	0	0	109.1	R252 G600	R252-E602 HydrophobicContact CG-CG 4.4Å; G600-E602 PolarHBondContact O-N 2.98Å
603	G	35.6	Very low	34.9	Very low	17 Å²	17	93 Å²	93	18%	0.175	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-73.7	151.8	156.5	0	0	0	0	0	108.9	V601 R605	V601-G603 PolarHBondContact O-N 2.94Å; V601-G603 VanDerWaalsContact O-N 3.08Å; G603-R605 PolarHBondContact O-N 3.42Å
604	P	32.4	Very low	35.2	Very low	101 Å²	101	90.8 Å²	90.8	66%	0.656	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-57.4	116.3	177.9	-14.2	25.1	0	0	0	109.6	G296	G296-P604 WeakPolarHBondContact O-CD 3.49Å
605	R	34.3	Very low	36.2	Very low	162 Å²	162	90.3 Å²	90.3	61%	0.611	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-70.9	143.6	171.9	-77.3	167.6	147.8	-162.8	-19.4	108.8	R252 G603	R252-R605 VanDerWaalsContact CZ-NE 3.3Å; G603-R605 PolarHBondContact O-N 3.42Å
606	R	37.4	Very low	36.8	Very low	102 Å²	102	90.7 Å²	90.7	39%	0.385	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-78	132.7	147.1	-111.8	-170	-169.4	161	11.9	108.2	E610 P612	R606-E610 HydrophobicContact CG-CB 4.48Å; R606-P612 VanDerWaalsContact CZ-CA 3.41Å; R606-P612 VanDerWaalsContact NH2-CA 3.28Å
607	H	33.3	Very low	37.6	Very low	111 Å²	111	89.4 Å²	89.4	51%	0.514	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-64.5	140.8	163.4	-157	-92	0	0	0	108.5	D609 E610	H607-D609 IonicContact CE1-OD2 3.66Å; H607-D609 PolarHBondContact CE1-OD2 3.46Å; H607-D609 PolarHBondContact ND1-N 3.34Å; H607-D609 IonicContact ND1-OD2 2.59Å; H607-D609 PolarHBondContact ND1-OD2 2.98Å; H607-D609 PolarHBondContact O-N 3.33Å; H607-E610 HydrophobicContact CB-CB 3.99Å; H607-E610 HydrophobicContact CB-CG 4.11Å; H607-E610 PolarHBondContact N-OE2 3.32Å; H607-E610 WeakPolarHBondContact O-CB 3.15Å; H607-E610 PolarHBondContact O-N 3.48Å
608	P	36.1	Very low	38.6	Very low	123 Å²	123	90.6 Å²	90.6	80%	0.799	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-24	175.7	-26.2	35	0	0	0	113.7
609	D	33	Very low	39.8	Very low	135 Å²	135	87.2 Å²	87.2	72%	0.722	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-1.9	178.5	-53.3	-52.3	0	0	0	113.6	H607 P611	H607-D609 IonicContact CE1-OD2 3.66Å; H607-D609 PolarHBondContact CE1-OD2 3.46Å; H607-D609 PolarHBondContact ND1-N 3.34Å; H607-D609 IonicContact ND1-OD2 2.59Å; H607-D609 PolarHBondContact ND1-OD2 2.98Å; H607-D609 PolarHBondContact O-N 3.33Å; D609-P611 WeakPolarHBondContact O-CD 3.5Å
610	E	34.3	Very low	41.1	Very low	107 Å²	107	82.2 Å²	82.2	50%	0.5	43%	0.427	S	S	.	.	S	Bend	trans	-77	117.9	174.1	-109.8	175.2	163.6	0	0	109.1	R606 H607	R606-E610 HydrophobicContact CG-CB 4.48Å; H607-E610 HydrophobicContact CB-CB 3.99Å; H607-E610 HydrophobicContact CB-CG 4.11Å; H607-E610 PolarHBondContact N-OE2 3.32Å; H607-E610 WeakPolarHBondContact O-CB 3.15Å; H607-E610 PolarHBondContact O-N 3.48Å
611	P	36	Very low	42.1	Very low	80 Å²	80	83.7 Å²	83.7	52%	0.519	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-60.3	148.3	179.4	24.9	-32.1	0	0	0	109.9	D609 E613	D609-P611 WeakPolarHBondContact O-CD 3.5Å; P611-E613 PolarHBondContact O-N 2.78Å
612	P	38.8	Very low	43.4	Very low	58 Å²	58	82 Å²	82	38%	0.377	42%	0.423	S	S	.	.	S	Bend	trans	-56.5	130.1	173.8	22.3	-30.5	0	0	0	109.7	R437 R606 D614	R437-P612 PolarHBondContact NH1-O 3.12Å; R606-P612 VanDerWaalsContact CZ-CA 3.41Å; R606-P612 VanDerWaalsContact NH2-CA 3.28Å; P612-D614 PolarHBondContact O-N 3.39Å
613	E	40.7	Very low	45	Very low	77 Å²	77	74.9 Å²	74.9	36%	0.36	39%	0.39	S	S	.	.			trans	-25.2	132	178.4	-75.8	177	179.1	0	0	111.8	S293 P611 E615	S293-E613 WeakPolarHBondContact CB-OE1 3.5Å; S293-E613 WeakPolarHBondContact CB-OE2 3.44Å; S293-E613 PolarHBondContact OG-OE2 2.99Å; P611-E613 PolarHBondContact O-N 2.78Å; E613-E615 PolarHBondContact O-N 3.24Å
614	D	40.6	Very low	46.5	Very low	85 Å²	85	74.7 Å²	74.7	46%	0.455	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-58.8	0.8	-171	-72	-43.1	0	0	0	115.8	R437 P612	R437-D614 IonicContact CZ-OD1 3.96Å; R437-D614 IonicContact NH1-OD1 3.22Å; R437-D614 IonicContact NH2-OD1 3.32Å; R437-D614 PolarHBondContact NH2-OD1 3.24Å; P612-D614 PolarHBondContact O-N 3.39Å
615	E	47.2	Very low	48	Very low	99 Å²	99	69.9 Å²	69.9	46%	0.463	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-96.4	15.3	-166.9	-58.4	-173.1	166.5	0	0	115.5	E613 F617 E618	E613-E615 PolarHBondContact O-N 3.24Å; E615-F617 VanDerWaalsContact C-N 3.32Å; E615-F617 PolarHBondContact O-N 3.36Å; E615-E618 HydrophobicContact CB-CG 4.34Å; E615-E618 WeakPolarHBondContact CB-OE1 3.42Å; E615-E618 VanDerWaalsContact CG-OE1 3.31Å; E615-E618 WeakPolarHBondContact CG-OE1 3.33Å
616	V	44.6	Very low	49.7	Very low	46 Å²	46	62.1 Å²	62.1	28%	0.279	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-72	-26.1	-177.7	-170.5	0	0	0	0	112.5	T439	T439-V616 HydrophobicContact CG2-CG1 4.3Å
617	F	52	Low	51.5	Low	28 Å²	28	57.3 Å²	57.3	12%	0.123	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-140.3	54.5	-173.8	-54.8	-74.1	0	0	0	114.2	V434 R437 T439 E496 E615 L619 F620	V434-F617 HydrophobicContact CB-CD1 4.46Å; V434-F617 HydrophobicContact CB-CG 4.42Å; V434-F617 HydrophobicContact CG1-CB 4.15Å; V434-F617 HydrophobicContact CG1-CD1 4.46Å; V434-F617 HydrophobicContact CG1-CD2 4.2Å; V434-F617 HydrophobicContact CG1-CG 4Å; V434-F617 HydrophobicContact CG2-CD1 3.74Å; V434-F617 HydrophobicContact CG2-CE1 3.86Å; V434-F617 HydrophobicContact CG2-CG 4.13Å; V434-F617 HydrophobicContact CG2-CZ 4.42Å; R437-F617 HydrophobicContact CB-CE2 4.44Å; T439-F617 HydrophobicContact CG2-CZ 4.15Å; E496-F617 HydrophobicContact CG-CB 4.14Å; E496-F617 HydrophobicContact CG-CD1 3.54Å; E496-F617 HydrophobicContact CG-CE1 4.46Å; E496-F617 HydrophobicContact CG-CG 4.31Å; E496-F617 WeakPolarHBondContact OE2-CA 3.47Å; E615-F617 VanDerWaalsContact C-N 3.32Å; E615-F617 PolarHBondContact O-N 3.36Å; F617-L619 VanDerWaalsContact C-N 3.29Å; F617-L619 PolarHBondContact O-N 3.36Å; F617-F620 HydrophobicContact CB-CB 4.5Å
618	E	55	Low	53.3	Low	114 Å²	114	52.2 Å²	52.2	53%	0.533	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-23	179.3	-62	-176.4	162.7	0	0	114.1	E496 E615 P621	E496-E618 PolarHBondContact OE2-N 3.28Å; E615-E618 HydrophobicContact CB-CG 4.34Å; E615-E618 WeakPolarHBondContact CB-OE1 3.42Å; E615-E618 VanDerWaalsContact CG-OE1 3.31Å; E615-E618 WeakPolarHBondContact CG-OE1 3.33Å; E618-P621 WeakPolarHBondContact O-CD 3.3Å
619	L	59.8	Low	55.1	Low	49 Å²	49	46.6 Å²	46.6	26%	0.257	25%	0.246	S	C	.	.	H	α-helix	trans	-84.5	-19.1	-176.5	-55.8	178.4	0	0	0	112.3	L391 A493 E496 F617 I622 F623	L391-L619 HydrophobicContact CD2-CD1 4.46Å; L391-L619 HydrophobicContact CD2-CD2 3.81Å; A493-L619 HydrophobicContact CB-CD1 3.69Å; E496-L619 HydrophobicContact CB-CB 4.4Å; E496-L619 VanDerWaalsContact OE2-CA 3.31Å; E496-L619 WeakPolarHBondContact OE2-CA 3.24Å; E496-L619 VanDerWaalsContact OE2-CB 3.32Å; E496-L619 WeakPolarHBondContact OE2-CB 3.41Å; E496-L619 PolarHBondContact OE2-N 2.89Å; F617-L619 VanDerWaalsContact C-N 3.29Å; F617-L619 PolarHBondContact O-N 3.36Å; L619-I622 HydrophobicContact CD2-CD1 4.15Å; L619-I622 WeakPolarHBondContact O-CB 3.41Å; L619-I622 PolarHBondContact O-N 2.87Å; L619-I622 VanDerWaalsContact O-N 3.14Å; L619-F623 HydrophobicContact CB-CD2 3.82Å; L619-F623 HydrophobicContact CB-CE2 3.45Å; L619-F623 VanDerWaalsContact CB-CE2 3.45Å; L619-F623 HydrophobicContact CB-CZ 4.16Å; L619-F623 HydrophobicContact CD1-CE2 4.08Å; L619-F623 HydrophobicContact CD1-CZ 4.23Å; L619-F623 HydrophobicContact CG-CE2 4.4Å; L619-F623 WeakPolarHBondContact O-CD2 3.42Å; L619-F623 WeakPolarHBondContact O-CG 3.16Å; L619-F623 PolarHBondContact O-N 3.13Å
620	F	61.8	Low	56.8	Low	13 Å²	13	43.6 Å²	43.6	6%	0.057	24%	0.24	C	C	.	.	H	α-helix	trans	-55.3	-50.2	-178.7	174.3	-92.6	0	0	0	113.3	V434 E496 A499 A500 I503 L522 F617 I622 F623 M624	V434-F620 HydrophobicContact CG1-CD2 4.2Å; V434-F620 HydrophobicContact CG1-CG 4.24Å; E496-F620 HydrophobicContact CB-CB 4.22Å; E496-F620 HydrophobicContact CG-CB 4.37Å; E496-F620 PolarHBondContact OE2-N 3.28Å; A499-F620 HydrophobicContact CB-CD2 3.87Å; A499-F620 HydrophobicContact CB-CE2 3.7Å; A500-F620 HydrophobicContact CB-CD2 4.1Å; A500-F620 HydrophobicContact CB-CE2 4.08Å; I503-F620 HydrophobicContact CD1-CZ 4.05Å; L522-F620 HydrophobicContact CD2-CD1 4.01Å; L522-F620 HydrophobicContact CD2-CE1 4.16Å; F617-F620 HydrophobicContact CB-CB 4.5Å; F620-I622 VanDerWaalsContact C-N 3.31Å; F620-I622 PolarHBondContact O-N 2.99Å; F620-F623 PolarHBondContact O-N 2.86Å; F620-M624 HydrophobicContact CE1-CG 4.16Å; F620-M624 HydrophobicContact CZ-CG 4.22Å; F620-M624 HydrophobicContact CZ-SD 4.3Å; F620-M624 VanDerWaalsContact O-CG 3.32Å; F620-M624 WeakPolarHBondContact O-CG 3.45Å; F620-M624 PolarHBondContact O-N 3.41Å
621	P	56.5	Low	58.6	Low	45 Å²	45	43.4 Å²	43.4	29%	0.292	24%	0.239	S	C	.	.	H	α-helix	trans	-64.9	-33	175.7	-20.1	33.5	0	0	0	113.6	E618 M624 G625	E618-P621 WeakPolarHBondContact O-CD 3.3Å; P621-M624 WeakPolarHBondContact O-CB 3.42Å; P621-M624 PolarHBondContact O-N 3Å; P621-G625 PolarHBondContact O-N 3.25Å
622	I	64.5	Low	60.6	Low	21 Å²	21	39.6 Å²	39.6	11%	0.108	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-49.2	177.5	-61.9	-178.2	0	0	0	109.5	L391 L619 F620 M624 G625 G626 F677 E681	L391-I622 HydrophobicContact CD2-CG2 4.39Å; L619-I622 HydrophobicContact CD2-CD1 4.15Å; L619-I622 WeakPolarHBondContact O-CB 3.41Å; L619-I622 PolarHBondContact O-N 2.87Å; L619-I622 VanDerWaalsContact O-N 3.14Å; F620-I622 VanDerWaalsContact C-N 3.31Å; F620-I622 PolarHBondContact O-N 2.99Å; I622-M624 PolarHBondContact O-N 2.77Å; I622-G625 PolarHBondContact O-N 3.33Å; I622-G626 PolarHBondContact O-N 3.41Å; I622-G626 VanDerWaalsContact O-N 3.08Å; I622-F677 HydrophobicContact CD1-CB 4.4Å; I622-F677 HydrophobicContact CD1-CD1 3.86Å; I622-F677 HydrophobicContact CD1-CE1 4.47Å; I622-F677 HydrophobicContact CD1-CG 4.28Å; I622-F677 HydrophobicContact CG1-CB 4.2Å; I622-F677 HydrophobicContact CG1-CD1 4.44Å; I622-E681 HydrophobicContact CB-CG 4.49Å; I622-E681 HydrophobicContact CG2-CG 3.45Å; I622-E681 VanDerWaalsContact CG2-CG 3.45Å
623	F	70.6	Confident	62.4	Low	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-40.3	176.4	-68.9	-48.5	0	0	0	112.6	L391 T392 Y395 A493 E496 Y497 A500 L619 F620 G625 G626 L627	L391-F623 HydrophobicContact CD2-CE1 4.02Å; L391-F623 HydrophobicContact CD2-CZ 4.1Å; L391-F623 HydrophobicContact CG-CE1 3.87Å; L391-F623 HydrophobicContact CG-CZ 4.28Å; T392-F623 HydrophobicContact CG2-CD1 4.09Å; T392-F623 WeakPolarHBondContact OG1-CD1 3.23Å; Y395-F623 AromaticContact CD2-CE1 3.84Å; Y395-F623 HydrophobicContact CD2-CE1 3.84Å; Y395-F623 HydrophobicContact CD2-CZ 4Å; Y395-F623 HydrophobicContact CE2-CE1 4.28Å; Y395-F623 HydrophobicContact CE2-CZ 4.02Å; Y395-F623 HydrophobicContact CG-CE1 4.18Å; Y395-F623 HydrophobicContact CG-CZ 4.36Å; A493-F623 WeakPolarHBondContact O-CE2 3.45Å; E496-F623 HydrophobicContact CB-CD2 3.9Å; E496-F623 HydrophobicContact CB-CE2 3.95Å; Y497-F623 HydrophobicContact CD2-CB 4.5Å; Y497-F623 AromaticContact CD2-CD1 3.66Å; Y497-F623 HydrophobicContact CD2-CD1 3.66Å; Y497-F623 AromaticContact CD2-CE1 3.91Å; Y497-F623 HydrophobicContact CD2-CE1 3.91Å; Y497-F623 HydrophobicContact CD2-CG 4.03Å; Y497-F623 HydrophobicContact CD2-CZ 4.49Å; A500-F623 HydrophobicContact CB-CB 3.79Å; L619-F623 HydrophobicContact CB-CD2 3.82Å; L619-F623 HydrophobicContact CB-CE2 3.45Å; L619-F623 VanDerWaalsContact CB-CE2 3.45Å; L619-F623 HydrophobicContact CB-CZ 4.16Å; L619-F623 HydrophobicContact CD1-CE2 4.08Å; L619-F623 HydrophobicContact CD1-CZ 4.23Å; L619-F623 HydrophobicContact CG-CE2 4.4Å; L619-F623 WeakPolarHBondContact O-CD2 3.42Å; L619-F623 WeakPolarHBondContact O-CG 3.16Å; L619-F623 PolarHBondContact O-N 3.13Å; F620-F623 PolarHBondContact O-N 2.86Å; F623-G625 VanDerWaalsContact C-N 3.3Å; F623-G625 PolarHBondContact O-N 3.05Å; F623-G626 PolarHBondContact O-N 3.26Å; F623-L627 WeakPolarHBondContact O-CB 3.44Å; F623-L627 WeakPolarHBondContact O-CD1 3.27Å; F623-L627 WeakPolarHBondContact O-CG 3.33Å; F623-L627 PolarHBondContact O-N 3.18Å
624	M	67.1	Low	63.9	Low	12 Å²	12	37.9 Å²	37.9	6%	0.059	21%	0.208	C	C	.	.	H	α-helix	trans	-54.6	-45.7	174.6	-74.9	-69.4	-60.8	0	0	111.8	A500 I503 V504 V515 F620 P621 I622 L628	A500-M624 VanDerWaalsContact CA-SD 3.56Å; A500-M624 HydrophobicContact CB-CG 3.78Å; A500-M624 HydrophobicContact CB-SD 3.7Å; A500-M624 VanDerWaalsContact O-SD 3.4Å; I503-M624 HydrophobicContact CB-CE 4.29Å; I503-M624 HydrophobicContact CB-SD 4.08Å; I503-M624 HydrophobicContact CG2-CE 3.69Å; I503-M624 HydrophobicContact CG2-SD 4.16Å; V504-M624 HydrophobicContact CG2-CE 3.6Å; V504-M624 HydrophobicContact CG2-SD 3.59Å; V504-M624 VanDerWaalsContact CG2-SD 3.59Å; V515-M624 HydrophobicContact CG1-CE 4.3Å; F620-M624 HydrophobicContact CE1-CG 4.16Å; F620-M624 HydrophobicContact CZ-CG 4.22Å; F620-M624 HydrophobicContact CZ-SD 4.3Å; F620-M624 VanDerWaalsContact O-CG 3.32Å; F620-M624 WeakPolarHBondContact O-CG 3.45Å; F620-M624 PolarHBondContact O-N 3.41Å; P621-M624 WeakPolarHBondContact O-CB 3.42Å; P621-M624 PolarHBondContact O-N 3Å; I622-M624 PolarHBondContact O-N 2.77Å; M624-L628 VanDerWaalsContact O-CG 3.32Å; M624-L628 WeakPolarHBondContact O-CG 3.24Å
625	G	64.1	Low	65.4	Low	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.9	-47.3	176	0	0	0	0	0	112.7	P621 I622 F623 L627 L628 F678 F682	P621-G625 PolarHBondContact O-N 3.25Å; I622-G625 PolarHBondContact O-N 3.33Å; F623-G625 VanDerWaalsContact C-N 3.3Å; F623-G625 PolarHBondContact O-N 3.05Å; G625-L627 PolarHBondContact O-N 3.44Å; G625-L628 PolarHBondContact O-N 2.96Å; G625-F678 VanDerWaalsContact CA-CD2 3.44Å; G625-F682 WeakPolarHBondContact O-CA 3.17Å
626	G	70.9	Confident	67	Low	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-68.4	-34.3	-176	0	0	0	0	0	114.1	T392 I622 F623 L628 S629 N632 E681	T392-G626 WeakPolarHBondContact OG1-CA 3.45Å; I622-G626 PolarHBondContact O-N 3.41Å; I622-G626 VanDerWaalsContact O-N 3.08Å; F623-G626 PolarHBondContact O-N 3.26Å; G626-L628 PolarHBondContact O-N 2.99Å; G626-S629 VanDerWaalsContact O-CB 3.27Å; G626-S629 WeakPolarHBondContact O-CB 3.35Å; G626-S629 PolarHBondContact O-N 2.69Å; G626-S629 VanDerWaalsContact O-N 3.1Å; G626-S629 PolarHBondContact O-OG 3.32Å; G626-N632 WeakPolarHBondContact O-CB 3.35Å; G626-N632 PolarHBondContact O-ND2 2.89Å; G626-E681 WeakPolarHBondContact CA-O 3.38Å
627	L	75.6	Confident	68.6	Low	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.2	-26.8	177.8	-73.3	169.7	0	0	0	111.9	T392 Y497 A500 L501 V504 F623 G625 S629 R633 L636	T392-L627 HydrophobicContact CG2-CD2 4Å; T392-L627 HydrophobicContact CG2-CG 3.82Å; Y497-L627 HydrophobicContact CE1-CD2 4.46Å; Y497-L627 HydrophobicContact CE2-CD2 3.79Å; Y497-L627 HydrophobicContact CE2-CG 4.49Å; Y497-L627 WeakPolarHBondContact OH-CD2 3.17Å; A500-L627 HydrophobicContact CB-CD1 3.71Å; L501-L627 HydrophobicContact CB-CD1 4.03Å; L501-L627 HydrophobicContact CD1-CD2 4.13Å; L501-L627 VanDerWaalsContact N-CD1 3.35Å; V504-L627 HydrophobicContact CG2-CB 4.32Å; V504-L627 HydrophobicContact CG2-CD1 4.33Å; F623-L627 WeakPolarHBondContact O-CB 3.44Å; F623-L627 WeakPolarHBondContact O-CD1 3.27Å; F623-L627 WeakPolarHBondContact O-CG 3.33Å; F623-L627 PolarHBondContact O-N 3.18Å; G625-L627 PolarHBondContact O-N 3.44Å; L627-S629 VanDerWaalsContact C-N 3.31Å; L627-R633 VanDerWaalsContact O-CG 3.23Å; L627-R633 WeakPolarHBondContact O-CG 3.36Å; L627-L636 HydrophobicContact CD2-CD1 3.66Å
628	L	70	Confident	69.7	Low	4 Å²	4	33 Å²	33	2%	0.021	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-11.2	176.8	-63.5	173.5	0	0	0	113.2	V504 M624 G625 G626 R633 A648 N651 F678 F682	V504-L628 HydrophobicContact CG1-CD2 3.62Å; V504-L628 HydrophobicContact CG1-CG 4.44Å; V504-L628 HydrophobicContact CG2-CD2 4.39Å; M624-L628 VanDerWaalsContact O-CG 3.32Å; M624-L628 WeakPolarHBondContact O-CG 3.24Å; G625-L628 PolarHBondContact O-N 2.96Å; G626-L628 PolarHBondContact O-N 2.99Å; L628-R633 PolarHBondContact O-NE 3.47Å; L628-A648 HydrophobicContact CD2-CB 3.85Å; L628-N651 HydrophobicContact CD1-CB 4.31Å; L628-F678 HydrophobicContact CD1-CZ 4.47Å; L628-F682 HydrophobicContact CB-CD2 3.69Å; L628-F682 HydrophobicContact CB-CE2 3.6Å
629	S	73.9	Confident	70.6	Confident	6 Å²	6	27.7 Å²	27.7	4%	0.042	17%	0.165	C	C	.	.	S	Bend	trans	-62.4	147.8	178	74	0	0	0	0	111.9	G626 L627 H631 N632 R633 F682	G626-S629 VanDerWaalsContact O-CB 3.27Å; G626-S629 WeakPolarHBondContact O-CB 3.35Å; G626-S629 PolarHBondContact O-N 2.69Å; G626-S629 VanDerWaalsContact O-N 3.1Å; G626-S629 PolarHBondContact O-OG 3.32Å; L627-S629 VanDerWaalsContact C-N 3.31Å; S629-H631 VanDerWaalsContact C-N 3.27Å; S629-H631 PolarHBondContact O-N 2.87Å; S629-N632 PolarHBondContact O-N 2.84Å; S629-N632 WeakPolarHBondContact OG-CB 3.46Å; S629-N632 PolarHBondContact OG-N 2.89Å; S629-N632 PolarHBondContact OG-ND2 3.08Å; S629-R633 WeakPolarHBondContact O-CB 3.38Å; S629-R633 VanDerWaalsContact O-CG 3.27Å; S629-R633 WeakPolarHBondContact O-CG 3.36Å; S629-R633 PolarHBondContact O-N 2.95Å; S629-F682 VanDerWaalsContact CB-O 3.31Å; S629-F682 WeakPolarHBondContact CB-O 3.07Å
630	A	68.8	Low	71.4	Confident	72 Å²	72	27.1 Å²	27.1	60%	0.595	17%	0.171	S	C	*	.	H	α-helix	trans	-60	-38.5	-178	0	0	0	0	0	112.7	A634	A630-A634 WeakPolarHBondContact O-CB 3.47Å; A630-A634 PolarHBondContact O-N 3.22Å; A630-A634 VanDerWaalsContact O-N 3.13Å
631	H	71.6	Confident	72.3	Confident	102 Å²	102	26.7 Å²	26.7	47%	0.472	17%	0.169	S	C	.	.	H	α-helix	trans	-64.2	-52.4	178.2	-178.5	79.4	0	0	0	111.7	S629 R633 A634 V635	S629-H631 VanDerWaalsContact C-N 3.27Å; S629-H631 PolarHBondContact O-N 2.87Å; H631-R633 VanDerWaalsContact C-N 3.34Å; H631-R633 PolarHBondContact O-N 3.25Å; H631-A634 WeakPolarHBondContact O-CB 3.44Å; H631-A634 PolarHBondContact O-N 3.23Å; H631-A634 VanDerWaalsContact O-N 3.16Å; H631-V635 PolarHBondContact O-N 3.34Å; H631-V635 VanDerWaalsContact O-N 3.09Å
632	N	78.1	Confident	73.3	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-66.7	-36.4	-177.5	-67.8	-22.5	0	0	0	111.7	S393 T396 G626 S629 A634 V635 L636	S393-N632 VanDerWaalsContact CA-OD1 3.28Å; S393-N632 WeakPolarHBondContact CA-OD1 3.17Å; T396-N632 HydrophobicContact CG2-CB 4.16Å; G626-N632 WeakPolarHBondContact O-CB 3.35Å; G626-N632 PolarHBondContact O-ND2 2.89Å; S629-N632 PolarHBondContact O-N 2.84Å; S629-N632 WeakPolarHBondContact OG-CB 3.46Å; S629-N632 PolarHBondContact OG-N 2.89Å; S629-N632 PolarHBondContact OG-ND2 3.08Å; N632-A634 VanDerWaalsContact C-N 3.33Å; N632-A634 PolarHBondContact O-N 3.39Å; N632-V635 PolarHBondContact O-N 2.86Å; N632-L636 WeakPolarHBondContact O-CB 3.47Å; N632-L636 VanDerWaalsContact O-CG 3.25Å; N632-L636 WeakPolarHBondContact O-CG 3.47Å; N632-L636 PolarHBondContact O-N 3.31Å
633	R	76.3	Confident	73.5	Confident	43 Å²	43	28.5 Å²	28.5	16%	0.162	18%	0.182	C	C	.	.	H	α-helix	trans	-61.7	-39.6	173	-68	-174.2	-56.7	168.2	12	112.8	L627 L628 S629 H631 V635 L636 A637 I643 N645	L627-R633 VanDerWaalsContact O-CG 3.23Å; L627-R633 WeakPolarHBondContact O-CG 3.36Å; L628-R633 PolarHBondContact O-NE 3.47Å; S629-R633 WeakPolarHBondContact O-CB 3.38Å; S629-R633 VanDerWaalsContact O-CG 3.27Å; S629-R633 WeakPolarHBondContact O-CG 3.36Å; S629-R633 PolarHBondContact O-N 2.95Å; H631-R633 VanDerWaalsContact C-N 3.34Å; H631-R633 PolarHBondContact O-N 3.25Å; R633-V635 VanDerWaalsContact C-N 3.32Å; R633-L636 PolarHBondContact O-N 3.02Å; R633-A637 WeakPolarHBondContact O-CB 3.42Å; R633-A637 PolarHBondContact O-N 3.31Å; R633-I643 HydrophobicContact CG-CB 4.01Å; R633-I643 HydrophobicContact CG-CD1 4Å; R633-I643 HydrophobicContact CG-CG2 4.35Å; R633-N645 PolarHBondContact NH1-OD1 2.85Å; R633-N645 PolarHBondContact NH2-OD1 3.31Å
634	A	72.1	Confident	73	Confident	55 Å²	55	35.6 Å²	35.6	46%	0.455	21%	0.212	S	C	.	.	H	α-helix	trans	-65.5	-37	176.5	0	0	0	0	0	112	A630 H631 N632 Q638	A630-A634 WeakPolarHBondContact O-CB 3.47Å; A630-A634 PolarHBondContact O-N 3.22Å; A630-A634 VanDerWaalsContact O-N 3.13Å; H631-A634 WeakPolarHBondContact O-CB 3.44Å; H631-A634 PolarHBondContact O-N 3.23Å; H631-A634 VanDerWaalsContact O-N 3.16Å; N632-A634 VanDerWaalsContact C-N 3.33Å; N632-A634 PolarHBondContact O-N 3.39Å; A634-Q638 WeakPolarHBondContact O-CG 3.42Å; A634-Q638 PolarHBondContact O-NE2 3Å
635	V	74	Confident	72.3	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.036	24%	0.239	C	C	.	.	H	α-helix	trans	-69.6	-44.8	174.6	176	0	0	0	0	111.4	T396 R400 H631 N632 R633 A637 Q638 L639	T396-V635 HydrophobicContact CG2-CB 3.91Å; T396-V635 HydrophobicContact CG2-CG1 3.72Å; R400-V635 HydrophobicContact CB-CG1 3.67Å; R400-V635 HydrophobicContact CG-CG1 3.87Å; H631-V635 PolarHBondContact O-N 3.34Å; H631-V635 VanDerWaalsContact O-N 3.09Å; N632-V635 PolarHBondContact O-N 2.86Å; R633-V635 VanDerWaalsContact C-N 3.32Å; V635-A637 VanDerWaalsContact C-N 3.31Å; V635-A637 PolarHBondContact O-N 2.64Å; V635-Q638 WeakPolarHBondContact O-CB 3.41Å; V635-Q638 PolarHBondContact O-N 3.15Å; V635-Q638 VanDerWaalsContact O-N 3.1Å; V635-L639 PolarHBondContact O-N 3.07Å
636	L	80.3	Confident	71.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-33.4	178.8	-71.2	164.2	0	0	0	112.5	T396 L501 L627 N632 R633 Q638 L639 G640 C641 I643	T396-L636 HydrophobicContact CG2-CD1 4.39Å; T396-L636 HydrophobicContact CG2-CD2 4.01Å; T396-L636 HydrophobicContact CG2-CG 3.78Å; L501-L636 HydrophobicContact CD1-CD1 3.97Å; L501-L636 HydrophobicContact CD1-CD2 3.93Å; L501-L636 HydrophobicContact CD2-CD2 4.35Å; L627-L636 HydrophobicContact CD2-CD1 3.66Å; N632-L636 WeakPolarHBondContact O-CB 3.47Å; N632-L636 VanDerWaalsContact O-CG 3.25Å; N632-L636 WeakPolarHBondContact O-CG 3.47Å; N632-L636 PolarHBondContact O-N 3.31Å; R633-L636 PolarHBondContact O-N 3.02Å; L636-Q638 VanDerWaalsContact C-N 3.27Å; L636-Q638 PolarHBondContact O-N 3.45Å; L636-L639 HydrophobicContact CD2-CD1 4.4Å; L636-L639 CarbonylContact O-C 3.46Å; L636-L639 WeakPolarHBondContact O-CA 3.16Å; L636-L639 WeakPolarHBondContact O-CB 3.42Å; L636-L639 PolarHBondContact O-N 2.89Å; L636-G640 PolarHBondContact O-N 3.16Å; L636-C641 CarbonylContact C-O 3.52Å; L636-C641 HydrophobicContact CB-CB 4.23Å; L636-C641 WeakPolarHBondContact CB-O 3.12Å; L636-C641 HydrophobicContact CD2-CB 4.42Å; L636-C641 CarbonylContact O-C 3.54Å; L636-C641 WeakPolarHBondContact O-CA 3.29Å; L636-C641 WeakPolarHBondContact O-CB 3.46Å; L636-C641 PolarHBondContact O-N 3.48Å; L636-I643 HydrophobicContact CD1-CD1 3.63Å
637	A	77.3	Confident	70.6	Confident	52 Å²	52	47.6 Å²	47.6	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-60.2	-37.4	172.4	0	0	0	0	0	112	R633 V635 L639 G640 P642	R633-A637 WeakPolarHBondContact O-CB 3.42Å; R633-A637 PolarHBondContact O-N 3.31Å; V635-A637 VanDerWaalsContact C-N 3.31Å; V635-A637 PolarHBondContact O-N 2.64Å; A637-L639 PolarHBondContact O-N 2.75Å; A637-G640 PolarHBondContact O-N 2.8Å; A637-G640 VanDerWaalsContact O-N 3.15Å; A637-P642 HydrophobicContact CB-CB 4.47Å
638	Q	76.4	Confident	69.4	Low	98 Å²	98	47.8 Å²	47.8	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-24.7	174.8	-62.4	168.4	34.4	0	0	112.4	A634 V635 L636 G640	A634-Q638 WeakPolarHBondContact O-CG 3.42Å; A634-Q638 PolarHBondContact O-NE2 3Å; V635-Q638 WeakPolarHBondContact O-CB 3.41Å; V635-Q638 PolarHBondContact O-N 3.15Å; V635-Q638 VanDerWaalsContact O-N 3.1Å; L636-Q638 VanDerWaalsContact C-N 3.27Å; L636-Q638 PolarHBondContact O-N 3.45Å; Q638-G640 VanDerWaalsContact C-N 3.27Å
639	L	72.8	Confident	68.4	Low	3 Å²	3	52 Å²	52	2%	0.016	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	10.6	175.6	-67.9	169.9	0	0	0	112.8	L399 R400 F403 S417 M419 V635 L636 A637 C641	L399-L639 HydrophobicContact CB-CD1 4.17Å; R400-L639 HydrophobicContact CB-CD1 4.18Å; R400-L639 HydrophobicContact CB-CD2 4.44Å; R400-L639 HydrophobicContact CB-CG 4.47Å; F403-L639 HydrophobicContact CB-CD2 3.95Å; S417-L639 WeakPolarHBondContact CB-O 3.41Å; S417-L639 PolarHBondContact OG-O 3.26Å; M419-L639 HydrophobicContact CB-CB 4.22Å; M419-L639 HydrophobicContact CB-CD2 4.5Å; M419-L639 HydrophobicContact CG-CB 3.98Å; M419-L639 HydrophobicContact CG-CD1 4.27Å; M419-L639 HydrophobicContact CG-CD2 4.49Å; M419-L639 HydrophobicContact CG-CG 4.48Å; V635-L639 PolarHBondContact O-N 3.07Å; L636-L639 HydrophobicContact CD2-CD1 4.4Å; L636-L639 CarbonylContact O-C 3.46Å; L636-L639 WeakPolarHBondContact O-CA 3.16Å; L636-L639 WeakPolarHBondContact O-CB 3.42Å; L636-L639 PolarHBondContact O-N 2.89Å; A637-L639 PolarHBondContact O-N 2.75Å; L639-C641 PolarHBondContact O-N 2.8Å
640	G	76.4	Confident	67.4	Low	37 Å²	37	55.5 Å²	55.5	38%	0.381	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	16.9	-176	0	0	0	0	0	114	A420 L636 A637 Q638 P642	A420-G640 WeakPolarHBondContact CB-O 3.49Å; L636-G640 PolarHBondContact O-N 3.16Å; A637-G640 PolarHBondContact O-N 2.8Å; A637-G640 VanDerWaalsContact O-N 3.15Å; Q638-G640 VanDerWaalsContact C-N 3.27Å; G640-P642 WeakPolarHBondContact O-CD 3.44Å
641	C	81.1	Confident	66.6	Low	3 Å²	3	52.7 Å²	52.7	2%	0.02	29%	0.29	C	S	.	.			trans	-111.9	60.3	176.9	-61.5	0	0	0	0	111	A420 L505 L636 L639 I643	A420-C641 VanDerWaalsContact CA-SG 3.6Å; L505-C641 HydrophobicContact CD1-CB 4.19Å; L505-C641 HydrophobicContact CD2-CB 4.03Å; L636-C641 CarbonylContact C-O 3.52Å; L636-C641 HydrophobicContact CB-CB 4.23Å; L636-C641 WeakPolarHBondContact CB-O 3.12Å; L636-C641 HydrophobicContact CD2-CB 4.42Å; L636-C641 CarbonylContact O-C 3.54Å; L636-C641 WeakPolarHBondContact O-CA 3.29Å; L636-C641 WeakPolarHBondContact O-CB 3.46Å; L636-C641 PolarHBondContact O-N 3.48Å; L639-C641 PolarHBondContact O-N 2.8Å; C641-I643 PolarHBondContact O-N 3.04Å
642	P	76.9	Confident	65.6	Low	89 Å²	89	48 Å²	48	58%	0.578	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-71	124.6	-175.3	30.3	-35.1	0	0	0	111.4	A637 G640	A637-P642 HydrophobicContact CB-CB 4.47Å; G640-P642 WeakPolarHBondContact O-CD 3.44Å
643	I	68.7	Low	64.4	Low	16 Å²	16	53 Å²	53	8%	0.082	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-96.2	119.3	170.7	-59.5	161.4	0	0	0	107.6	V504 L505 R633 L636 C641	V504-I643 HydrophobicContact CB-CD1 4.49Å; V504-I643 HydrophobicContact CG1-CB 4.47Å; V504-I643 HydrophobicContact CG1-CD1 3.45Å; V504-I643 VanDerWaalsContact CG1-CD1 3.45Å; V504-I643 HydrophobicContact CG1-CG1 3.85Å; V504-I643 HydrophobicContact CG1-CG2 3.78Å; L505-I643 HydrophobicContact CD2-CG1 3.81Å; R633-I643 HydrophobicContact CG-CB 4.01Å; R633-I643 HydrophobicContact CG-CD1 4Å; R633-I643 HydrophobicContact CG-CG2 4.35Å; L636-I643 HydrophobicContact CD1-CD1 3.63Å; C641-I643 PolarHBondContact O-N 3.04Å
644	K	60.9	Low	63.3	Low	148 Å²	148	52.8 Å²	52.8	64%	0.643	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-68.6	145.4	-177.9	-58.6	177.8	179.3	174.4	0	110.7	L646 D647 A648	K644-L646 PolarHBondContact O-N 3.45Å; K644-D647 WeakPolarHBondContact CB-OD2 3.34Å; K644-D647 PolarHBondContact O-N 2.67Å; K644-A648 PolarHBondContact O-N 3.02Å
645	N	52.5	Low	62.3	Low	115 Å²	115	51.4 Å²	51.4	62%	0.615	29%	0.285	S	S	*	.	H	α-helix	trans	-61.2	-33.2	178.8	-77.3	-38	0	0	0	113.1	R633 L649	R633-N645 PolarHBondContact NH1-OD1 2.85Å; R633-N645 PolarHBondContact NH2-OD1 3.31Å; N645-L649 WeakPolarHBondContact O-CB 3.38Å; N645-L649 PolarHBondContact O-N 3.47Å
646	L	48.9	Very low	61.2	Low	108 Å²	108	55.1 Å²	55.1	57%	0.565	30%	0.3	S	S	*	.	H	α-helix	trans	-67.9	-46.2	179.5	-170.1	65.1	0	0	0	111.6	K644 A648 L649 E650	K644-L646 PolarHBondContact O-N 3.45Å; L646-A648 VanDerWaalsContact C-N 3.31Å; L646-A648 PolarHBondContact O-N 3.08Å; L646-L649 WeakPolarHBondContact O-CB 3.46Å; L646-L649 PolarHBondContact O-N 3.04Å; L646-L649 VanDerWaalsContact O-N 3.09Å; L646-E650 WeakPolarHBondContact O-CG 3.35Å; L646-E650 PolarHBondContact O-N 2.97Å
647	D	50	Low	60	Low	41 Å²	41	62.3 Å²	62.3	22%	0.219	33%	0.332	C	S	.	.	H	α-helix	trans	-62.4	-39.9	179.2	-56.7	-33.1	0	0	0	111.4	K644 E650 N651	K644-D647 WeakPolarHBondContact CB-OD2 3.34Å; K644-D647 PolarHBondContact O-N 2.67Å; D647-E650 PolarHBondContact O-N 3.45Å; D647-N651 WeakPolarHBondContact O-CB 3.3Å; D647-N651 PolarHBondContact O-N 3.31Å; D647-N651 PolarHBondContact O-ND2 2.93Å; D647-N651 VanDerWaalsContact O-ND2 3.1Å
648	A	49.7	Very low	58.8	Low	4 Å²	4	63.4 Å²	63.4	3%	0.033	33%	0.327	C	S	.	.	H	α-helix	trans	-67.6	-35.7	175.2	0	0	0	0	0	113	L628 K644 L646 A652	L628-A648 HydrophobicContact CD2-CB 3.85Å; K644-A648 PolarHBondContact O-N 3.02Å; L646-A648 VanDerWaalsContact C-N 3.31Å; L646-A648 PolarHBondContact O-N 3.08Å; A648-A652 VanDerWaalsContact O-CB 3.24Å; A648-A652 WeakPolarHBondContact O-CB 3.4Å; A648-A652 PolarHBondContact O-N 3.2Å
649	L	50.5	Low	57.4	Low	92 Å²	92	59.8 Å²	59.8	48%	0.482	31%	0.311	S	S	.	.	H	α-helix	trans	-69.1	-43.1	175.5	-176.5	67	0	0	0	111.1	N645 L646 A652 Q653	N645-L649 WeakPolarHBondContact O-CB 3.38Å; N645-L649 PolarHBondContact O-N 3.47Å; L646-L649 WeakPolarHBondContact O-CB 3.46Å; L646-L649 PolarHBondContact O-N 3.04Å; L646-L649 VanDerWaalsContact O-N 3.09Å; L649-A652 PolarHBondContact O-N 3.17Å; L649-Q653 HydrophobicContact CD1-CG 4.45Å; L649-Q653 HydrophobicContact CG-CG 4.45Å; L649-Q653 VanDerWaalsContact O-CB 3.27Å; L649-Q653 WeakPolarHBondContact O-CB 3.39Å; L649-Q653 WeakPolarHBondContact O-CG 3.14Å; L649-Q653 PolarHBondContact O-N 3.5Å
650	E	53	Low	56.3	Low	80 Å²	80	62.3 Å²	62.3	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-65.1	-41.5	177.2	-72.5	178	142.6	0	0	111.6	L512 L646 D647 Q653 A654	L512-E650 HydrophobicContact CD2-CB 3.88Å; L512-E650 HydrophobicContact CD2-CG 4.4Å; L512-E650 WeakPolarHBondContact CD2-OE2 3.27Å; L646-E650 WeakPolarHBondContact O-CG 3.35Å; L646-E650 PolarHBondContact O-N 2.97Å; D647-E650 PolarHBondContact O-N 3.45Å; E650-Q653 PolarHBondContact O-N 2.87Å; E650-A654 WeakPolarHBondContact O-CB 3.27Å; E650-A654 PolarHBondContact O-N 3.33Å
651	N	51.7	Low	54.9	Low	13 Å²	13	67.6 Å²	67.6	7%	0.07	35%	0.35	C	S	.	.	H	α-helix	trans	-63	-47	173.1	-74.6	-31.6	0	0	0	111.9	L628 D647 Q653 A654 I655	L628-N651 HydrophobicContact CD1-CB 4.31Å; D647-N651 WeakPolarHBondContact O-CB 3.3Å; D647-N651 PolarHBondContact O-N 3.31Å; D647-N651 PolarHBondContact O-ND2 2.93Å; D647-N651 VanDerWaalsContact O-ND2 3.1Å; N651-Q653 VanDerWaalsContact C-N 3.32Å; N651-Q653 PolarHBondContact O-N 3.48Å; N651-A654 PolarHBondContact O-N 3.44Å; N651-I655 VanDerWaalsContact O-CG1 3.29Å; N651-I655 WeakPolarHBondContact O-CG1 3.4Å; N651-I655 PolarHBondContact O-N 3.31Å; N651-I655 VanDerWaalsContact O-N 3.08Å
652	A	51	Low	53	Low	4 Å²	4	68.9 Å²	68.9	3%	0.033	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-38	176.2	0	0	0	0	0	112	A648 L649 I655 K656 F682 F687	A648-A652 VanDerWaalsContact O-CB 3.24Å; A648-A652 WeakPolarHBondContact O-CB 3.4Å; A648-A652 PolarHBondContact O-N 3.2Å; L649-A652 PolarHBondContact O-N 3.17Å; A652-I655 PolarHBondContact O-N 3.28Å; A652-K656 WeakPolarHBondContact O-CB 3.36Å; A652-K656 PolarHBondContact O-N 3.1Å; A652-F682 HydrophobicContact CB-CE1 4.47Å; A652-F682 HydrophobicContact CB-CZ 4.15Å; A652-F687 HydrophobicContact CB-CD2 4.3Å; A652-F687 HydrophobicContact CB-CE2 3.83Å; A652-F687 HydrophobicContact CB-CZ 4.2Å; A652-F687 VanDerWaalsContact O-CE2 3.3Å; A652-F687 WeakPolarHBondContact O-CE2 3.23Å; A652-F687 WeakPolarHBondContact O-CZ 3.49Å
653	Q	52.8	Low	51.4	Low	106 Å²	106	67.9 Å²	67.9	50%	0.495	36%	0.363	S	S	.	.	H	α-helix	trans	-69.9	-37.4	176.6	-77	177.7	0.8	0	0	112.9	L649 E650 N651 K656 K657	L649-Q653 HydrophobicContact CD1-CG 4.45Å; L649-Q653 HydrophobicContact CG-CG 4.45Å; L649-Q653 VanDerWaalsContact O-CB 3.27Å; L649-Q653 WeakPolarHBondContact O-CB 3.39Å; L649-Q653 WeakPolarHBondContact O-CG 3.14Å; L649-Q653 PolarHBondContact O-N 3.5Å; E650-Q653 PolarHBondContact O-N 2.87Å; N651-Q653 VanDerWaalsContact C-N 3.32Å; N651-Q653 PolarHBondContact O-N 3.48Å; Q653-K656 PolarHBondContact O-N 2.81Å; Q653-K657 WeakPolarHBondContact O-CB 3.27Å; Q653-K657 PolarHBondContact O-N 2.83Å
654	A	52.5	Low	50.4	Low	38 Å²	38	78.3 Å²	78.3	31%	0.314	40%	0.401	S	S	.	.	H	α-helix	trans	-62.8	-44.1	174.1	0	0	0	0	0	111.2	E650 N651 K657 K658	E650-A654 WeakPolarHBondContact O-CB 3.27Å; E650-A654 PolarHBondContact O-N 3.33Å; N651-A654 PolarHBondContact O-N 3.44Å; A654-K657 PolarHBondContact O-N 2.76Å; A654-K658 PolarHBondContact O-N 3.2Å
655	I	50.5	Low	49.8	Very low	27 Å²	27	78.1 Å²	78.1	14%	0.138	40%	0.402	C	S	.	.	H	α-helix	trans	-62.9	-47.4	174.5	-66	167.8	0	0	0	110.1	N651 A652 K657 K658 L659 F678	N651-I655 VanDerWaalsContact O-CG1 3.29Å; N651-I655 WeakPolarHBondContact O-CG1 3.4Å; N651-I655 PolarHBondContact O-N 3.31Å; N651-I655 VanDerWaalsContact O-N 3.08Å; A652-I655 PolarHBondContact O-N 3.28Å; I655-K657 VanDerWaalsContact C-N 3.35Å; I655-K657 PolarHBondContact O-N 3.22Å; I655-K658 PolarHBondContact O-N 3.43Å; I655-K658 VanDerWaalsContact O-N 3.12Å; I655-L659 HydrophobicContact CG2-CD1 3.71Å; I655-L659 HydrophobicContact CG2-CG 4.28Å; I655-L659 WeakPolarHBondContact O-CG 3.31Å; I655-L659 PolarHBondContact O-N 3.4Å; I655-F678 HydrophobicContact CD1-CE1 4.13Å; I655-F678 HydrophobicContact CD1-CE2 3.76Å; I655-F678 HydrophobicContact CD1-CZ 3.43Å; I655-F678 VanDerWaalsContact CD1-CZ 3.43Å; I655-F678 HydrophobicContact CG2-CE1 4.35Å
656	K	52.3	Low	49.9	Very low	83 Å²	83	78.7 Å²	78.7	36%	0.361	41%	0.409	S	S	.	.	H	α-helix	trans	-56.6	-42.9	174.7	178.9	174.4	-179.4	177.7	0	112.8	A652 Q653 K658 L659 G660 F687 E690 V691	A652-K656 WeakPolarHBondContact O-CB 3.36Å; A652-K656 PolarHBondContact O-N 3.1Å; Q653-K656 PolarHBondContact O-N 2.81Å; K656-K658 VanDerWaalsContact C-N 3.26Å; K656-K658 PolarHBondContact O-N 3.37Å; K656-L659 PolarHBondContact O-N 3.02Å; K656-G660 PolarHBondContact O-N 2.93Å; K656-F687 HydrophobicContact CB-CE2 3.9Å; K656-F687 HydrophobicContact CB-CZ 4.13Å; K656-F687 HydrophobicContact CD-CE2 4.32Å; K656-E690 IonicContact NZ-OE2 3.06Å; K656-E690 PolarHBondContact NZ-OE2 3.41Å; K656-V691 HydrophobicContact CB-CG2 4.44Å; K656-V691 HydrophobicContact CD-CG2 4.44Å; K656-V691 HydrophobicContact CG-CG2 4.11Å
657	K	53.5	Low	50.3	Low	152 Å²	152	75 Å²	75	66%	0.661	39%	0.39	S	S	*	.	H	α-helix	trans	-66.6	-28.4	179.8	-170.4	175.8	-177.3	177	0	112.2	Q653 A654 I655 K661	Q653-K657 WeakPolarHBondContact O-CB 3.27Å; Q653-K657 PolarHBondContact O-N 2.83Å; A654-K657 PolarHBondContact O-N 2.76Å; I655-K657 VanDerWaalsContact C-N 3.35Å; I655-K657 PolarHBondContact O-N 3.22Å; K657-K661 WeakPolarHBondContact O-CG 3.34Å
658	K	51.8	Low	50.9	Low	74 Å²	74	75.8 Å²	75.8	32%	0.322	40%	0.397	S	S	.	.	H	α-helix	trans	-80	-45.7	174.2	-156.4	-178.8	-178.8	-148.6	0	111.2	A520 A654 I655 K656 G660 K661 L662	A520-K658 HydrophobicContact CB-CD 3.58Å; A520-K658 VanDerWaalsContact CB-CE 3.46Å; A520-K658 PolarHBondContact O-NZ 3.3Å; A654-K658 PolarHBondContact O-N 3.2Å; I655-K658 PolarHBondContact O-N 3.43Å; I655-K658 VanDerWaalsContact O-N 3.12Å; K656-K658 VanDerWaalsContact C-N 3.26Å; K656-K658 PolarHBondContact O-N 3.37Å; K658-G660 VanDerWaalsContact C-N 3.34Å; K658-G660 PolarHBondContact O-N 3.43Å; K658-K661 WeakPolarHBondContact O-CB 3.46Å; K658-K661 PolarHBondContact O-N 3.36Å; K658-L662 HydrophobicContact CG-CD1 4.27Å; K658-L662 WeakPolarHBondContact O-CG 3.48Å; K658-L662 PolarHBondContact O-N 3.09Å
659	L	48	Very low	51.5	Low	23 Å²	23	77.4 Å²	77.4	12%	0.12	41%	0.408	C	S	.	.	H	α-helix	trans	-60.4	-40.8	175.3	-68.9	172.6	0	0	0	112.5	I655 K656 K661 L662 G663 V691	I655-L659 HydrophobicContact CG2-CD1 3.71Å; I655-L659 HydrophobicContact CG2-CG 4.28Å; I655-L659 WeakPolarHBondContact O-CG 3.31Å; I655-L659 PolarHBondContact O-N 3.4Å; K656-L659 PolarHBondContact O-N 3.02Å; L659-K661 VanDerWaalsContact C-N 3.28Å; L659-K661 PolarHBondContact O-N 3.1Å; L659-L662 HydrophobicContact CD2-CD1 4.49Å; L659-L662 CarbonylContact O-C 3.48Å; L659-L662 PolarHBondContact O-N 3.41Å; L659-L662 VanDerWaalsContact O-N 3.1Å; L659-G663 PolarHBondContact O-N 3.16Å; L659-V691 HydrophobicContact CB-CG1 4.23Å; L659-V691 HydrophobicContact CD1-CG1 3.8Å
660	G	49.1	Very low	52	Low	56 Å²	56	76.1 Å²	76.1	58%	0.577	41%	0.406	S	S	*	.	H	α-helix	trans	-67.6	-23.7	175.1	0	0	0	0	0	114.1	K656 K658	K656-G660 PolarHBondContact O-N 2.93Å; K658-G660 VanDerWaalsContact C-N 3.34Å; K658-G660 PolarHBondContact O-N 3.43Å
661	K	47.7	Very low	52.6	Low	147 Å²	147	73.8 Å²	73.8	64%	0.639	40%	0.396	S	S	*	.	H	α-helix	trans	-79.9	-30.4	169.8	-76	178.6	176.5	-169.3	0	112	K657 K658 L659	K657-K661 WeakPolarHBondContact O-CG 3.34Å; K658-K661 WeakPolarHBondContact O-CB 3.46Å; K658-K661 PolarHBondContact O-N 3.36Å; L659-K661 VanDerWaalsContact C-N 3.28Å; L659-K661 PolarHBondContact O-N 3.1Å
662	L	41	Very low	53.4	Low	30 Å²	30	74.2 Å²	74.2	16%	0.157	40%	0.398	C	S	.	.	H	α-helix	trans	-79.2	-20.4	178.1	-71.1	161	0	0	0	113.5	K658 L659 R664 Q665 L667	K658-L662 HydrophobicContact CG-CD1 4.27Å; K658-L662 WeakPolarHBondContact O-CG 3.48Å; K658-L662 PolarHBondContact O-N 3.09Å; L659-L662 HydrophobicContact CD2-CD1 4.49Å; L659-L662 CarbonylContact O-C 3.48Å; L659-L662 PolarHBondContact O-N 3.41Å; L659-L662 VanDerWaalsContact O-N 3.1Å; L662-R664 PolarHBondContact O-N 3.13Å; L662-Q665 CarbonylContact O-C 3.59Å; L662-Q665 PolarHBondContact O-N 3.36Å; L662-L667 HydrophobicContact CB-CD1 4.35Å; L662-L667 HydrophobicContact CB-CD2 4.48Å; L662-L667 HydrophobicContact CB-CG 4.45Å; L662-L667 HydrophobicContact CD1-CD2 4.09Å; L662-L667 HydrophobicContact CD2-CD2 3.84Å; L662-L667 HydrophobicContact CG-CD2 4.34Å
663	G	44.1	Very low	54.4	Low	69 Å²	69	74.4 Å²	74.4	71%	0.711	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-0.4	171	0	0	0	0	0	115.4	L659	L659-G663 PolarHBondContact O-N 3.16Å
664	R	46.6	Very low	55	Low	234 Å²	234	73.4 Å²	73.4	88%	0.883	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-6.6	172.1	-64.7	-179	177.9	179.1	-2.1	113.8	L662	L662-R664 PolarHBondContact O-N 3.13Å
665	Q	49.3	Very low	55.8	Low	144 Å²	144	72.7 Å²	72.7	67%	0.673	39%	0.386	S	S	*	.	S	Bend	trans	-124	139.6	178.8	-82.3	-179.3	-34.5	0	0	109.9	L662 L667	L662-Q665 CarbonylContact O-C 3.59Å; L662-Q665 PolarHBondContact O-N 3.36Å; Q665-L667 PolarHBondContact O-N 3.27Å; Q665-L667 VanDerWaalsContact O-N 3.16Å
666	V	55.1	Low	56.9	Low	127 Å²	127	71.5 Å²	71.5	77%	0.77	38%	0.38	S	S	*	.			trans	-69.5	110.9	174.8	-179.2	0	0	0	0	107.9
667	L	56.9	Low	57.7	Low	32 Å²	32	68.9 Å²	68.9	17%	0.168	37%	0.369	C	S	.	.			trans	-70.1	143.2	173.4	-78.6	165.3	0	0	0	110.1	L662 Q665 E671 L672	L662-L667 HydrophobicContact CB-CD1 4.35Å; L662-L667 HydrophobicContact CB-CD2 4.48Å; L662-L667 HydrophobicContact CB-CG 4.45Å; L662-L667 HydrophobicContact CD1-CD2 4.09Å; L662-L667 HydrophobicContact CD2-CD2 3.84Å; L662-L667 HydrophobicContact CG-CD2 4.34Å; Q665-L667 PolarHBondContact O-N 3.27Å; Q665-L667 VanDerWaalsContact O-N 3.16Å; L667-E671 HydrophobicContact CD2-CB 4.46Å; L667-E671 WeakPolarHBondContact CD2-OE2 3.36Å; L667-L672 HydrophobicContact CB-CB 4.48Å
668	P	61.2	Low	58.6	Low	56 Å²	56	62.5 Å²	62.5	36%	0.364	34%	0.341	S	S	.	.			trans	-55.1	144.8	166.3	-24.3	34.7	0	0	0	111.4	S670 E671 L672	P668-S670 VanDerWaalsContact C-N 3.28Å; P668-S670 PolarHBondContact O-N 3.22Å; P668-E671 HydrophobicContact CB-CG 4.41Å; P668-E671 HydrophobicContact CG-CG 4.41Å; P668-E671 PolarHBondContact O-N 2.96Å; P668-L672 PolarHBondContact O-N 3.17Å; P668-L672 VanDerWaalsContact O-N 3.09Å
669	P	62.9	Low	59.4	Low	38 Å²	38	59.3 Å²	59.3	25%	0.247	33%	0.327	C	S	.	.	H	α-helix	trans	-52.9	-37.5	179.8	-33.4	39.1	0	0	0	115.5	L673 L700 V703	P669-L673 PolarHBondContact O-N 3.27Å; P669-L673 VanDerWaalsContact O-N 3.11Å; P669-L700 WeakPolarHBondContact O-CD2 3.32Å; P669-V703 HydrophobicContact CB-CG2 3.42Å; P669-V703 VanDerWaalsContact CB-CG2 3.42Å
670	S	60.3	Low	60.7	Low	65 Å²	65	59.1 Å²	59.1	46%	0.455	33%	0.325	S	S	.	.	H	α-helix	trans	-66.7	-49.9	178.8	46.8	0	0	0	0	112.2	P668 L672 L673 D674	P668-S670 VanDerWaalsContact C-N 3.28Å; P668-S670 PolarHBondContact O-N 3.22Å; S670-L672 VanDerWaalsContact C-N 3.3Å; S670-L672 PolarHBondContact O-N 3.27Å; S670-L673 WeakPolarHBondContact O-CB 3.3Å; S670-L673 PolarHBondContact O-N 2.85Å; S670-L673 VanDerWaalsContact O-N 3.09Å; S670-D674 PolarHBondContact O-N 2.66Å
671	E	65.7	Low	61.7	Low	32 Å²	32	56.8 Å²	56.8	15%	0.15	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-39.6	177.7	-67.3	-179.7	-156.2	0	0	111.7	L667 P668 L673 D674 H675	L667-E671 HydrophobicContact CD2-CB 4.46Å; L667-E671 WeakPolarHBondContact CD2-OE2 3.36Å; P668-E671 HydrophobicContact CB-CG 4.41Å; P668-E671 HydrophobicContact CG-CG 4.41Å; P668-E671 PolarHBondContact O-N 2.96Å; E671-L673 VanDerWaalsContact C-N 3.31Å; E671-L673 PolarHBondContact O-N 3.29Å; E671-D674 PolarHBondContact O-N 3.16Å; E671-H675 PolarHBondContact O-CD2 2.9Å; E671-H675 PolarHBondContact O-N 2.94Å
672	L	69.6	Low	62.8	Low	22 Å²	22	50.4 Å²	50.4	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-60.9	-42.6	175.1	-179.6	58.3	0	0	0	111.2	L667 P668 S670 H675 L676 L695 L698 L700	L667-L672 HydrophobicContact CB-CB 4.48Å; P668-L672 PolarHBondContact O-N 3.17Å; P668-L672 VanDerWaalsContact O-N 3.09Å; S670-L672 VanDerWaalsContact C-N 3.3Å; S670-L672 PolarHBondContact O-N 3.27Å; L672-H675 WeakPolarHBondContact O-CB 3.17Å; L672-H675 PolarHBondContact O-N 2.8Å; L672-L676 WeakPolarHBondContact O-CG 3.39Å; L672-L676 PolarHBondContact O-N 2.79Å; L672-L676 VanDerWaalsContact O-N 3.09Å; L672-L695 HydrophobicContact CD1-CD1 4.48Å; L672-L698 HydrophobicContact CD2-CD1 3.84Å; L672-L700 HydrophobicContact CB-CD2 4.25Å; L672-L700 HydrophobicContact CD2-CD2 3.96Å; L672-L700 HydrophobicContact CG-CD2 4.08Å
673	L	71.8	Confident	64.2	Low	7 Å²	7	53.1 Å²	53.1	4%	0.037	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-44.8	177.5	-176.2	64.9	0	0	0	111.5	P669 S670 E671 H675 L676 F677 L700 V703 K709 V713	P669-L673 PolarHBondContact O-N 3.27Å; P669-L673 VanDerWaalsContact O-N 3.11Å; S670-L673 WeakPolarHBondContact O-CB 3.3Å; S670-L673 PolarHBondContact O-N 2.85Å; S670-L673 VanDerWaalsContact O-N 3.09Å; E671-L673 VanDerWaalsContact C-N 3.31Å; E671-L673 PolarHBondContact O-N 3.29Å; L673-H675 PolarHBondContact O-N 3.38Å; L673-L676 WeakPolarHBondContact O-CA 3.49Å; L673-L676 WeakPolarHBondContact O-CB 3.37Å; L673-L676 PolarHBondContact O-N 2.91Å; L673-F677 HydrophobicContact CD1-CD2 4.1Å; L673-F677 HydrophobicContact CD1-CE2 3.86Å; L673-F677 HydrophobicContact CD2-CE2 4.18Å; L673-F677 HydrophobicContact CG-CD2 3.94Å; L673-F677 HydrophobicContact CG-CE2 3.85Å; L673-F677 WeakPolarHBondContact O-CD2 3.36Å; L673-F677 PolarHBondContact O-N 2.89Å; L673-L700 HydrophobicContact CB-CD2 4.32Å; L673-V703 HydrophobicContact CD2-CG1 3.72Å; L673-K709 HydrophobicContact CD1-CB 4.41Å; L673-K709 HydrophobicContact CD1-CG 4.43Å; L673-K709 HydrophobicContact CD2-CD 3.52Å; L673-K709 VanDerWaalsContact CD2-CE 3.47Å; L673-K709 HydrophobicContact CD2-CG 3.91Å; L673-V713 HydrophobicContact CD1-CG2 4.14Å
674	D	66.4	Low	65.4	Low	85 Å²	85	52.9 Å²	52.9	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-58.3	-38.5	177.2	-67.9	-18.9	0	0	0	111.8	S670 E671 F677 F678	S670-D674 PolarHBondContact O-N 2.66Å; E671-D674 PolarHBondContact O-N 3.16Å; D674-F677 WeakPolarHBondContact O-CB 3.09Å; D674-F677 PolarHBondContact O-N 3.31Å; D674-F678 PolarHBondContact O-N 2.66Å
675	H	68.9	Low	66.4	Low	24 Å²	24	49.4 Å²	49.4	11%	0.111	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-41.5	173.1	-72.8	-47	0	0	0	112.8	E671 L672 L673 F677 F678 H679	E671-H675 PolarHBondContact O-CD2 2.9Å; E671-H675 PolarHBondContact O-N 2.94Å; L672-H675 WeakPolarHBondContact O-CB 3.17Å; L672-H675 PolarHBondContact O-N 2.8Å; L673-H675 PolarHBondContact O-N 3.38Å; H675-F677 VanDerWaalsContact C-N 3.33Å; H675-F677 PolarHBondContact O-N 3.09Å; H675-F678 WeakPolarHBondContact O-CB 3.33Å; H675-F678 PolarHBondContact O-N 2.87Å; H675-H679 PolarHBondContact O-CD2 3.32Å; H675-H679 PolarHBondContact O-N 2.95Å
676	L	73.2	Confident	67.2	Low	2 Å²	2	52.4 Å²	52.4	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-39.3	175.4	-62.9	174	0	0	0	111.1	L672 L673 H679 Y680 L692 L698 V712 V713 V716 L717	L672-L676 WeakPolarHBondContact O-CG 3.39Å; L672-L676 PolarHBondContact O-N 2.79Å; L672-L676 VanDerWaalsContact O-N 3.09Å; L673-L676 WeakPolarHBondContact O-CA 3.49Å; L673-L676 WeakPolarHBondContact O-CB 3.37Å; L673-L676 PolarHBondContact O-N 2.91Å; L676-H679 PolarHBondContact O-N 3.39Å; L676-Y680 WeakPolarHBondContact O-CB 3.28Å; L676-Y680 PolarHBondContact O-N 3.23Å; L676-L692 HydrophobicContact CD2-CD2 4.37Å; L676-L698 HydrophobicContact CD1-CD1 4.28Å; L676-V712 HydrophobicContact CB-CG1 4.1Å; L676-V713 HydrophobicContact CD1-CG2 3.86Å; L676-V716 HydrophobicContact CD2-CB 4.42Å; L676-V716 HydrophobicContact CD2-CG1 3.7Å; L676-L717 HydrophobicContact CD1-CD1 4.11Å; L676-L717 HydrophobicContact CD2-CD1 3.98Å; L676-L717 HydrophobicContact CD2-CD2 4.25Å; L676-L717 HydrophobicContact CD2-CG 4.02Å
677	F	69.1	Low	67.7	Low	28 Å²	28	47.3 Å²	47.3	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-44.1	172.5	-90.8	-91.5	0	0	0	112.4	I622 L673 D674 H675 H679 Y680 E681 V708 K709 V712	I622-F677 HydrophobicContact CD1-CB 4.4Å; I622-F677 HydrophobicContact CD1-CD1 3.86Å; I622-F677 HydrophobicContact CD1-CE1 4.47Å; I622-F677 HydrophobicContact CD1-CG 4.28Å; I622-F677 HydrophobicContact CG1-CB 4.2Å; I622-F677 HydrophobicContact CG1-CD1 4.44Å; L673-F677 HydrophobicContact CD1-CD2 4.1Å; L673-F677 HydrophobicContact CD1-CE2 3.86Å; L673-F677 HydrophobicContact CD2-CE2 4.18Å; L673-F677 HydrophobicContact CG-CD2 3.94Å; L673-F677 HydrophobicContact CG-CE2 3.85Å; L673-F677 WeakPolarHBondContact O-CD2 3.36Å; L673-F677 PolarHBondContact O-N 2.89Å; D674-F677 WeakPolarHBondContact O-CB 3.09Å; D674-F677 PolarHBondContact O-N 3.31Å; H675-F677 VanDerWaalsContact C-N 3.33Å; H675-F677 PolarHBondContact O-N 3.09Å; F677-H679 VanDerWaalsContact C-N 3.35Å; F677-H679 PolarHBondContact O-N 3.01Å; F677-Y680 WeakPolarHBondContact O-CB 3.28Å; F677-Y680 PolarHBondContact O-N 3.45Å; F677-E681 PolarHBondContact O-N 3.15Å; F677-V708 HydrophobicContact CE1-CG1 4.01Å; F677-V708 HydrophobicContact CZ-CG1 4.09Å; F677-K709 HydrophobicContact CE2-CG 3.88Å; F677-K709 HydrophobicContact CZ-CG 3.93Å; F677-V712 HydrophobicContact CD1-CG1 4.47Å; F677-V712 HydrophobicContact CD1-CG2 3.96Å; F677-V712 HydrophobicContact CD2-CG1 4.01Å; F677-V712 HydrophobicContact CE1-CG2 3.7Å; F677-V712 HydrophobicContact CE2-CB 4.42Å; F677-V712 HydrophobicContact CE2-CG1 4.26Å; F677-V712 HydrophobicContact CE2-CG2 4.36Å; F677-V712 HydrophobicContact CG-CG1 4.12Å; F677-V712 HydrophobicContact CG-CG2 4.42Å; F677-V712 HydrophobicContact CZ-CB 4.4Å; F677-V712 HydrophobicContact CZ-CG2 3.91Å
678	F	71.2	Confident	68.1	Low	18 Å²	18	46.3 Å²	46.3	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-58.3	-47.3	174.9	175.9	-86.4	0	0	0	111.5	G625 L628 I655 D674 H675 Y680 E681 F682 F687	G625-F678 VanDerWaalsContact CA-CD2 3.44Å; L628-F678 HydrophobicContact CD1-CZ 4.47Å; I655-F678 HydrophobicContact CD1-CE1 4.13Å; I655-F678 HydrophobicContact CD1-CE2 3.76Å; I655-F678 HydrophobicContact CD1-CZ 3.43Å; I655-F678 VanDerWaalsContact CD1-CZ 3.43Å; I655-F678 HydrophobicContact CG2-CE1 4.35Å; D674-F678 PolarHBondContact O-N 2.66Å; H675-F678 WeakPolarHBondContact O-CB 3.33Å; H675-F678 PolarHBondContact O-N 2.87Å; F678-Y680 VanDerWaalsContact C-N 3.31Å; F678-Y680 PolarHBondContact O-N 3.08Å; F678-E681 PolarHBondContact O-N 3.44Å; F678-F682 HydrophobicContact CE1-CB 4.32Å; F678-F682 HydrophobicContact CE1-CG 4.49Å; F678-F682 VanDerWaalsContact O-CB 3.27Å; F678-F682 WeakPolarHBondContact O-CB 3.31Å; F678-F682 PolarHBondContact O-N 3.44Å; F678-F687 HydrophobicContact CE1-CE1 4.44Å
679	H	69.6	Low	68.3	Low	6 Å²	6	46.5 Å²	46.5	3%	0.028	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-38.7	179.1	-85.8	-74.9	0	0	0	112.7	H675 L676 F677 Q683 F687 S688 V716	H675-H679 PolarHBondContact O-CD2 3.32Å; H675-H679 PolarHBondContact O-N 2.95Å; L676-H679 PolarHBondContact O-N 3.39Å; F677-H679 VanDerWaalsContact C-N 3.35Å; F677-H679 PolarHBondContact O-N 3.01Å; H679-Q683 PolarHBondContact O-N 3.27Å; H679-F687 AromaticContact CE1-CD1 3.61Å; H679-F687 AromaticContact CE1-CE1 3.35Å; H679-F687 WeakPolarHBondContact CE1-CE1 3.26Å; H679-F687 AromaticContact ND1-CD1 3.81Å; H679-F687 AromaticContact ND1-CE1 3.89Å; H679-S688 PolarHBondContact ND1-OG 3.27Å; H679-V716 HydrophobicContact CB-CG1 3.92Å; H679-V716 HydrophobicContact CB-CG2 4.25Å
680	Y	74.3	Confident	68.3	Low	20 Å²	20	49.7 Å²	49.7	8%	0.078	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-48.9	174.6	176.7	-99.8	0	0	0	111.5	Q360 T390 L676 F677 F678 F682 Q683 V712 V716	Q360-Y680 PolarHBondContact NE2-OH 3.47Å; Q360-Y680 PolarHBondContact OE1-OH 2.89Å; T390-Y680 HydrophobicContact CG2-CE1 4.41Å; L676-Y680 WeakPolarHBondContact O-CB 3.28Å; L676-Y680 PolarHBondContact O-N 3.23Å; F677-Y680 WeakPolarHBondContact O-CB 3.28Å; F677-Y680 PolarHBondContact O-N 3.45Å; F678-Y680 VanDerWaalsContact C-N 3.31Å; F678-Y680 PolarHBondContact O-N 3.08Å; Y680-F682 PolarHBondContact O-N 2.79Å; Y680-Q683 VanDerWaalsContact O-CD 3.24Å; Y680-Q683 VanDerWaalsContact O-CG 3.31Å; Y680-Q683 WeakPolarHBondContact O-CG 3.37Å; Y680-Q683 PolarHBondContact O-N 2.85Å; Y680-Q683 PolarHBondContact O-NE2 2.99Å; Y680-V712 HydrophobicContact CD1-CG2 3.81Å; Y680-V712 HydrophobicContact CD2-CG2 4.28Å; Y680-V712 HydrophobicContact CE1-CG2 4.19Å; Y680-V712 HydrophobicContact CG-CB 4.41Å; Y680-V712 HydrophobicContact CG-CG1 4.32Å; Y680-V712 HydrophobicContact CG-CG2 3.85Å; Y680-V716 HydrophobicContact CD2-CG2 4.43Å
681	E	72	Confident	68.4	Low	6 Å²	6	47.6 Å²	47.6	3%	0.028	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-36.6	179.1	-76.5	-70.8	147.9	0	0	112.7	T390 L391 T392 I622 G626 F677 F678 Q683	T390-E681 VanDerWaalsContact CB-CD 3.42Å; T390-E681 WeakPolarHBondContact CB-OE1 3.47Å; T390-E681 WeakPolarHBondContact CB-OE2 3.43Å; T390-E681 PolarHBondContact OG1-OE2 2.84Å; L391-E681 WeakPolarHBondContact CB-OE1 2.97Å; L391-E681 PolarHBondContact N-OE1 3.44Å; T392-E681 WeakPolarHBondContact CB-OE2 3.41Å; T392-E681 PolarHBondContact N-OE2 3.35Å; T392-E681 VanDerWaalsContact N-OE2 3.16Å; T392-E681 PolarHBondContact OG1-OE2 2.96Å; I622-E681 HydrophobicContact CB-CG 4.49Å; I622-E681 HydrophobicContact CG2-CG 3.45Å; I622-E681 VanDerWaalsContact CG2-CG 3.45Å; G626-E681 WeakPolarHBondContact CA-O 3.38Å; F677-E681 PolarHBondContact O-N 3.15Å; F678-E681 PolarHBondContact O-N 3.44Å; E681-Q683 PolarHBondContact O-N 3.25Å
682	F	69.6	Low	68.3	Low	14 Å²	14	47 Å²	47	6%	0.061	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-23.5	-179.5	-175.1	-131.4	0	0	0	113.2	G625 L628 S629 A652 F678 Y680 N684 F687	G625-F682 WeakPolarHBondContact O-CA 3.17Å; L628-F682 HydrophobicContact CB-CD2 3.69Å; L628-F682 HydrophobicContact CB-CE2 3.6Å; S629-F682 VanDerWaalsContact CB-O 3.31Å; S629-F682 WeakPolarHBondContact CB-O 3.07Å; A652-F682 HydrophobicContact CB-CE1 4.47Å; A652-F682 HydrophobicContact CB-CZ 4.15Å; F678-F682 HydrophobicContact CE1-CB 4.32Å; F678-F682 HydrophobicContact CE1-CG 4.49Å; F678-F682 VanDerWaalsContact O-CB 3.27Å; F678-F682 WeakPolarHBondContact O-CB 3.31Å; F678-F682 PolarHBondContact O-N 3.44Å; Y680-F682 PolarHBondContact O-N 2.79Å; F682-N684 HydrophobicContact CD1-CB 3.4Å; F682-N684 HydrophobicContact CE1-CB 3.28Å; F682-N684 HydrophobicContact CG-CB 4.15Å; F682-N684 HydrophobicContact CZ-CB 3.95Å; F682-N684 PolarHBondContact O-N 3.01Å; F682-N684 VanDerWaalsContact O-N 3.1Å; F682-F687 HydrophobicContact CD1-CB 4.35Å; F682-F687 AromaticContact CD1-CD1 3.7Å; F682-F687 HydrophobicContact CD1-CD1 3.7Å; F682-F687 HydrophobicContact CD1-CE1 4.28Å; F682-F687 HydrophobicContact CD1-CG 4.19Å; F682-F687 HydrophobicContact CE1-CB 3.81Å; F682-F687 AromaticContact CE1-CD1 3.65Å; F682-F687 HydrophobicContact CE1-CD1 3.65Å; F682-F687 HydrophobicContact CE1-CD2 4.36Å; F682-F687 HydrophobicContact CE1-CE1 4.29Å; F682-F687 AromaticContact CE1-CG 3.68Å; F682-F687 HydrophobicContact CE1-CG 3.68Å
683	Q	71.4	Confident	68.2	Low	87 Å²	87	48.6 Å²	48.6	41%	0.407	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	36.2	174.8	-68.6	-66.8	-22.2	0	0	113.7	T390 H679 Y680 E681	T390-Q683 HydrophobicContact CG2-CG 3.49Å; T390-Q683 VanDerWaalsContact CG2-CG 3.49Å; T390-Q683 VanDerWaalsContact CG2-NE2 3.31Å; H679-Q683 PolarHBondContact O-N 3.27Å; Y680-Q683 VanDerWaalsContact O-CD 3.24Å; Y680-Q683 VanDerWaalsContact O-CG 3.31Å; Y680-Q683 WeakPolarHBondContact O-CG 3.37Å; Y680-Q683 PolarHBondContact O-N 2.85Å; Y680-Q683 PolarHBondContact O-NE2 2.99Å; E681-Q683 PolarHBondContact O-N 3.25Å
684	N	67.9	Low	67.9	Low	63 Å²	63	52.3 Å²	52.3	34%	0.337	27%	0.267	S	S	.	.			trans	-115.2	93.4	178.7	-168.8	-42.2	0	0	0	110.6	F682 R686 F687 S688	F682-N684 HydrophobicContact CD1-CB 3.4Å; F682-N684 HydrophobicContact CE1-CB 3.28Å; F682-N684 HydrophobicContact CG-CB 4.15Å; F682-N684 HydrophobicContact CZ-CB 3.95Å; F682-N684 PolarHBondContact O-N 3.01Å; F682-N684 VanDerWaalsContact O-N 3.1Å; N684-R686 VanDerWaalsContact C-N 3.28Å; N684-R686 PolarHBondContact O-N 2.97Å; N684-R686 PolarHBondContact OD1-N 2.98Å; N684-F687 HydrophobicContact CB-CB 3.97Å; N684-F687 PolarHBondContact O-N 3.31Å; N684-F687 WeakPolarHBondContact OD1-CB 3.38Å; N684-F687 PolarHBondContact OD1-N 2.86Å; N684-S688 WeakPolarHBondContact O-CB 3.41Å; N684-S688 PolarHBondContact O-N 3.31Å; N684-S688 PolarHBondContact O-OG 2.84Å
685	Q	67.5	Low	68.2	Low	161 Å²	161	49.6 Å²	49.6	75%	0.752	25%	0.253	S	S	*	.	H	α-helix	trans	-59.3	-35.6	-176.7	-70.4	-173.5	-8.5	0	0	113.5	A689	Q685-A689 WeakPolarHBondContact O-CB 2.92Å; Q685-A689 PolarHBondContact O-N 3.17Å
686	R	66.6	Low	68.6	Low	208 Å²	208	56 Å²	56	79%	0.785	28%	0.276	S	S	*	.	H	α-helix	trans	-67.8	-45.9	179.3	-67	-177.4	-175.8	169.2	1.3	111.1	N684 A689 E690	N684-R686 VanDerWaalsContact C-N 3.28Å; N684-R686 PolarHBondContact O-N 2.97Å; N684-R686 PolarHBondContact OD1-N 2.98Å; R686-A689 PolarHBondContact O-N 3.01Å; R686-E690 WeakPolarHBondContact O-CG 3.17Å; R686-E690 PolarHBondContact O-N 2.97Å
687	F	65.4	Low	68.7	Low	19 Å²	19	61.6 Å²	61.6	8%	0.083	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-47.5	177	-179.4	-97.2	0	0	0	111.8	A652 K656 F678 H679 F682 N684 E690 V691	A652-F687 HydrophobicContact CB-CD2 4.3Å; A652-F687 HydrophobicContact CB-CE2 3.83Å; A652-F687 HydrophobicContact CB-CZ 4.2Å; A652-F687 VanDerWaalsContact O-CE2 3.3Å; A652-F687 WeakPolarHBondContact O-CE2 3.23Å; A652-F687 WeakPolarHBondContact O-CZ 3.49Å; K656-F687 HydrophobicContact CB-CE2 3.9Å; K656-F687 HydrophobicContact CB-CZ 4.13Å; K656-F687 HydrophobicContact CD-CE2 4.32Å; F678-F687 HydrophobicContact CE1-CE1 4.44Å; H679-F687 AromaticContact CE1-CD1 3.61Å; H679-F687 AromaticContact CE1-CE1 3.35Å; H679-F687 WeakPolarHBondContact CE1-CE1 3.26Å; H679-F687 AromaticContact ND1-CD1 3.81Å; H679-F687 AromaticContact ND1-CE1 3.89Å; F682-F687 HydrophobicContact CD1-CB 4.35Å; F682-F687 AromaticContact CD1-CD1 3.7Å; F682-F687 HydrophobicContact CD1-CD1 3.7Å; F682-F687 HydrophobicContact CD1-CE1 4.28Å; F682-F687 HydrophobicContact CD1-CG 4.19Å; F682-F687 HydrophobicContact CE1-CB 3.81Å; F682-F687 AromaticContact CE1-CD1 3.65Å; F682-F687 HydrophobicContact CE1-CD1 3.65Å; F682-F687 HydrophobicContact CE1-CD2 4.36Å; F682-F687 HydrophobicContact CE1-CE1 4.29Å; F682-F687 AromaticContact CE1-CG 3.68Å; F682-F687 HydrophobicContact CE1-CG 3.68Å; N684-F687 HydrophobicContact CB-CB 3.97Å; N684-F687 PolarHBondContact O-N 3.31Å; N684-F687 WeakPolarHBondContact OD1-CB 3.38Å; N684-F687 PolarHBondContact OD1-N 2.86Å; F687-E690 PolarHBondContact O-N 3.07Å; F687-V691 HydrophobicContact CD1-CG2 4.38Å; F687-V691 HydrophobicContact CD2-CG2 4.49Å; F687-V691 HydrophobicContact CE1-CG2 4.06Å; F687-V691 HydrophobicContact CE2-CG2 4.18Å; F687-V691 HydrophobicContact CZ-CG2 3.95Å; F687-V691 WeakPolarHBondContact O-CG2 3.19Å; F687-V691 PolarHBondContact O-N 3.22Å
688	S	65.1	Low	69.4	Low	12 Å²	12	60.3 Å²	60.3	8%	0.084	30%	0.297	C	S	.	.	H	α-helix	trans	-62.6	-43.1	177	-61.6	0	0	0	0	111.2	H679 N684 E690 V691 L692	H679-S688 PolarHBondContact ND1-OG 3.27Å; N684-S688 WeakPolarHBondContact O-CB 3.41Å; N684-S688 PolarHBondContact O-N 3.31Å; N684-S688 PolarHBondContact O-OG 2.84Å; S688-E690 PolarHBondContact O-N 3.37Å; S688-V691 PolarHBondContact O-N 3.33Å; S688-L692 WeakPolarHBondContact O-CB 3.25Å; S688-L692 WeakPolarHBondContact O-CD1 3.15Å; S688-L692 WeakPolarHBondContact O-CG 3.31Å; S688-L692 PolarHBondContact O-N 2.82Å
689	A	65.2	Low	69.7	Low	59 Å²	59	62.3 Å²	62.3	49%	0.488	31%	0.308	S	S	.	.	H	α-helix	trans	-61.7	-41.7	176.1	0	0	0	0	0	112.3	Q685 R686 S693	Q685-A689 WeakPolarHBondContact O-CB 2.92Å; Q685-A689 PolarHBondContact O-N 3.17Å; R686-A689 PolarHBondContact O-N 3.01Å; A689-S693 WeakPolarHBondContact O-CA 3.32Å; A689-S693 WeakPolarHBondContact O-CB 3.34Å; A689-S693 PolarHBondContact O-N 3.08Å; A689-S693 PolarHBondContact O-OG 3.46Å
690	E	64.2	Low	70	Confident	105 Å²	105	62 Å²	62	49%	0.491	31%	0.307	S	S	.	.	H	α-helix	trans	-65.3	-48.6	177.3	-76.9	176.4	-159.3	0	0	112.4	K656 R686 F687 S688 S693	K656-E690 IonicContact NZ-OE2 3.06Å; K656-E690 PolarHBondContact NZ-OE2 3.41Å; R686-E690 WeakPolarHBondContact O-CG 3.17Å; R686-E690 PolarHBondContact O-N 2.97Å; F687-E690 PolarHBondContact O-N 3.07Å; S688-E690 PolarHBondContact O-N 3.37Å; E690-S693 PolarHBondContact O-OG 2.97Å
691	V	61.1	Low	69.7	Low	22 Å²	22	62.5 Å²	62.5	13%	0.133	32%	0.315	C	S	.	.	H	α-helix	trans	-70.2	-37.9	-176.9	174.4	0	0	0	0	111.5	K656 L659 F687 S688 S694	K656-V691 HydrophobicContact CB-CG2 4.44Å; K656-V691 HydrophobicContact CD-CG2 4.44Å; K656-V691 HydrophobicContact CG-CG2 4.11Å; L659-V691 HydrophobicContact CB-CG1 4.23Å; L659-V691 HydrophobicContact CD1-CG1 3.8Å; F687-V691 HydrophobicContact CD1-CG2 4.38Å; F687-V691 HydrophobicContact CD2-CG2 4.49Å; F687-V691 HydrophobicContact CE1-CG2 4.06Å; F687-V691 HydrophobicContact CE2-CG2 4.18Å; F687-V691 HydrophobicContact CZ-CG2 3.95Å; F687-V691 WeakPolarHBondContact O-CG2 3.19Å; F687-V691 PolarHBondContact O-N 3.22Å; S688-V691 PolarHBondContact O-N 3.33Å; V691-S694 PolarHBondContact O-OG 2.92Å; V691-S694 VanDerWaalsContact O-OG 3.08Å
692	L	64.9	Low	68.9	Low	18 Å²	18	64.6 Å²	64.6	9%	0.094	34%	0.338	C	S	.	.	H	α-helix	trans	-88.7	-11.7	-177.5	-55.6	167.5	0	0	0	112.5	L676 S688 S694 L695 V716 L717	L676-L692 HydrophobicContact CD2-CD2 4.37Å; S688-L692 WeakPolarHBondContact O-CB 3.25Å; S688-L692 WeakPolarHBondContact O-CD1 3.15Å; S688-L692 WeakPolarHBondContact O-CG 3.31Å; S688-L692 PolarHBondContact O-N 2.82Å; L692-S694 PolarHBondContact O-N 3.44Å; L692-L695 HydrophobicContact CD2-CD1 4.08Å; L692-L695 WeakPolarHBondContact O-CB 3.32Å; L692-L695 PolarHBondContact O-N 3.11Å; L692-V716 HydrophobicContact CD1-CG1 3.22Å; L692-L717 HydrophobicContact CB-CD2 4.32Å; L692-L717 HydrophobicContact CD1-CD2 4.04Å; L692-L717 HydrophobicContact CD2-CD2 4.05Å; L692-L717 HydrophobicContact CG-CD2 4.36Å
693	S	66.7	Low	68.6	Low	56 Å²	56	64.8 Å²	64.8	39%	0.392	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.6	173.7	64.2	0	0	0	0	112.9	A689 E690 H722	A689-S693 WeakPolarHBondContact O-CA 3.32Å; A689-S693 WeakPolarHBondContact O-CB 3.34Å; A689-S693 PolarHBondContact O-N 3.08Å; A689-S693 PolarHBondContact O-OG 3.46Å; E690-S693 PolarHBondContact O-OG 2.97Å; S693-H722 PolarHBondContact O-CD2 2.83Å
694	S	66.4	Low	68.5	Low	85 Å²	85	66.3 Å²	66.3	59%	0.594	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-10.3	176.2	51	0	0	0	0	114.2	V691 L692 R696	V691-S694 PolarHBondContact O-OG 2.92Å; V691-S694 VanDerWaalsContact O-OG 3.08Å; L692-S694 PolarHBondContact O-N 3.44Å; S694-R696 PolarHBondContact O-N 2.99Å
695	L	72.4	Confident	68.6	Low	29 Å²	29	63.7 Å²	63.7	15%	0.152	33%	0.328	C	S	.	.			trans	-77	114	-176.8	-165.4	157.8	0	0	0	109.2	L672 L692 Q697 L698 L717 L724	L672-L695 HydrophobicContact CD1-CD1 4.48Å; L692-L695 HydrophobicContact CD2-CD1 4.08Å; L692-L695 WeakPolarHBondContact O-CB 3.32Å; L692-L695 PolarHBondContact O-N 3.11Å; L695-Q697 WeakPolarHBondContact CD2-O 3.28Å; L695-L698 HydrophobicContact CD2-CB 4.42Å; L695-L717 HydrophobicContact CD1-CD2 4.48Å; L695-L724 HydrophobicContact CD2-CD2 3.56Å; L695-L724 WeakPolarHBondContact O-CD2 3.32Å
696	R	75.8	Confident	68.5	Low	158 Å²	158	58.4 Å²	58.4	60%	0.596	31%	0.306	S	S	*	.			trans	-106	-22.2	177.2	-62.8	-163.3	178.6	-148.4	1.6	113.5	S694 L724 D725 E726	S694-R696 PolarHBondContact O-N 2.99Å; R696-L724 CarbonylContact O-C 3.53Å; R696-L724 WeakPolarHBondContact O-CA 3.37Å; R696-D725 HydrophobicContact CB-CB 4.46Å; R696-D725 VanDerWaalsContact CD-OD2 3.25Å; R696-D725 WeakPolarHBondContact CD-OD2 3.44Å; R696-D725 IonicContact NH1-OD2 3.25Å; R696-D725 PolarHBondContact O-N 2.75Å; R696-E726 PolarHBondContact O-N 2.82Å
697	Q	77.3	Confident	68.4	Low	119 Å²	119	51.5 Å²	51.5	56%	0.556	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.2	179.7	-65	-176.5	-45.4	0	0	110.1	L695 E726	L695-Q697 WeakPolarHBondContact CD2-O 3.28Å; Q697-E726 CarbonylContact C-O 3.43Å; Q697-E726 WeakPolarHBondContact CA-O 3.38Å; Q697-E726 HydrophobicContact CG-CB 4.16Å; Q697-E726 PolarHBondContact NE2-OE2 3.15Å
698	L	83	Confident	68.4	Low	2 Å²	2	53.1 Å²	53.1	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	108.5	172.6	175.1	63.6	0	0	0	107.9	L672 L676 L695 L700 V713 L717 E726 V727 N728 V745	L672-L698 HydrophobicContact CD2-CD1 3.84Å; L676-L698 HydrophobicContact CD1-CD1 4.28Å; L695-L698 HydrophobicContact CD2-CB 4.42Å; L698-L700 HydrophobicContact CD1-CD1 3.9Å; L698-L700 HydrophobicContact CD1-CD2 4.33Å; L698-L700 HydrophobicContact CD1-CG 3.82Å; L698-L700 HydrophobicContact CG-CD1 4.35Å; L698-L700 HydrophobicContact CG-CG 4.29Å; L698-V713 HydrophobicContact CD2-CG1 4.17Å; L698-L717 HydrophobicContact CD1-CD1 3.82Å; L698-L717 HydrophobicContact CD2-CD1 3.71Å; L698-L717 HydrophobicContact CG-CD1 4.3Å; L698-E726 PolarHBondContact N-O 3.31Å; L698-V727 HydrophobicContact CB-CG2 4.27Å; L698-V727 HydrophobicContact CD2-CG1 4.08Å; L698-V727 HydrophobicContact CD2-CG2 4.49Å; L698-V727 CarbonylContact O-C 3.51Å; L698-V727 WeakPolarHBondContact O-CA 3.29Å; L698-N728 PolarHBondContact O-N 2.97Å; L698-V745 HydrophobicContact CD2-CG1 4.05Å
699	N	76.3	Confident	68.6	Low	60 Å²	60	54.9 Å²	54.9	32%	0.321	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	108	174.9	-174.3	8.2	0	0	0	109.7	A701 N728	N699-A701 WeakPolarHBondContact OD1-CB 3.42Å; N699-A701 PolarHBondContact OD1-N 3.13Å; N699-N728 PolarHBondContact OD1-ND2 3.33Å
700	L	76.1	Confident	69.2	Low	0 Å²	0	52 Å²	52	0%	0	28%	0.283	C	S	.	.			trans	-118.1	20.6	175.5	-60.6	174.6	0	0	0	111.7	P669 L672 L673 L698 G702 V703 M705 V713 N728 L729 C732	P669-L700 WeakPolarHBondContact O-CD2 3.32Å; L672-L700 HydrophobicContact CB-CD2 4.25Å; L672-L700 HydrophobicContact CD2-CD2 3.96Å; L672-L700 HydrophobicContact CG-CD2 4.08Å; L673-L700 HydrophobicContact CB-CD2 4.32Å; L698-L700 HydrophobicContact CD1-CD1 3.9Å; L698-L700 HydrophobicContact CD1-CD2 4.33Å; L698-L700 HydrophobicContact CD1-CG 3.82Å; L698-L700 HydrophobicContact CG-CD1 4.35Å; L698-L700 HydrophobicContact CG-CG 4.29Å; L700-G702 PolarHBondContact O-N 3.05Å; L700-V703 VanDerWaalsContact O-CB 3.3Å; L700-V703 WeakPolarHBondContact O-CB 3.41Å; L700-V703 WeakPolarHBondContact O-CG2 2.87Å; L700-V703 PolarHBondContact O-N 3.27Å; L700-V703 VanDerWaalsContact O-N 3.08Å; L700-M705 HydrophobicContact CD1-SD 4.27Å; L700-V713 HydrophobicContact CD1-CG2 3.96Å; L700-N728 PolarHBondContact N-O 3.33Å; L700-L729 HydrophobicContact CB-CD2 3.77Å; L700-L729 HydrophobicContact CD1-CD2 3.99Å; L700-L729 HydrophobicContact CG-CD2 4.27Å; L700-C732 PolarHBondContact O-SG 3.11Å
701	A	69.4	Low	69.6	Low	30 Å²	30	47.9 Å²	47.9	25%	0.248	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	138	-176.3	0	0	0	0	0	112	N699 V703 A730	N699-A701 WeakPolarHBondContact OD1-CB 3.42Å; N699-A701 PolarHBondContact OD1-N 3.13Å; A701-V703 PolarHBondContact O-N 3.15Å; A701-A730 CarbonylContact C-O 3.54Å; A701-A730 WeakPolarHBondContact CA-O 3.5Å; A701-A730 HydrophobicContact CB-CB 4.23Å
702	G	54.3	Low	70.3	Confident	49 Å²	49	47 Å²	47	51%	0.505	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	-8.7	-177.4	0	0	0	0	0	115.1	L700 A730 S731	L700-G702 PolarHBondContact O-N 3.05Å; G702-A730 PolarHBondContact N-O 3.28Å; G702-S731 WeakPolarHBondContact CA-O 3.49Å
703	V	64.2	Low	71.2	Confident	18 Å²	18	46.1 Å²	46.1	11%	0.109	26%	0.255	C	S	.	.			trans	-83.1	121.7	177.4	-178.4	0	0	0	0	109.8	P669 L673 L700 A701 M705 K709 C732	P669-V703 HydrophobicContact CB-CG2 3.42Å; P669-V703 VanDerWaalsContact CB-CG2 3.42Å; L673-V703 HydrophobicContact CD2-CG1 3.72Å; L700-V703 VanDerWaalsContact O-CB 3.3Å; L700-V703 WeakPolarHBondContact O-CB 3.41Å; L700-V703 WeakPolarHBondContact O-CG2 2.87Å; L700-V703 PolarHBondContact O-N 3.27Å; L700-V703 VanDerWaalsContact O-N 3.08Å; A701-V703 PolarHBondContact O-N 3.15Å; V703-M705 PolarHBondContact O-N 3.07Å; V703-M705 VanDerWaalsContact O-N 3.08Å; V703-K709 HydrophobicContact CG1-CD 4.49Å; V703-C732 VanDerWaalsContact O-CA 3.28Å; V703-C732 WeakPolarHBondContact O-CA 3.44Å; V703-C732 WeakPolarHBondContact O-CB 3.33Å; V703-C732 PolarHBondContact O-SG 3.16Å
704	R	68.6	Low	72.1	Confident	120 Å²	120	44.4 Å²	44.4	45%	0.453	24%	0.242	S	C	.	.			trans	-60	113.8	172.3	-179	173.4	-177.3	173	-1.7	110.4	E308 T706 K709 C732 Q733	E308-R704 IonicContact OE1-NH1 2.84Å; E308-R704 IonicContact OE1-NH2 3.69Å; R704-T706 HydrophobicContact CG-CG2 4.5Å; R704-T706 PolarHBondContact O-N 3.33Å; R704-K709 WeakPolarHBondContact O-CD 3.36Å; R704-K709 PolarHBondContact O-NZ 2.84Å; R704-C732 WeakPolarHBondContact CA-O 3.36Å; R704-Q733 VanDerWaalsContact CG-OE1 3.25Å
705	M	70	Confident	72.6	Confident	7 Å²	7	43 Å²	43	3%	0.034	23%	0.232	C	C	.	.			trans	-90.8	91.9	-177	-72.9	-59.9	-69.4	0	0	111.1	L700 V703 K709 V713 C732 L734 L742	L700-M705 HydrophobicContact CD1-SD 4.27Å; V703-M705 PolarHBondContact O-N 3.07Å; V703-M705 VanDerWaalsContact O-N 3.08Å; M705-K709 HydrophobicContact CE-CB 4.17Å; M705-K709 HydrophobicContact SD-CB 4.17Å; M705-V713 HydrophobicContact CE-CG2 4.03Å; M705-C732 HydrophobicContact CB-CB 4.19Å; M705-C732 HydrophobicContact CG-CB 3.61Å; M705-C732 PolarHBondContact N-O 2.87Å; M705-L734 HydrophobicContact CB-CD1 3.78Å; M705-L734 HydrophobicContact CG-CD1 4.44Å; M705-L742 HydrophobicContact CE-CD1 4.19Å
706	T	66.3	Low	72.9	Confident	50 Å²	50	42.1 Å²	42.1	31%	0.307	23%	0.229	S	C	.	.			trans	-76.9	162.4	173.2	65.5	0	0	0	0	111.4	R704 V708 K709 C710	R704-T706 HydrophobicContact CG-CG2 4.5Å; R704-T706 PolarHBondContact O-N 3.33Å; T706-V708 PolarHBondContact O-N 3.36Å; T706-V708 VanDerWaalsContact O-N 3.11Å; T706-K709 WeakPolarHBondContact O-CB 3.43Å; T706-K709 PolarHBondContact O-N 2.91Å; T706-K709 WeakPolarHBondContact OG1-CG 3.45Å; T706-K709 PolarHBondContact OG1-N 3.47Å; T706-C710 PolarHBondContact O-N 3.14Å; T706-C710 PolarHBondContact O-SG 3.26Å
707	P	64.9	Low	73.3	Confident	63 Å²	63	34.7 Å²	34.7	41%	0.409	20%	0.201	S	C	.	.	H	α-helix	trans	-52.5	-36.6	177	-29.9	36.6	0	0	0	113.9	A363 T711	A363-P707 HydrophobicContact CB-CB 3.98Å; P707-T711 WeakPolarHBondContact O-CB 3.13Å; P707-T711 PolarHBondContact O-N 2.82Å; P707-T711 PolarHBondContact O-OG1 3.44Å
708	V	64.4	Low	73.5	Confident	53 Å²	53	30 Å²	30	32%	0.321	19%	0.185	S	C	.	.	H	α-helix	trans	-65	-48.2	175.7	179.2	0	0	0	0	110.9	A363 F677 T706 C710 T711 V712	A363-V708 HydrophobicContact CB-CG2 4.11Å; F677-V708 HydrophobicContact CE1-CG1 4.01Å; F677-V708 HydrophobicContact CZ-CG1 4.09Å; T706-V708 PolarHBondContact O-N 3.36Å; T706-V708 VanDerWaalsContact O-N 3.11Å; V708-C710 PolarHBondContact O-N 3.35Å; V708-T711 PolarHBondContact O-N 3.36Å; V708-T711 VanDerWaalsContact O-N 3.17Å; V708-V712 WeakPolarHBondContact O-CG2 3.46Å; V708-V712 PolarHBondContact O-N 2.86Å
709	K	69.9	Low	72.9	Confident	49 Å²	49	34.2 Å²	34.2	21%	0.213	21%	0.214	C	C	.	.	H	α-helix	trans	-61.4	-44.1	177.9	-67.3	177.2	174.7	-168.9	0	111.3	L673 F677 V703 R704 M705 T706 T711 V712 V713	L673-K709 HydrophobicContact CD1-CB 4.41Å; L673-K709 HydrophobicContact CD1-CG 4.43Å; L673-K709 HydrophobicContact CD2-CD 3.52Å; L673-K709 VanDerWaalsContact CD2-CE 3.47Å; L673-K709 HydrophobicContact CD2-CG 3.91Å; F677-K709 HydrophobicContact CE2-CG 3.88Å; F677-K709 HydrophobicContact CZ-CG 3.93Å; V703-K709 HydrophobicContact CG1-CD 4.49Å; R704-K709 WeakPolarHBondContact O-CD 3.36Å; R704-K709 PolarHBondContact O-NZ 2.84Å; M705-K709 HydrophobicContact CE-CB 4.17Å; M705-K709 HydrophobicContact SD-CB 4.17Å; T706-K709 WeakPolarHBondContact O-CB 3.43Å; T706-K709 PolarHBondContact O-N 2.91Å; T706-K709 WeakPolarHBondContact OG1-CG 3.45Å; T706-K709 PolarHBondContact OG1-N 3.47Å; K709-T711 VanDerWaalsContact C-N 3.3Å; K709-T711 PolarHBondContact O-N 3.42Å; K709-V712 PolarHBondContact O-N 2.92Å; K709-V713 WeakPolarHBondContact O-CB 3.17Å; K709-V713 VanDerWaalsContact O-CG2 3.24Å; K709-V713 WeakPolarHBondContact O-CG2 3.34Å; K709-V713 PolarHBondContact O-N 2.87Å
710	C	77.5	Confident	72.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.9	-43.2	174.5	-66.7	0	0	0	0	111.9	T706 V708 S714 T741 L742	T706-C710 PolarHBondContact O-N 3.14Å; T706-C710 PolarHBondContact O-SG 3.26Å; V708-C710 PolarHBondContact O-N 3.35Å; C710-S714 WeakPolarHBondContact O-CB 3.45Å; C710-S714 PolarHBondContact O-N 2.9Å; C710-T741 HydrophobicContact CB-CG2 3.88Å; C710-L742 HydrophobicContact CB-CD1 4.43Å; C710-L742 HydrophobicContact CB-CD2 4.33Å; C710-L742 HydrophobicContact CB-CG 4.09Å; C710-L742 WeakPolarHBondContact O-CD2 3.08Å
711	T	72.9	Confident	72.2	Confident	18 Å²	18	44.9 Å²	44.9	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-41.8	179.8	-57.7	0	0	0	0	112.1	Q360 P707 V708 K709 S714 S715	Q360-T711 HydrophobicContact CG-CG2 3.45Å; Q360-T711 VanDerWaalsContact CG-CG2 3.45Å; P707-T711 WeakPolarHBondContact O-CB 3.13Å; P707-T711 PolarHBondContact O-N 2.82Å; P707-T711 PolarHBondContact O-OG1 3.44Å; V708-T711 PolarHBondContact O-N 3.36Å; V708-T711 VanDerWaalsContact O-N 3.17Å; K709-T711 VanDerWaalsContact C-N 3.3Å; K709-T711 PolarHBondContact O-N 3.42Å; T711-S714 PolarHBondContact O-N 2.83Å; T711-S715 VanDerWaalsContact O-CB 3.25Å; T711-S715 WeakPolarHBondContact O-CB 3.34Å; T711-S715 PolarHBondContact O-N 3.31Å
712	V	74.6	Confident	72.6	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-52.5	175.1	165.2	0	0	0	0	110.4	L676 F677 Y680 V708 K709 S714 S715 V716	L676-V712 HydrophobicContact CB-CG1 4.1Å; F677-V712 HydrophobicContact CD1-CG1 4.47Å; F677-V712 HydrophobicContact CD1-CG2 3.96Å; F677-V712 HydrophobicContact CD2-CG1 4.01Å; F677-V712 HydrophobicContact CE1-CG2 3.7Å; F677-V712 HydrophobicContact CE2-CB 4.42Å; F677-V712 HydrophobicContact CE2-CG1 4.26Å; F677-V712 HydrophobicContact CE2-CG2 4.36Å; F677-V712 HydrophobicContact CG-CG1 4.12Å; F677-V712 HydrophobicContact CG-CG2 4.42Å; F677-V712 HydrophobicContact CZ-CB 4.4Å; F677-V712 HydrophobicContact CZ-CG2 3.91Å; Y680-V712 HydrophobicContact CD1-CG2 3.81Å; Y680-V712 HydrophobicContact CD2-CG2 4.28Å; Y680-V712 HydrophobicContact CE1-CG2 4.19Å; Y680-V712 HydrophobicContact CG-CB 4.41Å; Y680-V712 HydrophobicContact CG-CG1 4.32Å; Y680-V712 HydrophobicContact CG-CG2 3.85Å; V708-V712 WeakPolarHBondContact O-CG2 3.46Å; V708-V712 PolarHBondContact O-N 2.86Å; K709-V712 PolarHBondContact O-N 2.92Å; V712-S714 VanDerWaalsContact C-N 3.32Å; V712-S714 PolarHBondContact O-N 3.4Å; V712-S715 PolarHBondContact O-N 3.12Å; V712-V716 WeakPolarHBondContact O-CB 3.47Å; V712-V716 VanDerWaalsContact O-CG2 3.25Å; V712-V716 WeakPolarHBondContact O-CG2 3.35Å; V712-V716 PolarHBondContact O-N 3.27Å
713	V	83.9	Confident	74.1	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-58.2	-46	178.7	172.5	0	0	0	0	110.5	L673 L676 L698 L700 M705 K709 V716 L717 L742 V745	L673-V713 HydrophobicContact CD1-CG2 4.14Å; L676-V713 HydrophobicContact CD1-CG2 3.86Å; L698-V713 HydrophobicContact CD2-CG1 4.17Å; L700-V713 HydrophobicContact CD1-CG2 3.96Å; M705-V713 HydrophobicContact CE-CG2 4.03Å; K709-V713 WeakPolarHBondContact O-CB 3.17Å; K709-V713 VanDerWaalsContact O-CG2 3.24Å; K709-V713 WeakPolarHBondContact O-CG2 3.34Å; K709-V713 PolarHBondContact O-N 2.87Å; V713-V716 PolarHBondContact O-N 3.12Å; V713-L717 HydrophobicContact CG1-CD1 4.3Å; V713-L717 WeakPolarHBondContact O-CA 3.33Å; V713-L717 WeakPolarHBondContact O-CB 3.45Å; V713-L717 PolarHBondContact O-N 3.32Å; V713-L742 HydrophobicContact CB-CD2 3.85Å; V713-L742 HydrophobicContact CG1-CD2 3.61Å; V713-V745 HydrophobicContact CG1-CG2 4.29Å
714	S	85.1	Confident	75.2	Confident	19 Å²	19	46.2 Å²	46.2	13%	0.133	25%	0.254	C	S	.	.	H	α-helix	trans	-65.2	-41.4	178	-171.3	0	0	0	0	113.2	C710 T711 V712 V716 G718 T741	C710-S714 WeakPolarHBondContact O-CB 3.45Å; C710-S714 PolarHBondContact O-N 2.9Å; T711-S714 PolarHBondContact O-N 2.83Å; V712-S714 VanDerWaalsContact C-N 3.32Å; V712-S714 PolarHBondContact O-N 3.4Å; S714-V716 VanDerWaalsContact C-N 3.33Å; S714-V716 PolarHBondContact O-N 3.42Å; S714-G718 WeakPolarHBondContact O-CA 3.49Å; S714-G718 PolarHBondContact O-N 3.32Å; S714-T741 WeakPolarHBondContact CB-O 3.34Å; S714-T741 PolarHBondContact OG-O 2.82Å
715	S	78.8	Confident	75.9	Confident	55 Å²	55	43.2 Å²	43.2	39%	0.385	25%	0.247	S	C	.	.	H	α-helix	trans	-67.1	-35.7	178.5	-177.9	0	0	0	0	112.5	T711 V712	T711-S715 VanDerWaalsContact O-CB 3.25Å; T711-S715 WeakPolarHBondContact O-CB 3.34Å; T711-S715 PolarHBondContact O-N 3.31Å; V712-S715 PolarHBondContact O-N 3.12Å
716	V	78.8	Confident	76.5	Confident	12 Å²	12	45 Å²	45	7%	0.073	26%	0.255	C	S	.	.	H	α-helix	trans	-87.6	-40.7	-173.5	174.6	0	0	0	0	111.3	L676 H679 Y680 L692 V712 V713 S714	L676-V716 HydrophobicContact CD2-CB 4.42Å; L676-V716 HydrophobicContact CD2-CG1 3.7Å; H679-V716 HydrophobicContact CB-CG1 3.92Å; H679-V716 HydrophobicContact CB-CG2 4.25Å; Y680-V716 HydrophobicContact CD2-CG2 4.43Å; L692-V716 HydrophobicContact CD1-CG1 3.22Å; V712-V716 WeakPolarHBondContact O-CB 3.47Å; V712-V716 VanDerWaalsContact O-CG2 3.25Å; V712-V716 WeakPolarHBondContact O-CG2 3.35Å; V712-V716 PolarHBondContact O-N 3.27Å; V713-V716 PolarHBondContact O-N 3.12Å; S714-V716 VanDerWaalsContact C-N 3.33Å; S714-V716 PolarHBondContact O-N 3.42Å
717	L	83.1	Confident	77.5	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-107.8	-0.9	-176.7	-59.8	176.9	0	0	0	113.5	L676 L692 L695 L698 V713 S719 V745 R748	L676-L717 HydrophobicContact CD1-CD1 4.11Å; L676-L717 HydrophobicContact CD2-CD1 3.98Å; L676-L717 HydrophobicContact CD2-CD2 4.25Å; L676-L717 HydrophobicContact CD2-CG 4.02Å; L692-L717 HydrophobicContact CB-CD2 4.32Å; L692-L717 HydrophobicContact CD1-CD2 4.04Å; L692-L717 HydrophobicContact CD2-CD2 4.05Å; L692-L717 HydrophobicContact CG-CD2 4.36Å; L695-L717 HydrophobicContact CD1-CD2 4.48Å; L698-L717 HydrophobicContact CD1-CD1 3.82Å; L698-L717 HydrophobicContact CD2-CD1 3.71Å; L698-L717 HydrophobicContact CG-CD1 4.3Å; V713-L717 HydrophobicContact CG1-CD1 4.3Å; V713-L717 WeakPolarHBondContact O-CA 3.33Å; V713-L717 WeakPolarHBondContact O-CB 3.45Å; V713-L717 PolarHBondContact O-N 3.32Å; L717-S719 VanDerWaalsContact C-N 3.28Å; L717-S719 PolarHBondContact O-N 3.43Å; L717-V745 HydrophobicContact CB-CG1 4.37Å; L717-V745 HydrophobicContact CB-CG2 4.08Å; L717-R748 WeakPolarHBondContact O-CD 3.45Å; L717-R748 PolarHBondContact O-NH1 2.81Å
718	G	81	Confident	78.2	Confident	22 Å²	22	41 Å²	41	23%	0.227	23%	0.229	C	C	.	.	S	Bend	trans	-72.5	-22.7	176.8	0	0	0	0	0	113.3	S714	S714-G718 WeakPolarHBondContact O-CA 3.49Å; S714-G718 PolarHBondContact O-N 3.32Å
719	S	70.5	Confident	79	Confident	89 Å²	89	38.6 Å²	38.6	62%	0.622	21%	0.214	S	C	*	.	S	Bend	trans	-119.9	112.4	177.8	61.6	0	0	0	0	110.9	L717	L717-S719 VanDerWaalsContact C-N 3.28Å; L717-S719 PolarHBondContact O-N 3.43Å
720	G	69.5	Low	79.1	Confident	43 Å²	43	37 Å²	37	44%	0.443	21%	0.209	S	C	.	.			trans	-164.2	151.5	176	0	0	0	0	0	112.2	H722 R748	G720-H722 VanDerWaalsContact C-N 3.34Å; G720-R748 VanDerWaalsContact CA-CZ 3.5Å
721	R	68.9	Low	78.8	Confident	241 Å²	241	37.6 Å²	37.6	91%	0.909	21%	0.214	S	C	*	.	S	Bend	trans	-77	-19.6	-173.2	-64.5	-173.3	-173.8	-156.6	1.2	114.1
722	H	78.3	Confident	78.7	Confident	101 Å²	101	36.8 Å²	36.8	47%	0.468	21%	0.209	S	C	.	.	S	Bend	trans	-112.9	145.9	-174.4	-57.7	-63	0	0	0	110.7	S693 G720 R748	S693-H722 PolarHBondContact O-CD2 2.83Å; G720-H722 VanDerWaalsContact C-N 3.34Å; H722-R748 PolarHBondContact O-NE 3.41Å; H722-R748 PolarHBondContact O-NH2 2.83Å
723	A	84.4	Confident	78.6	Confident	24 Å²	24	40.1 Å²	40.1	20%	0.198	22%	0.224	C	C	.	.			trans	-64.9	150.6	168.6	0	0	0	0	0	110.3	R748 R750	A723-R748 CarbonylContact C-O 3.56Å; A723-R748 WeakPolarHBondContact CA-O 3.49Å; A723-R750 HydrophobicContact CB-CG 4.37Å
724	L	87.1	Confident	78.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-87.4	118.5	166.3	-63.5	174.3	0	0	0	107.3	L695 R696 E726 V727 V745 R748 A749 R750	L695-L724 HydrophobicContact CD2-CD2 3.56Å; L695-L724 WeakPolarHBondContact O-CD2 3.32Å; R696-L724 CarbonylContact O-C 3.53Å; R696-L724 WeakPolarHBondContact O-CA 3.37Å; L724-E726 PolarHBondContact O-N 3.25Å; L724-V727 HydrophobicContact CB-CG2 3.89Å; L724-V727 HydrophobicContact CD1-CG2 3.58Å; L724-V727 HydrophobicContact CG-CG2 4.37Å; L724-V745 HydrophobicContact CD1-CG1 4Å; L724-R748 HydrophobicContact CD1-CB 4.42Å; L724-R748 HydrophobicContact CG-CB 4.37Å; L724-R748 PolarHBondContact N-O 3.36Å; L724-A749 CarbonylContact O-C 3.57Å; L724-A749 WeakPolarHBondContact O-CA 3.4Å; L724-R750 PolarHBondContact O-N 3.05Å
725	D	84.1	Confident	78	Confident	56 Å²	56	42.5 Å²	42.5	30%	0.299	24%	0.236	S	C	.	.	S	Bend	trans	-60.6	-36.4	176.3	-67.3	-26.5	0	0	0	110.6	R696 K751	R696-D725 HydrophobicContact CB-CB 4.46Å; R696-D725 VanDerWaalsContact CD-OD2 3.25Å; R696-D725 WeakPolarHBondContact CD-OD2 3.44Å; R696-D725 IonicContact NH1-OD2 3.25Å; R696-D725 PolarHBondContact O-N 2.75Å; D725-K751 WeakPolarHBondContact O-CB 3.49Å; D725-K751 WeakPolarHBondContact O-CG 3.2Å; D725-K751 PolarHBondContact O-N 3.13Å
726	E	81.6	Confident	78.3	Confident	44 Å²	44	42 Å²	42	21%	0.206	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	135.7	177	-173.3	160.5	-152.5	0	0	112.8	R696 Q697 L698 L724 K751 R782	R696-E726 PolarHBondContact O-N 2.82Å; Q697-E726 CarbonylContact C-O 3.43Å; Q697-E726 WeakPolarHBondContact CA-O 3.38Å; Q697-E726 HydrophobicContact CG-CB 4.16Å; Q697-E726 PolarHBondContact NE2-OE2 3.15Å; L698-E726 PolarHBondContact N-O 3.31Å; L724-E726 PolarHBondContact O-N 3.25Å; E726-K751 CarbonylContact C-O 3.55Å; E726-K751 WeakPolarHBondContact CA-O 3.5Å; E726-K751 HydrophobicContact CB-CB 4.33Å; E726-K751 HydrophobicContact CG-CB 4.22Å; E726-R782 IonicContact OE1-NH1 3.66Å; E726-R782 PolarHBondContact OE1-NH1 3.31Å
727	V	88	Confident	78.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	111.8	169.2	175.1	0	0	0	0	107.6	L698 L724 L729 V745 A749 K751 L752 G753	L698-V727 HydrophobicContact CB-CG2 4.27Å; L698-V727 HydrophobicContact CD2-CG1 4.08Å; L698-V727 HydrophobicContact CD2-CG2 4.49Å; L698-V727 CarbonylContact O-C 3.51Å; L698-V727 WeakPolarHBondContact O-CA 3.29Å; L724-V727 HydrophobicContact CB-CG2 3.89Å; L724-V727 HydrophobicContact CD1-CG2 3.58Å; L724-V727 HydrophobicContact CG-CG2 4.37Å; V727-L729 HydrophobicContact CG1-CD1 4.45Å; V727-L729 HydrophobicContact CG1-CG 4.13Å; V727-V745 HydrophobicContact CG2-CG1 4.49Å; V727-A749 HydrophobicContact CB-CB 4.04Å; V727-A749 HydrophobicContact CG2-CB 3.65Å; V727-K751 PolarHBondContact N-O 3.43Å; V727-L752 HydrophobicContact CB-CD1 4.01Å; V727-L752 HydrophobicContact CG1-CD1 3.85Å; V727-L752 WeakPolarHBondContact O-CA 3.14Å; V727-G753 PolarHBondContact O-N 2.83Å
728	N	80.3	Confident	78.2	Confident	31 Å²	31	43.3 Å²	43.3	17%	0.166	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	111.2	179.6	-176.6	12.3	0	0	0	110.3	L698 N699 L700 A730	L698-N728 PolarHBondContact O-N 2.97Å; N699-N728 PolarHBondContact OD1-ND2 3.33Å; L700-N728 PolarHBondContact N-O 3.33Å; N728-A730 VanDerWaalsContact OD1-CB 3.31Å; N728-A730 WeakPolarHBondContact OD1-CB 2.87Å; N728-A730 PolarHBondContact OD1-N 3.2Å; N728-A730 VanDerWaalsContact OD1-N 3.09Å
729	L	81.5	Confident	78.6	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	23%	0.233	C	C	.	.			trans	-120.5	37.6	174.8	-53.4	179.4	0	0	0	110.4	L700 V727 C732 L734 L742 F746 G753 L754 N757	L700-L729 HydrophobicContact CB-CD2 3.77Å; L700-L729 HydrophobicContact CD1-CD2 3.99Å; L700-L729 HydrophobicContact CG-CD2 4.27Å; V727-L729 HydrophobicContact CG1-CD1 4.45Å; V727-L729 HydrophobicContact CG1-CG 4.13Å; L729-C732 HydrophobicContact CB-CB 4.38Å; L729-C732 WeakPolarHBondContact O-CB 3.47Å; L729-C732 PolarHBondContact O-SG 2.72Å; L729-C732 VanDerWaalsContact O-SG 3.37Å; L729-L734 HydrophobicContact CD1-CD2 4.26Å; L729-L742 HydrophobicContact CD1-CD1 3.68Å; L729-F746 HydrophobicContact CD1-CE1 3.69Å; L729-F746 HydrophobicContact CD1-CZ 4.05Å; L729-G753 PolarHBondContact N-O 2.84Å; L729-L754 HydrophobicContact CB-CD2 4.13Å; L729-L754 HydrophobicContact CD1-CD2 4.22Å; L729-N757 PolarHBondContact O-ND2 3.28Å
730	A	71.3	Confident	79.5	Confident	14 Å²	14	44.6 Å²	44.6	12%	0.116	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	141.9	177.3	0	0	0	0	0	111.6	A701 G702 N728 C732 Q755	A701-A730 CarbonylContact C-O 3.54Å; A701-A730 WeakPolarHBondContact CA-O 3.5Å; A701-A730 HydrophobicContact CB-CB 4.23Å; G702-A730 PolarHBondContact N-O 3.28Å; N728-A730 VanDerWaalsContact OD1-CB 3.31Å; N728-A730 WeakPolarHBondContact OD1-CB 2.87Å; N728-A730 PolarHBondContact OD1-N 3.2Å; N728-A730 VanDerWaalsContact OD1-N 3.09Å; A730-C732 VanDerWaalsContact C-N 3.29Å; A730-C732 PolarHBondContact O-N 3.48Å; A730-Q755 CarbonylContact C-O 3.48Å; A730-Q755 WeakPolarHBondContact CA-O 3.49Å; A730-Q755 HydrophobicContact CB-CB 4.19Å
731	S	70.7	Confident	80.2	Confident	14 Å²	14	43.9 Å²	43.9	10%	0.098	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	38.8	178	-172.2	0	0	0	0	113.8	G702 Q755 L756	G702-S731 WeakPolarHBondContact CA-O 3.49Å; S731-Q755 PolarHBondContact N-O 2.77Å; S731-L756 VanDerWaalsContact CA-O 3.29Å; S731-L756 WeakPolarHBondContact CA-O 3.37Å
732	C	70.9	Confident	81.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-99.5	-1.3	-176	-78.9	0	0	0	0	114.4	L700 V703 R704 M705 L729 A730 L734 N757	L700-C732 PolarHBondContact O-SG 3.11Å; V703-C732 VanDerWaalsContact O-CA 3.28Å; V703-C732 WeakPolarHBondContact O-CA 3.44Å; V703-C732 WeakPolarHBondContact O-CB 3.33Å; V703-C732 PolarHBondContact O-SG 3.16Å; R704-C732 WeakPolarHBondContact CA-O 3.36Å; M705-C732 HydrophobicContact CB-CB 4.19Å; M705-C732 HydrophobicContact CG-CB 3.61Å; M705-C732 PolarHBondContact N-O 2.87Å; L729-C732 HydrophobicContact CB-CB 4.38Å; L729-C732 WeakPolarHBondContact O-CB 3.47Å; L729-C732 PolarHBondContact O-SG 2.72Å; L729-C732 VanDerWaalsContact O-SG 3.37Å; A730-C732 VanDerWaalsContact C-N 3.29Å; A730-C732 PolarHBondContact O-N 3.48Å; C732-L734 PolarHBondContact O-N 3.45Å; C732-N757 WeakPolarHBondContact CA-OD1 3.25Å; C732-N757 WeakPolarHBondContact CB-OD1 3.31Å; C732-N757 PolarHBondContact N-OD1 3.39Å
733	Q	73.3	Confident	82.2	Confident	72 Å²	72	29.4 Å²	29.4	34%	0.336	16%	0.159	S	C	.	.			trans	52.8	40.6	-172.3	-57.9	176.5	-16.2	0	0	112.1	R704 N757	R704-Q733 VanDerWaalsContact CG-OE1 3.25Å; Q733-N757 PolarHBondContact N-OD1 3.31Å; Q733-N757 VanDerWaalsContact N-OD1 3.07Å
734	L	78.8	Confident	82.6	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.016	17%	0.165	C	C	.	.			trans	-76.1	127.7	-176	-166.4	69	0	0	0	111.1	M705 L729 C732 L739 L742 F746 L754 N757 L759	M705-L734 HydrophobicContact CB-CD1 3.78Å; M705-L734 HydrophobicContact CG-CD1 4.44Å; L729-L734 HydrophobicContact CD1-CD2 4.26Å; C732-L734 PolarHBondContact O-N 3.45Å; L734-L739 HydrophobicContact CD2-CD2 3.59Å; L734-L739 HydrophobicContact CD2-CG 4.09Å; L734-L739 HydrophobicContact CG-CD2 4.49Å; L734-L739 HydrophobicContact CG-CG 4.49Å; L734-L742 HydrophobicContact CD1-CD1 3.85Å; L734-L742 HydrophobicContact CD2-CD1 4.2Å; L734-F746 HydrophobicContact CD2-CZ 4.25Å; L734-L754 HydrophobicContact CD2-CD2 4.02Å; L734-N757 HydrophobicContact CB-CB 4.21Å; L734-N757 WeakPolarHBondContact CB-OD1 3.49Å; L734-N757 PolarHBondContact N-OD1 2.91Å; L734-L759 WeakPolarHBondContact O-CD2 3.42Å
735	D	77.9	Confident	82.8	Confident	68 Å²	68	30.8 Å²	30.8	36%	0.364	17%	0.165	S	C	.	.			trans	-97.7	170.2	177.6	73	0.2	0	0	0	112.2	A737 G738 L739	D735-A737 VanDerWaalsContact C-N 3.25Å; D735-A737 PolarHBondContact O-N 3.22Å; D735-A737 PolarHBondContact OD1-N 3.28Å; D735-G738 WeakPolarHBondContact O-CA 3.29Å; D735-G738 PolarHBondContact O-N 3.19Å; D735-G738 VanDerWaalsContact O-N 3.08Å; D735-G738 WeakPolarHBondContact OD1-CA 3.46Å; D735-G738 PolarHBondContact OD1-N 3.03Å; D735-L739 PolarHBondContact O-N 2.87Å
736	P	84.3	Confident	83.4	Confident	43 Å²	43	28.2 Å²	28.2	28%	0.279	15%	0.152	S	C	.	.	H	α-helix	trans	-58.2	-33.4	178.6	-26.6	35.3	0	0	0	114.1	L739 R740 A763	P736-L739 PolarHBondContact O-N 3.44Å; P736-R740 PolarHBondContact O-N 3.43Å; P736-R740 VanDerWaalsContact O-N 3.09Å; P736-A763 HydrophobicContact CG-CB 4.23Å
737	A	78.3	Confident	84	Confident	41 Å²	41	27.2 Å²	27.2	34%	0.339	15%	0.147	S	C	.	.	H	α-helix	trans	-67.5	-38	176	0	0	0	0	0	111.8	D735 R740 T741	D735-A737 VanDerWaalsContact C-N 3.25Å; D735-A737 PolarHBondContact O-N 3.22Å; D735-A737 PolarHBondContact OD1-N 3.28Å; A737-R740 PolarHBondContact O-N 3.31Å; A737-T741 WeakPolarHBondContact O-CB 3.28Å; A737-T741 PolarHBondContact O-N 3.44Å; A737-T741 PolarHBondContact O-OG1 2.91Å
738	G	81.7	Confident	84.2	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-61.5	-44.1	171.6	0	0	0	0	0	111.7	D735 R740 T741 L742	D735-G738 WeakPolarHBondContact O-CA 3.29Å; D735-G738 PolarHBondContact O-N 3.19Å; D735-G738 VanDerWaalsContact O-N 3.08Å; D735-G738 WeakPolarHBondContact OD1-CA 3.46Å; D735-G738 PolarHBondContact OD1-N 3.03Å; G738-R740 PolarHBondContact O-N 2.96Å; G738-T741 PolarHBondContact O-N 2.89Å; G738-L742 WeakPolarHBondContact O-CB 3.25Å; G738-L742 WeakPolarHBondContact O-CG 3.34Å; G738-L742 PolarHBondContact O-N 3.02Å
739	L	89.6	Confident	84.8	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-57.8	-48.7	174.8	-73.9	175	0	0	0	111.9	L734 D735 P736 T741 L742 M743 F746 L754 L759 A763 D766 L767	L734-L739 HydrophobicContact CD2-CD2 3.59Å; L734-L739 HydrophobicContact CD2-CG 4.09Å; L734-L739 HydrophobicContact CG-CD2 4.49Å; L734-L739 HydrophobicContact CG-CG 4.49Å; D735-L739 PolarHBondContact O-N 2.87Å; P736-L739 PolarHBondContact O-N 3.44Å; L739-T741 VanDerWaalsContact C-N 3.31Å; L739-T741 PolarHBondContact O-N 3Å; L739-L742 PolarHBondContact O-N 3.25Å; L739-M743 PolarHBondContact O-N 3.27Å; L739-F746 HydrophobicContact CB-CE2 4.43Å; L739-F746 HydrophobicContact CD2-CE2 3.59Å; L739-F746 HydrophobicContact CD2-CZ 3.89Å; L739-L754 HydrophobicContact CD2-CD1 3.94Å; L739-L754 HydrophobicContact CD2-CD2 4.38Å; L739-L759 HydrophobicContact CD1-CD1 4.38Å; L739-L759 HydrophobicContact CD1-CD2 3.93Å; L739-A763 HydrophobicContact CD1-CB 3.78Å; L739-D766 HydrophobicContact CB-CB 4.35Å; L739-L767 HydrophobicContact CD1-CG 4.49Å
740	R	88.6	Confident	85.3	Confident	134 Å²	134	32.3 Å²	32.3	51%	0.506	16%	0.164	S	C	.	.	H	α-helix	trans	-59.6	-42.1	176	-73.3	-170.2	-74.9	-84.5	0.9	112.4	P736 A737 G738 L742 M743 D766	P736-R740 PolarHBondContact O-N 3.43Å; P736-R740 VanDerWaalsContact O-N 3.09Å; A737-R740 PolarHBondContact O-N 3.31Å; G738-R740 PolarHBondContact O-N 2.96Å; R740-L742 VanDerWaalsContact C-N 3.32Å; R740-L742 PolarHBondContact O-N 3.31Å; R740-M743 VanDerWaalsContact O-CB 3.31Å; R740-M743 WeakPolarHBondContact O-CB 3.44Å; R740-M743 PolarHBondContact O-N 3.21Å; R740-D766 VanDerWaalsContact CD-OD1 3.23Å; R740-D766 WeakPolarHBondContact CD-OD1 3.2Å; R740-D766 HydrophobicContact CG-CB 4.38Å; R740-D766 WeakPolarHBondContact CG-OD1 3.44Å; R740-D766 IonicContact CZ-OD1 2.88Å; R740-D766 IonicContact CZ-OD2 2.91Å; R740-D766 IonicContact NE-OD1 2.7Å; R740-D766 VanDerWaalsContact NH1-CG 3.29Å; R740-D766 IonicContact NH1-OD1 3.96Å; R740-D766 PolarHBondContact NH1-OD1 3.17Å; R740-D766 IonicContact NH1-OD2 3.81Å; R740-D766 PolarHBondContact NH1-OD2 2.97Å
741	T	84.1	Confident	86.2	Confident	29 Å²	29	35.8 Å²	35.8	18%	0.178	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-38.2	179.3	-57	0	0	0	0	111.4	C710 S714 A737 G738 L739 P744	C710-T741 HydrophobicContact CB-CG2 3.88Å; S714-T741 WeakPolarHBondContact CB-O 3.34Å; S714-T741 PolarHBondContact OG-O 2.82Å; A737-T741 WeakPolarHBondContact O-CB 3.28Å; A737-T741 PolarHBondContact O-N 3.44Å; A737-T741 PolarHBondContact O-OG1 2.91Å; G738-T741 PolarHBondContact O-N 2.89Å; L739-T741 VanDerWaalsContact C-N 3.31Å; L739-T741 PolarHBondContact O-N 3Å; T741-P744 WeakPolarHBondContact O-CD 3.37Å
742	L	94.3	Very high	87.3	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-86.2	-1.4	-178.4	-69.4	174	0	0	0	114.4	M705 C710 V713 L729 L734 G738 L739 R740 P744 V745 F746	M705-L742 HydrophobicContact CE-CD1 4.19Å; C710-L742 HydrophobicContact CB-CD1 4.43Å; C710-L742 HydrophobicContact CB-CD2 4.33Å; C710-L742 HydrophobicContact CB-CG 4.09Å; C710-L742 WeakPolarHBondContact O-CD2 3.08Å; V713-L742 HydrophobicContact CB-CD2 3.85Å; V713-L742 HydrophobicContact CG1-CD2 3.61Å; L729-L742 HydrophobicContact CD1-CD1 3.68Å; L734-L742 HydrophobicContact CD1-CD1 3.85Å; L734-L742 HydrophobicContact CD2-CD1 4.2Å; G738-L742 WeakPolarHBondContact O-CB 3.25Å; G738-L742 WeakPolarHBondContact O-CG 3.34Å; G738-L742 PolarHBondContact O-N 3.02Å; L739-L742 PolarHBondContact O-N 3.25Å; R740-L742 VanDerWaalsContact C-N 3.32Å; R740-L742 PolarHBondContact O-N 3.31Å; L742-P744 VanDerWaalsContact C-N 3.3Å; L742-P744 VanDerWaalsContact O-N 3.16Å; L742-V745 HydrophobicContact CD2-CG2 4.42Å; L742-V745 WeakPolarHBondContact O-CA 3.41Å; L742-V745 WeakPolarHBondContact O-CB 3.37Å; L742-V745 PolarHBondContact O-N 3.39Å; L742-F746 HydrophobicContact CB-CD1 4.47Å; L742-F746 HydrophobicContact CB-CD2 4.26Å; L742-F746 HydrophobicContact CB-CE1 3.86Å; L742-F746 HydrophobicContact CB-CE2 3.62Å; L742-F746 HydrophobicContact CB-CZ 3.4Å; L742-F746 HydrophobicContact CD1-CE1 4.33Å; L742-F746 HydrophobicContact CD1-CZ 3.91Å; L742-F746 HydrophobicContact CG-CZ 4.31Å; L742-F746 PolarHBondContact O-N 3.48Å
743	M	94.7	Very high	87.9	Confident	37 Å²	37	35.1 Å²	35.1	18%	0.182	17%	0.172	C	C	.	.	H	α-helix	trans	-44.9	-46.7	177	-173.3	69.4	74.5	0	0	113.4	L739 R740 V745 F746 L747 L770	L739-M743 PolarHBondContact O-N 3.27Å; R740-M743 VanDerWaalsContact O-CB 3.31Å; R740-M743 WeakPolarHBondContact O-CB 3.44Å; R740-M743 PolarHBondContact O-N 3.21Å; M743-V745 PolarHBondContact O-N 3.36Å; M743-F746 PolarHBondContact O-N 3.1Å; M743-L747 HydrophobicContact CG-CD1 4.25Å; M743-L747 WeakPolarHBondContact O-CG 3.11Å; M743-L747 PolarHBondContact O-N 3.38Å; M743-L770 HydrophobicContact CE-CB 3.97Å; M743-L770 HydrophobicContact SD-CB 3.69Å; M743-L770 HydrophobicContact SD-CD1 3.56Å; M743-L770 VanDerWaalsContact SD-CD1 3.56Å; M743-L770 HydrophobicContact SD-CG 4.18Å
744	P	92.8	Very high	88.5	Confident	52 Å²	52	31.7 Å²	31.7	34%	0.338	16%	0.156	S	C	.	.	H	α-helix	trans	-61.1	-28.9	178.5	-23.5	36.2	0	0	0	114.1	T741 L742	T741-P744 WeakPolarHBondContact O-CD 3.37Å; L742-P744 VanDerWaalsContact C-N 3.3Å; L742-P744 VanDerWaalsContact O-N 3.16Å
745	V	93.2	Very high	88.6	Confident	1 Å²	1	33 Å²	33	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-80.4	-39.9	178.2	-175.6	0	0	0	0	110.4	L698 V713 L717 L724 V727 L742 M743 L747 R748 A749	L698-V745 HydrophobicContact CD2-CG1 4.05Å; V713-V745 HydrophobicContact CG1-CG2 4.29Å; L717-V745 HydrophobicContact CB-CG1 4.37Å; L717-V745 HydrophobicContact CB-CG2 4.08Å; L724-V745 HydrophobicContact CD1-CG1 4Å; V727-V745 HydrophobicContact CG2-CG1 4.49Å; L742-V745 HydrophobicContact CD2-CG2 4.42Å; L742-V745 WeakPolarHBondContact O-CA 3.41Å; L742-V745 WeakPolarHBondContact O-CB 3.37Å; L742-V745 PolarHBondContact O-N 3.39Å; M743-V745 PolarHBondContact O-N 3.36Å; V745-L747 VanDerWaalsContact C-N 3.34Å; V745-L747 PolarHBondContact O-N 3.19Å; V745-R748 WeakPolarHBondContact O-CB 3.5Å; V745-R748 PolarHBondContact O-N 2.71Å; V745-R748 VanDerWaalsContact O-N 3.07Å; V745-A749 PolarHBondContact O-N 3.43Å
746	F	95.6	Very high	88.2	Confident	3 Å²	3	31.4 Å²	31.4	1%	0.013	15%	0.153	C	C	.	.	H	α-helix	trans	-64.1	-38.4	177.5	-59.6	-28.2	0	0	0	112.6	L729 L734 L739 L742 M743 R748 A749 L752 L754 L770	L729-F746 HydrophobicContact CD1-CE1 3.69Å; L729-F746 HydrophobicContact CD1-CZ 4.05Å; L734-F746 HydrophobicContact CD2-CZ 4.25Å; L739-F746 HydrophobicContact CB-CE2 4.43Å; L739-F746 HydrophobicContact CD2-CE2 3.59Å; L739-F746 HydrophobicContact CD2-CZ 3.89Å; L742-F746 HydrophobicContact CB-CD1 4.47Å; L742-F746 HydrophobicContact CB-CD2 4.26Å; L742-F746 HydrophobicContact CB-CE1 3.86Å; L742-F746 HydrophobicContact CB-CE2 3.62Å; L742-F746 HydrophobicContact CB-CZ 3.4Å; L742-F746 HydrophobicContact CD1-CE1 4.33Å; L742-F746 HydrophobicContact CD1-CZ 3.91Å; L742-F746 HydrophobicContact CG-CZ 4.31Å; L742-F746 PolarHBondContact O-N 3.48Å; M743-F746 PolarHBondContact O-N 3.1Å; F746-R748 PolarHBondContact O-N 3.21Å; F746-R748 VanDerWaalsContact O-N 3.11Å; F746-A749 WeakPolarHBondContact O-CB 3.45Å; F746-A749 PolarHBondContact O-N 3.39Å; F746-L752 HydrophobicContact CB-CD2 4.16Å; F746-L752 HydrophobicContact CD1-CD1 3.61Å; F746-L752 HydrophobicContact CD1-CD2 3.99Å; F746-L752 HydrophobicContact CD1-CG 4.49Å; F746-L752 HydrophobicContact CE1-CD1 3.82Å; F746-L752 HydrophobicContact CG-CD1 4.45Å; F746-L752 HydrophobicContact CG-CD2 4.02Å; F746-L754 HydrophobicContact CE1-CD2 4.33Å; F746-L754 HydrophobicContact CZ-CD2 4.18Å; F746-L770 HydrophobicContact CB-CD1 3.71Å; F746-L770 HydrophobicContact CB-CD2 3.9Å; F746-L770 HydrophobicContact CB-CG 4.49Å; F746-L770 HydrophobicContact CD2-CD2 4.16Å; F746-L770 HydrophobicContact CG-CD2 4.34Å
747	L	94.5	Very high	87.6	Confident	22 Å²	22	29.9 Å²	29.9	12%	0.115	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.9	174.5	-66.5	171.1	0	0	0	112.9	M743 V745 L770 H773 Q775 C776 Q777	M743-L747 HydrophobicContact CG-CD1 4.25Å; M743-L747 WeakPolarHBondContact O-CG 3.11Å; M743-L747 PolarHBondContact O-N 3.38Å; V745-L747 VanDerWaalsContact C-N 3.34Å; V745-L747 PolarHBondContact O-N 3.19Å; L747-L770 HydrophobicContact CD2-CD1 3.75Å; L747-L770 HydrophobicContact CG-CD1 4.18Å; L747-H773 WeakPolarHBondContact CD1-NE2 3.12Å; L747-H773 HydrophobicContact CD2-CB 3.67Å; L747-Q775 HydrophobicContact CD2-CB 4.37Å; L747-C776 HydrophobicContact CD2-CB 4.48Å; L747-Q777 PolarHBondContact O-NE2 3.32Å
748	R	91.8	Very high	87.5	Confident	22 Å²	22	30.3 Å²	30.3	8%	0.083	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-13.1	174	-64.5	-179.4	62.8	-157.8	-7.6	113.4	L717 G720 H722 A723 L724 V745 F746	L717-R748 WeakPolarHBondContact O-CD 3.45Å; L717-R748 PolarHBondContact O-NH1 2.81Å; G720-R748 VanDerWaalsContact CA-CZ 3.5Å; H722-R748 PolarHBondContact O-NE 3.41Å; H722-R748 PolarHBondContact O-NH2 2.83Å; A723-R748 CarbonylContact C-O 3.56Å; A723-R748 WeakPolarHBondContact CA-O 3.49Å; L724-R748 HydrophobicContact CD1-CB 4.42Å; L724-R748 HydrophobicContact CG-CB 4.37Å; L724-R748 PolarHBondContact N-O 3.36Å; V745-R748 WeakPolarHBondContact O-CB 3.5Å; V745-R748 PolarHBondContact O-N 2.71Å; V745-R748 VanDerWaalsContact O-N 3.07Å; F746-R748 PolarHBondContact O-N 3.21Å; F746-R748 VanDerWaalsContact O-N 3.11Å
749	A	93.4	Very high	87.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-83.1	137.9	-171.8	0	0	0	0	0	112.5	L724 V727 V745 F746 L752 Q777 I778	L724-A749 CarbonylContact O-C 3.57Å; L724-A749 WeakPolarHBondContact O-CA 3.4Å; V727-A749 HydrophobicContact CB-CB 4.04Å; V727-A749 HydrophobicContact CG2-CB 3.65Å; V745-A749 PolarHBondContact O-N 3.43Å; F746-A749 WeakPolarHBondContact O-CB 3.45Å; F746-A749 PolarHBondContact O-N 3.39Å; A749-L752 HydrophobicContact CB-CB 4.47Å; A749-Q777 CarbonylContact O-C 3.5Å; A749-Q777 WeakPolarHBondContact O-CG 3.19Å; A749-I778 WeakPolarHBondContact O-CA 3.33Å; A749-I778 WeakPolarHBondContact O-CG1 3.41Å; A749-I778 PolarHBondContact O-N 3.26Å
750	R	92.4	Very high	87.3	Confident	119 Å²	119	31.2 Å²	31.2	45%	0.449	16%	0.161	S	C	.	.	S	Bend	trans	-89.4	-38.4	165.8	-68.6	-178.5	176.1	-102.3	-3.5	111.8	A723 L724 T779 T780	A723-R750 HydrophobicContact CB-CG 4.37Å; L724-R750 PolarHBondContact O-N 3.05Å; R750-T779 PolarHBondContact O-N 2.98Å; R750-T779 PolarHBondContact O-OG1 3Å; R750-T780 PolarHBondContact O-N 2.96Å; R750-T780 VanDerWaalsContact O-N 3.13Å
751	K	88.6	Confident	87.2	Confident	86 Å²	86	26.4 Å²	26.4	37%	0.374	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.8	173.4	-57.2	-176	178.8	178.4	0	108.8	D725 E726 V727 T780	D725-K751 WeakPolarHBondContact O-CB 3.49Å; D725-K751 WeakPolarHBondContact O-CG 3.2Å; D725-K751 PolarHBondContact O-N 3.13Å; E726-K751 CarbonylContact C-O 3.55Å; E726-K751 WeakPolarHBondContact CA-O 3.5Å; E726-K751 HydrophobicContact CB-CB 4.33Å; E726-K751 HydrophobicContact CG-CB 4.22Å; V727-K751 PolarHBondContact N-O 3.43Å; K751-T780 CarbonylContact C-O 3.41Å; K751-T780 WeakPolarHBondContact CA-O 3.47Å
752	L	94.4	Very high	87.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116.4	-179	-178.9	57.5	0	0	0	110.1	V727 F746 A749 L754 L770 I778 T780 L781 R782	V727-L752 HydrophobicContact CB-CD1 4.01Å; V727-L752 HydrophobicContact CG1-CD1 3.85Å; V727-L752 WeakPolarHBondContact O-CA 3.14Å; F746-L752 HydrophobicContact CB-CD2 4.16Å; F746-L752 HydrophobicContact CD1-CD1 3.61Å; F746-L752 HydrophobicContact CD1-CD2 3.99Å; F746-L752 HydrophobicContact CD1-CG 4.49Å; F746-L752 HydrophobicContact CE1-CD1 3.82Å; F746-L752 HydrophobicContact CG-CD1 4.45Å; F746-L752 HydrophobicContact CG-CD2 4.02Å; A749-L752 HydrophobicContact CB-CB 4.47Å; L752-L754 HydrophobicContact CD1-CD2 4.17Å; L752-L754 HydrophobicContact CD1-CG 4.13Å; L752-L754 HydrophobicContact CD2-CD1 3.99Å; L752-L754 HydrophobicContact CD2-CG 4.39Å; L752-L754 HydrophobicContact CG-CD1 4.14Å; L752-L754 HydrophobicContact CG-CG 3.99Å; L752-L770 HydrophobicContact CD2-CD2 3.92Å; L752-I778 HydrophobicContact CB-CD1 4.37Å; L752-I778 HydrophobicContact CB-CG2 4.29Å; L752-I778 HydrophobicContact CD2-CD1 3.79Å; L752-T780 PolarHBondContact N-O 2.72Å; L752-L781 HydrophobicContact CB-CD1 4.18Å; L752-L781 HydrophobicContact CD2-CD1 4.05Å; L752-L781 HydrophobicContact CG-CD1 4.16Å; L752-R782 PolarHBondContact O-N 3.33Å
753	G	84.1	Confident	87.3	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.2	173.5	0	0	0	0	0	111.4	V727 L729 Q755	V727-G753 PolarHBondContact O-N 2.83Å; L729-G753 PolarHBondContact N-O 2.84Å; G753-Q755 VanDerWaalsContact C-OE1 3.22Å
754	L	86.1	Confident	87.3	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.			trans	-128.7	26.4	178.4	-64	174.1	0	0	0	111.5	L729 L734 L739 F746 L752 N757 L759 L767 R782 L783 N786	L729-L754 HydrophobicContact CB-CD2 4.13Å; L729-L754 HydrophobicContact CD1-CD2 4.22Å; L734-L754 HydrophobicContact CD2-CD2 4.02Å; L739-L754 HydrophobicContact CD2-CD1 3.94Å; L739-L754 HydrophobicContact CD2-CD2 4.38Å; F746-L754 HydrophobicContact CE1-CD2 4.33Å; F746-L754 HydrophobicContact CZ-CD2 4.18Å; L752-L754 HydrophobicContact CD1-CD2 4.17Å; L752-L754 HydrophobicContact CD1-CG 4.13Å; L752-L754 HydrophobicContact CD2-CD1 3.99Å; L752-L754 HydrophobicContact CD2-CG 4.39Å; L752-L754 HydrophobicContact CG-CD1 4.14Å; L752-L754 HydrophobicContact CG-CG 3.99Å; L754-N757 VanDerWaalsContact C-ND2 3.27Å; L754-N757 PolarHBondContact O-ND2 3.22Å; L754-L759 HydrophobicContact CB-CD1 4.2Å; L754-L767 HydrophobicContact CD1-CD2 3.85Å; L754-R782 PolarHBondContact N-O 2.81Å; L754-L783 HydrophobicContact CB-CD2 4.05Å; L754-L783 HydrophobicContact CD1-CD2 4.08Å; L754-N786 PolarHBondContact O-ND2 3.26Å
755	Q	80.8	Confident	87.4	Confident	30 Å²	30	30.6 Å²	30.6	14%	0.14	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	152.4	-177.1	-52.7	94.7	-44.6	0	0	111.7	A730 S731 G753 N757 R782 S784	A730-Q755 CarbonylContact C-O 3.48Å; A730-Q755 WeakPolarHBondContact CA-O 3.49Å; A730-Q755 HydrophobicContact CB-CB 4.19Å; S731-Q755 PolarHBondContact N-O 2.77Å; G753-Q755 VanDerWaalsContact C-OE1 3.22Å; Q755-N757 VanDerWaalsContact C-N 3.34Å; Q755-N757 PolarHBondContact O-N 2.83Å; Q755-N757 PolarHBondContact O-ND2 2.86Å; Q755-N757 VanDerWaalsContact O-ND2 3.17Å; Q755-R782 HydrophobicContact CG-CB 4.11Å; Q755-S784 WeakPolarHBondContact CA-O 3.44Å; Q755-S784 WeakPolarHBondContact CB-O 3.33Å
756	L	68.5	Low	87.5	Confident	34 Å²	34	31.2 Å²	31.2	18%	0.178	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	37.9	170.6	-58.9	156.7	0	0	0	114	V128 A131 S731 S784 N785	V128-L756 HydrophobicContact CG1-CD1 4.03Å; V128-L756 HydrophobicContact CG1-CD2 4.02Å; A131-L756 HydrophobicContact CB-CD2 3.67Å; S731-L756 VanDerWaalsContact CA-O 3.29Å; S731-L756 WeakPolarHBondContact CA-O 3.37Å; L756-S784 PolarHBondContact N-O 3.46Å; L756-S784 VanDerWaalsContact N-O 3.13Å; L756-N785 WeakPolarHBondContact CA-O 3.19Å; L756-N785 HydrophobicContact CD2-CB 3.44Å; L756-N785 VanDerWaalsContact CD2-CB 3.44Å; L756-N785 HydrophobicContact CG-CB 3.91Å; L756-N785 PolarHBondContact N-O 2.87Å
757	N	73.2	Confident	87.6	Confident	12 Å²	12	31.1 Å²	31.1	6%	0.064	16%	0.161	C	C	.	.	S	Bend	trans	-105.5	-4.2	179.4	-82	-69.6	0	0	0	113.9	L729 C732 Q733 L734 L754 Q755 L759 N786	L729-N757 PolarHBondContact O-ND2 3.28Å; C732-N757 WeakPolarHBondContact CA-OD1 3.25Å; C732-N757 WeakPolarHBondContact CB-OD1 3.31Å; C732-N757 PolarHBondContact N-OD1 3.39Å; Q733-N757 PolarHBondContact N-OD1 3.31Å; Q733-N757 VanDerWaalsContact N-OD1 3.07Å; L734-N757 HydrophobicContact CB-CB 4.21Å; L734-N757 WeakPolarHBondContact CB-OD1 3.49Å; L734-N757 PolarHBondContact N-OD1 2.91Å; L754-N757 VanDerWaalsContact C-ND2 3.27Å; L754-N757 PolarHBondContact O-ND2 3.22Å; Q755-N757 VanDerWaalsContact C-N 3.34Å; Q755-N757 PolarHBondContact O-N 2.83Å; Q755-N757 PolarHBondContact O-ND2 2.86Å; Q755-N757 VanDerWaalsContact O-ND2 3.17Å; N757-L759 VanDerWaalsContact C-N 3.29Å; N757-L759 HydrophobicContact CB-CD1 4.27Å; N757-L759 HydrophobicContact CB-CD2 4.15Å; N757-L759 HydrophobicContact CB-CG 3.79Å; N757-N786 WeakPolarHBondContact CA-OD1 3.34Å; N757-N786 PolarHBondContact N-OD1 2.93Å
758	G	75	Confident	87.7	Confident	49 Å²	49	33 Å²	33	51%	0.505	17%	0.167	S	C	.	.			trans	69.2	27.4	-174.3	0	0	0	0	0	112.9	G760 N786	G758-G760 PolarHBondContact O-N 3.39Å; G758-N786 PolarHBondContact N-OD1 3.42Å
759	L	82.3	Confident	87.9	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.016	18%	0.181	C	C	.	.			trans	-68.7	120.8	179.4	-58	176.5	0	0	0	110.3	L734 L739 L754 N757 A763 N786 P787 L788	L734-L759 WeakPolarHBondContact O-CD2 3.42Å; L739-L759 HydrophobicContact CD1-CD1 4.38Å; L739-L759 HydrophobicContact CD1-CD2 3.93Å; L754-L759 HydrophobicContact CB-CD1 4.2Å; N757-L759 VanDerWaalsContact C-N 3.29Å; N757-L759 HydrophobicContact CB-CD1 4.27Å; N757-L759 HydrophobicContact CB-CD2 4.15Å; N757-L759 HydrophobicContact CB-CG 3.79Å; L759-A763 HydrophobicContact CB-CB 3.98Å; L759-A763 HydrophobicContact CD2-CB 4Å; L759-A763 HydrophobicContact CG-CB 4.48Å; L759-N786 HydrophobicContact CB-CB 4.02Å; L759-N786 PolarHBondContact N-OD1 3.33Å; L759-P787 CarbonylContact O-C 3.2Å; L759-P787 VanDerWaalsContact O-CD 3.26Å; L759-P787 WeakPolarHBondContact O-CD 3.34Å; L759-L788 HydrophobicContact CB-CD2 4.21Å; L759-L788 WeakPolarHBondContact O-CD2 3.23Å
760	G	84.2	Confident	88.1	Confident	21 Å²	21	35.5 Å²	35.5	22%	0.216	18%	0.182	C	C	.	.			trans	-97.9	-173.7	175.9	0	0	0	0	0	114	G758 E762 A763 P787	G758-G760 PolarHBondContact O-N 3.39Å; G760-E762 PolarHBondContact O-N 3.34Å; G760-E762 VanDerWaalsContact O-N 3.12Å; G760-A763 WeakPolarHBondContact O-CB 3.44Å; G760-A763 PolarHBondContact O-N 3.39Å; G760-P787 WeakPolarHBondContact CA-O 3.44Å
761	P	88.1	Confident	88.3	Confident	33 Å²	33	30 Å²	30	21%	0.214	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-33	179.1	-23.5	29.1	0	0	0	114.4	A763 C764 L788 M789 A791	P761-A763 VanDerWaalsContact C-N 3.32Å; P761-A763 PolarHBondContact O-N 2.95Å; P761-C764 WeakPolarHBondContact O-CB 3.43Å; P761-C764 PolarHBondContact O-N 3.48Å; P761-C764 VanDerWaalsContact O-N 3.14Å; P761-L788 WeakPolarHBondContact CG-O 3.24Å; P761-M789 HydrophobicContact CG-CB 4.44Å; P761-M789 HydrophobicContact CG-SD 4.38Å; P761-A791 HydrophobicContact CB-CB 4.34Å; P761-A791 HydrophobicContact CG-CB 4.46Å
762	E	88.7	Confident	88.7	Confident	119 Å²	119	29.6 Å²	29.6	56%	0.556	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-36.6	178.4	-65.9	-58.7	149.3	0	0	112.7	G760 C764 K765	G760-E762 PolarHBondContact O-N 3.34Å; G760-E762 VanDerWaalsContact O-N 3.12Å; E762-C764 PolarHBondContact O-N 3.1Å; E762-K765 PolarHBondContact O-N 2.89Å; E762-K765 IonicContact OE1-NZ 3.67Å; E762-K765 IonicContact OE2-NZ 2.54Å; E762-K765 PolarHBondContact OE2-NZ 2.85Å
763	A	91.4	Very high	88.8	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-25	176.9	0	0	0	0	0	112.3	P736 L739 L759 G760 P761 K765 D766 L767	P736-A763 HydrophobicContact CG-CB 4.23Å; L739-A763 HydrophobicContact CD1-CB 3.78Å; L759-A763 HydrophobicContact CB-CB 3.98Å; L759-A763 HydrophobicContact CD2-CB 4Å; L759-A763 HydrophobicContact CG-CB 4.48Å; G760-A763 WeakPolarHBondContact O-CB 3.44Å; G760-A763 PolarHBondContact O-N 3.39Å; P761-A763 VanDerWaalsContact C-N 3.32Å; P761-A763 PolarHBondContact O-N 2.95Å; A763-K765 PolarHBondContact O-N 2.89Å; A763-D766 PolarHBondContact O-N 2.92Å; A763-D766 VanDerWaalsContact O-N 3.16Å; A763-L767 PolarHBondContact O-N 3.47Å
764	C	95.1	Very high	89.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.9	-21.4	178	-66.8	0	0	0	0	113.1	P761 E762 R768 G792 L795	P761-C764 WeakPolarHBondContact O-CB 3.43Å; P761-C764 PolarHBondContact O-N 3.48Å; P761-C764 VanDerWaalsContact O-N 3.14Å; E762-C764 PolarHBondContact O-N 3.1Å; C764-R768 WeakPolarHBondContact O-CB 3.24Å; C764-R768 PolarHBondContact O-N 3.01Å; C764-G792 WeakPolarHBondContact CB-O 3.38Å; C764-G792 VanDerWaalsContact SG-CA 3.53Å; C764-G792 PolarHBondContact SG-O 2.98Å; C764-L795 HydrophobicContact CB-CB 3.88Å; C764-L795 HydrophobicContact CB-CD1 4.1Å
765	K	94.8	Very high	89.5	Confident	86 Å²	86	46.9 Å²	46.9	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-63.7	-47.9	171.2	-63.9	174.2	-177.1	159.5	0	110.6	E762 A763 R768 D769 L795	E762-K765 PolarHBondContact O-N 2.89Å; E762-K765 IonicContact OE1-NZ 3.67Å; E762-K765 IonicContact OE2-NZ 2.54Å; E762-K765 PolarHBondContact OE2-NZ 2.85Å; A763-K765 PolarHBondContact O-N 2.89Å; K765-R768 WeakPolarHBondContact O-CB 3.43Å; K765-R768 PolarHBondContact O-N 3.46Å; K765-D769 PolarHBondContact O-N 3.37Å; K765-L795 HydrophobicContact CG-CD1 3.74Å
766	D	95.6	Very high	90.2	Very high	14 Å²	14	46.2 Å²	46.2	8%	0.075	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-36.8	178.7	-56.4	-61.1	0	0	0	111.4	L739 R740 A763 D769 L770	L739-D766 HydrophobicContact CB-CB 4.35Å; R740-D766 VanDerWaalsContact CD-OD1 3.23Å; R740-D766 WeakPolarHBondContact CD-OD1 3.2Å; R740-D766 HydrophobicContact CG-CB 4.38Å; R740-D766 WeakPolarHBondContact CG-OD1 3.44Å; R740-D766 IonicContact CZ-OD1 2.88Å; R740-D766 IonicContact CZ-OD2 2.91Å; R740-D766 IonicContact NE-OD1 2.7Å; R740-D766 VanDerWaalsContact NH1-CG 3.29Å; R740-D766 IonicContact NH1-OD1 3.96Å; R740-D766 PolarHBondContact NH1-OD1 3.17Å; R740-D766 IonicContact NH1-OD2 3.81Å; R740-D766 PolarHBondContact NH1-OD2 2.97Å; A763-D766 PolarHBondContact O-N 2.92Å; A763-D766 VanDerWaalsContact O-N 3.16Å; D766-D769 PolarHBondContact O-N 2.89Å; D766-L770 WeakPolarHBondContact O-CB 3.19Å; D766-L770 PolarHBondContact O-N 2.98Å
767	L	96.8	Very high	91.5	Very high	2 Å²	2	48 Å²	48	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-67.9	-39.3	174.4	-67.9	172.8	0	0	0	112.5	L739 L754 A763 D769 L770 L771 L783 L796	L739-L767 HydrophobicContact CD1-CG 4.49Å; L754-L767 HydrophobicContact CD1-CD2 3.85Å; A763-L767 PolarHBondContact O-N 3.47Å; L767-D769 VanDerWaalsContact C-N 3.33Å; L767-L770 HydrophobicContact CD2-CD2 4.36Å; L767-L770 WeakPolarHBondContact O-CB 3.34Å; L767-L770 PolarHBondContact O-N 2.75Å; L767-L771 WeakPolarHBondContact O-CG 3.35Å; L767-L771 PolarHBondContact O-N 3.19Å; L767-L783 HydrophobicContact CD1-CD1 4.04Å; L767-L783 HydrophobicContact CD1-CD2 3.75Å; L767-L783 HydrophobicContact CD2-CD2 4.47Å; L767-L796 HydrophobicContact CB-CD1 4.18Å
768	R	96.8	Very high	92.6	Very high	61 Å²	61	47.4 Å²	47.4	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-58.7	-48.3	172.5	178.7	-158.7	65.9	-167.4	-4.4	110.1	C764 K765 L770 L771 L772 L795 E798	C764-R768 WeakPolarHBondContact O-CB 3.24Å; C764-R768 PolarHBondContact O-N 3.01Å; K765-R768 WeakPolarHBondContact O-CB 3.43Å; K765-R768 PolarHBondContact O-N 3.46Å; R768-L770 VanDerWaalsContact C-N 3.29Å; R768-L770 PolarHBondContact O-N 3.23Å; R768-L771 PolarHBondContact O-N 3.35Å; R768-L771 VanDerWaalsContact O-N 3.12Å; R768-L772 HydrophobicContact CG-CD1 3.92Å; R768-L772 HydrophobicContact CG-CG 4.46Å; R768-L772 WeakPolarHBondContact O-CG 3.44Å; R768-L772 PolarHBondContact O-N 3.15Å; R768-L795 WeakPolarHBondContact CB-O 3.43Å; R768-L795 WeakPolarHBondContact CG-O 3.08Å; R768-E798 HydrophobicContact CG-CB 4.34Å; R768-E798 IonicContact NH1-OE2 3.54Å
769	D	96.3	Very high	93.6	Very high	72 Å²	72	47 Å²	47	39%	0.385	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-35.9	-179.9	-63.5	-8.3	0	0	0	111.4	K765 D766 L767 H773	K765-D769 PolarHBondContact O-N 3.37Å; D766-D769 PolarHBondContact O-N 2.89Å; L767-D769 VanDerWaalsContact C-N 3.33Å; D769-H773 PolarHBondContact O-N 3.31Å; D769-H773 VanDerWaalsContact O-N 3.17Å
770	L	97.3	Very high	94	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-46	170.5	170.9	63.7	0	0	0	112.2	M743 F746 L747 L752 D766 L767 R768 H773 C776 I778	M743-L770 HydrophobicContact CE-CB 3.97Å; M743-L770 HydrophobicContact SD-CB 3.69Å; M743-L770 HydrophobicContact SD-CD1 3.56Å; M743-L770 VanDerWaalsContact SD-CD1 3.56Å; M743-L770 HydrophobicContact SD-CG 4.18Å; F746-L770 HydrophobicContact CB-CD1 3.71Å; F746-L770 HydrophobicContact CB-CD2 3.9Å; F746-L770 HydrophobicContact CB-CG 4.49Å; F746-L770 HydrophobicContact CD2-CD2 4.16Å; F746-L770 HydrophobicContact CG-CD2 4.34Å; L747-L770 HydrophobicContact CD2-CD1 3.75Å; L747-L770 HydrophobicContact CG-CD1 4.18Å; L752-L770 HydrophobicContact CD2-CD2 3.92Å; D766-L770 WeakPolarHBondContact O-CB 3.19Å; D766-L770 PolarHBondContact O-N 2.98Å; L767-L770 HydrophobicContact CD2-CD2 4.36Å; L767-L770 WeakPolarHBondContact O-CB 3.34Å; L767-L770 PolarHBondContact O-N 2.75Å; R768-L770 VanDerWaalsContact C-N 3.29Å; R768-L770 PolarHBondContact O-N 3.23Å; L770-H773 WeakPolarHBondContact O-CB 3.15Å; L770-H773 PolarHBondContact O-N 3.03Å; L770-C776 WeakPolarHBondContact O-CB 3.4Å; L770-C776 PolarHBondContact O-SG 3.07Å; L770-I778 HydrophobicContact CD1-CD1 4.06Å; L770-I778 HydrophobicContact CD2-CD1 3.74Å; L770-I778 HydrophobicContact CG-CD1 3.98Å
771	L	97.1	Very high	94.5	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-67.4	-35.2	-179	-71.7	177.6	0	0	0	112.7	L767 R768 H773 L781 L796 N803 V806	L767-L771 WeakPolarHBondContact O-CG 3.35Å; L767-L771 PolarHBondContact O-N 3.19Å; R768-L771 PolarHBondContact O-N 3.35Å; R768-L771 VanDerWaalsContact O-N 3.12Å; L771-H773 VanDerWaalsContact C-N 3.32Å; L771-L781 HydrophobicContact CD2-CD2 4.22Å; L771-L796 HydrophobicContact CD1-CD1 3.73Å; L771-L796 HydrophobicContact CD1-CG 4.4Å; L771-N803 HydrophobicContact CB-CB 4.31Å; L771-N803 PolarHBondContact O-ND2 2.94Å; L771-V806 HydrophobicContact CD2-CG2 3.68Å
772	L	96.4	Very high	94.4	Very high	78 Å²	78	48 Å²	48	41%	0.408	23%	0.233	S	C	.	.	H	α-helix	trans	-79.9	-11.5	178.1	-67.6	176	0	0	0	113.6	R768 D774	R768-L772 HydrophobicContact CG-CD1 3.92Å; R768-L772 HydrophobicContact CG-CG 4.46Å; R768-L772 WeakPolarHBondContact O-CG 3.44Å; R768-L772 PolarHBondContact O-N 3.15Å; L772-D774 PolarHBondContact O-N 3.15Å
773	H	96.5	Very high	94.3	Very high	80 Å²	80	42.3 Å²	42.3	37%	0.37	21%	0.207	S	C	.	.	S	Bend	trans	-68	133.5	-177.8	-165.6	-49.8	0	0	0	111.4	L747 D769 L770 L771 Q775 C776	L747-H773 WeakPolarHBondContact CD1-NE2 3.12Å; L747-H773 HydrophobicContact CD2-CB 3.67Å; D769-H773 PolarHBondContact O-N 3.31Å; D769-H773 VanDerWaalsContact O-N 3.17Å; L770-H773 WeakPolarHBondContact O-CB 3.15Å; L770-H773 PolarHBondContact O-N 3.03Å; L771-H773 VanDerWaalsContact C-N 3.32Å; H773-Q775 PolarHBondContact ND1-N 2.98Å; H773-Q775 VanDerWaalsContact ND1-N 3.17Å; H773-Q775 PolarHBondContact O-N 2.93Å; H773-C776 WeakPolarHBondContact O-CB 3.38Å; H773-C776 PolarHBondContact O-N 2.97Å
774	D	93.3	Very high	93.8	Very high	153 Å²	153	42.9 Å²	42.9	82%	0.818	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-17.7	-179	-62.8	-22.2	0	0	0	115.7	L772	L772-D774 PolarHBondContact O-N 3.15Å
775	Q	92.3	Very high	92.7	Very high	132 Å²	132	44.3 Å²	44.3	62%	0.617	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103	4.8	-177.9	-59.8	-60.8	-58.7	0	0	111.6	L747 H773 Q777	L747-Q775 HydrophobicContact CD2-CB 4.37Å; H773-Q775 PolarHBondContact ND1-N 2.98Å; H773-Q775 VanDerWaalsContact ND1-N 3.17Å; H773-Q775 PolarHBondContact O-N 2.93Å; Q775-Q777 PolarHBondContact O-N 3.35Å; Q775-Q777 VanDerWaalsContact O-N 3.12Å
776	C	94.9	Very high	91.7	Very high	15 Å²	15	40.3 Å²	40.3	10%	0.101	20%	0.201	C	C	.	.			trans	-68.4	109.7	-178.3	-172.9	0	0	0	0	110.8	L747 L770 H773 S805	L747-C776 HydrophobicContact CD2-CB 4.48Å; L770-C776 WeakPolarHBondContact O-CB 3.4Å; L770-C776 PolarHBondContact O-SG 3.07Å; H773-C776 WeakPolarHBondContact O-CB 3.38Å; H773-C776 PolarHBondContact O-N 2.97Å; C776-S805 WeakPolarHBondContact O-CB 3.25Å; C776-S805 PolarHBondContact O-OG 3.44Å
777	Q	95.1	Very high	91.1	Very high	71 Å²	71	42 Å²	42	33%	0.332	21%	0.213	S	C	.	.			trans	-110.8	18.6	178	69.2	-168.7	-50.2	0	0	112.9	L747 A749 Q775 T779	L747-Q777 PolarHBondContact O-NE2 3.32Å; A749-Q777 CarbonylContact O-C 3.5Å; A749-Q777 WeakPolarHBondContact O-CG 3.19Å; Q775-Q777 PolarHBondContact O-N 3.35Å; Q775-Q777 VanDerWaalsContact O-N 3.12Å; Q777-T779 PolarHBondContact O-N 3.45Å
778	I	97.1	Very high	90.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.			trans	-71.5	119.3	-178.9	-60.8	170.7	0	0	0	108.6	A749 L752 L770 T780 L781 S805 V806	A749-I778 WeakPolarHBondContact O-CA 3.33Å; A749-I778 WeakPolarHBondContact O-CG1 3.41Å; A749-I778 PolarHBondContact O-N 3.26Å; L752-I778 HydrophobicContact CB-CD1 4.37Å; L752-I778 HydrophobicContact CB-CG2 4.29Å; L752-I778 HydrophobicContact CD2-CD1 3.79Å; L770-I778 HydrophobicContact CD1-CD1 4.06Å; L770-I778 HydrophobicContact CD2-CD1 3.74Å; L770-I778 HydrophobicContact CG-CD1 3.98Å; I778-T780 WeakPolarHBondContact CG2-O 3.45Å; I778-L781 HydrophobicContact CG2-CB 4.2Å; I778-S805 CarbonylContact O-C 3.55Å; I778-S805 WeakPolarHBondContact O-CB 3.21Å; I778-S805 PolarHBondContact O-OG 2.94Å; I778-V806 HydrophobicContact CB-CG2 4.49Å; I778-V806 HydrophobicContact CG2-CG2 4.35Å; I778-V806 VanDerWaalsContact O-CA 3.3Å; I778-V806 WeakPolarHBondContact O-CA 3.3Å; I778-V806 VanDerWaalsContact O-CG2 3.27Å; I778-V806 WeakPolarHBondContact O-CG2 3.27Å; I778-V806 PolarHBondContact O-N 3.12Å; I778-V806 VanDerWaalsContact O-N 3.12Å
779	T	95.3	Very high	90.4	Very high	42 Å²	42	42 Å²	42	26%	0.258	22%	0.216	S	C	.	.	S	Bend	trans	-97.1	-32.7	175.4	58.6	0	0	0	0	112.4	R750 Q777 S805 T807 H808	R750-T779 PolarHBondContact O-N 2.98Å; R750-T779 PolarHBondContact O-OG1 3Å; Q777-T779 PolarHBondContact O-N 3.45Å; T779-S805 WeakPolarHBondContact CA-O 3.26Å; T779-T807 PolarHBondContact O-N 3.38Å; T779-T807 PolarHBondContact O-OG1 2.88Å; T779-T807 VanDerWaalsContact O-OG1 3.08Å; T779-H808 PolarHBondContact O-N 2.88Å
780	T	90.4	Very high	90.1	Very high	16 Å²	16	39 Å²	39	10%	0.098	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120.6	178.6	-51.9	0	0	0	0	109.7	R750 K751 L752 I778 R782 H808	R750-T780 PolarHBondContact O-N 2.96Å; R750-T780 VanDerWaalsContact O-N 3.13Å; K751-T780 CarbonylContact C-O 3.41Å; K751-T780 WeakPolarHBondContact CA-O 3.47Å; L752-T780 PolarHBondContact N-O 2.72Å; I778-T780 WeakPolarHBondContact CG2-O 3.45Å; T780-R782 HydrophobicContact CG2-CG 4.12Å; T780-H808 WeakPolarHBondContact CA-O 3.08Å; T780-H808 HydrophobicContact CG2-CB 3.94Å
781	L	96.1	Very high	89.8	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	120.8	175.6	179.4	58.6	0	0	0	109.8	L752 L771 I778 L783 H808 L809 S810	L752-L781 HydrophobicContact CB-CD1 4.18Å; L752-L781 HydrophobicContact CD2-CD1 4.05Å; L752-L781 HydrophobicContact CG-CD1 4.16Å; L771-L781 HydrophobicContact CD2-CD2 4.22Å; I778-L781 HydrophobicContact CG2-CB 4.2Å; L781-L783 HydrophobicContact CD1-CD2 4.16Å; L781-L783 HydrophobicContact CD1-CG 4.22Å; L781-L783 HydrophobicContact CD2-CD1 4.04Å; L781-L783 HydrophobicContact CD2-CG 4.42Å; L781-L783 HydrophobicContact CG-CD1 4.18Å; L781-L783 HydrophobicContact CG-CD2 4.5Å; L781-L783 HydrophobicContact CG-CG 4.03Å; L781-H808 PolarHBondContact N-O 3.38Å; L781-L809 HydrophobicContact CB-CD1 4.1Å; L781-L809 HydrophobicContact CD2-CD1 4.1Å; L781-L809 HydrophobicContact CG-CD1 4.11Å; L781-L809 WeakPolarHBondContact O-CA 3.39Å; L781-S810 PolarHBondContact O-N 3.36Å
782	R	85.6	Confident	89.6	Confident	58 Å²	58	41.7 Å²	41.7	22%	0.219	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	114.1	179.4	-55	-178.1	-178.8	116.7	-9.7	110.2	E726 L752 L754 Q755 T780	E726-R782 IonicContact OE1-NH1 3.66Å; E726-R782 PolarHBondContact OE1-NH1 3.31Å; L752-R782 PolarHBondContact O-N 3.33Å; L754-R782 PolarHBondContact N-O 2.81Å; Q755-R782 HydrophobicContact CG-CB 4.11Å; T780-R782 HydrophobicContact CG2-CG 4.12Å
783	L	86.7	Confident	89.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.			trans	-117.6	14.7	-178.2	-63.2	170.9	0	0	0	112.4	L754 L767 L781 N786 L788 L796 S810 L811 T814	L754-L783 HydrophobicContact CB-CD2 4.05Å; L754-L783 HydrophobicContact CD1-CD2 4.08Å; L767-L783 HydrophobicContact CD1-CD1 4.04Å; L767-L783 HydrophobicContact CD1-CD2 3.75Å; L767-L783 HydrophobicContact CD2-CD2 4.47Å; L781-L783 HydrophobicContact CD1-CD2 4.16Å; L781-L783 HydrophobicContact CD1-CG 4.22Å; L781-L783 HydrophobicContact CD2-CD1 4.04Å; L781-L783 HydrophobicContact CD2-CG 4.42Å; L781-L783 HydrophobicContact CG-CD1 4.18Å; L781-L783 HydrophobicContact CG-CD2 4.5Å; L781-L783 HydrophobicContact CG-CG 4.03Å; L783-N786 WeakPolarHBondContact O-CB 3.42Å; L783-N786 PolarHBondContact O-ND2 3.1Å; L783-L788 HydrophobicContact CB-CD1 4.16Å; L783-L788 HydrophobicContact CD1-CD1 4.14Å; L783-L796 HydrophobicContact CD1-CD1 4.14Å; L783-L796 HydrophobicContact CD1-CD2 3.82Å; L783-S810 PolarHBondContact N-O 3.49Å; L783-L811 HydrophobicContact CB-CD2 4.2Å; L783-L811 HydrophobicContact CD1-CD2 4.01Å; L783-T814 WeakPolarHBondContact O-CG2 3.08Å
784	S	80.7	Confident	89.5	Confident	13 Å²	13	35.5 Å²	35.5	9%	0.091	20%	0.199	C	C	.	.			trans	-55.8	147.5	-173.7	-41.1	0	0	0	0	113.4	Q755 L756 N786 S810 L812	Q755-S784 WeakPolarHBondContact CA-O 3.44Å; Q755-S784 WeakPolarHBondContact CB-O 3.33Å; L756-S784 PolarHBondContact N-O 3.46Å; L756-S784 VanDerWaalsContact N-O 3.13Å; S784-N786 PolarHBondContact O-ND2 3.18Å; S784-S810 PolarHBondContact OG-OG 3.06Å; S784-L812 CarbonylContact C-O 3.57Å; S784-L812 WeakPolarHBondContact CA-O 3.49Å; S784-L812 WeakPolarHBondContact CB-O 3.44Å
785	N	71.6	Confident	89.6	Confident	30 Å²	30	29.8 Å²	29.8	16%	0.16	17%	0.168	C	C	.	.	S	Bend	trans	56.2	51.7	-179	-53.2	-71.6	0	0	0	112.5	A131 L756 L812 H813	A131-N785 HydrophobicContact CB-CB 4.2Å; L756-N785 WeakPolarHBondContact CA-O 3.19Å; L756-N785 HydrophobicContact CD2-CB 3.44Å; L756-N785 VanDerWaalsContact CD2-CB 3.44Å; L756-N785 HydrophobicContact CG-CB 3.91Å; L756-N785 PolarHBondContact N-O 2.87Å; N785-L812 PolarHBondContact N-O 3.23Å; N785-H813 WeakPolarHBondContact CA-O 3.47Å; N785-H813 PolarHBondContact N-O 3.41Å; N785-H813 VanDerWaalsContact N-O 3.12Å; N785-H813 WeakPolarHBondContact OD1-CB 3.14Å; N785-H813 PolarHBondContact OD1-CD2 3.05Å
786	N	74.2	Confident	89.8	Confident	2 Å²	2	23.5 Å²	23.5	1%	0.011	14%	0.139	C	C	.	.			trans	-134.9	133.3	170.5	-75	-69	0	0	0	108.7	L754 N757 G758 L759 L783 S784 L788 T814	L754-N786 PolarHBondContact O-ND2 3.26Å; N757-N786 WeakPolarHBondContact CA-OD1 3.34Å; N757-N786 PolarHBondContact N-OD1 2.93Å; G758-N786 PolarHBondContact N-OD1 3.42Å; L759-N786 HydrophobicContact CB-CB 4.02Å; L759-N786 PolarHBondContact N-OD1 3.33Å; L783-N786 WeakPolarHBondContact O-CB 3.42Å; L783-N786 PolarHBondContact O-ND2 3.1Å; S784-N786 PolarHBondContact O-ND2 3.18Å; N786-L788 HydrophobicContact CB-CD2 4Å; N786-L788 HydrophobicContact CB-CG 4.22Å; N786-L788 PolarHBondContact O-N 3.29Å; N786-T814 CarbonylContact O-C 3.57Å; N786-T814 WeakPolarHBondContact O-CA 3.19Å; N786-T814 WeakPolarHBondContact O-CB 3.46Å; N786-T814 WeakPolarHBondContact O-CG2 3.39Å
787	P	82.8	Confident	89.8	Confident	50 Å²	50	23 Å²	23	33%	0.325	14%	0.135	S	C	.	.			trans	-75.5	63.3	-176.3	33.5	-38.1	0	0	0	112.4	L759 G760 M789	L759-P787 CarbonylContact O-C 3.2Å; L759-P787 VanDerWaalsContact O-CD 3.26Å; L759-P787 WeakPolarHBondContact O-CD 3.34Å; G760-P787 WeakPolarHBondContact CA-O 3.44Å; P787-M789 VanDerWaalsContact C-N 3.32Å; P787-M789 PolarHBondContact O-N 3.19Å
788	L	87.6	Confident	89.7	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.141	C	C	.	.			trans	-67.5	-33.8	-178.2	-54.3	-178.7	0	0	0	111.9	L759 P761 L783 N786 G792 L811 T814	L759-L788 HydrophobicContact CB-CD2 4.21Å; L759-L788 WeakPolarHBondContact O-CD2 3.23Å; P761-L788 WeakPolarHBondContact CG-O 3.24Å; L783-L788 HydrophobicContact CB-CD1 4.16Å; L783-L788 HydrophobicContact CD1-CD1 4.14Å; N786-L788 HydrophobicContact CB-CD2 4Å; N786-L788 HydrophobicContact CB-CG 4.22Å; N786-L788 PolarHBondContact O-N 3.29Å; L788-G792 WeakPolarHBondContact O-CA 3.32Å; L788-G792 PolarHBondContact O-N 3.48Å; L788-L811 HydrophobicContact CD1-CD2 4.02Å; L788-T814 HydrophobicContact CD1-CG2 3.95Å; L788-T814 HydrophobicContact CG-CG2 4.17Å; L788-T814 PolarHBondContact N-O 2.72Å; L788-T814 VanDerWaalsContact N-O 3.17Å
789	M	90.4	Very high	89.6	Confident	62 Å²	62	24.4 Å²	24.4	31%	0.305	14%	0.141	S	C	.	.	H	α-helix	trans	60.2	173.6	-176.3	-50.5	179	178.1	0	0	113.3	P136 P761 P787 A791 G792 V793 T814 G815	P136-M789 HydrophobicContact CB-CE 4.41Å; P761-M789 HydrophobicContact CG-CB 4.44Å; P761-M789 HydrophobicContact CG-SD 4.38Å; P787-M789 VanDerWaalsContact C-N 3.32Å; P787-M789 PolarHBondContact O-N 3.19Å; M789-A791 VanDerWaalsContact C-N 3.27Å; M789-A791 PolarHBondContact O-N 2.96Å; M789-G792 PolarHBondContact O-N 3.29Å; M789-V793 PolarHBondContact O-N 2.92Å; M789-V793 VanDerWaalsContact O-N 3.11Å; M789-T814 PolarHBondContact N-O 2.64Å; M789-G815 WeakPolarHBondContact CA-O 3.44Å
790	A	90	Very high	89.6	Confident	9 Å²	9	22.5 Å²	22.5	7%	0.074	13%	0.129	C	C	.	.	H	α-helix	trans	-57.1	-40.3	175.4	0	0	0	0	0	112.3	G792 V793 A794 E819	A790-G792 PolarHBondContact O-N 2.84Å; A790-V793 PolarHBondContact O-N 3.28Å; A790-A794 PolarHBondContact O-N 2.82Å; A790-A794 VanDerWaalsContact O-N 3.07Å; A790-E819 HydrophobicContact CB-CB 4.08Å; A790-E819 HydrophobicContact CB-CG 3.87Å
791	A	92.4	Very high	89.8	Confident	62 Å²	62	23.5 Å²	23.5	51%	0.512	14%	0.139	S	C	.	.	H	α-helix	trans	-61.2	-41	178	0	0	0	0	0	113.3	P761 M789 A794	P761-A791 HydrophobicContact CB-CB 4.34Å; P761-A791 HydrophobicContact CG-CB 4.46Å; M789-A791 VanDerWaalsContact C-N 3.27Å; M789-A791 PolarHBondContact O-N 2.96Å; A791-A794 WeakPolarHBondContact O-CB 3.46Å
792	G	92.9	Very high	89.4	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-71.3	-35.7	176.7	0	0	0	0	0	112.6	C764 L788 M789 A790 A794 L795 L796	C764-G792 WeakPolarHBondContact CB-O 3.38Å; C764-G792 VanDerWaalsContact SG-CA 3.53Å; C764-G792 PolarHBondContact SG-O 2.98Å; L788-G792 WeakPolarHBondContact O-CA 3.32Å; L788-G792 PolarHBondContact O-N 3.48Å; M789-G792 PolarHBondContact O-N 3.29Å; A790-G792 PolarHBondContact O-N 2.84Å; G792-A794 VanDerWaalsContact C-N 3.3Å; G792-A794 PolarHBondContact O-N 2.9Å; G792-L795 PolarHBondContact O-N 3.24Å; G792-L796 PolarHBondContact O-N 3.33Å
793	V	94.4	Very high	89.9	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-66.1	-33.8	176.9	109.2	0	0	0	0	111.9	M789 A790 L795 L796 M797 L811 L816 L823 L824	M789-V793 PolarHBondContact O-N 2.92Å; M789-V793 VanDerWaalsContact O-N 3.11Å; A790-V793 PolarHBondContact O-N 3.28Å; V793-L795 PolarHBondContact O-N 3.12Å; V793-L796 PolarHBondContact O-N 2.83Å; V793-M797 WeakPolarHBondContact O-CG 3.26Å; V793-M797 PolarHBondContact O-N 3.26Å; V793-L811 HydrophobicContact CG2-CD1 3.76Å; V793-L816 HydrophobicContact CB-CD2 3.67Å; V793-L816 HydrophobicContact CG1-CD2 4.28Å; V793-L816 HydrophobicContact CG2-CD1 4.49Å; V793-L816 HydrophobicContact CG2-CD2 3.52Å; V793-L823 HydrophobicContact CG1-CD2 3.99Å; V793-L824 HydrophobicContact CG1-CD2 4.5Å; V793-L824 HydrophobicContact CG1-CG 4.3Å; V793-L824 HydrophobicContact CG2-CD1 4.46Å; V793-L824 HydrophobicContact CG2-CD2 4.02Å; V793-L824 HydrophobicContact CG2-CG 4.29Å
794	A	94.9	Very high	90.3	Very high	29 Å²	29	28.7 Å²	28.7	24%	0.24	19%	0.187	C	C	.	.	H	α-helix	trans	-55.9	-49.5	174.5	0	0	0	0	0	111.8	A790 A791 G792 L796 M797 E798 L823	A790-A794 PolarHBondContact O-N 2.82Å; A790-A794 VanDerWaalsContact O-N 3.07Å; A791-A794 WeakPolarHBondContact O-CB 3.46Å; G792-A794 VanDerWaalsContact C-N 3.3Å; G792-A794 PolarHBondContact O-N 2.9Å; A794-L796 PolarHBondContact O-N 2.77Å; A794-M797 PolarHBondContact O-N 3.37Å; A794-E798 PolarHBondContact O-N 3.02Å; A794-E798 VanDerWaalsContact O-N 3.11Å; A794-L823 HydrophobicContact CB-CD1 3.57Å; A794-L823 HydrophobicContact CB-CD2 4.3Å
795	L	96.3	Very high	91	Very high	32 Å²	32	29.1 Å²	29.1	17%	0.168	19%	0.19	C	C	.	.	H	α-helix	trans	-65	-38.7	176.7	-67.7	170.6	0	0	0	112.2	C764 K765 R768 G792 V793 M797 E798 G799	C764-L795 HydrophobicContact CB-CB 3.88Å; C764-L795 HydrophobicContact CB-CD1 4.1Å; K765-L795 HydrophobicContact CG-CD1 3.74Å; R768-L795 WeakPolarHBondContact CB-O 3.43Å; R768-L795 WeakPolarHBondContact CG-O 3.08Å; G792-L795 PolarHBondContact O-N 3.24Å; V793-L795 PolarHBondContact O-N 3.12Å; L795-M797 VanDerWaalsContact C-N 3.3Å; L795-M797 PolarHBondContact O-N 3.09Å; L795-E798 WeakPolarHBondContact O-CB 3.5Å; L795-E798 PolarHBondContact O-N 2.99Å; L795-G799 PolarHBondContact O-N 3.12Å
796	L	95.6	Very high	92.2	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-64.1	-38.6	177.3	-166.5	71.3	0	0	0	111.3	L767 L771 L783 G792 V793 A794 G799 L800 L809 L811	L767-L796 HydrophobicContact CB-CD1 4.18Å; L771-L796 HydrophobicContact CD1-CD1 3.73Å; L771-L796 HydrophobicContact CD1-CG 4.4Å; L783-L796 HydrophobicContact CD1-CD1 4.14Å; L783-L796 HydrophobicContact CD1-CD2 3.82Å; G792-L796 PolarHBondContact O-N 3.33Å; V793-L796 PolarHBondContact O-N 2.83Å; A794-L796 PolarHBondContact O-N 2.77Å; L796-G799 PolarHBondContact O-N 2.97Å; L796-L800 WeakPolarHBondContact O-CB 3.34Å; L796-L800 PolarHBondContact O-N 3.36Å; L796-L809 HydrophobicContact CD2-CD1 4.4Å; L796-L809 HydrophobicContact CD2-CD2 4.34Å; L796-L811 HydrophobicContact CD2-CD1 4.43Å; L796-L811 HydrophobicContact CD2-CD2 3.7Å
797	M	94.9	Very high	93.1	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.02	19%	0.19	C	C	.	.	H	α-helix	trans	-68.9	-35	176.8	-72.5	-52	-65.2	0	0	113.1	V793 A794 L795 G799 L800 A801 L823 L824 Q827	V793-M797 WeakPolarHBondContact O-CG 3.26Å; V793-M797 PolarHBondContact O-N 3.26Å; A794-M797 PolarHBondContact O-N 3.37Å; L795-M797 VanDerWaalsContact C-N 3.3Å; L795-M797 PolarHBondContact O-N 3.09Å; M797-G799 VanDerWaalsContact C-N 3.26Å; M797-G799 PolarHBondContact O-N 3.29Å; M797-L800 HydrophobicContact CE-CD2 4.36Å; M797-L800 PolarHBondContact O-N 3.45Å; M797-L800 HydrophobicContact SD-CB 4.48Å; M797-L800 HydrophobicContact SD-CD2 3.98Å; M797-A801 WeakPolarHBondContact O-CB 3.47Å; M797-A801 PolarHBondContact O-N 3.5Å; M797-L823 HydrophobicContact CB-CD2 4.35Å; M797-L823 HydrophobicContact CG-CD2 4.11Å; M797-L824 HydrophobicContact CE-CD2 4.46Å; M797-L824 HydrophobicContact CG-CD2 3.71Å; M797-L824 HydrophobicContact SD-CD2 3.41Å; M797-L824 WeakPolarHBondContact SD-CD2 3.39Å; M797-Q827 HydrophobicContact CB-CB 4.14Å; M797-Q827 HydrophobicContact CE-CB 3.75Å; M797-Q827 WeakPolarHBondContact CE-O 3.32Å; M797-Q827 HydrophobicContact CG-CB 4.31Å
798	E	94.6	Very high	93.5	Very high	101 Å²	101	29.3 Å²	29.3	47%	0.472	19%	0.188	S	C	.	.	H	α-helix	trans	-56.8	-43.4	168.6	-69.4	176.3	-174.6	0	0	111.2	R768 A794 L795	R768-E798 HydrophobicContact CG-CB 4.34Å; R768-E798 IonicContact NH1-OE2 3.54Å; A794-E798 PolarHBondContact O-N 3.02Å; A794-E798 VanDerWaalsContact O-N 3.11Å; L795-E798 WeakPolarHBondContact O-CB 3.5Å; L795-E798 PolarHBondContact O-N 2.99Å
799	G	94.6	Very high	93.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.3	-41.5	178.6	0	0	0	0	0	112.5	L795 L796 M797 A801 G802 N803	L795-G799 PolarHBondContact O-N 3.12Å; L796-G799 PolarHBondContact O-N 2.97Å; M797-G799 VanDerWaalsContact C-N 3.26Å; M797-G799 PolarHBondContact O-N 3.29Å; G799-A801 VanDerWaalsContact C-N 3.33Å; G799-A801 PolarHBondContact O-N 2.9Å; G799-G802 PolarHBondContact O-N 3.46Å; G799-N803 WeakPolarHBondContact O-CB 3.38Å; G799-N803 PolarHBondContact O-N 3.28Å
800	L	94.8	Very high	93.8	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-68.9	-30.9	-179.2	-159.2	67.9	0	0	0	112.6	L796 M797 G802 N803 V806 L809 N831 L834	L796-L800 WeakPolarHBondContact O-CB 3.34Å; L796-L800 PolarHBondContact O-N 3.36Å; M797-L800 HydrophobicContact CE-CD2 4.36Å; M797-L800 PolarHBondContact O-N 3.45Å; M797-L800 HydrophobicContact SD-CB 4.48Å; M797-L800 HydrophobicContact SD-CD2 3.98Å; L800-G802 VanDerWaalsContact C-N 3.28Å; L800-G802 PolarHBondContact O-N 2.9Å; L800-N803 PolarHBondContact O-N 2.87Å; L800-V806 HydrophobicContact CD1-CB 3.96Å; L800-V806 HydrophobicContact CD1-CG1 4.02Å; L800-V806 HydrophobicContact CD1-CG2 4.43Å; L800-L809 HydrophobicContact CD2-CD2 3.97Å; L800-N831 HydrophobicContact CG-CB 4.39Å; L800-N831 PolarHBondContact O-ND2 3.04Å; L800-L834 HydrophobicContact CD2-CD2 4.36Å
801	A	93.7	Very high	93.7	Very high	37 Å²	37	27.1 Å²	27.1	31%	0.306	18%	0.177	S	C	.	.	H	α-helix	trans	-61.3	-35.5	174.5	0	0	0	0	0	112.6	M797 G799 R830	M797-A801 WeakPolarHBondContact O-CB 3.47Å; M797-A801 PolarHBondContact O-N 3.5Å; G799-A801 VanDerWaalsContact C-N 3.33Å; G799-A801 PolarHBondContact O-N 2.9Å; A801-R830 HydrophobicContact CB-CB 3.72Å
802	G	89.7	Confident	93.2	Very high	49 Å²	49	25.8 Å²	25.8	51%	0.505	16%	0.161	S	C	.	.	H	α-helix	trans	-90.2	-7.2	176.1	0	0	0	0	0	114.6	G799 L800	G799-G802 PolarHBondContact O-N 3.46Å; L800-G802 VanDerWaalsContact C-N 3.28Å; L800-G802 PolarHBondContact O-N 2.9Å
803	N	95.4	Very high	92.5	Very high	7 Å²	7	26.5 Å²	26.5	4%	0.037	17%	0.165	C	C	.	.			trans	-92	139.9	-175.6	-176.2	-88.7	0	0	0	112.1	L771 G799 L800 S805 V806 N831	L771-N803 HydrophobicContact CB-CB 4.31Å; L771-N803 PolarHBondContact O-ND2 2.94Å; G799-N803 WeakPolarHBondContact O-CB 3.38Å; G799-N803 PolarHBondContact O-N 3.28Å; L800-N803 PolarHBondContact O-N 2.87Å; N803-S805 PolarHBondContact ND2-OG 3.22Å; N803-S805 PolarHBondContact OD1-N 3.49Å; N803-S805 PolarHBondContact OD1-OG 2.96Å; N803-V806 WeakPolarHBondContact OD1-CB 3.2Å; N803-V806 WeakPolarHBondContact OD1-CG2 3.47Å; N803-V806 PolarHBondContact OD1-N 2.99Å; N803-N831 PolarHBondContact O-ND2 3.4Å
804	T	93.8	Very high	91.6	Very high	114 Å²	114	26.5 Å²	26.5	70%	0.699	17%	0.165	S	C	*	.	S	Bend	trans	-120.1	2.2	179.6	55.8	0	0	0	0	113.8
805	S	95.7	Very high	90.9	Very high	22 Å²	22	27 Å²	27	15%	0.154	17%	0.172	C	C	.	.	S	Bend	trans	-101.9	-34.6	-175.4	45.4	0	0	0	0	113.6	C776 I778 T779 N803 T807	C776-S805 WeakPolarHBondContact O-CB 3.25Å; C776-S805 PolarHBondContact O-OG 3.44Å; I778-S805 CarbonylContact O-C 3.55Å; I778-S805 WeakPolarHBondContact O-CB 3.21Å; I778-S805 PolarHBondContact O-OG 2.94Å; T779-S805 WeakPolarHBondContact CA-O 3.26Å; N803-S805 PolarHBondContact ND2-OG 3.22Å; N803-S805 PolarHBondContact OD1-N 3.49Å; N803-S805 PolarHBondContact OD1-OG 2.96Å; S805-T807 PolarHBondContact O-N 3.37Å
806	V	97	Very high	90.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	17%	0.165	C	C	.	.			trans	-72.5	122.5	-176	177.1	0	0	0	0	110.4	L771 I778 L800 N803 L809 L834	L771-V806 HydrophobicContact CD2-CG2 3.68Å; I778-V806 HydrophobicContact CB-CG2 4.49Å; I778-V806 HydrophobicContact CG2-CG2 4.35Å; I778-V806 VanDerWaalsContact O-CA 3.3Å; I778-V806 WeakPolarHBondContact O-CA 3.3Å; I778-V806 VanDerWaalsContact O-CG2 3.27Å; I778-V806 WeakPolarHBondContact O-CG2 3.27Å; I778-V806 PolarHBondContact O-N 3.12Å; I778-V806 VanDerWaalsContact O-N 3.12Å; L800-V806 HydrophobicContact CD1-CB 3.96Å; L800-V806 HydrophobicContact CD1-CG1 4.02Å; L800-V806 HydrophobicContact CD1-CG2 4.43Å; N803-V806 WeakPolarHBondContact OD1-CB 3.2Å; N803-V806 WeakPolarHBondContact OD1-CG2 3.47Å; N803-V806 PolarHBondContact OD1-N 2.99Å; V806-L809 HydrophobicContact CG1-CB 4.46Å; V806-L834 HydrophobicContact CG1-CD1 4.17Å
807	T	93.6	Very high	90.2	Very high	27 Å²	27	26.6 Å²	26.6	17%	0.166	18%	0.176	C	C	.	.			trans	-113.8	-25.6	175.7	50.3	0	0	0	0	111.7	T779 S805 Q835 E836	T779-T807 PolarHBondContact O-N 3.38Å; T779-T807 PolarHBondContact O-OG1 2.88Å; T779-T807 VanDerWaalsContact O-OG1 3.08Å; S805-T807 PolarHBondContact O-N 3.37Å; T807-Q835 HydrophobicContact CG2-CG 4.5Å; T807-Q835 WeakPolarHBondContact O-CA 3.44Å; T807-Q835 PolarHBondContact O-N 3.26Å; T807-E836 PolarHBondContact O-N 3.11Å
808	H	91.4	Very high	90.1	Very high	59 Å²	59	29.5 Å²	29.5	27%	0.273	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.3	-178.5	-60.6	64.7	0	0	0	109.9	T779 T780 L781 E836	T779-H808 PolarHBondContact O-N 2.88Å; T780-H808 WeakPolarHBondContact CA-O 3.08Å; T780-H808 HydrophobicContact CG2-CB 3.94Å; L781-H808 PolarHBondContact N-O 3.38Å; H808-E836 WeakPolarHBondContact CA-O 3.47Å; H808-E836 HydrophobicContact CB-CB 4.42Å; H808-E836 IonicContact CD2-OE2 3.64Å; H808-E836 PolarHBondContact CD2-OE2 2.77Å; H808-E836 VanDerWaalsContact CD2-OE2 3.25Å; H808-E836 IonicContact NE2-OE2 2.76Å
809	L	95.2	Very high	90.2	Very high	5 Å²	5	31.5 Å²	31.5	3%	0.026	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.9	178.8	178.6	60	0	0	0	110.4	L781 L796 L800 V806 L811 L834 E836 L837 N838	L781-L809 HydrophobicContact CB-CD1 4.1Å; L781-L809 HydrophobicContact CD2-CD1 4.1Å; L781-L809 HydrophobicContact CG-CD1 4.11Å; L781-L809 WeakPolarHBondContact O-CA 3.39Å; L796-L809 HydrophobicContact CD2-CD1 4.4Å; L796-L809 HydrophobicContact CD2-CD2 4.34Å; L800-L809 HydrophobicContact CD2-CD2 3.97Å; V806-L809 HydrophobicContact CG1-CB 4.46Å; L809-L811 HydrophobicContact CD1-CD2 4.04Å; L809-L811 HydrophobicContact CD1-CG 4.37Å; L809-L811 HydrophobicContact CD2-CD1 4.15Å; L809-L811 HydrophobicContact CD2-CG 4.27Å; L809-L811 HydrophobicContact CG-CD1 4.46Å; L809-L811 HydrophobicContact CG-CD2 4.27Å; L809-L811 HydrophobicContact CG-CG 4.05Å; L809-L834 HydrophobicContact CB-CD1 3.85Å; L809-E836 PolarHBondContact N-O 2.75Å; L809-L837 HydrophobicContact CB-CD1 4.2Å; L809-L837 HydrophobicContact CD2-CD1 4.05Å; L809-L837 HydrophobicContact CG-CD1 4.16Å; L809-L837 WeakPolarHBondContact O-CA 3.11Å; L809-N838 PolarHBondContact O-N 3.44Å
810	S	88.4	Confident	90.2	Very high	19 Å²	19	31.5 Å²	31.5	13%	0.133	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.9	172.9	-177.8	0	0	0	0	112.1	L781 L783 S784	L781-S810 PolarHBondContact O-N 3.36Å; L783-S810 PolarHBondContact N-O 3.49Å; S784-S810 PolarHBondContact OG-OG 3.06Å
811	L	88.8	Confident	90.3	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	20%	0.2	C	C	.	.			trans	-118.7	27.2	175.5	-55.2	178.5	0	0	0	110.9	L783 L788 V793 L796 L809 H813 T814 L816 L824 N838 V839 N842	L783-L811 HydrophobicContact CB-CD2 4.2Å; L783-L811 HydrophobicContact CD1-CD2 4.01Å; L788-L811 HydrophobicContact CD1-CD2 4.02Å; V793-L811 HydrophobicContact CG2-CD1 3.76Å; L796-L811 HydrophobicContact CD2-CD1 4.43Å; L796-L811 HydrophobicContact CD2-CD2 3.7Å; L809-L811 HydrophobicContact CD1-CD2 4.04Å; L809-L811 HydrophobicContact CD1-CG 4.37Å; L809-L811 HydrophobicContact CD2-CD1 4.15Å; L809-L811 HydrophobicContact CD2-CG 4.27Å; L809-L811 HydrophobicContact CG-CD1 4.46Å; L809-L811 HydrophobicContact CG-CD2 4.27Å; L809-L811 HydrophobicContact CG-CG 4.05Å; L811-H813 PolarHBondContact O-N 3.39Å; L811-T814 HydrophobicContact CB-CG2 4.35Å; L811-T814 WeakPolarHBondContact O-CG2 3.4Å; L811-T814 PolarHBondContact O-OG1 2.79Å; L811-L816 HydrophobicContact CB-CD1 4.29Å; L811-L816 HydrophobicContact CD1-CD1 4.35Å; L811-L824 HydrophobicContact CD1-CD1 4.28Å; L811-L824 HydrophobicContact CD1-CD2 4.44Å; L811-N838 CarbonylContact C-O 3.57Å; L811-N838 WeakPolarHBondContact CA-O 3.39Å; L811-N838 PolarHBondContact N-O 3.28Å; L811-V839 HydrophobicContact CB-CG1 4.38Å; L811-V839 HydrophobicContact CD1-CG1 4.41Å; L811-N842 PolarHBondContact O-ND2 2.89Å
812	L	81.9	Confident	90.4	Very high	33 Å²	33	34.4 Å²	34.4	17%	0.173	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	129	177.3	178.3	151.9	0	0	0	110.4	S784 N785 N838 A840 Y868	S784-L812 CarbonylContact C-O 3.57Å; S784-L812 WeakPolarHBondContact CA-O 3.49Å; S784-L812 WeakPolarHBondContact CB-O 3.44Å; N785-L812 PolarHBondContact N-O 3.23Å; L812-N838 PolarHBondContact N-O 3.49Å; L812-A840 VanDerWaalsContact CA-O 3.3Å; L812-A840 WeakPolarHBondContact CA-O 3.39Å; L812-A840 HydrophobicContact CD1-CB 4.08Å; L812-A840 HydrophobicContact CG-CB 4.31Å; L812-Y868 HydrophobicContact CD1-CE2 3.93Å; L812-Y868 WeakPolarHBondContact CD1-OH 3.28Å
813	H	78.6	Confident	90.8	Very high	15 Å²	15	34.3 Å²	34.3	7%	0.069	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	63.6	179.4	-162.4	61.8	0	0	0	113.3	H134 N785 L811 A840 Y841	H134-H813 AromaticContact CE1-CE1 3.96Å; N785-H813 WeakPolarHBondContact CA-O 3.47Å; N785-H813 PolarHBondContact N-O 3.41Å; N785-H813 VanDerWaalsContact N-O 3.12Å; N785-H813 WeakPolarHBondContact OD1-CB 3.14Å; N785-H813 PolarHBondContact OD1-CD2 3.05Å; L811-H813 PolarHBondContact O-N 3.39Å; H813-A840 PolarHBondContact N-O 3.36Å; H813-Y841 VanDerWaalsContact CA-O 3.27Å; H813-Y841 WeakPolarHBondContact CA-O 3.35Å; H813-Y841 HydrophobicContact CB-CD1 3.94Å; H813-Y841 HydrophobicContact CB-CG 4.31Å; H813-Y841 AromaticContact CE1-CE1 3.82Å; H813-Y841 AromaticContact CE1-CZ 3.91Å; H813-Y841 AromaticContact CG-CD1 3.8Å; H813-Y841 AromaticContact ND1-CD1 3.44Å; H813-Y841 WeakPolarHBondContact ND1-CD1 3.41Å; H813-Y841 AromaticContact ND1-CE1 3.54Å; H813-Y841 AromaticContact ND1-CG 3.71Å; H813-Y841 AromaticContact ND1-CZ 3.87Å; H813-Y841 PolarHBondContact ND1-O 2.78Å
814	T	74.3	Confident	90.8	Very high	1 Å²	1	34 Å²	34	1%	0.006	19%	0.194	C	C	.	.	S	Bend	trans	-119.4	8.8	177.9	59.3	0	0	0	0	114.4	L783 N786 L788 M789 L811 L816 N842	L783-T814 WeakPolarHBondContact O-CG2 3.08Å; N786-T814 CarbonylContact O-C 3.57Å; N786-T814 WeakPolarHBondContact O-CA 3.19Å; N786-T814 WeakPolarHBondContact O-CB 3.46Å; N786-T814 WeakPolarHBondContact O-CG2 3.39Å; L788-T814 HydrophobicContact CD1-CG2 3.95Å; L788-T814 HydrophobicContact CG-CG2 4.17Å; L788-T814 PolarHBondContact N-O 2.72Å; L788-T814 VanDerWaalsContact N-O 3.17Å; M789-T814 PolarHBondContact N-O 2.64Å; L811-T814 HydrophobicContact CB-CG2 4.35Å; L811-T814 WeakPolarHBondContact O-CG2 3.4Å; L811-T814 PolarHBondContact O-OG1 2.79Å; T814-L816 WeakPolarHBondContact OG1-CG 3.35Å; T814-N842 WeakPolarHBondContact CA-OD1 3.29Å; T814-N842 PolarHBondContact N-OD1 2.8Å; T814-N842 PolarHBondContact OG1-OD1 3.29Å
815	G	80.6	Confident	90.9	Very high	38 Å²	38	29.4 Å²	29.4	39%	0.392	17%	0.168	S	C	.	.			trans	69.7	35.2	177.3	0	0	0	0	0	113.5	M789 N842	M789-G815 WeakPolarHBondContact CA-O 3.44Å; G815-N842 PolarHBondContact N-OD1 3.45Å; G815-N842 VanDerWaalsContact N-OD1 3.12Å
816	L	87.9	Confident	90.8	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	19%	0.186	C	C	.	.			trans	-67.1	-39.8	-177.4	-58.4	177.7	0	0	0	113.1	V793 L811 T814 G820 L821 L824 V839 N842	V793-L816 HydrophobicContact CB-CD2 3.67Å; V793-L816 HydrophobicContact CG1-CD2 4.28Å; V793-L816 HydrophobicContact CG2-CD1 4.49Å; V793-L816 HydrophobicContact CG2-CD2 3.52Å; L811-L816 HydrophobicContact CB-CD1 4.29Å; L811-L816 HydrophobicContact CD1-CD1 4.35Å; T814-L816 WeakPolarHBondContact OG1-CG 3.35Å; L816-G820 WeakPolarHBondContact O-CA 3.42Å; L816-G820 PolarHBondContact O-N 3.25Å; L816-L821 HydrophobicContact CB-CD1 3.8Å; L816-L821 HydrophobicContact CD1-CD1 3.87Å; L816-L821 HydrophobicContact CG-CD1 4.5Å; L816-L824 HydrophobicContact CD1-CD1 3.85Å; L816-V839 HydrophobicContact CD1-CB 4.45Å; L816-V839 HydrophobicContact CD1-CG1 4.15Å; L816-N842 HydrophobicContact CB-CB 3.95Å; L816-N842 HydrophobicContact CD1-CB 4.41Å; L816-N842 HydrophobicContact CG-CB 4.28Å; L816-N842 WeakPolarHBondContact CG-OD1 3.48Å; L816-N842 PolarHBondContact N-OD1 3.22Å
817	G	90.2	Very high	90.7	Very high	22 Å²	22	33.6 Å²	33.6	23%	0.227	20%	0.196	C	C	.	.	H	α-helix	trans	59.6	-167.9	-170.7	0	0	0	0	0	113.2	L821 N842	G817-L821 PolarHBondContact O-N 3.13Å; G817-N842 WeakPolarHBondContact CA-O 3.27Å; G817-N842 PolarHBondContact N-O 3.48Å
818	D	92.9	Very high	90.7	Very high	64 Å²	64	32.4 Å²	32.4	34%	0.342	19%	0.188	S	C	.	.	H	α-helix	trans	-61.8	-47.2	176.2	-73.5	-22.1	0	0	0	112	G820 L821 E822 A844 G845 A848	D818-G820 VanDerWaalsContact C-N 3.31Å; D818-G820 PolarHBondContact O-N 2.81Å; D818-L821 PolarHBondContact O-N 2.92Å; D818-L821 VanDerWaalsContact O-N 3.15Å; D818-E822 WeakPolarHBondContact O-CG 3.35Å; D818-E822 PolarHBondContact O-N 3.07Å; D818-A844 VanDerWaalsContact OD1-CA 3.28Å; D818-A844 WeakPolarHBondContact OD1-CA 3.37Å; D818-G845 PolarHBondContact OD1-N 3.47Å; D818-A848 HydrophobicContact CB-CB 3.92Å; D818-A848 WeakPolarHBondContact OD1-CB 3.46Å
819	E	95.8	Very high	90.7	Very high	144 Å²	144	34.6 Å²	34.6	67%	0.673	20%	0.202	S	C	*	.	H	α-helix	trans	-55.3	-45.1	-179.3	-174.5	-175.3	178.9	0	0	112	A790 L823	A790-E819 HydrophobicContact CB-CB 4.08Å; A790-E819 HydrophobicContact CB-CG 3.87Å; E819-L823 WeakPolarHBondContact O-CB 3.35Å; E819-L823 PolarHBondContact O-N 3.48Å
820	G	95.1	Very high	90.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-68.2	-38.2	179.3	0	0	0	0	0	113.2	L816 D818 L823 L824	L816-G820 WeakPolarHBondContact O-CA 3.42Å; L816-G820 PolarHBondContact O-N 3.25Å; D818-G820 VanDerWaalsContact C-N 3.31Å; D818-G820 PolarHBondContact O-N 2.81Å; G820-L823 PolarHBondContact O-N 2.74Å; G820-L824 WeakPolarHBondContact O-CG 3.41Å; G820-L824 PolarHBondContact O-N 3.44Å
821	L	96.6	Very high	90.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-71.2	-37.7	177	-96.3	72.2	0	0	0	112.5	L816 G817 D818 L823 L824 A825 V839 N842 A844 A848 L852 L867	L816-L821 HydrophobicContact CB-CD1 3.8Å; L816-L821 HydrophobicContact CD1-CD1 3.87Å; L816-L821 HydrophobicContact CG-CD1 4.5Å; G817-L821 PolarHBondContact O-N 3.13Å; D818-L821 PolarHBondContact O-N 2.92Å; D818-L821 VanDerWaalsContact O-N 3.15Å; L821-L823 VanDerWaalsContact C-N 3.34Å; L821-L824 WeakPolarHBondContact O-CB 3.34Å; L821-L824 PolarHBondContact O-N 3.49Å; L821-A825 WeakPolarHBondContact O-CB 3.44Å; L821-A825 PolarHBondContact O-N 2.75Å; L821-V839 HydrophobicContact CD1-CB 4.48Å; L821-N842 HydrophobicContact CD1-CB 4.2Å; L821-A844 HydrophobicContact CD1-CB 4.07Å; L821-A844 HydrophobicContact CD2-CB 3.52Å; L821-A844 HydrophobicContact CG-CB 4.22Å; L821-A848 HydrophobicContact CB-CB 4.01Å; L821-L852 HydrophobicContact CD2-CD2 4.14Å; L821-L852 HydrophobicContact CG-CD2 3.98Å; L821-L867 HydrophobicContact CD2-CD2 3.93Å
822	E	96.5	Very high	91	Very high	98 Å²	98	48.8 Å²	48.8	46%	0.458	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-40.2	173.9	-72.1	179.5	173.6	0	0	111.3	D818 A825 A826 A848	D818-E822 WeakPolarHBondContact O-CG 3.35Å; D818-E822 PolarHBondContact O-N 3.07Å; E822-A825 WeakPolarHBondContact O-CB 3.07Å; E822-A825 PolarHBondContact O-N 2.82Å; E822-A826 WeakPolarHBondContact O-CB 3.43Å; E822-A826 PolarHBondContact O-N 2.95Å; E822-A848 HydrophobicContact CG-CB 3.98Å
823	L	96.4	Very high	91.5	Very high	47 Å²	47	51.5 Å²	51.5	25%	0.246	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-46.7	173.3	-167.5	155.6	0	0	0	111.3	V793 A794 M797 E819 G820 L821 A825 A826 Q827	V793-L823 HydrophobicContact CG1-CD2 3.99Å; A794-L823 HydrophobicContact CB-CD1 3.57Å; A794-L823 HydrophobicContact CB-CD2 4.3Å; M797-L823 HydrophobicContact CB-CD2 4.35Å; M797-L823 HydrophobicContact CG-CD2 4.11Å; E819-L823 WeakPolarHBondContact O-CB 3.35Å; E819-L823 PolarHBondContact O-N 3.48Å; G820-L823 PolarHBondContact O-N 2.74Å; L821-L823 VanDerWaalsContact C-N 3.34Å; L823-A825 VanDerWaalsContact C-N 3.31Å; L823-A825 PolarHBondContact O-N 3.21Å; L823-A826 PolarHBondContact O-N 2.89Å; L823-Q827 HydrophobicContact CD2-CG 3.96Å; L823-Q827 WeakPolarHBondContact O-CB 3.25Å; L823-Q827 VanDerWaalsContact O-CG 3.3Å; L823-Q827 WeakPolarHBondContact O-CG 3.46Å; L823-Q827 PolarHBondContact O-N 2.9Å; L823-Q827 VanDerWaalsContact O-N 3.14Å
824	L	96.1	Very high	92.2	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-55.6	-48	174.5	-75.9	173.6	0	0	0	110.7	V793 M797 L811 L816 G820 L821 A826 Q827 L828 V839 L852	V793-L824 HydrophobicContact CG1-CD2 4.5Å; V793-L824 HydrophobicContact CG1-CG 4.3Å; V793-L824 HydrophobicContact CG2-CD1 4.46Å; V793-L824 HydrophobicContact CG2-CD2 4.02Å; V793-L824 HydrophobicContact CG2-CG 4.29Å; M797-L824 HydrophobicContact CE-CD2 4.46Å; M797-L824 HydrophobicContact CG-CD2 3.71Å; M797-L824 HydrophobicContact SD-CD2 3.41Å; M797-L824 WeakPolarHBondContact SD-CD2 3.39Å; L811-L824 HydrophobicContact CD1-CD1 4.28Å; L811-L824 HydrophobicContact CD1-CD2 4.44Å; L816-L824 HydrophobicContact CD1-CD1 3.85Å; G820-L824 WeakPolarHBondContact O-CG 3.41Å; G820-L824 PolarHBondContact O-N 3.44Å; L821-L824 WeakPolarHBondContact O-CB 3.34Å; L821-L824 PolarHBondContact O-N 3.49Å; L824-A826 VanDerWaalsContact C-N 3.3Å; L824-A826 PolarHBondContact O-N 2.9Å; L824-Q827 PolarHBondContact O-N 3.18Å; L824-L828 VanDerWaalsContact O-CB 3.31Å; L824-L828 WeakPolarHBondContact O-CB 3.41Å; L824-L828 PolarHBondContact O-N 2.85Å; L824-V839 HydrophobicContact CD1-CG1 3.61Å; L824-L852 HydrophobicContact CB-CD1 3.98Å
825	A	95.7	Very high	92.9	Very high	18 Å²	18	54 Å²	54	15%	0.149	28%	0.276	C	S	.	.	H	α-helix	trans	-58.2	-41.3	179.1	0	0	0	0	0	112.4	L821 E822 L823 Q827 A851 L852 A855	L821-A825 WeakPolarHBondContact O-CB 3.44Å; L821-A825 PolarHBondContact O-N 2.75Å; E822-A825 WeakPolarHBondContact O-CB 3.07Å; E822-A825 PolarHBondContact O-N 2.82Å; L823-A825 VanDerWaalsContact C-N 3.31Å; L823-A825 PolarHBondContact O-N 3.21Å; A825-Q827 VanDerWaalsContact C-N 3.31Å; A825-Q827 PolarHBondContact O-N 2.95Å; A825-A851 HydrophobicContact CB-CB 4.27Å; A825-L852 HydrophobicContact CB-CB 4.23Å; A825-L852 HydrophobicContact CB-CD1 4.23Å; A825-A855 HydrophobicContact CB-CB 4.08Å; A825-A855 WeakPolarHBondContact O-CB 3.49Å
826	A	94.8	Very high	93.2	Very high	65 Å²	65	54.9 Å²	54.9	54%	0.537	27%	0.27	S	S	.	.	H	α-helix	trans	-75	-15.3	-178.9	0	0	0	0	0	114.6	E822 L823 L824	E822-A826 WeakPolarHBondContact O-CB 3.43Å; E822-A826 PolarHBondContact O-N 2.95Å; L823-A826 PolarHBondContact O-N 2.89Å; L824-A826 VanDerWaalsContact C-N 3.3Å; L824-A826 PolarHBondContact O-N 2.9Å
827	Q	94.4	Very high	93.5	Very high	45 Å²	45	54.8 Å²	54.8	21%	0.21	27%	0.269	C	S	.	.	H	α-helix	trans	-118.7	-7.8	-174.1	-60.1	-63.7	-58.2	0	0	113.5	M797 L823 L824 A825 D829 R830	M797-Q827 HydrophobicContact CB-CB 4.14Å; M797-Q827 HydrophobicContact CE-CB 3.75Å; M797-Q827 WeakPolarHBondContact CE-O 3.32Å; M797-Q827 HydrophobicContact CG-CB 4.31Å; L823-Q827 HydrophobicContact CD2-CG 3.96Å; L823-Q827 WeakPolarHBondContact O-CB 3.25Å; L823-Q827 VanDerWaalsContact O-CG 3.3Å; L823-Q827 WeakPolarHBondContact O-CG 3.46Å; L823-Q827 PolarHBondContact O-N 2.9Å; L823-Q827 VanDerWaalsContact O-N 3.14Å; L824-Q827 PolarHBondContact O-N 3.18Å; A825-Q827 VanDerWaalsContact C-N 3.31Å; A825-Q827 PolarHBondContact O-N 2.95Å; Q827-D829 VanDerWaalsContact C-N 3.3Å; Q827-D829 PolarHBondContact O-N 2.95Å; Q827-R830 WeakPolarHBondContact O-CB 3.48Å; Q827-R830 PolarHBondContact O-N 2.84Å; Q827-R830 VanDerWaalsContact OE1-CD 3.28Å
828	L	93.2	Very high	93.3	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-61.6	-37.2	-172.6	-165.4	61.5	0	0	0	112.6	L824 R830 N831 L834 L837 L852 A855 A856 H859 L862	L824-L828 VanDerWaalsContact O-CB 3.31Å; L824-L828 WeakPolarHBondContact O-CB 3.41Å; L824-L828 PolarHBondContact O-N 2.85Å; L828-R830 PolarHBondContact O-N 3.05Å; L828-N831 PolarHBondContact O-N 3.18Å; L828-L834 HydrophobicContact CD1-CD2 4.02Å; L828-L837 HydrophobicContact CD1-CD2 4.12Å; L828-L852 HydrophobicContact CD2-CD1 4.14Å; L828-A855 HydrophobicContact CD2-CB 4.43Å; L828-A856 HydrophobicContact CD2-CB 4.29Å; L828-H859 PolarHBondContact O-CD2 2.86Å; L828-H859 VanDerWaalsContact O-CD2 3.28Å; L828-H859 PolarHBondContact O-NE2 3.22Å; L828-L862 HydrophobicContact CD2-CD2 4.29Å
829	D	90.9	Very high	93.1	Very high	106 Å²	106	51.3 Å²	51.3	57%	0.567	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-65.1	-16.3	-179	71.6	-35.2	0	0	0	114.5	Q827 N831	Q827-D829 VanDerWaalsContact C-N 3.3Å; Q827-D829 PolarHBondContact O-N 2.95Å; D829-N831 VanDerWaalsContact C-N 3.31Å; D829-N831 CarbonylContact C-O 3.5Å
830	R	92.6	Very high	92.2	Very high	144 Å²	144	44.5 Å²	44.5	54%	0.543	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-72.2	-26.5	175.8	-60.8	-173.5	171.9	-172.8	0.2	112.4	A801 Q827 L828	A801-R830 HydrophobicContact CB-CB 3.72Å; Q827-R830 WeakPolarHBondContact O-CB 3.48Å; Q827-R830 PolarHBondContact O-N 2.84Å; Q827-R830 VanDerWaalsContact OE1-CD 3.28Å; L828-R830 PolarHBondContact O-N 3.05Å
831	N	93.9	Very high	91.3	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.011	23%	0.227	C	C	.	.			trans	-91.5	155	168.7	-170.8	-88.9	0	0	0	109.7	L800 N803 L828 D829 Q833 L834 H859	L800-N831 HydrophobicContact CG-CB 4.39Å; L800-N831 PolarHBondContact O-ND2 3.04Å; N803-N831 PolarHBondContact O-ND2 3.4Å; L828-N831 PolarHBondContact O-N 3.18Å; D829-N831 VanDerWaalsContact C-N 3.31Å; D829-N831 CarbonylContact C-O 3.5Å; N831-Q833 PolarHBondContact OD1-N 2.65Å; N831-L834 WeakPolarHBondContact OD1-CB 3.47Å; N831-L834 PolarHBondContact OD1-N 2.9Å; N831-H859 PolarHBondContact O-NE2 3.08Å
832	R	91.8	Very high	90.5	Very high	177 Å²	177	48.2 Å²	48.2	67%	0.668	23%	0.229	S	C	*	.	S	Bend	trans	-135.1	8.3	177.1	-62.7	-164.6	176.9	174.6	0.3	114.1	P860 S861	R832-P860 HydrophobicContact CB-CG 4.03Å; R832-P860 HydrophobicContact CG-CG 3.97Å; R832-S861 WeakPolarHBondContact O-CB 3.42Å; R832-S861 PolarHBondContact O-OG 3.39Å
833	Q	92.9	Very high	89.6	Confident	89 Å²	89	45.3 Å²	45.3	42%	0.416	23%	0.225	S	C	.	.			trans	-115.9	-16.8	-175.2	-55.1	-57.5	-33	0	0	112.9	N831 Q835 S861	N831-Q833 PolarHBondContact OD1-N 2.65Å; Q833-Q835 PolarHBondContact O-N 3.42Å; Q833-S861 PolarHBondContact N-OG 3.21Å
834	L	93.8	Very high	89.3	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.			trans	-65.5	124	-176.9	-165	69.8	0	0	0	111.3	L800 V806 L809 L828 N831 L837 H859 S861 L862	L800-L834 HydrophobicContact CD2-CD2 4.36Å; V806-L834 HydrophobicContact CG1-CD1 4.17Å; L809-L834 HydrophobicContact CB-CD1 3.85Å; L828-L834 HydrophobicContact CD1-CD2 4.02Å; N831-L834 WeakPolarHBondContact OD1-CB 3.47Å; N831-L834 PolarHBondContact OD1-N 2.9Å; L834-L837 HydrophobicContact CD2-CB 4.05Å; L834-L837 HydrophobicContact CD2-CD1 4.37Å; L834-L837 HydrophobicContact CD2-CD2 4.46Å; L834-H859 PolarHBondContact O-CE1 2.98Å; L834-H859 VanDerWaalsContact O-CE1 3.31Å; L834-S861 CarbonylContact O-C 3.57Å; L834-S861 PolarHBondContact O-OG 3.48Å; L834-L862 HydrophobicContact CB-CD1 4.28Å; L834-L862 HydrophobicContact CD2-CD1 4.02Å; L834-L862 HydrophobicContact CG-CD1 3.86Å; L834-L862 WeakPolarHBondContact O-CA 3.41Å; L834-L862 WeakPolarHBondContact O-CD1 3.35Å; L834-L862 PolarHBondContact O-N 2.89Å
835	Q	89.3	Confident	89	Confident	70 Å²	70	43.8 Å²	43.8	33%	0.327	22%	0.221	S	C	.	.			trans	-106.1	-39	-178.8	-68.1	173.3	-11.9	0	0	111.9	T807 Q833 S861 E863 L864	T807-Q835 HydrophobicContact CG2-CG 4.5Å; T807-Q835 WeakPolarHBondContact O-CA 3.44Å; T807-Q835 PolarHBondContact O-N 3.26Å; Q833-Q835 PolarHBondContact O-N 3.42Å; Q835-S861 WeakPolarHBondContact CA-O 3.4Å; Q835-E863 PolarHBondContact O-N 3.5Å; Q835-L864 PolarHBondContact O-N 3.34Å
836	E	87.1	Confident	88.8	Confident	56 Å²	56	45.4 Å²	45.4	26%	0.262	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.1	178.9	-175.8	175.6	165.2	0	0	111.1	T807 H808 L809 L864 H866	T807-E836 PolarHBondContact O-N 3.11Å; H808-E836 WeakPolarHBondContact CA-O 3.47Å; H808-E836 HydrophobicContact CB-CB 4.42Å; H808-E836 IonicContact CD2-OE2 3.64Å; H808-E836 PolarHBondContact CD2-OE2 2.77Å; H808-E836 VanDerWaalsContact CD2-OE2 3.25Å; H808-E836 IonicContact NE2-OE2 2.76Å; L809-E836 PolarHBondContact N-O 2.75Å; E836-L864 WeakPolarHBondContact CA-O 3.43Å; E836-L864 HydrophobicContact CB-CB 4.43Å; E836-L864 HydrophobicContact CG-CB 4.13Å; E836-L864 HydrophobicContact CG-CD2 4.05Å; E836-L864 HydrophobicContact CG-CG 4.19Å; E836-H866 IonicContact OE1-CD2 3.99Å; E836-H866 IonicContact OE1-CE1 3.42Å; E836-H866 IonicContact OE1-NE2 3.59Å; E836-H866 PolarHBondContact OE1-NE2 3.29Å
837	L	93.8	Very high	88.7	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.8	173.4	179.6	58.7	0	0	0	110.1	L809 L828 L834 V839 L852 L862 L864 L865 H866	L809-L837 HydrophobicContact CB-CD1 4.2Å; L809-L837 HydrophobicContact CD2-CD1 4.05Å; L809-L837 HydrophobicContact CG-CD1 4.16Å; L809-L837 WeakPolarHBondContact O-CA 3.11Å; L828-L837 HydrophobicContact CD1-CD2 4.12Å; L834-L837 HydrophobicContact CD2-CB 4.05Å; L834-L837 HydrophobicContact CD2-CD1 4.37Å; L834-L837 HydrophobicContact CD2-CD2 4.46Å; L837-V839 HydrophobicContact CD1-CG1 3.99Å; L837-V839 HydrophobicContact CD2-CG1 4.28Å; L837-V839 HydrophobicContact CG-CG1 3.97Å; L837-L852 HydrophobicContact CD2-CD1 4.47Å; L837-L862 HydrophobicContact CB-CD1 4.07Å; L837-L864 PolarHBondContact N-O 2.99Å; L837-L865 HydrophobicContact CB-CD1 4.16Å; L837-L865 HydrophobicContact CD2-CD1 4.06Å; L837-L865 HydrophobicContact CG-CD1 4.12Å; L837-L865 WeakPolarHBondContact O-CA 3.36Å; L837-H866 PolarHBondContact O-N 3.16Å
838	N	84.8	Confident	88.8	Confident	14 Å²	14	44.8 Å²	44.8	8%	0.075	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	112.8	172.6	-171.4	-17.2	0	0	0	110.9	L809 L811 L812 A840 H866 Y868	L809-N838 PolarHBondContact O-N 3.44Å; L811-N838 CarbonylContact C-O 3.57Å; L811-N838 WeakPolarHBondContact CA-O 3.39Å; L811-N838 PolarHBondContact N-O 3.28Å; L812-N838 PolarHBondContact N-O 3.49Å; N838-A840 WeakPolarHBondContact OD1-CB 3.47Å; N838-A840 PolarHBondContact OD1-N 2.79Å; N838-H866 HydrophobicContact CB-CB 4.12Å; N838-Y868 PolarHBondContact ND2-OH 3.17Å; N838-Y868 VanDerWaalsContact ND2-OH 3.1Å
839	V	89.4	Confident	88.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.22	C	C	.	.			trans	-123.1	26.6	175.2	-67.3	0	0	0	0	111.1	L811 L816 L821 L824 L837 N842 L852 L865 H866 L867 N870	L811-V839 HydrophobicContact CB-CG1 4.38Å; L811-V839 HydrophobicContact CD1-CG1 4.41Å; L816-V839 HydrophobicContact CD1-CB 4.45Å; L816-V839 HydrophobicContact CD1-CG1 4.15Å; L821-V839 HydrophobicContact CD1-CB 4.48Å; L824-V839 HydrophobicContact CD1-CG1 3.61Å; L837-V839 HydrophobicContact CD1-CG1 3.99Å; L837-V839 HydrophobicContact CD2-CG1 4.28Å; L837-V839 HydrophobicContact CG-CG1 3.97Å; V839-N842 PolarHBondContact O-ND2 3.14Å; V839-L852 HydrophobicContact CG1-CD2 4.44Å; V839-L852 HydrophobicContact CG2-CD2 3.63Å; V839-L865 HydrophobicContact CG2-CD1 4.08Å; V839-H866 CarbonylContact C-O 3.58Å; V839-H866 VanDerWaalsContact CG2-O 3.27Å; V839-H866 WeakPolarHBondContact CG2-O 3.38Å; V839-H866 PolarHBondContact N-O 3.32Å; V839-H866 VanDerWaalsContact N-O 3.14Å; V839-L867 HydrophobicContact CG2-CD2 3.68Å; V839-L867 HydrophobicContact CG2-CG 4.46Å; V839-N870 PolarHBondContact O-ND2 3.47Å; V839-N870 VanDerWaalsContact O-ND2 3.15Å
840	A	77	Confident	88.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	155.1	177.6	0	0	0	0	0	112.3	L812 H813 N838 N842 H866 Y868	L812-A840 VanDerWaalsContact CA-O 3.3Å; L812-A840 WeakPolarHBondContact CA-O 3.39Å; L812-A840 HydrophobicContact CD1-CB 4.08Å; L812-A840 HydrophobicContact CG-CB 4.31Å; H813-A840 PolarHBondContact N-O 3.36Å; N838-A840 WeakPolarHBondContact OD1-CB 3.47Å; N838-A840 PolarHBondContact OD1-N 2.79Å; A840-N842 PolarHBondContact O-N 2.94Å; A840-N842 PolarHBondContact O-ND2 2.76Å; A840-N842 VanDerWaalsContact O-ND2 3.07Å; A840-H866 PolarHBondContact N-O 3.42Å; A840-Y868 CarbonylContact C-O 3.58Å; A840-Y868 WeakPolarHBondContact CA-O 3.41Å; A840-Y868 HydrophobicContact CB-CD1 4Å; A840-Y868 HydrophobicContact CB-CD2 3.47Å; A840-Y868 VanDerWaalsContact CB-CD2 3.47Å; A840-Y868 HydrophobicContact CB-CE1 3.87Å; A840-Y868 HydrophobicContact CB-CE2 3.28Å; A840-Y868 HydrophobicContact CB-CG 3.81Å; A840-Y868 VanDerWaalsContact CB-CZ 3.49Å; A840-Y868 WeakPolarHBondContact CB-O 3.48Å
841	Y	77.3	Confident	89	Confident	72 Å²	72	36.3 Å²	36.3	28%	0.282	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	44	175.8	-162.2	-165.3	0	0	0	115.4	H813 Y868 F869	H813-Y841 VanDerWaalsContact CA-O 3.27Å; H813-Y841 WeakPolarHBondContact CA-O 3.35Å; H813-Y841 HydrophobicContact CB-CD1 3.94Å; H813-Y841 HydrophobicContact CB-CG 4.31Å; H813-Y841 AromaticContact CE1-CE1 3.82Å; H813-Y841 AromaticContact CE1-CZ 3.91Å; H813-Y841 AromaticContact CG-CD1 3.8Å; H813-Y841 AromaticContact ND1-CD1 3.44Å; H813-Y841 WeakPolarHBondContact ND1-CD1 3.41Å; H813-Y841 AromaticContact ND1-CE1 3.54Å; H813-Y841 AromaticContact ND1-CG 3.71Å; H813-Y841 AromaticContact ND1-CZ 3.87Å; H813-Y841 PolarHBondContact ND1-O 2.78Å; Y841-Y868 PolarHBondContact N-O 2.94Å; Y841-F869 WeakPolarHBondContact CA-O 3.39Å; Y841-F869 HydrophobicContact CD2-CB 4.22Å; Y841-F869 HydrophobicContact CG-CB 4.09Å
842	N	79.5	Confident	89	Confident	6 Å²	6	36.2 Å²	36.2	3%	0.032	19%	0.19	C	C	.	.	S	Bend	trans	-109.3	8.7	179.7	-82.4	-66.8	0	0	0	114.2	L811 T814 G815 L816 G817 L821 V839 A840 A844 N870	L811-N842 PolarHBondContact O-ND2 2.89Å; T814-N842 WeakPolarHBondContact CA-OD1 3.29Å; T814-N842 PolarHBondContact N-OD1 2.8Å; T814-N842 PolarHBondContact OG1-OD1 3.29Å; G815-N842 PolarHBondContact N-OD1 3.45Å; G815-N842 VanDerWaalsContact N-OD1 3.12Å; L816-N842 HydrophobicContact CB-CB 3.95Å; L816-N842 HydrophobicContact CD1-CB 4.41Å; L816-N842 HydrophobicContact CG-CB 4.28Å; L816-N842 WeakPolarHBondContact CG-OD1 3.48Å; L816-N842 PolarHBondContact N-OD1 3.22Å; G817-N842 WeakPolarHBondContact CA-O 3.27Å; G817-N842 PolarHBondContact N-O 3.48Å; L821-N842 HydrophobicContact CD1-CB 4.2Å; V839-N842 PolarHBondContact O-ND2 3.14Å; A840-N842 PolarHBondContact O-N 2.94Å; A840-N842 PolarHBondContact O-ND2 2.76Å; A840-N842 VanDerWaalsContact O-ND2 3.07Å; N842-A844 VanDerWaalsContact C-N 3.3Å; N842-A844 PolarHBondContact O-N 2.9Å; N842-N870 WeakPolarHBondContact CA-OD1 3.45Å; N842-N870 PolarHBondContact N-OD1 3.03Å
843	G	77.8	Confident	89	Confident	37 Å²	37	27.8 Å²	27.8	38%	0.381	16%	0.158	S	C	.	.			trans	69.4	24.7	176.3	0	0	0	0	0	114.1	N870	G843-N870 PolarHBondContact N-OD1 3.12Å
844	A	88.8	Confident	88.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.162	C	C	.	.			trans	-87.2	144.6	179.1	0	0	0	0	0	112.3	D818 L821 N842 A848 N870 E871	D818-A844 VanDerWaalsContact OD1-CA 3.28Å; D818-A844 WeakPolarHBondContact OD1-CA 3.37Å; L821-A844 HydrophobicContact CD1-CB 4.07Å; L821-A844 HydrophobicContact CD2-CB 3.52Å; L821-A844 HydrophobicContact CG-CB 4.22Å; N842-A844 VanDerWaalsContact C-N 3.3Å; N842-A844 PolarHBondContact O-N 2.9Å; A844-A848 HydrophobicContact CB-CB 4.47Å; A844-N870 PolarHBondContact N-OD1 3.03Å; A844-N870 WeakPolarHBondContact O-CB 3.32Å; A844-E871 CarbonylContact O-C 3.59Å; A844-E871 WeakPolarHBondContact O-CA 3.47Å; A844-E871 PolarHBondContact O-N 3.42Å
845	G	89.2	Confident	88.9	Confident	16 Å²	16	30.9 Å²	30.9	17%	0.165	17%	0.17	C	C	.	.			trans	-87.5	-178.5	175.3	0	0	0	0	0	113.9	D818 T847 A849	D818-G845 PolarHBondContact OD1-N 3.47Å; G845-T847 VanDerWaalsContact C-N 3.35Å; G845-T847 PolarHBondContact O-N 3.48Å; G845-A849 WeakPolarHBondContact O-CB 3.07Å; G845-A849 PolarHBondContact O-N 3.09Å; G845-A849 VanDerWaalsContact O-N 3.16Å
846	D	91.9	Very high	88.9	Confident	53 Å²	53	27.5 Å²	27.5	28%	0.283	16%	0.155	S	C	.	.	H	α-helix	trans	-59.2	-39.9	-172.2	-66.4	-26.2	0	0	0	113.9	L850 L872 S873	D846-L850 WeakPolarHBondContact O-CB 3.29Å; D846-L850 PolarHBondContact O-N 3.44Å; D846-L872 VanDerWaalsContact OD1-CA 3.23Å; D846-L872 WeakPolarHBondContact OD1-CA 3.18Å; D846-S873 PolarHBondContact OD1-N 2.91Å; D846-S873 WeakPolarHBondContact OD2-CB 3.38Å; D846-S873 PolarHBondContact OD2-OG 2.86Å
847	T	93.8	Very high	88.9	Confident	97 Å²	97	29.7 Å²	29.7	60%	0.595	16%	0.16	S	C	*	.	H	α-helix	trans	-67.4	-49.2	-175.2	45.9	0	0	0	0	111.9	G845 L850 A851	G845-T847 VanDerWaalsContact C-N 3.35Å; G845-T847 PolarHBondContact O-N 3.48Å; T847-L850 PolarHBondContact O-N 3.4Å; T847-A851 WeakPolarHBondContact O-CB 3.48Å; T847-A851 PolarHBondContact O-N 2.81Å
848	A	95.1	Very high	88.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-42.5	179.3	0	0	0	0	0	111.3	D818 L821 E822 A844 L850 A851 L852	D818-A848 HydrophobicContact CB-CB 3.92Å; D818-A848 WeakPolarHBondContact OD1-CB 3.46Å; L821-A848 HydrophobicContact CB-CB 4.01Å; E822-A848 HydrophobicContact CG-CB 3.98Å; A844-A848 HydrophobicContact CB-CB 4.47Å; A848-L850 PolarHBondContact O-N 3.34Å; A848-A851 PolarHBondContact O-N 2.98Å; A848-L852 PolarHBondContact O-N 2.98Å
849	A	92.6	Very high	88.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-40.4	176.1	0	0	0	0	0	112.6	G845 A853 L867 L872 L880	G845-A849 WeakPolarHBondContact O-CB 3.07Å; G845-A849 PolarHBondContact O-N 3.09Å; G845-A849 VanDerWaalsContact O-N 3.16Å; A849-A853 WeakPolarHBondContact O-CB 3.4Å; A849-A853 PolarHBondContact O-N 2.88Å; A849-L867 HydrophobicContact CB-CD1 4.22Å; A849-L867 HydrophobicContact CB-CD2 4.18Å; A849-L872 HydrophobicContact CB-CD2 3.4Å; A849-L880 HydrophobicContact CB-CD1 4.31Å
850	L	93.1	Very high	88.8	Confident	35 Å²	35	40.4 Å²	40.4	18%	0.183	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-40.1	175.3	-177.7	61	0	0	0	112.2	D846 T847 A848 A853 R854 V879 L880 L883	D846-L850 WeakPolarHBondContact O-CB 3.29Å; D846-L850 PolarHBondContact O-N 3.44Å; T847-L850 PolarHBondContact O-N 3.4Å; A848-L850 PolarHBondContact O-N 3.34Å; L850-A853 PolarHBondContact O-N 3Å; L850-R854 WeakPolarHBondContact O-CG 3.48Å; L850-R854 PolarHBondContact O-N 3.22Å; L850-V879 HydrophobicContact CD1-CG1 3.84Å; L850-V879 HydrophobicContact CD2-CG1 4.23Å; L850-L880 HydrophobicContact CD1-CD2 4.21Å; L850-L883 HydrophobicContact CD1-CD2 4.37Å
851	A	95.1	Very high	89.4	Confident	37 Å²	37	41.8 Å²	41.8	31%	0.306	23%	0.227	S	C	.	.	H	α-helix	trans	-59.7	-48.1	175.8	0	0	0	0	0	111.1	A825 T847 A848 R854 A855	A825-A851 HydrophobicContact CB-CB 4.27Å; T847-A851 WeakPolarHBondContact O-CB 3.48Å; T847-A851 PolarHBondContact O-N 2.81Å; A848-A851 PolarHBondContact O-N 2.98Å; A851-R854 PolarHBondContact O-N 3.33Å; A851-A855 PolarHBondContact O-N 3.33Å; A851-A855 VanDerWaalsContact O-N 3.08Å
852	L	95.4	Very high	89.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-40.8	177.1	-177.2	60.3	0	0	0	112.4	L821 L824 A825 L828 L837 V839 A848 R854 A855 A856 L865	L821-L852 HydrophobicContact CD2-CD2 4.14Å; L821-L852 HydrophobicContact CG-CD2 3.98Å; L824-L852 HydrophobicContact CB-CD1 3.98Å; A825-L852 HydrophobicContact CB-CB 4.23Å; A825-L852 HydrophobicContact CB-CD1 4.23Å; L828-L852 HydrophobicContact CD2-CD1 4.14Å; L837-L852 HydrophobicContact CD2-CD1 4.47Å; V839-L852 HydrophobicContact CG1-CD2 4.44Å; V839-L852 HydrophobicContact CG2-CD2 3.63Å; A848-L852 PolarHBondContact O-N 2.98Å; L852-R854 VanDerWaalsContact C-N 3.31Å; L852-R854 PolarHBondContact O-N 3.22Å; L852-A855 PolarHBondContact O-N 2.79Å; L852-A856 WeakPolarHBondContact O-CB 3.33Å; L852-A856 PolarHBondContact O-N 2.88Å; L852-L865 HydrophobicContact CD2-CD1 4.08Å; L852-L865 HydrophobicContact CG-CD1 4.3Å; L852-L865 HydrophobicContact CG-CD2 4.25Å
853	A	91.4	Very high	90.1	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-35.3	177.6	0	0	0	0	0	112.9	A849 L850 R857 L865 L867 L880 L883 V895	A849-A853 WeakPolarHBondContact O-CB 3.4Å; A849-A853 PolarHBondContact O-N 2.88Å; L850-A853 PolarHBondContact O-N 3Å; A853-R857 PolarHBondContact O-N 3.18Å; A853-R857 VanDerWaalsContact O-N 3.13Å; A853-L865 HydrophobicContact CB-CD2 4.26Å; A853-L867 HydrophobicContact CB-CD1 4.47Å; A853-L880 HydrophobicContact CB-CD2 3.45Å; A853-L880 VanDerWaalsContact CB-CD2 3.45Å; A853-L883 HydrophobicContact CB-CD2 3.82Å; A853-V895 HydrophobicContact CB-CG2 4.43Å
854	R	90.9	Very high	90.2	Very high	132 Å²	132	43.9 Å²	43.9	50%	0.498	23%	0.231	S	C	.	.	H	α-helix	trans	-67	-49.2	173.3	-73.6	175.2	-179.1	170.1	1.1	111.7	L850 A851 L852 A856 R857 E858 L883	L850-R854 WeakPolarHBondContact O-CG 3.48Å; L850-R854 PolarHBondContact O-N 3.22Å; A851-R854 PolarHBondContact O-N 3.33Å; L852-R854 VanDerWaalsContact C-N 3.31Å; L852-R854 PolarHBondContact O-N 3.22Å; R854-A856 VanDerWaalsContact C-N 3.3Å; R854-A856 PolarHBondContact O-N 3.08Å; R854-R857 WeakPolarHBondContact O-CB 3.38Å; R854-R857 PolarHBondContact O-N 3.33Å; R854-E858 PolarHBondContact O-N 2.94Å; R854-L883 HydrophobicContact CG-CD2 4.35Å
855	A	92.9	Very high	90.1	Very high	21 Å²	21	43.9 Å²	43.9	17%	0.174	23%	0.231	C	C	.	.	H	α-helix	trans	-59.6	-42.6	177.2	0	0	0	0	0	111.7	A825 L828 A851 L852 R857 E858 H859	A825-A855 HydrophobicContact CB-CB 4.08Å; A825-A855 WeakPolarHBondContact O-CB 3.49Å; L828-A855 HydrophobicContact CD2-CB 4.43Å; A851-A855 PolarHBondContact O-N 3.33Å; A851-A855 VanDerWaalsContact O-N 3.08Å; L852-A855 PolarHBondContact O-N 2.79Å; A855-R857 VanDerWaalsContact C-N 3.35Å; A855-R857 PolarHBondContact O-N 2.97Å; A855-E858 PolarHBondContact O-N 3.33Å; A855-H859 PolarHBondContact O-N 3.14Å; A855-H859 VanDerWaalsContact O-N 3.08Å
856	A	90.3	Very high	89.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-55.8	-47.1	174.6	0	0	0	0	0	111.9	L828 L852 R854 E858 H859 L862 L865 V893	L828-A856 HydrophobicContact CD2-CB 4.29Å; L852-A856 WeakPolarHBondContact O-CB 3.33Å; L852-A856 PolarHBondContact O-N 2.88Å; R854-A856 VanDerWaalsContact C-N 3.3Å; R854-A856 PolarHBondContact O-N 3.08Å; A856-E858 PolarHBondContact O-N 3.01Å; A856-H859 WeakPolarHBondContact O-CB 3.2Å; A856-H859 PolarHBondContact O-N 3.43Å; A856-L862 HydrophobicContact CB-CD2 3.5Å; A856-L862 VanDerWaalsContact CB-CD2 3.5Å; A856-L865 HydrophobicContact CB-CD2 3.83Å; A856-V893 HydrophobicContact CB-CG1 4.25Å; A856-V893 VanDerWaalsContact O-CG2 3.24Å; A856-V893 WeakPolarHBondContact O-CG2 3.45Å
857	R	86.8	Confident	89.2	Confident	101 Å²	101	41.3 Å²	41.3	38%	0.381	21%	0.213	S	C	.	.	H	α-helix	trans	-62.8	-29.7	179.9	-168.5	-176	64.9	-179.3	0.3	113.4	A853 R854 A855	A853-R857 PolarHBondContact O-N 3.18Å; A853-R857 VanDerWaalsContact O-N 3.13Å; R854-R857 WeakPolarHBondContact O-CB 3.38Å; R854-R857 PolarHBondContact O-N 3.33Å; A855-R857 VanDerWaalsContact C-N 3.35Å; A855-R857 PolarHBondContact O-N 2.97Å
858	E	88.3	Confident	88.3	Confident	151 Å²	151	37.7 Å²	37.7	71%	0.706	19%	0.188	S	C	*	.	H	α-helix	trans	-85.5	-12.4	176.7	-67.2	175.1	-170.2	0	0	112.6	R854 A855 A856	R854-E858 PolarHBondContact O-N 2.94Å; A855-E858 PolarHBondContact O-N 3.33Å; A856-E858 PolarHBondContact O-N 3.01Å
859	H	89.9	Confident	87.1	Confident	4 Å²	4	42 Å²	42	2%	0.019	21%	0.207	C	C	.	.	S	Bend	trans	-69.6	134.6	179.5	-171.3	-93.1	0	0	0	111.1	L828 N831 L834 A855 A856 S861 L862	L828-H859 PolarHBondContact O-CD2 2.86Å; L828-H859 VanDerWaalsContact O-CD2 3.28Å; L828-H859 PolarHBondContact O-NE2 3.22Å; N831-H859 PolarHBondContact O-NE2 3.08Å; L834-H859 PolarHBondContact O-CE1 2.98Å; L834-H859 VanDerWaalsContact O-CE1 3.31Å; A855-H859 PolarHBondContact O-N 3.14Å; A855-H859 VanDerWaalsContact O-N 3.08Å; A856-H859 WeakPolarHBondContact O-CB 3.2Å; A856-H859 PolarHBondContact O-N 3.43Å; H859-S861 VanDerWaalsContact C-N 3.3Å; H859-S861 PolarHBondContact CE1-OG 3.45Å; H859-S861 PolarHBondContact ND1-N 3.26Å; H859-S861 PolarHBondContact O-N 2.92Å; H859-L862 HydrophobicContact CB-CB 3.93Å; H859-L862 WeakPolarHBondContact ND1-CB 3.38Å; H859-L862 PolarHBondContact ND1-N 3.36Å; H859-L862 VanDerWaalsContact ND1-N 3.11Å
860	P	87.8	Confident	86.4	Confident	86 Å²	86	42.3 Å²	42.3	56%	0.558	21%	0.209	S	C	*	.	S	Bend	trans	-70.6	-18.9	-168.2	26.9	-36.6	0	0	0	115.3	R832	R832-P860 HydrophobicContact CB-CG 4.03Å; R832-P860 HydrophobicContact CG-CG 3.97Å
861	S	88.4	Confident	85.9	Confident	29 Å²	29	47.4 Å²	47.4	20%	0.203	23%	0.232	C	C	.	.	S	Bend	trans	-134.9	-0.6	-172.8	51.1	0	0	0	0	114.8	R832 Q833 L834 Q835 H859 E863	R832-S861 WeakPolarHBondContact O-CB 3.42Å; R832-S861 PolarHBondContact O-OG 3.39Å; Q833-S861 PolarHBondContact N-OG 3.21Å; L834-S861 CarbonylContact O-C 3.57Å; L834-S861 PolarHBondContact O-OG 3.48Å; Q835-S861 WeakPolarHBondContact CA-O 3.4Å; H859-S861 VanDerWaalsContact C-N 3.3Å; H859-S861 PolarHBondContact CE1-OG 3.45Å; H859-S861 PolarHBondContact ND1-N 3.26Å; H859-S861 PolarHBondContact O-N 2.92Å; S861-E863 PolarHBondContact O-N 2.84Å
862	L	88.1	Confident	85.2	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.026	22%	0.221	C	C	.	.			trans	-76.2	131.1	-178.5	-161.6	74.8	0	0	0	108.4	L828 L834 L837 A856 H859 V893	L828-L862 HydrophobicContact CD2-CD2 4.29Å; L834-L862 HydrophobicContact CB-CD1 4.28Å; L834-L862 HydrophobicContact CD2-CD1 4.02Å; L834-L862 HydrophobicContact CG-CD1 3.86Å; L834-L862 WeakPolarHBondContact O-CA 3.41Å; L834-L862 WeakPolarHBondContact O-CD1 3.35Å; L834-L862 PolarHBondContact O-N 2.89Å; L837-L862 HydrophobicContact CB-CD1 4.07Å; A856-L862 HydrophobicContact CB-CD2 3.5Å; A856-L862 VanDerWaalsContact CB-CD2 3.5Å; H859-L862 HydrophobicContact CB-CB 3.93Å; H859-L862 WeakPolarHBondContact ND1-CB 3.38Å; H859-L862 PolarHBondContact ND1-N 3.36Å; H859-L862 VanDerWaalsContact ND1-N 3.11Å; L862-V893 HydrophobicContact CB-CG2 4.36Å; L862-V893 VanDerWaalsContact O-CG2 3.28Å; L862-V893 WeakPolarHBondContact O-CG2 3.42Å
863	E	84.1	Confident	84.7	Confident	122 Å²	122	48.5 Å²	48.5	57%	0.57	24%	0.235	S	C	*	.			trans	-113.3	-33.2	-178.5	-62.5	-177.1	-175.7	0	0	111.1	Q835 S861 V893 V894	Q835-E863 PolarHBondContact O-N 3.5Å; S861-E863 PolarHBondContact O-N 2.84Å; E863-V893 WeakPolarHBondContact O-CA 3.42Å; E863-V894 PolarHBondContact O-N 2.79Å
864	L	80.3	Confident	83.9	Confident	32 Å²	32	53.1 Å²	53.1	17%	0.168	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	124.2	-172.1	-175.1	58.4	0	0	0	111.7	Q835 E836 L837 H866 V894	Q835-L864 PolarHBondContact O-N 3.34Å; E836-L864 WeakPolarHBondContact CA-O 3.43Å; E836-L864 HydrophobicContact CB-CB 4.43Å; E836-L864 HydrophobicContact CG-CB 4.13Å; E836-L864 HydrophobicContact CG-CD2 4.05Å; E836-L864 HydrophobicContact CG-CG 4.19Å; L837-L864 PolarHBondContact N-O 2.99Å; L864-H866 WeakPolarHBondContact CD2-NE2 3.44Å; L864-V894 HydrophobicContact CD1-CB 4.07Å; L864-V894 HydrophobicContact CD1-CG1 4.13Å; L864-V894 WeakPolarHBondContact CD1-O 3.37Å
865	L	86.4	Confident	83.4	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.8	174.2	176.6	66	0	0	0	109.7	L837 V839 L852 A853 A856 L867 V893 V894 V895 S896	L837-L865 HydrophobicContact CB-CD1 4.16Å; L837-L865 HydrophobicContact CD2-CD1 4.06Å; L837-L865 HydrophobicContact CG-CD1 4.12Å; L837-L865 WeakPolarHBondContact O-CA 3.36Å; V839-L865 HydrophobicContact CG2-CD1 4.08Å; L852-L865 HydrophobicContact CD2-CD1 4.08Å; L852-L865 HydrophobicContact CG-CD1 4.3Å; L852-L865 HydrophobicContact CG-CD2 4.25Å; A853-L865 HydrophobicContact CB-CD2 4.26Å; A856-L865 HydrophobicContact CB-CD2 3.83Å; L865-L867 HydrophobicContact CD2-CD1 3.89Å; L865-L867 HydrophobicContact CD2-CG 4.23Å; L865-L867 HydrophobicContact CG-CD1 4.34Å; L865-L867 HydrophobicContact CG-CG 4.18Å; L865-V893 HydrophobicContact CB-CG1 4.02Å; L865-V894 PolarHBondContact N-O 2.77Å; L865-V895 CarbonylContact O-C 3.08Å; L865-V895 WeakPolarHBondContact O-CA 3.27Å; L865-S896 PolarHBondContact O-N 3.49Å
866	H	81	Confident	82.7	Confident	15 Å²	15	53.4 Å²	53.4	7%	0.069	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.4	176.6	-54.3	-86.2	0	0	0	111.8	E836 L837 N838 V839 A840 L864 Y868 S896	E836-H866 IonicContact OE1-CD2 3.99Å; E836-H866 IonicContact OE1-CE1 3.42Å; E836-H866 IonicContact OE1-NE2 3.59Å; E836-H866 PolarHBondContact OE1-NE2 3.29Å; L837-H866 PolarHBondContact O-N 3.16Å; N838-H866 HydrophobicContact CB-CB 4.12Å; V839-H866 CarbonylContact C-O 3.58Å; V839-H866 VanDerWaalsContact CG2-O 3.27Å; V839-H866 WeakPolarHBondContact CG2-O 3.38Å; V839-H866 PolarHBondContact N-O 3.32Å; V839-H866 VanDerWaalsContact N-O 3.14Å; A840-H866 PolarHBondContact N-O 3.42Å; L864-H866 WeakPolarHBondContact CD2-NE2 3.44Å; H866-Y868 HydrophobicContact CB-CD1 4Å; H866-Y868 HydrophobicContact CB-CE1 3.62Å; H866-Y868 AromaticContact CG-CE1 3.93Å; H866-Y868 AromaticContact ND1-CE1 3.7Å; H866-S896 WeakPolarHBondContact ND1-CB 3.3Å
867	L	82.1	Confident	82.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.286	C	S	.	.			trans	-127.4	7.4	-178.7	-77.2	171.3	0	0	0	113.6	L821 V839 A849 A853 L865 N870 L872 L880 V895 S896 L897	L821-L867 HydrophobicContact CD2-CD2 3.93Å; V839-L867 HydrophobicContact CG2-CD2 3.68Å; V839-L867 HydrophobicContact CG2-CG 4.46Å; A849-L867 HydrophobicContact CB-CD1 4.22Å; A849-L867 HydrophobicContact CB-CD2 4.18Å; A853-L867 HydrophobicContact CB-CD1 4.47Å; L865-L867 HydrophobicContact CD2-CD1 3.89Å; L865-L867 HydrophobicContact CD2-CG 4.23Å; L865-L867 HydrophobicContact CG-CD1 4.34Å; L865-L867 HydrophobicContact CG-CG 4.18Å; L867-N870 PolarHBondContact O-ND2 3.23Å; L867-L872 HydrophobicContact CB-CD1 4.43Å; L867-L880 HydrophobicContact CD1-CD1 4.24Å; L867-L880 HydrophobicContact CD1-CD2 4.41Å; L867-V895 HydrophobicContact CD1-CG1 3.85Å; L867-S896 PolarHBondContact N-O 3.13Å; L867-L897 HydrophobicContact CB-CD2 3.99Å
868	Y	74.3	Confident	81.7	Confident	20 Å²	20	55.7 Å²	55.7	8%	0.078	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	158.1	178.9	57.9	-97.1	0	0	0	112.7	L812 N838 A840 Y841 H866 N870 S896 E899	L812-Y868 HydrophobicContact CD1-CE2 3.93Å; L812-Y868 WeakPolarHBondContact CD1-OH 3.28Å; N838-Y868 PolarHBondContact ND2-OH 3.17Å; N838-Y868 VanDerWaalsContact ND2-OH 3.1Å; A840-Y868 CarbonylContact C-O 3.58Å; A840-Y868 WeakPolarHBondContact CA-O 3.41Å; A840-Y868 HydrophobicContact CB-CD1 4Å; A840-Y868 HydrophobicContact CB-CD2 3.47Å; A840-Y868 VanDerWaalsContact CB-CD2 3.47Å; A840-Y868 HydrophobicContact CB-CE1 3.87Å; A840-Y868 HydrophobicContact CB-CE2 3.28Å; A840-Y868 HydrophobicContact CB-CG 3.81Å; A840-Y868 VanDerWaalsContact CB-CZ 3.49Å; A840-Y868 WeakPolarHBondContact CB-O 3.48Å; Y841-Y868 PolarHBondContact N-O 2.94Å; H866-Y868 HydrophobicContact CB-CD1 4Å; H866-Y868 HydrophobicContact CB-CE1 3.62Å; H866-Y868 AromaticContact CG-CE1 3.93Å; H866-Y868 AromaticContact ND1-CE1 3.7Å; Y868-N870 PolarHBondContact O-N 3.06Å; Y868-S896 PolarHBondContact N-O 3.36Å; Y868-E899 HydrophobicContact CD2-CG 4.49Å; Y868-E899 HydrophobicContact CE2-CG 4.14Å
869	F	70	Confident	81.5	Confident	92 Å²	92	51.7 Å²	51.7	40%	0.404	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	15.1	-177	-60.6	-20	0	0	0	116.6	Y841	Y841-F869 WeakPolarHBondContact CA-O 3.39Å; Y841-F869 HydrophobicContact CD2-CB 4.22Å; Y841-F869 HydrophobicContact CG-CB 4.09Å
870	N	77.9	Confident	81	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.032	27%	0.271	C	S	.	.	S	Bend	trans	-79.9	164.9	160.6	-74.2	-63.3	0	0	0	110.6	V839 N842 G843 A844 L867 Y868 L872 R877	V839-N870 PolarHBondContact O-ND2 3.47Å; V839-N870 VanDerWaalsContact O-ND2 3.15Å; N842-N870 WeakPolarHBondContact CA-OD1 3.45Å; N842-N870 PolarHBondContact N-OD1 3.03Å; G843-N870 PolarHBondContact N-OD1 3.12Å; A844-N870 PolarHBondContact N-OD1 3.03Å; A844-N870 WeakPolarHBondContact O-CB 3.32Å; L867-N870 PolarHBondContact O-ND2 3.23Å; Y868-N870 PolarHBondContact O-N 3.06Å; N870-L872 HydrophobicContact CB-CD1 4.43Å; N870-L872 HydrophobicContact CB-CD2 4.31Å; N870-L872 HydrophobicContact CB-CG 3.97Å; N870-L872 PolarHBondContact O-N 3.3Å; N870-R877 PolarHBondContact O-NH2 3.16Å
871	E	82.5	Confident	80.5	Confident	142 Å²	142	54.3 Å²	54.3	66%	0.664	27%	0.27	S	S	*	.			trans	-77.7	51.8	-177.2	-61.4	-61.7	156.2	0	0	111.3	A844	A844-E871 CarbonylContact O-C 3.59Å; A844-E871 WeakPolarHBondContact O-CA 3.47Å; A844-E871 PolarHBondContact O-N 3.42Å
872	L	80.8	Confident	80	Confident	14 Å²	14	57.4 Å²	57.4	7%	0.073	28%	0.284	C	S	.	.			trans	-87	126	-177.2	-53.8	177.4	0	0	0	110.9	D846 A849 L867 N870 R877 L880 L897	D846-L872 VanDerWaalsContact OD1-CA 3.23Å; D846-L872 WeakPolarHBondContact OD1-CA 3.18Å; A849-L872 HydrophobicContact CB-CD2 3.4Å; L867-L872 HydrophobicContact CB-CD1 4.43Å; N870-L872 HydrophobicContact CB-CD1 4.43Å; N870-L872 HydrophobicContact CB-CD2 4.31Å; N870-L872 HydrophobicContact CB-CG 3.97Å; N870-L872 PolarHBondContact O-N 3.3Å; L872-R877 HydrophobicContact CB-CG 3.83Å; L872-R877 HydrophobicContact CD1-CG 4.38Å; L872-R877 PolarHBondContact O-NE 3.12Å; L872-L880 HydrophobicContact CD1-CD1 3.87Å; L872-L897 HydrophobicContact CD1-CD2 4.13Å
873	S	83.4	Confident	79.3	Confident	45 Å²	45	58.9 Å²	58.9	32%	0.315	29%	0.292	S	S	.	.			trans	-66.6	163.5	173	77.7	0	0	0	0	111.2	D846 E875 G876 R877	D846-S873 PolarHBondContact OD1-N 2.91Å; D846-S873 WeakPolarHBondContact OD2-CB 3.38Å; D846-S873 PolarHBondContact OD2-OG 2.86Å; S873-E875 PolarHBondContact O-N 2.92Å; S873-E875 PolarHBondContact OG-N 3.41Å; S873-G876 PolarHBondContact O-N 3.4Å; S873-G876 PolarHBondContact OG-N 3.15Å; S873-R877 WeakPolarHBondContact O-CG 3.31Å; S873-R877 PolarHBondContact O-N 3.36Å
874	S	75.7	Confident	78.1	Confident	99 Å²	99	54.1 Å²	54.1	69%	0.692	28%	0.276	S	S	*	.	H	α-helix	trans	-58.3	-36.4	173.7	49.1	0	0	0	0	112	Q878	S874-Q878 PolarHBondContact O-N 2.81Å; S874-Q878 VanDerWaalsContact O-N 3.14Å
875	E	79.3	Confident	76.8	Confident	151 Å²	151	55.5 Å²	55.5	71%	0.706	30%	0.297	S	S	*	.	H	α-helix	trans	-68.5	-47.9	175.7	-63.2	-173.9	176.1	0	0	111.2	S873 R877 Q878 V879	S873-E875 PolarHBondContact O-N 2.92Å; S873-E875 PolarHBondContact OG-N 3.41Å; E875-R877 VanDerWaalsContact C-N 3.31Å; E875-R877 PolarHBondContact O-N 3.43Å; E875-Q878 WeakPolarHBondContact O-CA 3.39Å; E875-Q878 WeakPolarHBondContact O-CB 3.47Å; E875-Q878 PolarHBondContact O-N 3.16Å; E875-V879 WeakPolarHBondContact O-CG2 3.42Å; E875-V879 PolarHBondContact O-N 2.53Å
876	G	80.3	Confident	75.1	Confident	8 Å²	8	59 Å²	59	8%	0.082	33%	0.327	C	S	.	.	H	α-helix	trans	-57.9	-41.5	176.2	0	0	0	0	0	112.8	S873 Q878 V879 L880	S873-G876 PolarHBondContact O-N 3.4Å; S873-G876 PolarHBondContact OG-N 3.15Å; G876-Q878 VanDerWaalsContact C-N 3.32Å; G876-Q878 PolarHBondContact O-N 2.69Å; G876-V879 PolarHBondContact O-N 2.7Å; G876-L880 WeakPolarHBondContact O-CG 3.32Å; G876-L880 PolarHBondContact O-N 3.02Å
877	R	78.2	Confident	73.3	Confident	71 Å²	71	62.5 Å²	62.5	27%	0.268	36%	0.358	S	S	.	.	H	α-helix	trans	-64.6	-33	173.8	-70.1	171.8	-174.2	-86.5	-3.8	113.2	N870 L872 S873 E875 R881 L897	N870-R877 PolarHBondContact O-NH2 3.16Å; L872-R877 HydrophobicContact CB-CG 3.83Å; L872-R877 HydrophobicContact CD1-CG 4.38Å; L872-R877 PolarHBondContact O-NE 3.12Å; S873-R877 WeakPolarHBondContact O-CG 3.31Å; S873-R877 PolarHBondContact O-N 3.36Å; E875-R877 VanDerWaalsContact C-N 3.31Å; E875-R877 PolarHBondContact O-N 3.43Å; R877-R881 WeakPolarHBondContact O-CG 3.32Å; R877-R881 PolarHBondContact O-N 2.89Å; R877-R881 PolarHBondContact O-NE 2.96Å; R877-R881 VanDerWaalsContact O-NE 3.15Å; R877-L897 HydrophobicContact CB-CD1 4.31Å; R877-L897 PolarHBondContact NH1-O 2.95Å; R877-L897 WeakPolarHBondContact O-CD1 3.28Å
878	Q	76.7	Confident	71.6	Confident	77 Å²	77	72.5 Å²	72.5	36%	0.36	41%	0.405	S	S	.	.	H	α-helix	trans	-69.7	-47.2	174.7	-172.7	60.8	41.3	0	0	110.4	S874 E875 G876 L880 R881 D882	S874-Q878 PolarHBondContact O-N 2.81Å; S874-Q878 VanDerWaalsContact O-N 3.14Å; E875-Q878 WeakPolarHBondContact O-CA 3.39Å; E875-Q878 WeakPolarHBondContact O-CB 3.47Å; E875-Q878 PolarHBondContact O-N 3.16Å; G876-Q878 VanDerWaalsContact C-N 3.32Å; G876-Q878 PolarHBondContact O-N 2.69Å; Q878-L880 VanDerWaalsContact C-N 3.31Å; Q878-L880 PolarHBondContact O-N 2.85Å; Q878-R881 WeakPolarHBondContact O-CB 3.41Å; Q878-R881 PolarHBondContact O-N 2.84Å; Q878-R881 VanDerWaalsContact O-N 3.08Å; Q878-D882 PolarHBondContact NE2-OD1 3.12Å; Q878-D882 PolarHBondContact O-N 3.31Å
879	V	83.6	Confident	70.5	Confident	68 Å²	68	74.8 Å²	74.8	41%	0.412	44%	0.435	S	S	.	.	H	α-helix	trans	-57.5	-43	177.3	174.7	0	0	0	0	111.6	L850 E875 G876 D882 L883	L850-V879 HydrophobicContact CD1-CG1 3.84Å; L850-V879 HydrophobicContact CD2-CG1 4.23Å; E875-V879 WeakPolarHBondContact O-CG2 3.42Å; E875-V879 PolarHBondContact O-N 2.53Å; G876-V879 PolarHBondContact O-N 2.7Å; V879-D882 PolarHBondContact O-N 3.35Å; V879-L883 WeakPolarHBondContact O-CB 3.5Å; V879-L883 PolarHBondContact O-N 3.12Å
880	L	80.8	Confident	69.5	Low	3 Å²	3	75 Å²	75	2%	0.016	46%	0.462	C	S	.	.	H	α-helix	trans	-67	-35.7	177.2	-70.9	169.7	0	0	0	112.9	A849 L850 A853 L867 L872 G876 Q878 L883 G884 L897	A849-L880 HydrophobicContact CB-CD1 4.31Å; L850-L880 HydrophobicContact CD1-CD2 4.21Å; A853-L880 HydrophobicContact CB-CD2 3.45Å; A853-L880 VanDerWaalsContact CB-CD2 3.45Å; L867-L880 HydrophobicContact CD1-CD1 4.24Å; L867-L880 HydrophobicContact CD1-CD2 4.41Å; L872-L880 HydrophobicContact CD1-CD1 3.87Å; G876-L880 WeakPolarHBondContact O-CG 3.32Å; G876-L880 PolarHBondContact O-N 3.02Å; Q878-L880 VanDerWaalsContact C-N 3.31Å; Q878-L880 PolarHBondContact O-N 2.85Å; L880-L883 PolarHBondContact O-N 3.34Å; L880-G884 PolarHBondContact O-N 2.98Å; L880-L897 HydrophobicContact CB-CD1 3.79Å; L880-L897 HydrophobicContact CB-CD2 4.11Å; L880-L897 HydrophobicContact CB-CG 4.48Å; L880-L897 HydrophobicContact CD1-CD2 3.74Å
881	R	76.9	Confident	68.1	Low	141 Å²	141	77.4 Å²	77.4	53%	0.532	48%	0.483	S	S	.	.	H	α-helix	trans	-66.5	-44	173.6	-79.7	-178.9	-77.9	157.9	-0.8	111.7	R877 Q878 L883 G884 G885 L897	R877-R881 WeakPolarHBondContact O-CG 3.32Å; R877-R881 PolarHBondContact O-N 2.89Å; R877-R881 PolarHBondContact O-NE 2.96Å; R877-R881 VanDerWaalsContact O-NE 3.15Å; Q878-R881 WeakPolarHBondContact O-CB 3.41Å; Q878-R881 PolarHBondContact O-N 2.84Å; Q878-R881 VanDerWaalsContact O-N 3.08Å; R881-L883 VanDerWaalsContact C-N 3.28Å; R881-L883 PolarHBondContact O-N 3.08Å; R881-G884 PolarHBondContact O-N 3.38Å; R881-G884 VanDerWaalsContact O-N 3.11Å; R881-G885 PolarHBondContact O-N 2.9Å; R881-L897 HydrophobicContact CG-CD1 3.77Å
882	D	77.4	Confident	67.1	Low	94 Å²	94	79.7 Å²	79.7	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-64.3	-36.8	178.4	-63.1	-18.6	0	0	0	110.7	Q878 V879 G884 G885	Q878-D882 PolarHBondContact NE2-OD1 3.12Å; Q878-D882 PolarHBondContact O-N 3.31Å; V879-D882 PolarHBondContact O-N 3.35Å; D882-G884 VanDerWaalsContact C-N 3.27Å; D882-G884 PolarHBondContact O-N 3.11Å; D882-G885 PolarHBondContact O-N 3.04Å; D882-G885 VanDerWaalsContact O-N 3.13Å
883	L	73.1	Confident	66.5	Low	37 Å²	37	79.4 Å²	79.4	19%	0.194	48%	0.484	C	S	.	.	H	α-helix	trans	-61.5	-33.4	173.7	-158	79.9	0	0	0	112.7	L850 A853 R854 V879 L880 R881	L850-L883 HydrophobicContact CD1-CD2 4.37Å; A853-L883 HydrophobicContact CB-CD2 3.82Å; R854-L883 HydrophobicContact CG-CD2 4.35Å; V879-L883 WeakPolarHBondContact O-CB 3.5Å; V879-L883 PolarHBondContact O-N 3.12Å; L880-L883 PolarHBondContact O-N 3.34Å; R881-L883 VanDerWaalsContact C-N 3.28Å; R881-L883 PolarHBondContact O-N 3.08Å
884	G	59.3	Low	66.1	Low	22 Å²	22	80.4 Å²	80.4	23%	0.227	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-6.7	176.4	0	0	0	0	0	115.1	L880 R881 D882 R892	L880-G884 PolarHBondContact O-N 2.98Å; R881-G884 PolarHBondContact O-N 3.38Å; R881-G884 VanDerWaalsContact O-N 3.11Å; D882-G884 VanDerWaalsContact C-N 3.27Å; D882-G884 PolarHBondContact O-N 3.11Å; G884-R892 PolarHBondContact O-NE 2.82Å; G884-R892 PolarHBondContact O-NH2 3.03Å
885	G	53.5	Low	66	Low	60 Å²	60	77 Å²	77	62%	0.619	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-16.8	-174	0	0	0	0	0	116.1	R881 D882	R881-G885 PolarHBondContact O-N 2.9Å; D882-G885 PolarHBondContact O-N 3.04Å; D882-G885 VanDerWaalsContact O-N 3.13Å
886	A	50.1	Low	65.4	Low	75 Å²	75	70 Å²	70	62%	0.62	43%	0.431	S	S	*	.			trans	-140.2	102.3	-168.9	0	0	0	0	0	113.9
887	A	44	Very low	64.4	Low	88 Å²	88	70.3 Å²	70.3	73%	0.727	43%	0.431	S	S	*	.			trans	-169.9	123.4	145.3	0	0	0	0	0	111.9	G889	A887-G889 PolarHBondContact O-N 3.38Å
888	E	47.2	Very low	63.1	Low	210 Å²	210	69.5 Å²	69.5	98%	0.981	43%	0.434	S	S	*	.			trans	-67.6	102	158.9	-68.4	179.6	148.8	0	0	108.4
889	G	49.2	Very low	61.6	Low	68 Å²	68	67.7 Å²	67.7	70%	0.701	43%	0.425	S	S	*	.	S	Bend	trans	149.4	78.8	174.2	0	0	0	0	0	116.2	A887 A891	A887-G889 PolarHBondContact O-N 3.38Å; G889-A891 PolarHBondContact O-N 3.37Å; G889-A891 VanDerWaalsContact O-N 3.13Å
890	G	49.3	Very low	59.8	Low	95 Å²	95	65.1 Å²	65.1	98%	0.979	41%	0.412	S	S	*	.	S	Bend	trans	89.5	-47.8	141.4	0	0	0	0	0	120.2
891	A	48.8	Very low	57.8	Low	57 Å²	57	67.4 Å²	67.4	47%	0.471	43%	0.427	S	S	.	.			trans	-135	116.8	-178	0	0	0	0	0	111.4	G889	G889-A891 PolarHBondContact O-N 3.37Å; G889-A891 VanDerWaalsContact O-N 3.13Å
892	R	62.4	Low	56	Low	191 Å²	191	64.2 Å²	64.2	72%	0.721	43%	0.431	S	S	*	.			trans	-106.1	95.8	-179.8	-170.3	179.7	-173.1	-176.3	2	109.4	G884 V894	G884-R892 PolarHBondContact O-NE 2.82Å; G884-R892 PolarHBondContact O-NH2 3.03Å; R892-V894 PolarHBondContact O-N 2.94Å
893	V	68.3	Low	54.6	Low	8 Å²	8	61.6 Å²	61.6	5%	0.048	42%	0.418	C	S	.	.			trans	-67.5	123.8	165.1	178.4	0	0	0	0	108.7	A856 L862 E863 L865 V895	A856-V893 HydrophobicContact CB-CG1 4.25Å; A856-V893 VanDerWaalsContact O-CG2 3.24Å; A856-V893 WeakPolarHBondContact O-CG2 3.45Å; L862-V893 HydrophobicContact CB-CG2 4.36Å; L862-V893 VanDerWaalsContact O-CG2 3.28Å; L862-V893 WeakPolarHBondContact O-CG2 3.42Å; E863-V893 WeakPolarHBondContact O-CA 3.42Å; L865-V893 HydrophobicContact CB-CG1 4.02Å; V893-V895 HydrophobicContact CG1-CG2 4.42Å
894	V	73.4	Confident	53.3	Low	65 Å²	65	62.4 Å²	62.4	39%	0.394	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	115.2	170.9	179.8	0	0	0	0	107.9	E863 L864 L865 R892	E863-V894 PolarHBondContact O-N 2.79Å; L864-V894 HydrophobicContact CD1-CB 4.07Å; L864-V894 HydrophobicContact CD1-CG1 4.13Å; L864-V894 WeakPolarHBondContact CD1-O 3.37Å; L865-V894 PolarHBondContact N-O 2.77Å; R892-V894 PolarHBondContact O-N 2.94Å
895	V	73.9	Confident	52.5	Low	28 Å²	28	70 Å²	70	17%	0.17	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	107.8	172.4	-176	0	0	0	0	108.6	A853 L865 L867 V893 L897	A853-V895 HydrophobicContact CB-CG2 4.43Å; L865-V895 CarbonylContact O-C 3.08Å; L865-V895 WeakPolarHBondContact O-CA 3.27Å; L867-V895 HydrophobicContact CD1-CG1 3.85Å; V893-V895 HydrophobicContact CG1-CG2 4.42Å; V895-L897 HydrophobicContact CG1-CD2 3.72Å; V895-L897 HydrophobicContact CG1-CG 4.17Å; V895-L897 PolarHBondContact O-N 2.95Å
896	S	66.4	Low	52.2	Low	3 Å²	3	73 Å²	73	2%	0.021	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	105.2	175.8	-151.8	0	0	0	0	109.4	L865 H866 L867 Y868 T898 T901	L865-S896 PolarHBondContact O-N 3.49Å; H866-S896 WeakPolarHBondContact ND1-CB 3.3Å; L867-S896 PolarHBondContact N-O 3.13Å; Y868-S896 PolarHBondContact N-O 3.36Å; S896-T898 PolarHBondContact OG-O 3.32Å; S896-T901 WeakPolarHBondContact OG-CG2 3.24Å; S896-T901 PolarHBondContact OG-OG1 2.83Å
897	L	60.8	Low	52.4	Low	16 Å²	16	70.1 Å²	70.1	8%	0.084	42%	0.423	C	S	.	.			trans	-95.4	-4.4	174.2	-57.5	178.9	0	0	0	113	L867 L872 R877 L880 R881 V895	L867-L897 HydrophobicContact CB-CD2 3.99Å; L872-L897 HydrophobicContact CD1-CD2 4.13Å; R877-L897 HydrophobicContact CB-CD1 4.31Å; R877-L897 PolarHBondContact NH1-O 2.95Å; R877-L897 WeakPolarHBondContact O-CD1 3.28Å; L880-L897 HydrophobicContact CB-CD1 3.79Å; L880-L897 HydrophobicContact CB-CD2 4.11Å; L880-L897 HydrophobicContact CB-CG 4.48Å; L880-L897 HydrophobicContact CD1-CD2 3.74Å; R881-L897 HydrophobicContact CG-CD1 3.77Å; V895-L897 HydrophobicContact CG1-CD2 3.72Å; V895-L897 HydrophobicContact CG1-CG 4.17Å; V895-L897 PolarHBondContact O-N 2.95Å
898	T	51	Low	52.6	Low	54 Å²	54	68.6 Å²	68.6	33%	0.331	41%	0.407	S	S	.	.	S	Bend	trans	-128.8	147.1	-175.4	53	0	0	0	0	108.3	S896 G900 D936	S896-T898 PolarHBondContact OG-O 3.32Å; T898-G900 PolarHBondContact O-N 3.37Å; T898-D936 WeakPolarHBondContact CB-OD1 3.4Å; T898-D936 WeakPolarHBondContact CB-OD2 3.39Å; T898-D936 WeakPolarHBondContact CG2-OD1 3.43Å
899	E	45	Very low	52.4	Low	38 Å²	38	62.7 Å²	62.7	18%	0.178	39%	0.385	C	S	.	.	S	Bend	trans	-82.1	110.9	-178.5	-158.5	-178.1	167.9	0	0	108	Y868 W907 D936	Y868-E899 HydrophobicContact CD2-CG 4.49Å; Y868-E899 HydrophobicContact CE2-CG 4.14Å; E899-W907 HydrophobicContact CB-CH2 3.87Å; E899-W907 HydrophobicContact CB-CZ2 3.88Å; E899-W907 VanDerWaalsContact CD-CZ2 3.47Å; E899-W907 HydrophobicContact CG-CH2 3.52Å; E899-W907 HydrophobicContact CG-CZ2 3.45Å; E899-W907 VanDerWaalsContact CG-CZ2 3.45Å; E899-W907 VanDerWaalsContact OE1-CH2 3.24Å; E899-W907 WeakPolarHBondContact OE1-CH2 3.49Å; E899-W907 WeakPolarHBondContact OE2-CH2 3.34Å; E899-D936 PolarHBondContact N-OD2 3.2Å
900	G	45.8	Very low	52.4	Low	14 Å²	14	62.8 Å²	62.8	14%	0.144	37%	0.369	C	S	.	.			trans	129.9	35.1	172	0	0	0	0	0	118.3	T898 A902 R949	T898-G900 PolarHBondContact O-N 3.37Å; G900-A902 PolarHBondContact O-N 2.95Å; G900-R949 PolarHBondContact O-NH2 2.86Å
901	T	38.2	Very low	52.6	Low	52 Å²	52	58.4 Å²	58.4	32%	0.319	32%	0.323	S	S	.	.	S	Bend	trans	-65.4	-21.1	160.8	45.8	0	0	0	0	112.5	S896 R949	S896-T901 WeakPolarHBondContact OG-CG2 3.24Å; S896-T901 PolarHBondContact OG-OG1 2.83Å; T901-R949 PolarHBondContact O-NH2 3.34Å
902	A	40	Very low	52.5	Low	74 Å²	74	58.1 Å²	58.1	61%	0.612	32%	0.317	S	S	*	.	S	Bend	trans	-124.7	105.2	163.5	0	0	0	0	0	110.5	G900 S904	G900-A902 PolarHBondContact O-N 2.95Å; A902-S904 VanDerWaalsContact C-N 3.31Å; A902-S904 PolarHBondContact O-N 3.43Å
903	V	45.9	Very low	51.7	Low	38 Å²	38	52.8 Å²	52.8	23%	0.23	30%	0.3	C	S	.	.			trans	-72.7	91.2	168.4	-174.9	0	0	0	0	106.9	Q952 L953 V956	V903-Q952 HydrophobicContact CG1-CB 4.14Å; V903-L953 HydrophobicContact CG2-CD2 3.57Å; V903-L953 HydrophobicContact CG2-CG 4.09Å; V903-V956 HydrophobicContact CG1-CG2 4.4Å
904	S	46.8	Very low	50.8	Low	55 Å²	55	53.1 Å²	53.1	39%	0.385	30%	0.302	S	S	.	.			trans	-90.1	161.3	173.5	86.9	0	0	0	0	110.8	A902 Y906 W907	A902-S904 VanDerWaalsContact C-N 3.31Å; A902-S904 PolarHBondContact O-N 3.43Å; S904-Y906 PolarHBondContact O-N 2.91Å; S904-Y906 VanDerWaalsContact OG-CB 3.3Å; S904-Y906 WeakPolarHBondContact OG-CB 3.5Å; S904-Y906 VanDerWaalsContact OG-CD2 3.32Å; S904-Y906 WeakPolarHBondContact OG-CD2 3.37Å; S904-Y906 PolarHBondContact OG-N 2.94Å; S904-W907 PolarHBondContact O-N 3.01Å
905	E	43.2	Very low	49.6	Very low	180 Å²	180	55 Å²	55	84%	0.841	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-3.1	173	-65.3	-176	154.6	0	0	114	W907 S908	E905-W907 VanDerWaalsContact C-N 3.33Å; E905-W907 PolarHBondContact O-N 3.38Å; E905-S908 PolarHBondContact O-OG 3.34Å
906	Y	45.7	Very low	48.2	Very low	125 Å²	125	63.3 Å²	63.3	49%	0.49	34%	0.335	S	S	.	.	H	α-helix	trans	-68.8	-25	175.2	-86.1	-98.1	0	0	0	114.4	S904 S908 V909 I910	S904-Y906 PolarHBondContact O-N 2.91Å; S904-Y906 VanDerWaalsContact OG-CB 3.3Å; S904-Y906 WeakPolarHBondContact OG-CB 3.5Å; S904-Y906 VanDerWaalsContact OG-CD2 3.32Å; S904-Y906 WeakPolarHBondContact OG-CD2 3.37Å; S904-Y906 PolarHBondContact OG-N 2.94Å; Y906-S908 VanDerWaalsContact C-N 3.31Å; Y906-S908 PolarHBondContact O-N 3.16Å; Y906-V909 WeakPolarHBondContact O-CA 3.31Å; Y906-V909 WeakPolarHBondContact O-CB 3.17Å; Y906-V909 PolarHBondContact O-N 3.39Å; Y906-I910 WeakPolarHBondContact O-CG1 3.48Å; Y906-I910 PolarHBondContact O-N 2.88Å
907	W	54.9	Low	47.1	Very low	13 Å²	13	64.4 Å²	64.4	5%	0.049	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-39.9	-177.6	-80.5	112.3	0	0	0	112.9	E899 S904 E905 V909 I910 L911 L933 V956	E899-W907 HydrophobicContact CB-CH2 3.87Å; E899-W907 HydrophobicContact CB-CZ2 3.88Å; E899-W907 VanDerWaalsContact CD-CZ2 3.47Å; E899-W907 HydrophobicContact CG-CH2 3.52Å; E899-W907 HydrophobicContact CG-CZ2 3.45Å; E899-W907 VanDerWaalsContact CG-CZ2 3.45Å; E899-W907 VanDerWaalsContact OE1-CH2 3.24Å; E899-W907 WeakPolarHBondContact OE1-CH2 3.49Å; E899-W907 WeakPolarHBondContact OE2-CH2 3.34Å; S904-W907 PolarHBondContact O-N 3.01Å; E905-W907 VanDerWaalsContact C-N 3.33Å; E905-W907 PolarHBondContact O-N 3.38Å; W907-V909 PolarHBondContact O-N 3.02Å; W907-I910 HydrophobicContact CE3-CD1 4.36Å; W907-I910 PolarHBondContact O-N 3.28Å; W907-L911 VanDerWaalsContact O-CB 3.32Å; W907-L911 WeakPolarHBondContact O-CB 3.41Å; W907-L911 VanDerWaalsContact O-CG 3.25Å; W907-L911 WeakPolarHBondContact O-CG 3.44Å; W907-L911 PolarHBondContact O-N 3.06Å; W907-L933 HydrophobicContact CH2-CD1 3.44Å; W907-L933 VanDerWaalsContact CH2-CD1 3.44Å; W907-L933 HydrophobicContact CH2-CD2 4.22Å; W907-L933 HydrophobicContact CH2-CG 4.48Å; W907-L933 HydrophobicContact CZ2-CD1 4.29Å; W907-L933 HydrophobicContact CZ3-CD1 3.9Å; W907-L933 HydrophobicContact CZ3-CD2 3.79Å; W907-V956 HydrophobicContact CB-CG1 4.16Å; W907-V956 HydrophobicContact CB-CG2 4Å; W907-V956 HydrophobicContact CD2-CG1 4.36Å; W907-V956 HydrophobicContact CG-CG1 4.23Å; W907-V956 HydrophobicContact CG-CG2 4.35Å
908	S	49.1	Very low	46.7	Very low	57 Å²	57	64.2 Å²	64.2	40%	0.399	34%	0.34	S	S	.	.	H	α-helix	trans	-64.2	-30.3	175	49.3	0	0	0	0	112.4	E905 Y906 S912	E905-S908 PolarHBondContact O-OG 3.34Å; Y906-S908 VanDerWaalsContact C-N 3.31Å; Y906-S908 PolarHBondContact O-N 3.16Å; S908-S912 WeakPolarHBondContact O-CB 3.48Å; S908-S912 PolarHBondContact O-N 3.37Å; S908-S912 PolarHBondContact O-OG 3.27Å
909	V	43.2	Very low	46.4	Very low	85 Å²	85	68.1 Å²	68.1	52%	0.515	36%	0.359	S	S	.	.	H	α-helix	trans	-73.9	-46.7	176.9	-176.5	0	0	0	0	110	Y906 W907 S912 E913	Y906-V909 WeakPolarHBondContact O-CA 3.31Å; Y906-V909 WeakPolarHBondContact O-CB 3.17Å; Y906-V909 PolarHBondContact O-N 3.39Å; W907-V909 PolarHBondContact O-N 3.02Å; V909-S912 PolarHBondContact O-N 2.88Å; V909-S912 PolarHBondContact O-OG 3.14Å; V909-E913 PolarHBondContact O-N 2.91Å
910	I	47.8	Very low	46.1	Very low	70 Å²	70	70 Å²	70	36%	0.359	38%	0.376	S	S	.	.	H	α-helix	trans	-60.1	-50.4	177.1	-64.1	167.1	0	0	0	110.1	Y906 W907 S912 E913 V914	Y906-I910 WeakPolarHBondContact O-CG1 3.48Å; Y906-I910 PolarHBondContact O-N 2.88Å; W907-I910 HydrophobicContact CE3-CD1 4.36Å; W907-I910 PolarHBondContact O-N 3.28Å; I910-S912 VanDerWaalsContact C-N 3.34Å; I910-S912 PolarHBondContact O-N 2.91Å; I910-E913 WeakPolarHBondContact O-CB 3.33Å; I910-E913 PolarHBondContact O-N 3.33Å; I910-E913 VanDerWaalsContact O-N 3.11Å; I910-V914 HydrophobicContact CG2-CG2 4.47Å; I910-V914 VanDerWaalsContact O-CG2 3.24Å; I910-V914 WeakPolarHBondContact O-CG2 3.34Å; I910-V914 PolarHBondContact O-N 3.48Å
911	L	53.9	Low	46.1	Very low	4 Å²	4	73.3 Å²	73.3	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-67.8	-32.6	179.3	-64.1	179.1	0	0	0	112.4	W907 E913 V914 Q915 L930 L933 V956 E959 V960 L963	W907-L911 VanDerWaalsContact O-CB 3.32Å; W907-L911 WeakPolarHBondContact O-CB 3.41Å; W907-L911 VanDerWaalsContact O-CG 3.25Å; W907-L911 WeakPolarHBondContact O-CG 3.44Å; W907-L911 PolarHBondContact O-N 3.06Å; L911-E913 VanDerWaalsContact C-N 3.28Å; L911-E913 PolarHBondContact O-N 2.8Å; L911-V914 PolarHBondContact O-N 2.99Å; L911-Q915 VanDerWaalsContact O-CB 3.29Å; L911-Q915 WeakPolarHBondContact O-CB 3.37Å; L911-Q915 PolarHBondContact O-N 3.29Å; L911-L930 HydrophobicContact CD2-CD2 4.32Å; L911-L933 HydrophobicContact CD2-CD2 4.37Å; L911-V956 HydrophobicContact CD1-CG1 3.84Å; L911-E959 HydrophobicContact CD1-CB 3.73Å; L911-V960 HydrophobicContact CD1-CG2 3.79Å; L911-V960 HydrophobicContact CD2-CG2 3.82Å; L911-V960 HydrophobicContact CG-CG2 4.49Å; L911-L963 HydrophobicContact CB-CD1 4.12Å; L911-L963 HydrophobicContact CD2-CD1 3.98Å
912	S	46.8	Very low	46.8	Very low	50 Å²	50	75.6 Å²	75.6	35%	0.35	40%	0.395	S	S	.	.	H	α-helix	trans	-65.5	-33	171.1	76.9	0	0	0	0	112.5	S908 V909 I910 Q915 R916	S908-S912 WeakPolarHBondContact O-CB 3.48Å; S908-S912 PolarHBondContact O-N 3.37Å; S908-S912 PolarHBondContact O-OG 3.27Å; V909-S912 PolarHBondContact O-N 2.88Å; V909-S912 PolarHBondContact O-OG 3.14Å; I910-S912 VanDerWaalsContact C-N 3.34Å; I910-S912 PolarHBondContact O-N 2.91Å; S912-Q915 PolarHBondContact O-N 2.96Å; S912-R916 WeakPolarHBondContact O-CG 3.41Å; S912-R916 PolarHBondContact O-N 3.38Å
913	E	45.5	Very low	47.6	Very low	79 Å²	79	77.5 Å²	77.5	37%	0.369	39%	0.386	S	S	.	.	H	α-helix	trans	-75.7	-40	177	-161.3	59.2	-145.7	0	0	110.8	V909 I910 L911 Q915 R916 N917	V909-E913 PolarHBondContact O-N 2.91Å; I910-E913 WeakPolarHBondContact O-CB 3.33Å; I910-E913 PolarHBondContact O-N 3.33Å; I910-E913 VanDerWaalsContact O-N 3.11Å; L911-E913 VanDerWaalsContact C-N 3.28Å; L911-E913 PolarHBondContact O-N 2.8Å; E913-Q915 VanDerWaalsContact C-N 3.26Å; E913-Q915 PolarHBondContact O-N 3.46Å; E913-R916 PolarHBondContact O-N 2.9Å; E913-N917 WeakPolarHBondContact O-CB 3.34Å; E913-N917 PolarHBondContact O-N 3.34Å; E913-N917 PolarHBondContact O-ND2 3.5Å; E913-N917 PolarHBondContact OE1-ND2 2.86Å
914	V	49.3	Very low	48.2	Very low	15 Å²	15	78.5 Å²	78.5	9%	0.091	40%	0.398	C	S	.	.	H	α-helix	trans	-58.3	-42	169.1	-178.1	0	0	0	0	110.3	I910 L911 N917 L918 W921 V926 L930 L963	I910-V914 HydrophobicContact CG2-CG2 4.47Å; I910-V914 VanDerWaalsContact O-CG2 3.24Å; I910-V914 WeakPolarHBondContact O-CG2 3.34Å; I910-V914 PolarHBondContact O-N 3.48Å; L911-V914 PolarHBondContact O-N 2.99Å; V914-N917 CarbonylContact O-C 3.39Å; V914-N917 PolarHBondContact O-N 2.94Å; V914-L918 WeakPolarHBondContact O-CA 3.21Å; V914-L918 VanDerWaalsContact O-CB 3.31Å; V914-L918 WeakPolarHBondContact O-CB 3.33Å; V914-L918 PolarHBondContact O-N 2.99Å; V914-W921 HydrophobicContact CB-CZ3 4.04Å; V914-W921 HydrophobicContact CG1-CE3 4.38Å; V914-W921 HydrophobicContact CG1-CZ3 4.03Å; V914-W921 HydrophobicContact CG2-CH2 4.16Å; V914-W921 HydrophobicContact CG2-CZ3 3.7Å; V914-V926 HydrophobicContact CG1-CG1 3.99Å; V914-L930 HydrophobicContact CG1-CD1 4.35Å; V914-L930 HydrophobicContact CG1-CD2 4.46Å; V914-L963 HydrophobicContact CG1-CD1 4.46Å
915	Q	47.8	Very low	48.4	Very low	104 Å²	104	82.1 Å²	82.1	49%	0.486	40%	0.404	S	S	.	.	H	α-helix	trans	-66.2	-40	178	-167.3	172	3.6	0	0	112.8	L911 S912 E913 N917 L963	L911-Q915 VanDerWaalsContact O-CB 3.29Å; L911-Q915 WeakPolarHBondContact O-CB 3.37Å; L911-Q915 PolarHBondContact O-N 3.29Å; S912-Q915 PolarHBondContact O-N 2.96Å; E913-Q915 VanDerWaalsContact C-N 3.26Å; E913-Q915 PolarHBondContact O-N 3.46Å; Q915-N917 VanDerWaalsContact C-N 3.31Å; Q915-L963 HydrophobicContact CB-CD2 3.63Å; Q915-L963 HydrophobicContact CG-CD2 3.66Å
916	R	44.9	Very low	49.1	Very low	204 Å²	204	74.4 Å²	74.4	77%	0.77	37%	0.369	S	S	*	.	H	α-helix	trans	-67.1	-32.8	176.1	-77.5	-178.2	97.4	148.2	4.7	112.6	S912 E913	S912-R916 WeakPolarHBondContact O-CG 3.41Å; S912-R916 PolarHBondContact O-N 3.38Å; E913-R916 PolarHBondContact O-N 2.9Å
917	N	44.2	Very low	50.1	Low	26 Å²	26	71.8 Å²	71.8	14%	0.139	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	9.9	-176	-60.3	-57.9	0	0	0	113.6	E913 V914 Q915 N919 S920 W921	E913-N917 WeakPolarHBondContact O-CB 3.34Å; E913-N917 PolarHBondContact O-N 3.34Å; E913-N917 PolarHBondContact O-ND2 3.5Å; E913-N917 PolarHBondContact OE1-ND2 2.86Å; V914-N917 CarbonylContact O-C 3.39Å; V914-N917 PolarHBondContact O-N 2.94Å; Q915-N917 VanDerWaalsContact C-N 3.31Å; N917-N919 PolarHBondContact O-N 3.49Å; N917-N919 VanDerWaalsContact O-N 3.11Å; N917-S920 WeakPolarHBondContact CA-OG 3.41Å; N917-S920 WeakPolarHBondContact CB-OG 3.49Å; N917-S920 PolarHBondContact O-N 3.25Å; N917-S920 PolarHBondContact O-OG 3.15Å; N917-W921 HydrophobicContact CB-CD2 3.89Å; N917-W921 VanDerWaalsContact CB-CE2 3.48Å; N917-W921 HydrophobicContact CB-CG 4.18Å; N917-W921 HydrophobicContact CB-CZ2 3.85Å; N917-W921 PolarHBondContact O-N 3.11Å
918	L	50.6	Low	50.5	Low	12 Å²	12	79 Å²	79	6%	0.063	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.6	-175.2	-149.3	137.6	0	0	0	113.3	V914 L963 L967	V914-L918 WeakPolarHBondContact O-CA 3.21Å; V914-L918 VanDerWaalsContact O-CB 3.31Å; V914-L918 WeakPolarHBondContact O-CB 3.33Å; V914-L918 PolarHBondContact O-N 2.99Å; L918-L963 HydrophobicContact CD1-CB 4.24Å; L918-L963 HydrophobicContact CD1-CD2 3.52Å; L918-L963 HydrophobicContact CD1-CG 4.42Å; L918-L967 HydrophobicContact CD2-CD2 3.42Å; L918-L967 VanDerWaalsContact CD2-CD2 3.42Å; L918-L967 HydrophobicContact CD2-CG 3.8Å; L918-L967 HydrophobicContact CG-CD2 4.03Å; L918-L967 HydrophobicContact CG-CG 4.34Å
919	N	46.5	Very low	50.7	Low	135 Å²	135	80 Å²	80	72%	0.722	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-13.7	176.2	-66.2	-31.2	0	0	0	113.8	N917 R923	N917-N919 PolarHBondContact O-N 3.49Å; N917-N919 VanDerWaalsContact O-N 3.11Å; N919-R923 PolarHBondContact OD1-NH2 2.54Å
920	S	38.7	Very low	51.7	Low	79 Å²	79	76.4 Å²	76.4	55%	0.552	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-22.8	-178.7	51	0	0	0	0	113.3	N917	N917-S920 WeakPolarHBondContact CA-OG 3.41Å; N917-S920 WeakPolarHBondContact CB-OG 3.49Å; N917-S920 PolarHBondContact O-N 3.25Å; N917-S920 PolarHBondContact O-OG 3.15Å
921	W	44.6	Very low	52.7	Low	82 Å²	82	77.5 Å²	77.5	31%	0.311	37%	0.368	S	S	.	.	S	Bend	trans	-87.3	153.9	177.6	-65.9	-4.9	0	0	0	112.7	V914 N917 R923 V926	V914-W921 HydrophobicContact CB-CZ3 4.04Å; V914-W921 HydrophobicContact CG1-CE3 4.38Å; V914-W921 HydrophobicContact CG1-CZ3 4.03Å; V914-W921 HydrophobicContact CG2-CH2 4.16Å; V914-W921 HydrophobicContact CG2-CZ3 3.7Å; N917-W921 HydrophobicContact CB-CD2 3.89Å; N917-W921 VanDerWaalsContact CB-CE2 3.48Å; N917-W921 HydrophobicContact CB-CG 4.18Å; N917-W921 HydrophobicContact CB-CZ2 3.85Å; N917-W921 PolarHBondContact O-N 3.11Å; W921-R923 PolarHBondContact O-N 3.07Å; W921-V926 HydrophobicContact CB-CG2 3.48Å; W921-V926 VanDerWaalsContact CB-CG2 3.48Å; W921-V926 HydrophobicContact CD2-CG2 4.32Å; W921-V926 HydrophobicContact CE3-CG2 3.73Å; W921-V926 HydrophobicContact CG-CG2 4.3Å
922	D	53.3	Low	53	Low	100 Å²	100	82.4 Å²	82.4	54%	0.535	39%	0.394	S	S	.	.			trans	-57.9	108.3	173.8	174.4	-11.8	0	0	0	110.2	A924 R925 V926	D922-A924 VanDerWaalsContact C-N 3.32Å; D922-A924 PolarHBondContact O-N 3.43Å; D922-A924 PolarHBondContact OD1-N 2.73Å; D922-R925 HydrophobicContact CB-CB 3.9Å; D922-R925 PolarHBondContact O-N 3.34Å; D922-R925 VanDerWaalsContact O-N 3.15Å; D922-R925 PolarHBondContact OD1-N 3.36Å; D922-V926 VanDerWaalsContact O-CG2 3.32Å; D922-V926 WeakPolarHBondContact O-CG2 3.33Å; D922-V926 PolarHBondContact O-N 3.26Å
923	R	57.1	Low	53.8	Low	114 Å²	114	80.9 Å²	80.9	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-58.7	-40.7	-174.6	-74.9	-172.6	168.5	-169.5	-2.2	112.9	N919 W921 R925 V926 Q927 L967	N919-R923 PolarHBondContact OD1-NH2 2.54Å; W921-R923 PolarHBondContact O-N 3.07Å; R923-R925 VanDerWaalsContact C-N 3.32Å; R923-R925 PolarHBondContact O-N 3.46Å; R923-V926 PolarHBondContact O-N 2.7Å; R923-Q927 WeakPolarHBondContact O-CB 3Å; R923-Q927 PolarHBondContact O-N 3.43Å; R923-L967 HydrophobicContact CB-CD2 4.27Å; R923-L967 HydrophobicContact CG-CD2 4.01Å
924	A	58.6	Low	55	Low	59 Å²	59	78 Å²	78	49%	0.488	37%	0.368	S	S	.	.	H	α-helix	trans	-68.7	-37.1	-179	0	0	0	0	0	110.9	D922 R928	D922-A924 VanDerWaalsContact C-N 3.32Å; D922-A924 PolarHBondContact O-N 3.43Å; D922-A924 PolarHBondContact OD1-N 2.73Å; A924-R928 WeakPolarHBondContact O-CB 3.23Å; A924-R928 PolarHBondContact O-N 3.25Å; A924-R928 VanDerWaalsContact O-N 3.11Å
925	R	51.3	Low	55.7	Low	132 Å²	132	85.4 Å²	85.4	50%	0.498	40%	0.395	S	S	.	.	H	α-helix	trans	-67.8	-52.5	174.3	-169.9	175.6	179.9	177.5	0.9	110.7	D922 R923 Q927 R928 H929	D922-R925 HydrophobicContact CB-CB 3.9Å; D922-R925 PolarHBondContact O-N 3.34Å; D922-R925 VanDerWaalsContact O-N 3.15Å; D922-R925 PolarHBondContact OD1-N 3.36Å; R923-R925 VanDerWaalsContact C-N 3.32Å; R923-R925 PolarHBondContact O-N 3.46Å; R925-Q927 VanDerWaalsContact C-N 3.32Å; R925-Q927 PolarHBondContact O-N 3.13Å; R925-R928 PolarHBondContact O-N 3.21Å; R925-H929 WeakPolarHBondContact CG-CE1 3.47Å; R925-H929 PolarHBondContact O-N 3.3Å; R925-H929 PolarHBondContact O-ND1 2.88Å
926	V	56.8	Low	56.1	Low	17 Å²	17	82 Å²	82	10%	0.103	38%	0.38	C	S	.	.	H	α-helix	trans	-60.2	-43.3	-179.3	175.8	0	0	0	0	111.2	V914 W921 D922 R923 R928 H929 L930 L967	V914-V926 HydrophobicContact CG1-CG1 3.99Å; W921-V926 HydrophobicContact CB-CG2 3.48Å; W921-V926 VanDerWaalsContact CB-CG2 3.48Å; W921-V926 HydrophobicContact CD2-CG2 4.32Å; W921-V926 HydrophobicContact CE3-CG2 3.73Å; W921-V926 HydrophobicContact CG-CG2 4.3Å; D922-V926 VanDerWaalsContact O-CG2 3.32Å; D922-V926 WeakPolarHBondContact O-CG2 3.33Å; D922-V926 PolarHBondContact O-N 3.26Å; R923-V926 PolarHBondContact O-N 2.7Å; V926-R928 PolarHBondContact O-N 3.48Å; V926-H929 PolarHBondContact O-N 3Å; V926-L930 HydrophobicContact CG1-CD1 3.78Å; V926-L930 HydrophobicContact CG1-CG 4.2Å; V926-L930 WeakPolarHBondContact O-CB 3.31Å; V926-L930 WeakPolarHBondContact O-CG 3.21Å; V926-L930 PolarHBondContact O-N 3.13Å; V926-L967 HydrophobicContact CG1-CD1 4.08Å
927	Q	67.4	Low	56.9	Low	70 Å²	70	72.4 Å²	72.4	33%	0.327	34%	0.344	S	S	.	.	H	α-helix	trans	-57.3	-49.7	174.6	-177.6	-179.1	-11	0	0	111.1	R923 R925 H929 L930 E931 L964 L967	R923-Q927 WeakPolarHBondContact O-CB 3Å; R923-Q927 PolarHBondContact O-N 3.43Å; R925-Q927 VanDerWaalsContact C-N 3.32Å; R925-Q927 PolarHBondContact O-N 3.13Å; Q927-H929 VanDerWaalsContact C-N 3.3Å; Q927-H929 PolarHBondContact O-N 3.01Å; Q927-L930 PolarHBondContact O-N 3.18Å; Q927-E931 HydrophobicContact CG-CG 4.41Å; Q927-E931 WeakPolarHBondContact CG-OE1 3.49Å; Q927-E931 PolarHBondContact NE2-OE1 3.42Å; Q927-E931 WeakPolarHBondContact O-CB 3.36Å; Q927-E931 VanDerWaalsContact O-CG 3.31Å; Q927-E931 WeakPolarHBondContact O-CG 3.39Å; Q927-E931 PolarHBondContact O-N 2.68Å; Q927-L964 HydrophobicContact CG-CD2 4.02Å; Q927-L967 HydrophobicContact CB-CD1 4.19Å
928	R	62.2	Low	58.2	Low	164 Å²	164	74.2 Å²	74.2	62%	0.619	35%	0.351	S	S	*	.	H	α-helix	trans	-60.3	-38.5	177.5	-170.8	179.6	-65.5	162.5	1.6	112.5	A924 R925 V926 L932	A924-R928 WeakPolarHBondContact O-CB 3.23Å; A924-R928 PolarHBondContact O-N 3.25Å; A924-R928 VanDerWaalsContact O-N 3.11Å; R925-R928 PolarHBondContact O-N 3.21Å; V926-R928 PolarHBondContact O-N 3.48Å; R928-L932 HydrophobicContact CG-CD1 4.36Å; R928-L932 WeakPolarHBondContact O-CB 3.26Å; R928-L932 VanDerWaalsContact O-CG 3.22Å; R928-L932 WeakPolarHBondContact O-CG 3.48Å; R928-L932 PolarHBondContact O-N 3.48Å
929	H	53.8	Low	58.9	Low	80 Å²	80	78.6 Å²	78.6	37%	0.37	38%	0.375	S	S	.	.	H	α-helix	trans	-70.5	-40.2	178.1	-71.7	72.3	0	0	0	111.7	R925 V926 Q927 L932 L933	R925-H929 WeakPolarHBondContact CG-CE1 3.47Å; R925-H929 PolarHBondContact O-N 3.3Å; R925-H929 PolarHBondContact O-ND1 2.88Å; V926-H929 PolarHBondContact O-N 3Å; Q927-H929 VanDerWaalsContact C-N 3.3Å; Q927-H929 PolarHBondContact O-N 3.01Å; H929-L932 PolarHBondContact O-N 3.33Å; H929-L933 VanDerWaalsContact O-CB 3.27Å; H929-L933 WeakPolarHBondContact O-CB 3.37Å; H929-L933 PolarHBondContact O-N 2.83Å
930	L	63.6	Low	59.3	Low	8 Å²	8	73.6 Å²	73.6	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-68.8	-34.9	175.5	-70.8	174.1	0	0	0	112.1	L911 V914 V926 Q927 L933 L934 V960 L963 L964 L967	L911-L930 HydrophobicContact CD2-CD2 4.32Å; V914-L930 HydrophobicContact CG1-CD1 4.35Å; V914-L930 HydrophobicContact CG1-CD2 4.46Å; V926-L930 HydrophobicContact CG1-CD1 3.78Å; V926-L930 HydrophobicContact CG1-CG 4.2Å; V926-L930 WeakPolarHBondContact O-CB 3.31Å; V926-L930 WeakPolarHBondContact O-CG 3.21Å; V926-L930 PolarHBondContact O-N 3.13Å; Q927-L930 PolarHBondContact O-N 3.18Å; L930-L933 HydrophobicContact CD2-CD2 4.4Å; L930-L933 PolarHBondContact O-N 3.28Å; L930-L934 VanDerWaalsContact O-CB 3.25Å; L930-L934 WeakPolarHBondContact O-CB 3.32Å; L930-L934 PolarHBondContact O-N 2.98Å; L930-V960 HydrophobicContact CB-CG1 4.24Å; L930-V960 HydrophobicContact CD2-CG1 4.17Å; L930-V960 WeakPolarHBondContact O-CG1 3.48Å; L930-L963 HydrophobicContact CD1-CB 3.95Å; L930-L964 HydrophobicContact CB-CD1 4.28Å; L930-L964 HydrophobicContact CB-CD2 3.56Å; L930-L964 HydrophobicContact CB-CG 3.82Å; L930-L964 HydrophobicContact CD1-CD2 4.42Å; L930-L967 HydrophobicContact CD1-CD1 3.56Å
931	E	69.6	Low	61	Low	94 Å²	94	73.4 Å²	73.4	44%	0.439	34%	0.338	S	S	.	.	H	α-helix	trans	-65.7	-43.7	173	-76.4	171.3	-176.1	0	0	111.6	Q927 L934 R935 L964	Q927-E931 HydrophobicContact CG-CG 4.41Å; Q927-E931 WeakPolarHBondContact CG-OE1 3.49Å; Q927-E931 PolarHBondContact NE2-OE1 3.42Å; Q927-E931 WeakPolarHBondContact O-CB 3.36Å; Q927-E931 VanDerWaalsContact O-CG 3.31Å; Q927-E931 WeakPolarHBondContact O-CG 3.39Å; Q927-E931 PolarHBondContact O-N 2.68Å; E931-L934 PolarHBondContact O-N 2.85Å; E931-R935 WeakPolarHBondContact O-CB 3.49Å; E931-R935 PolarHBondContact O-N 2.89Å; E931-L964 HydrophobicContact CG-CD1 4.4Å; E931-L964 HydrophobicContact CG-CD2 3.83Å
932	L	61.1	Low	62	Low	107 Å²	107	72.4 Å²	72.4	56%	0.56	35%	0.352	S	S	*	.	H	α-helix	trans	-63.6	-44.1	174.5	-73.1	170.3	0	0	0	111.3	R928 H929 R935 D936	R928-L932 HydrophobicContact CG-CD1 4.36Å; R928-L932 WeakPolarHBondContact O-CB 3.26Å; R928-L932 VanDerWaalsContact O-CG 3.22Å; R928-L932 WeakPolarHBondContact O-CG 3.48Å; R928-L932 PolarHBondContact O-N 3.48Å; H929-L932 PolarHBondContact O-N 3.33Å; L932-R935 PolarHBondContact O-N 2.9Å; L932-D936 WeakPolarHBondContact O-CB 3.31Å; L932-D936 PolarHBondContact O-N 3.22Å
933	L	62	Low	62.2	Low	17 Å²	17	71.8 Å²	71.8	9%	0.089	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-43.6	175.6	177.5	62.4	0	0	0	111.6	W907 L911 H929 L930 R935 D936 L937 V960	W907-L933 HydrophobicContact CH2-CD1 3.44Å; W907-L933 VanDerWaalsContact CH2-CD1 3.44Å; W907-L933 HydrophobicContact CH2-CD2 4.22Å; W907-L933 HydrophobicContact CH2-CG 4.48Å; W907-L933 HydrophobicContact CZ2-CD1 4.29Å; W907-L933 HydrophobicContact CZ3-CD1 3.9Å; W907-L933 HydrophobicContact CZ3-CD2 3.79Å; L911-L933 HydrophobicContact CD2-CD2 4.37Å; H929-L933 VanDerWaalsContact O-CB 3.27Å; H929-L933 WeakPolarHBondContact O-CB 3.37Å; H929-L933 PolarHBondContact O-N 2.83Å; L930-L933 HydrophobicContact CD2-CD2 4.4Å; L930-L933 PolarHBondContact O-N 3.28Å; L933-R935 PolarHBondContact O-N 3.17Å; L933-D936 PolarHBondContact O-N 3.11Å; L933-L937 HydrophobicContact CD1-CD1 4.25Å; L933-L937 HydrophobicContact CD1-CG 4.23Å; L933-L937 HydrophobicContact CG-CD1 4Å; L933-L937 HydrophobicContact CG-CG 4.43Å; L933-L937 WeakPolarHBondContact O-CB 3.42Å; L933-L937 VanDerWaalsContact O-CG 3.24Å; L933-L937 WeakPolarHBondContact O-CG 3.35Å; L933-L937 PolarHBondContact O-N 3.41Å; L933-V960 HydrophobicContact CD2-CG2 3.82Å; L933-V960 HydrophobicContact CG-CG2 4.36Å
934	L	71.4	Confident	62.1	Low	19 Å²	19	67.3 Å²	67.3	10%	0.099	35%	0.346	C	S	.	.	H	α-helix	trans	-61.4	-46.3	178.7	-178.6	61.9	0	0	0	111	L930 E931 D936 L937 E938 E957 V960 R961 L964	L930-L934 VanDerWaalsContact O-CB 3.25Å; L930-L934 WeakPolarHBondContact O-CB 3.32Å; L930-L934 PolarHBondContact O-N 2.98Å; E931-L934 PolarHBondContact O-N 2.85Å; L934-D936 VanDerWaalsContact C-N 3.29Å; L934-D936 PolarHBondContact O-N 3.04Å; L934-L937 PolarHBondContact O-N 3.34Å; L934-E938 WeakPolarHBondContact O-CG 3.4Å; L934-E938 PolarHBondContact O-N 2.97Å; L934-E957 HydrophobicContact CD1-CB 4.22Å; L934-E957 HydrophobicContact CD1-CG 4.21Å; L934-V960 HydrophobicContact CB-CG1 3.89Å; L934-V960 HydrophobicContact CD1-CG1 4.33Å; L934-R961 HydrophobicContact CD1-CG 3.8Å; L934-R961 HydrophobicContact CD2-CG 3.83Å; L934-L964 HydrophobicContact CB-CD1 4.15Å; L934-L964 HydrophobicContact CD2-CD1 3.67Å
935	R	64.6	Low	62.5	Low	171 Å²	171	72.2 Å²	72.2	65%	0.645	36%	0.364	S	S	*	.	H	α-helix	trans	-62.4	-39.4	178.1	-164.1	173	-173.7	169.9	2.7	111.7	E931 L932 L933 E938 D939	E931-R935 WeakPolarHBondContact O-CB 3.49Å; E931-R935 PolarHBondContact O-N 2.89Å; L932-R935 PolarHBondContact O-N 2.9Å; L933-R935 PolarHBondContact O-N 3.17Å; R935-E938 PolarHBondContact O-N 3.45Å; R935-D939 WeakPolarHBondContact O-CB 3.2Å; R935-D939 PolarHBondContact O-N 3.31Å
936	D	55	Low	63	Low	32 Å²	32	69.7 Å²	69.7	17%	0.171	36%	0.36	C	S	.	.	H	α-helix	trans	-66.8	-39.5	176.7	-166.7	33.8	0	0	0	112.7	T898 E899 L932 L933 L934 S940	T898-D936 WeakPolarHBondContact CB-OD1 3.4Å; T898-D936 WeakPolarHBondContact CB-OD2 3.39Å; T898-D936 WeakPolarHBondContact CG2-OD1 3.43Å; E899-D936 PolarHBondContact N-OD2 3.2Å; L932-D936 WeakPolarHBondContact O-CB 3.31Å; L932-D936 PolarHBondContact O-N 3.22Å; L933-D936 PolarHBondContact O-N 3.11Å; L934-D936 VanDerWaalsContact C-N 3.29Å; L934-D936 PolarHBondContact O-N 3.04Å; D936-S940 WeakPolarHBondContact O-CB 3.2Å; D936-S940 PolarHBondContact O-N 3.28Å; D936-S940 PolarHBondContact O-OG 2.85Å
937	L	62.3	Low	63.1	Low	3 Å²	3	74 Å²	74	2%	0.016	39%	0.388	C	S	.	.	H	α-helix	trans	-65.2	-43.1	174.1	-71.1	167.5	0	0	0	111.6	L933 L934 S940 R941 L953 V956 E957 V960	L933-L937 HydrophobicContact CD1-CD1 4.25Å; L933-L937 HydrophobicContact CD1-CG 4.23Å; L933-L937 HydrophobicContact CG-CD1 4Å; L933-L937 HydrophobicContact CG-CG 4.43Å; L933-L937 WeakPolarHBondContact O-CB 3.42Å; L933-L937 VanDerWaalsContact O-CG 3.24Å; L933-L937 WeakPolarHBondContact O-CG 3.35Å; L933-L937 PolarHBondContact O-N 3.41Å; L934-L937 PolarHBondContact O-N 3.34Å; L937-S940 PolarHBondContact O-N 2.88Å; L937-R941 WeakPolarHBondContact O-CB 3.45Å; L937-R941 PolarHBondContact O-N 3.06Å; L937-L953 HydrophobicContact CD2-CD2 3.71Å; L937-V956 HydrophobicContact CD1-CB 4.41Å; L937-V956 HydrophobicContact CD1-CG1 3.82Å; L937-V956 HydrophobicContact CD2-CG1 4.3Å; L937-E957 HydrophobicContact CB-CG 3.66Å; L937-E957 HydrophobicContact CD1-CG 4.34Å; L937-V960 HydrophobicContact CD1-CG2 4.02Å
938	E	72.1	Confident	62.1	Low	63 Å²	63	79.1 Å²	79.1	29%	0.294	41%	0.405	S	S	.	.	H	α-helix	trans	-61.9	-47.4	176.7	-74.1	174.9	158.8	0	0	111.9	L934 R935 R941 G942 R961	L934-E938 WeakPolarHBondContact O-CG 3.4Å; L934-E938 PolarHBondContact O-N 2.97Å; R935-E938 PolarHBondContact O-N 3.45Å; E938-R941 PolarHBondContact O-N 2.86Å; E938-G942 PolarHBondContact O-N 3.08Å; E938-R961 IonicContact OE1-CZ 2.6Å; E938-R961 IonicContact OE1-NH1 3.43Å; E938-R961 IonicContact OE1-NH2 2.69Å; E938-R961 PolarHBondContact OE1-NH2 3.47Å
939	D	64.1	Low	61.8	Low	105 Å²	105	75.3 Å²	75.3	56%	0.561	39%	0.39	S	S	*	.	H	α-helix	trans	-63.5	-43.3	177.6	-74.9	-18.4	0	0	0	110.8	R935 R941 G942 A943	R935-D939 WeakPolarHBondContact O-CB 3.2Å; R935-D939 PolarHBondContact O-N 3.31Å; D939-R941 VanDerWaalsContact C-N 3.35Å; D939-R941 PolarHBondContact O-N 2.87Å; D939-G942 PolarHBondContact O-N 3.29Å; D939-A943 WeakPolarHBondContact O-CB 3.37Å; D939-A943 PolarHBondContact O-N 3.2Å
940	S	56	Low	62.4	Low	29 Å²	29	75.3 Å²	75.3	20%	0.203	39%	0.389	C	S	.	.	H	α-helix	trans	-63.8	-37.1	176.5	-67.8	0	0	0	0	112.8	D936 L937 T944	D936-S940 WeakPolarHBondContact O-CB 3.2Å; D936-S940 PolarHBondContact O-N 3.28Å; D936-S940 PolarHBondContact O-OG 2.85Å; L937-S940 PolarHBondContact O-N 2.88Å; S940-T944 PolarHBondContact O-N 3.27Å
941	R	73.1	Confident	62.3	Low	76 Å²	76	77.7 Å²	77.7	29%	0.287	41%	0.41	S	S	.	.	H	α-helix	trans	-70.1	-36.4	174.4	-177.5	176.6	56.5	79.1	2.9	111.8	L937 E938 D939 K950 L953 E957	L937-R941 WeakPolarHBondContact O-CB 3.45Å; L937-R941 PolarHBondContact O-N 3.06Å; E938-R941 PolarHBondContact O-N 2.86Å; D939-R941 VanDerWaalsContact C-N 3.35Å; D939-R941 PolarHBondContact O-N 2.87Å; R941-K950 HydrophobicContact CG-CB 4.4Å; R941-K950 HydrophobicContact CG-CG 4.15Å; R941-K950 WeakPolarHBondContact O-CE 3.44Å; R941-L953 HydrophobicContact CB-CB 4.21Å; R941-L953 HydrophobicContact CB-CD1 4.07Å; R941-E957 WeakPolarHBondContact CB-OE1 3.45Å; R941-E957 WeakPolarHBondContact CD-OE1 3.15Å; R941-E957 IonicContact CZ-OE1 3.55Å; R941-E957 IonicContact CZ-OE2 3.54Å; R941-E957 IonicContact NE-OE1 3.51Å; R941-E957 PolarHBondContact NE-OE1 3.36Å; R941-E957 IonicContact NE-OE2 2.77Å; R941-E957 PolarHBondContact NE-OE2 3.17Å; R941-E957 IonicContact NH2-OE1 3.31Å; R941-E957 IonicContact NH2-OE2 2.79Å; R941-E957 PolarHBondContact NH2-OE2 3.03Å
942	G	65.4	Low	61.6	Low	60 Å²	60	76 Å²	76	62%	0.619	40%	0.402	S	S	*	.	H	α-helix	trans	-65.4	-38.4	174.2	0	0	0	0	0	112.9	E938 D939	E938-G942 PolarHBondContact O-N 3.08Å; D939-G942 PolarHBondContact O-N 3.29Å
943	A	59	Low	61.6	Low	87 Å²	87	71 Å²	71	72%	0.719	38%	0.376	S	S	*	.	H	α-helix	trans	-80	-20.4	-176.8	0	0	0	0	0	114.8	D939	D939-A943 WeakPolarHBondContact O-CB 3.37Å; D939-A943 PolarHBondContact O-N 3.2Å
944	T	55.2	Low	62	Low	20 Å²	20	75 Å²	75	12%	0.123	40%	0.397	C	S	.	.			trans	-92.5	141.5	-179.4	-165.9	0	0	0	0	112.8	S940 R949 K950 L953	S940-T944 PolarHBondContact O-N 3.27Å; T944-R949 HydrophobicContact CG2-CB 4.45Å; T944-R949 HydrophobicContact CG2-CG 4.31Å; T944-K950 HydrophobicContact CG2-CG 3.81Å; T944-K950 WeakPolarHBondContact O-CE 3.38Å; T944-K950 PolarHBondContact O-NZ 3.47Å; T944-L953 HydrophobicContact CG2-CD1 4.21Å
945	L	65.6	Low	61.7	Low	163 Å²	163	81.3 Å²	81.3	85%	0.853	42%	0.419	S	S	*	.			trans	-97.5	-5.2	173.8	-67.3	170.4	0	0	0	113.1	P947	L945-P947 WeakPolarHBondContact O-CD 3.45Å
946	N	63	Low	61.5	Low	79 Å²	79	73.6 Å²	73.6	42%	0.422	39%	0.391	S	S	.	.			trans	-79.6	118.4	-176.4	-179.4	-33.2	0	0	0	111.2	W948 R949 K950	N946-W948 PolarHBondContact O-N 3.43Å; N946-W948 PolarHBondContact OD1-N 3.19Å; N946-R949 HydrophobicContact CB-CB 3.87Å; N946-R949 PolarHBondContact O-N 3.42Å; N946-R949 PolarHBondContact OD1-N 2.83Å; N946-K950 WeakPolarHBondContact O-CG 3.31Å; N946-K950 PolarHBondContact O-N 3.19Å
947	P	57.9	Low	62.3	Low	106 Å²	106	72.3 Å²	72.3	69%	0.688	38%	0.384	S	S	*	.	H	α-helix	trans	-66.9	-32.8	-174.6	25.3	-33	0	0	0	113.7	L945 A951	L945-P947 WeakPolarHBondContact O-CD 3.45Å; P947-A951 PolarHBondContact O-N 3.22Å; P947-A951 VanDerWaalsContact O-N 3.1Å
948	W	47.3	Very low	62.5	Low	179 Å²	179	74.2 Å²	74.2	68%	0.678	40%	0.404	S	S	*	.	H	α-helix	trans	-72.1	-39.1	176.9	-173.6	82	0	0	0	111.2	N946 A951 Q952	N946-W948 PolarHBondContact O-N 3.43Å; N946-W948 PolarHBondContact OD1-N 3.19Å; W948-A951 PolarHBondContact O-N 3.42Å; W948-Q952 HydrophobicContact CD2-CG 4.4Å; W948-Q952 HydrophobicContact CE3-CG 4.48Å; W948-Q952 HydrophobicContact CH2-CG 4.38Å; W948-Q952 HydrophobicContact CZ2-CG 4.29Å; W948-Q952 HydrophobicContact CZ3-CG 4.47Å; W948-Q952 WeakPolarHBondContact O-CG 3.5Å; W948-Q952 PolarHBondContact O-N 3.13Å; W948-Q952 VanDerWaalsContact O-N 3.11Å
949	R	55.3	Low	61.9	Low	84 Å²	84	74.3 Å²	74.3	32%	0.317	41%	0.405	S	S	.	.	H	α-helix	trans	-65.5	-40.2	173.9	-168	173	178.9	167.5	1.7	111.8	G900 T901 T944 N946 A951 Q952 L953	G900-R949 PolarHBondContact O-NH2 2.86Å; T901-R949 PolarHBondContact O-NH2 3.34Å; T944-R949 HydrophobicContact CG2-CB 4.45Å; T944-R949 HydrophobicContact CG2-CG 4.31Å; N946-R949 HydrophobicContact CB-CB 3.87Å; N946-R949 PolarHBondContact O-N 3.42Å; N946-R949 PolarHBondContact OD1-N 2.83Å; R949-A951 VanDerWaalsContact C-N 3.33Å; R949-A951 PolarHBondContact O-N 2.95Å; R949-Q952 PolarHBondContact O-N 3.4Å; R949-L953 HydrophobicContact CG-CD1 4.16Å; R949-L953 WeakPolarHBondContact O-CG 3.48Å; R949-L953 PolarHBondContact O-N 3.4Å
950	K	66.4	Low	61.9	Low	80 Å²	80	69.3 Å²	69.3	35%	0.348	38%	0.378	S	S	.	.	H	α-helix	trans	-58.4	-44.2	172.2	-74.7	-168.9	-178.9	-172.9	0	111.8	R941 T944 N946 Q952 L953 L954	R941-K950 HydrophobicContact CG-CB 4.4Å; R941-K950 HydrophobicContact CG-CG 4.15Å; R941-K950 WeakPolarHBondContact O-CE 3.44Å; T944-K950 HydrophobicContact CG2-CG 3.81Å; T944-K950 WeakPolarHBondContact O-CE 3.38Å; T944-K950 PolarHBondContact O-NZ 3.47Å; N946-K950 WeakPolarHBondContact O-CG 3.31Å; N946-K950 PolarHBondContact O-N 3.19Å; K950-Q952 PolarHBondContact O-N 3.02Å; K950-L953 PolarHBondContact O-N 3.3Å; K950-L954 VanDerWaalsContact O-CB 3.31Å; K950-L954 WeakPolarHBondContact O-CB 3.41Å; K950-L954 PolarHBondContact O-N 3.34Å
951	A	61.4	Low	62.9	Low	58 Å²	58	72.7 Å²	72.7	48%	0.479	39%	0.386	S	S	.	.	H	α-helix	trans	-64.7	-38	179.9	0	0	0	0	0	113.1	P947 W948 R949 R955	P947-A951 PolarHBondContact O-N 3.22Å; P947-A951 VanDerWaalsContact O-N 3.1Å; W948-A951 PolarHBondContact O-N 3.42Å; R949-A951 VanDerWaalsContact C-N 3.33Å; R949-A951 PolarHBondContact O-N 2.95Å; A951-R955 PolarHBondContact O-N 3.12Å
952	Q	54.9	Low	62.6	Low	58 Å²	58	70.2 Å²	70.2	27%	0.271	39%	0.385	S	S	.	.	H	α-helix	trans	-71.8	-42	177.1	-66.4	-63.1	-23.2	0	0	112.5	V903 W948 R949 K950 L954 R955 V956	V903-Q952 HydrophobicContact CG1-CB 4.14Å; W948-Q952 HydrophobicContact CD2-CG 4.4Å; W948-Q952 HydrophobicContact CE3-CG 4.48Å; W948-Q952 HydrophobicContact CH2-CG 4.38Å; W948-Q952 HydrophobicContact CZ2-CG 4.29Å; W948-Q952 HydrophobicContact CZ3-CG 4.47Å; W948-Q952 WeakPolarHBondContact O-CG 3.5Å; W948-Q952 PolarHBondContact O-N 3.13Å; W948-Q952 VanDerWaalsContact O-N 3.11Å; R949-Q952 PolarHBondContact O-N 3.4Å; K950-Q952 PolarHBondContact O-N 3.02Å; Q952-L954 VanDerWaalsContact C-N 3.32Å; Q952-L954 PolarHBondContact O-N 3.34Å; Q952-R955 WeakPolarHBondContact O-CB 3.38Å; Q952-R955 PolarHBondContact O-N 3.21Å; Q952-V956 PolarHBondContact O-N 2.9Å
953	L	61	Low	62.3	Low	2 Å²	2	67.7 Å²	67.7	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-61.2	-42.4	173.2	-71.1	168	0	0	0	111.1	V903 L937 R941 T944 R949 K950 R955 V956 E957	V903-L953 HydrophobicContact CG2-CD2 3.57Å; V903-L953 HydrophobicContact CG2-CG 4.09Å; L937-L953 HydrophobicContact CD2-CD2 3.71Å; R941-L953 HydrophobicContact CB-CB 4.21Å; R941-L953 HydrophobicContact CB-CD1 4.07Å; T944-L953 HydrophobicContact CG2-CD1 4.21Å; R949-L953 HydrophobicContact CG-CD1 4.16Å; R949-L953 WeakPolarHBondContact O-CG 3.48Å; R949-L953 PolarHBondContact O-N 3.4Å; K950-L953 PolarHBondContact O-N 3.3Å; L953-R955 PolarHBondContact O-N 3.33Å; L953-V956 PolarHBondContact O-N 3.08Å; L953-E957 WeakPolarHBondContact O-CB 3.36Å; L953-E957 WeakPolarHBondContact O-CG 3.48Å; L953-E957 PolarHBondContact O-N 3.41Å
954	L	70.8	Confident	62.8	Low	100 Å²	100	64.8 Å²	64.8	52%	0.524	33%	0.329	S	S	.	.	H	α-helix	trans	-61.2	-31.7	177.1	-147.6	110.7	0	0	0	112.8	K950 Q952 G958	K950-L954 VanDerWaalsContact O-CB 3.31Å; K950-L954 WeakPolarHBondContact O-CB 3.41Å; K950-L954 PolarHBondContact O-N 3.34Å; Q952-L954 VanDerWaalsContact C-N 3.32Å; Q952-L954 PolarHBondContact O-N 3.34Å; L954-G958 PolarHBondContact O-N 2.99Å; L954-G958 VanDerWaalsContact O-N 3.1Å
955	R	64.5	Low	63.7	Low	153 Å²	153	70.6 Å²	70.6	58%	0.577	36%	0.355	S	S	*	.	H	α-helix	trans	-69.6	-47.9	176.3	-177.7	-177.7	174.7	178.6	1.8	111.4	A951 Q952 L953 G958 E959	A951-R955 PolarHBondContact O-N 3.12Å; Q952-R955 WeakPolarHBondContact O-CB 3.38Å; Q952-R955 PolarHBondContact O-N 3.21Å; L953-R955 PolarHBondContact O-N 3.33Å; R955-G958 PolarHBondContact O-N 3.44Å; R955-G958 VanDerWaalsContact O-N 3.16Å; R955-E959 IonicContact NE-OE1 2.8Å; R955-E959 PolarHBondContact O-N 3.3Å; R955-E959 VanDerWaalsContact O-N 3.12Å
956	V	60.8	Low	63.5	Low	8 Å²	8	67.9 Å²	67.9	5%	0.048	34%	0.338	C	S	.	.	H	α-helix	trans	-67	-39.3	177.7	-176.7	0	0	0	0	110.7	V903 W907 L911 L937 Q952 L953 G958 E959 V960	V903-V956 HydrophobicContact CG1-CG2 4.4Å; W907-V956 HydrophobicContact CB-CG1 4.16Å; W907-V956 HydrophobicContact CB-CG2 4Å; W907-V956 HydrophobicContact CD2-CG1 4.36Å; W907-V956 HydrophobicContact CG-CG1 4.23Å; W907-V956 HydrophobicContact CG-CG2 4.35Å; L911-V956 HydrophobicContact CD1-CG1 3.84Å; L937-V956 HydrophobicContact CD1-CB 4.41Å; L937-V956 HydrophobicContact CD1-CG1 3.82Å; L937-V956 HydrophobicContact CD2-CG1 4.3Å; Q952-V956 PolarHBondContact O-N 2.9Å; L953-V956 PolarHBondContact O-N 3.08Å; V956-G958 VanDerWaalsContact C-N 3.25Å; V956-G958 PolarHBondContact O-N 3.18Å; V956-E959 PolarHBondContact O-N 3.11Å; V956-E959 VanDerWaalsContact O-N 3.15Å; V956-V960 HydrophobicContact CG1-CG2 4.35Å; V956-V960 WeakPolarHBondContact O-CG2 3.4Å; V956-V960 PolarHBondContact O-N 3.36Å
957	E	71.4	Confident	63.3	Low	6 Å²	6	64.7 Å²	64.7	3%	0.028	32%	0.321	C	S	.	.	H	α-helix	trans	-54.5	-42.3	169.9	-76.8	176.8	-138.5	0	0	111.4	L934 L937 R941 L953 R961	L934-E957 HydrophobicContact CD1-CB 4.22Å; L934-E957 HydrophobicContact CD1-CG 4.21Å; L937-E957 HydrophobicContact CB-CG 3.66Å; L937-E957 HydrophobicContact CD1-CG 4.34Å; R941-E957 WeakPolarHBondContact CB-OE1 3.45Å; R941-E957 WeakPolarHBondContact CD-OE1 3.15Å; R941-E957 IonicContact CZ-OE1 3.55Å; R941-E957 IonicContact CZ-OE2 3.54Å; R941-E957 IonicContact NE-OE1 3.51Å; R941-E957 PolarHBondContact NE-OE1 3.36Å; R941-E957 IonicContact NE-OE2 2.77Å; R941-E957 PolarHBondContact NE-OE2 3.17Å; R941-E957 IonicContact NH2-OE1 3.31Å; R941-E957 IonicContact NH2-OE2 2.79Å; R941-E957 PolarHBondContact NH2-OE2 3.03Å; L953-E957 WeakPolarHBondContact O-CB 3.36Å; L953-E957 WeakPolarHBondContact O-CG 3.48Å; L953-E957 PolarHBondContact O-N 3.41Å; E957-R961 WeakPolarHBondContact O-CB 3.49Å; E957-R961 VanDerWaalsContact O-CG 3.25Å; E957-R961 WeakPolarHBondContact O-CG 3.46Å; E957-R961 PolarHBondContact O-N 3.42Å; E957-R961 IonicContact OE2-NH2 3.75Å
958	G	66.3	Low	63	Low	42 Å²	42	61.7 Å²	61.7	43%	0.433	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-41.5	176.6	0	0	0	0	0	113.3	L954 R955 V956 G962	L954-G958 PolarHBondContact O-N 2.99Å; L954-G958 VanDerWaalsContact O-N 3.1Å; R955-G958 PolarHBondContact O-N 3.44Å; R955-G958 VanDerWaalsContact O-N 3.16Å; V956-G958 VanDerWaalsContact C-N 3.25Å; V956-G958 PolarHBondContact O-N 3.18Å; G958-G962 PolarHBondContact O-N 2.93Å
959	E	60.3	Low	62.9	Low	66 Å²	66	56.5 Å²	56.5	31%	0.308	31%	0.311	S	S	.	.	H	α-helix	trans	-68.1	-43.1	177.1	-68.8	173.7	-164.1	0	0	111.5	L911 R955 V956 G962 L963	L911-E959 HydrophobicContact CD1-CB 3.73Å; R955-E959 IonicContact NE-OE1 2.8Å; R955-E959 PolarHBondContact O-N 3.3Å; R955-E959 VanDerWaalsContact O-N 3.12Å; V956-E959 PolarHBondContact O-N 3.11Å; V956-E959 VanDerWaalsContact O-N 3.15Å; E959-G962 PolarHBondContact O-N 3.5Å; E959-L963 WeakPolarHBondContact O-CG 3.48Å; E959-L963 PolarHBondContact O-N 3.07Å; E959-L963 VanDerWaalsContact O-N 3.09Å
960	V	63.4	Low	62.2	Low	0 Å²	0	57.3 Å²	57.3	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-42.1	176.1	174.6	0	0	0	0	111.8	L911 L930 L933 L934 L937 V956 G962 L963 L964	L911-V960 HydrophobicContact CD1-CG2 3.79Å; L911-V960 HydrophobicContact CD2-CG2 3.82Å; L911-V960 HydrophobicContact CG-CG2 4.49Å; L930-V960 HydrophobicContact CB-CG1 4.24Å; L930-V960 HydrophobicContact CD2-CG1 4.17Å; L930-V960 WeakPolarHBondContact O-CG1 3.48Å; L933-V960 HydrophobicContact CD2-CG2 3.82Å; L933-V960 HydrophobicContact CG-CG2 4.36Å; L934-V960 HydrophobicContact CB-CG1 3.89Å; L934-V960 HydrophobicContact CD1-CG1 4.33Å; L937-V960 HydrophobicContact CD1-CG2 4.02Å; V956-V960 HydrophobicContact CG1-CG2 4.35Å; V956-V960 WeakPolarHBondContact O-CG2 3.4Å; V956-V960 PolarHBondContact O-N 3.36Å; V960-G962 VanDerWaalsContact C-N 3.33Å; V960-G962 PolarHBondContact O-N 3.44Å; V960-L963 PolarHBondContact O-N 3.01Å; V960-L964 HydrophobicContact CG1-CD1 4.04Å; V960-L964 WeakPolarHBondContact O-CG 3.35Å; V960-L964 PolarHBondContact O-N 3.24Å
961	R	77.1	Confident	61	Low	99 Å²	99	56.7 Å²	56.7	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-41	173.8	-75.4	-178.6	-159.6	-86.8	1	111.7	L934 E938 E957 L963 L964 E965	L934-R961 HydrophobicContact CD1-CG 3.8Å; L934-R961 HydrophobicContact CD2-CG 3.83Å; E938-R961 IonicContact OE1-CZ 2.6Å; E938-R961 IonicContact OE1-NH1 3.43Å; E938-R961 IonicContact OE1-NH2 2.69Å; E938-R961 PolarHBondContact OE1-NH2 3.47Å; E957-R961 WeakPolarHBondContact O-CB 3.49Å; E957-R961 VanDerWaalsContact O-CG 3.25Å; E957-R961 WeakPolarHBondContact O-CG 3.46Å; E957-R961 PolarHBondContact O-N 3.42Å; E957-R961 IonicContact OE2-NH2 3.75Å; R961-L963 VanDerWaalsContact C-N 3.29Å; R961-L963 PolarHBondContact O-N 3.29Å; R961-L964 PolarHBondContact O-N 2.88Å; R961-E965 WeakPolarHBondContact O-CB 3.38Å; R961-E965 WeakPolarHBondContact O-CG 3.3Å; R961-E965 PolarHBondContact O-N 3.21Å
962	G	67.5	Low	59.4	Low	25 Å²	25	63.2 Å²	63.2	26%	0.258	39%	0.388	S	S	.	.	H	α-helix	trans	-61.2	-37	175.3	0	0	0	0	0	113	G958 E959 V960 Q966	G958-G962 PolarHBondContact O-N 2.93Å; E959-G962 PolarHBondContact O-N 3.5Å; V960-G962 VanDerWaalsContact C-N 3.33Å; V960-G962 PolarHBondContact O-N 3.44Å; G962-Q966 WeakPolarHBondContact O-CG 3.4Å; G962-Q966 PolarHBondContact O-N 3.18Å; G962-Q966 VanDerWaalsContact O-N 3.1Å
963	L	58.3	Low	59.7	Low	6 Å²	6	63.5 Å²	63.5	3%	0.031	39%	0.394	C	S	.	.	H	α-helix	trans	-72.9	-38.6	174.9	-65.2	169.6	0	0	0	112.3	L911 V914 Q915 L918 L930 E959 V960 R961 Q966 L967	L911-L963 HydrophobicContact CB-CD1 4.12Å; L911-L963 HydrophobicContact CD2-CD1 3.98Å; V914-L963 HydrophobicContact CG1-CD1 4.46Å; Q915-L963 HydrophobicContact CB-CD2 3.63Å; Q915-L963 HydrophobicContact CG-CD2 3.66Å; L918-L963 HydrophobicContact CD1-CB 4.24Å; L918-L963 HydrophobicContact CD1-CD2 3.52Å; L918-L963 HydrophobicContact CD1-CG 4.42Å; L930-L963 HydrophobicContact CD1-CB 3.95Å; E959-L963 WeakPolarHBondContact O-CG 3.48Å; E959-L963 PolarHBondContact O-N 3.07Å; E959-L963 VanDerWaalsContact O-N 3.09Å; V960-L963 PolarHBondContact O-N 3.01Å; R961-L963 VanDerWaalsContact C-N 3.29Å; R961-L963 PolarHBondContact O-N 3.29Å; L963-Q966 PolarHBondContact O-N 3.2Å; L963-L967 WeakPolarHBondContact O-CG 3.37Å; L963-L967 PolarHBondContact O-N 3.47Å
964	L	70.1	Confident	59.6	Low	26 Å²	26	66.7 Å²	66.7	14%	0.136	41%	0.414	C	S	.	.	H	α-helix	trans	-65.6	-36.9	173.5	-75.9	168.5	0	0	0	112.3	Q927 L930 E931 L934 V960 R961 L967 G968	Q927-L964 HydrophobicContact CG-CD2 4.02Å; L930-L964 HydrophobicContact CB-CD1 4.28Å; L930-L964 HydrophobicContact CB-CD2 3.56Å; L930-L964 HydrophobicContact CB-CG 3.82Å; L930-L964 HydrophobicContact CD1-CD2 4.42Å; E931-L964 HydrophobicContact CG-CD1 4.4Å; E931-L964 HydrophobicContact CG-CD2 3.83Å; L934-L964 HydrophobicContact CB-CD1 4.15Å; L934-L964 HydrophobicContact CD2-CD1 3.67Å; V960-L964 HydrophobicContact CG1-CD1 4.04Å; V960-L964 WeakPolarHBondContact O-CG 3.35Å; V960-L964 PolarHBondContact O-N 3.24Å; R961-L964 PolarHBondContact O-N 2.88Å; L964-L967 CarbonylContact O-C 3.54Å; L964-L967 PolarHBondContact O-N 3.34Å; L964-G968 PolarHBondContact O-N 3.19Å
965	E	74.6	Confident	59	Low	142 Å²	142	64.9 Å²	64.9	66%	0.664	41%	0.408	S	S	*	.	H	α-helix	trans	-66.1	-37	172.7	-76.4	174.9	-170.2	0	0	111.7	R961 L967 G968 G969	R961-E965 WeakPolarHBondContact O-CB 3.38Å; R961-E965 WeakPolarHBondContact O-CG 3.3Å; R961-E965 PolarHBondContact O-N 3.21Å; E965-L967 VanDerWaalsContact C-N 3.29Å; E965-L967 PolarHBondContact O-N 3.18Å; E965-G968 PolarHBondContact O-N 3.24Å; E965-G969 WeakPolarHBondContact O-CA 3.48Å; E965-G969 PolarHBondContact O-N 2.93Å
966	Q	61.9	Low	58.6	Low	107 Å²	107	59.7 Å²	59.7	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-67.5	-28.6	172.5	-75	173.9	8.2	0	0	113	G962 L963	G962-Q966 WeakPolarHBondContact O-CG 3.4Å; G962-Q966 PolarHBondContact O-N 3.18Å; G962-Q966 VanDerWaalsContact O-N 3.1Å; L963-Q966 PolarHBondContact O-N 3.2Å
967	L	58.9	Low	58.5	Low	12 Å²	12	62.9 Å²	62.9	6%	0.063	42%	0.42	C	S	.	.	H	α-helix	trans	-81.8	-33.2	174.2	-71	165.4	0	0	0	112.9	L918 R923 V926 Q927 L930 L963 L964 E965	L918-L967 HydrophobicContact CD2-CD2 3.42Å; L918-L967 VanDerWaalsContact CD2-CD2 3.42Å; L918-L967 HydrophobicContact CD2-CG 3.8Å; L918-L967 HydrophobicContact CG-CD2 4.03Å; L918-L967 HydrophobicContact CG-CG 4.34Å; R923-L967 HydrophobicContact CB-CD2 4.27Å; R923-L967 HydrophobicContact CG-CD2 4.01Å; V926-L967 HydrophobicContact CG1-CD1 4.08Å; Q927-L967 HydrophobicContact CB-CD1 4.19Å; L930-L967 HydrophobicContact CD1-CD1 3.56Å; L963-L967 WeakPolarHBondContact O-CG 3.37Å; L963-L967 PolarHBondContact O-N 3.47Å; L964-L967 CarbonylContact O-C 3.54Å; L964-L967 PolarHBondContact O-N 3.34Å; E965-L967 VanDerWaalsContact C-N 3.29Å; E965-L967 PolarHBondContact O-N 3.18Å
968	G	51.1	Low	57.7	Low	43 Å²	43	66.7 Å²	66.7	44%	0.443	45%	0.446	S	S	.	.	H	α-helix	trans	-89.2	-11.6	179.7	0	0	0	0	0	115	L964 E965 S970	L964-G968 PolarHBondContact O-N 3.19Å; E965-G968 PolarHBondContact O-N 3.24Å; G968-S970 PolarHBondContact O-N 3.14Å
969	G	45.1	Very low	57	Low	69 Å²	69	68.5 Å²	68.5	71%	0.711	45%	0.447	S	S	*	.			trans	-69.6	18.6	-177.1	0	0	0	0	0	116.6	E965	E965-G969 WeakPolarHBondContact O-CA 3.48Å; E965-G969 PolarHBondContact O-N 2.93Å
970	S	40.3	Very low	56.8	Low	101 Å²	101	68.7 Å²	68.7	71%	0.706	46%	0.458	S	S	*	.	S	Bend	trans	-127.4	59.7	167.4	63.8	0	0	0	0	110.3	G968	G968-S970 PolarHBondContact O-N 3.14Å
971	G	40.3	Very low	56.2	Low	68 Å²	68	74.4 Å²	74.4	70%	0.701	50%	0.496	S	S	*	.			trans	170	40.9	176.5	0	0	0	0	0	118.3
972	S	29.6	Very low	54.3	Low	195 Å²	195	72.2 Å²	72.2	100%	1.364	51%	0.507	S	S	*	.			trans	179.6	0	147.4	63.9	0	0	0	0	111.3

Retrieved 972 of 972 residues in 227.9 ms (Link to these results)

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