A0A096MRW7_PAPAN Loading...

Conserved oligomeric Golgi complex subunit 3

AlphaFold DB (A0A2K5XMW8), UniProt , Accession A0A096MRW7, Species PAPAN (Papio anubis, Olive baboon), Gene COG3, Length 828 aa.

						>A0A096MRW7_PAPAN|A0A096MRW7|COG3
MAEAALLLLPEAAAERDAREKLALWDRRPDTTAPLTDRQTDSVLELKAAAENLPVPSELPIEDLCSLTSQSLPIELTSVVPESTEDILLKGFTSLGMEEERIETAQQFFSWFAKLQTQMDQDEGTKYRQMRDYLSGFQEQCDAILNDVNSALQHLESLQKQYLFVSNKTGTLHEACEQLLKEQSELVDLAENIQQKLSYFNELETINTKLNSPTLSVNSDGFIPMLAKLDDCITYISSHPNFKDYPVYLLKFKQCLSKALHLMKTYTVNTLQTLTNQLLKRDPSSVPNADNAFTLFYVKFRAAAPKVRTLIEQIELRSEKIPEYQQLLNDIHQCYLDQRELLLGPSIACTVAELTSQNNRDHCALVRSGCAFMVHVCQDEHQLYNEFFTKPTSKLDELLEKLCVSLYDVFRPLIIHVIHLETLSELCGILKNEVLEDHVQNNAEQLGAFAAGVKQMLEDVQERLVYRTHIYIQTDITGYKPAPGDLAYPDKLVMMEQIAQSLKDEQKKVPSEASFSDVHLEEGESNSLTKSGSTESLNPRPQTTISPADLHGMWYPTVRRTLVCLSKLYRCIDRAVFQGLSQEALSACIQSLLGASESISKNKTQIDGQLFLIKHLLILREQIAPFHTEFTIKEISLDLKKTRDAAFKILNPMTVPRFFRLNSNNALIEFLLEGTPEIREHYLDSKKDVDRHLKSACEQFIEQQTKLFVDQLEEFMTKVSALKTMASQGGPKYTLSQQPWAQPAKVSDLAATAYKTLKTKLPVTLRSMSLYLCNKDTEFILFKPVRNNIQQVFQKFHALLKEEFSPEDIQIIACPSMEQLSLLLSVSK
					

Structure Viewer

Loading PAE data...

(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	43.8	Very low	40.6	Very low	246 Å²	246	151.6 Å²	151.6	100%	1.212	86%	0.863	S	S	*	*				0	140.3	0	-89.6	-149.6	-74.2	0	0	108.3
2	A	37.3	Very low	41.5	Very low	98 Å²	98	145 Å²	145	81%	0.81	84%	0.84	S	S	*	*			trans	79.1	69.2	172	0	0	0	0	0	117.7
3	E	30.7	Very low	42.3	Very low	204 Å²	204	139.5 Å²	139.5	95%	0.953	82%	0.823	S	S	*	*	S	Bend	trans	-160.4	36.2	134.1	-119	174.8	-172.1	0	0	112.1
4	A	34.6	Very low	43.1	Very low	104 Å²	104	134.4 Å²	134.4	86%	0.86	80%	0.804	S	S	*	*	S	Bend	trans	-117.3	35.2	-175.9	0	0	0	0	0	113
5	A	40.6	Very low	43.9	Very low	96 Å²	96	132 Å²	132	79%	0.793	78%	0.781	S	S	*	*			trans	-137.7	27.1	-164.6	0	0	0	0	0	117.6
6	L	40	Very low	44.9	Very low	167 Å²	167	135.9 Å²	135.9	87%	0.874	78%	0.778	S	S	*	*	S	Bend	trans	-140.1	18.3	-175.7	-106.3	166.3	0	0	0	119.8
7	L	37.8	Very low	45.7	Very low	172 Å²	172	132.7 Å²	132.7	90%	0.901	76%	0.758	S	S	*	*	S	Bend	trans	-136.2	21.1	175.3	-79.2	171.9	0	0	0	116.3
8	L	41.7	Very low	46.4	Very low	163 Å²	163	128 Å²	128	85%	0.853	74%	0.738	S	S	*	*			trans	-110.7	97	170.7	-78.6	161.8	0	0	0	108.9
9	L	50.1	Low	47.2	Very low	167 Å²	167	129.7 Å²	129.7	87%	0.874	73%	0.731	S	S	*	*			trans	173	54.3	160.9	-96	154.4	0	0	0	115.4
10	P	45.8	Very low	48	Very low	102 Å²	102	130 Å²	130	66%	0.662	73%	0.726	S	S	*	*	S	Bend	trans	-124.7	-21.6	149.6	8.1	13	0	0	0	115.4	A12	P10-A12 PolarHBondContact O-N 3.14Å
11	E	44	Very low	48.5	Very low	149 Å²	149	129.6 Å²	129.6	70%	0.696	72%	0.716	S	S	*	*	H	α-helix	trans	-70.4	-29.8	-170.5	-83.9	177	143.8	0	0	114.1	A13 A14 E15	E11-A13 VanDerWaalsContact C-N 3.3Å; E11-A13 PolarHBondContact O-N 3.06Å; E11-A14 PolarHBondContact O-N 3.44Å; E11-E15 PolarHBondContact O-N 3.21Å
12	A	51.5	Low	49.2	Very low	72 Å²	72	123.1 Å²	123.1	60%	0.595	69%	0.686	S	S	*	*	H	α-helix	trans	-70.4	-22.6	-174.7	0	0	0	0	0	114.2	P10	P10-A12 PolarHBondContact O-N 3.14Å
13	A	52.3	Low	50.3	Low	74 Å²	74	121.2 Å²	121.2	61%	0.612	67%	0.671	S	S	*	*	H	α-helix	trans	-84	-39.2	175.8	0	0	0	0	0	111.9	E11 R16 D17	E11-A13 VanDerWaalsContact C-N 3.3Å; E11-A13 PolarHBondContact O-N 3.06Å; A13-R16 PolarHBondContact O-N 3.07Å; A13-D17 PolarHBondContact O-N 2.89Å
14	A	53.3	Low	51.6	Low	67 Å²	67	117.3 Å²	117.3	55%	0.554	66%	0.655	S	S	*	*	H	α-helix	trans	-69	-37.8	177.5	0	0	0	0	0	112.3	E11 R16 A18	E11-A14 PolarHBondContact O-N 3.44Å; A14-R16 VanDerWaalsContact C-N 3.31Å; A14-R16 PolarHBondContact O-N 3.3Å; A14-A18 WeakPolarHBondContact O-CB 3.43Å; A14-A18 PolarHBondContact O-N 3.48Å
15	E	54.2	Low	52.5	Low	99 Å²	99	121.1 Å²	121.1	46%	0.463	65%	0.648	S	S	.	*	H	α-helix	trans	-65.5	-33.1	174.2	-82.3	-160.7	167	0	0	113.1	E11 R19	E11-E15 PolarHBondContact O-N 3.21Å; E15-R19 WeakPolarHBondContact O-CB 3.4Å; E15-R19 VanDerWaalsContact O-CG 3.29Å; E15-R19 WeakPolarHBondContact O-CG 3.4Å; E15-R19 PolarHBondContact O-N 2.79Å; E15-R19 IonicContact OE2-CZ 3.45Å; E15-R19 IonicContact OE2-NH1 3.58Å; E15-R19 PolarHBondContact OE2-NH1 2.87Å; E15-R19 IonicContact OE2-NH2 3.68Å; E15-R19 PolarHBondContact OE2-NH2 3.45Å
16	R	60	Low	53.3	Low	194 Å²	194	123 Å²	123	73%	0.732	65%	0.645	S	S	*	*	H	α-helix	trans	-71.5	-41.6	-179	-162.7	175.9	-175.7	163.9	1.3	111.1	A13 A14 R19 E20	A13-R16 PolarHBondContact O-N 3.07Å; A14-R16 VanDerWaalsContact C-N 3.31Å; A14-R16 PolarHBondContact O-N 3.3Å; R16-R19 PolarHBondContact O-N 3.01Å; R16-E20 WeakPolarHBondContact O-CB 3.43Å; R16-E20 PolarHBondContact O-N 3.27Å
17	D	59.7	Low	53.9	Low	82 Å²	82	123.8 Å²	123.8	44%	0.439	64%	0.636	S	S	.	*	H	α-helix	trans	-68.9	-35.8	176.5	-152	48.9	0	0	0	111.6	A13 K21	A13-D17 PolarHBondContact O-N 2.89Å; D17-K21 WeakPolarHBondContact O-CB 3.49Å; D17-K21 WeakPolarHBondContact O-CD 3.34Å; D17-K21 VanDerWaalsContact O-CG 3.27Å; D17-K21 WeakPolarHBondContact O-CG 3.34Å; D17-K21 PolarHBondContact O-N 2.84Å; D17-K21 VanDerWaalsContact O-N 3.14Å; D17-K21 IonicContact OD2-NZ 3.74Å; D17-K21 PolarHBondContact OD2-NZ 2.69Å
18	A	57.5	Low	54.5	Low	48 Å²	48	127.3 Å²	127.3	40%	0.397	64%	0.637	S	S	.	*	H	α-helix	trans	-68	-40.1	172.2	0	0	0	0	0	112.7	A14 K21 L22	A14-A18 WeakPolarHBondContact O-CB 3.43Å; A14-A18 PolarHBondContact O-N 3.48Å; A18-K21 PolarHBondContact O-N 3.4Å; A18-L22 WeakPolarHBondContact O-CB 3.39Å; A18-L22 WeakPolarHBondContact O-CD1 3.37Å; A18-L22 WeakPolarHBondContact O-CG 3.44Å; A18-L22 PolarHBondContact O-N 3.3Å
19	R	62.5	Low	54.9	Low	160 Å²	160	125 Å²	125	60%	0.604	63%	0.632	S	S	*	*	H	α-helix	trans	-67.7	-36.7	175.9	-79.4	178.9	-180	121.3	6.9	112.6	E15 R16 L22 A23	E15-R19 WeakPolarHBondContact O-CB 3.4Å; E15-R19 VanDerWaalsContact O-CG 3.29Å; E15-R19 WeakPolarHBondContact O-CG 3.4Å; E15-R19 PolarHBondContact O-N 2.79Å; E15-R19 IonicContact OE2-CZ 3.45Å; E15-R19 IonicContact OE2-NH1 3.58Å; E15-R19 PolarHBondContact OE2-NH1 2.87Å; E15-R19 IonicContact OE2-NH2 3.68Å; E15-R19 PolarHBondContact OE2-NH2 3.45Å; R16-R19 PolarHBondContact O-N 3.01Å; R19-L22 PolarHBondContact O-N 3.39Å; R19-A23 WeakPolarHBondContact O-CB 3.38Å; R19-A23 PolarHBondContact O-N 3.26Å
20	E	63	Low	54.8	Low	136 Å²	136	123.8 Å²	123.8	64%	0.636	63%	0.626	S	S	*	*	H	α-helix	trans	-71.1	-35.3	177.5	-153.9	166.2	-154.1	0	0	111.8	R16 A23	R16-E20 WeakPolarHBondContact O-CB 3.43Å; R16-E20 PolarHBondContact O-N 3.27Å; E20-A23 PolarHBondContact O-N 3.2Å
21	K	59	Low	54.9	Low	121 Å²	121	124.2 Å²	124.2	53%	0.526	63%	0.627	S	S	.	*	H	α-helix	trans	-69.2	-35.2	171.8	-74.1	167	-180	157.7	0	113.3	D17 A18	D17-K21 WeakPolarHBondContact O-CB 3.49Å; D17-K21 WeakPolarHBondContact O-CD 3.34Å; D17-K21 VanDerWaalsContact O-CG 3.27Å; D17-K21 WeakPolarHBondContact O-CG 3.34Å; D17-K21 PolarHBondContact O-N 2.84Å; D17-K21 VanDerWaalsContact O-N 3.14Å; D17-K21 IonicContact OD2-NZ 3.74Å; D17-K21 PolarHBondContact OD2-NZ 2.69Å; A18-K21 PolarHBondContact O-N 3.4Å
22	L	57.9	Low	55.6	Low	111 Å²	111	123 Å²	123	58%	0.581	63%	0.63	S	S	*	*	H	α-helix	trans	-70.3	-33.7	172.3	-78.6	160.6	0	0	0	112.1	A18 R19 L24 W25	A18-L22 WeakPolarHBondContact O-CB 3.39Å; A18-L22 WeakPolarHBondContact O-CD1 3.37Å; A18-L22 WeakPolarHBondContact O-CG 3.44Å; A18-L22 PolarHBondContact O-N 3.3Å; R19-L22 PolarHBondContact O-N 3.39Å; L22-L24 PolarHBondContact O-N 2.86Å; L22-W25 WeakPolarHBondContact O-CB 3.4Å; L22-W25 PolarHBondContact O-N 3.36Å
23	A	60.4	Low	55.6	Low	58 Å²	58	122.7 Å²	122.7	48%	0.479	63%	0.628	S	S	.	*	H	α-helix	trans	-66.5	-19.5	176.9	0	0	0	0	0	113.8	R19 E20 W25	R19-A23 WeakPolarHBondContact O-CB 3.38Å; R19-A23 PolarHBondContact O-N 3.26Å; E20-A23 PolarHBondContact O-N 3.2Å; A23-W25 VanDerWaalsContact C-N 3.3Å
24	L	57.5	Low	56.1	Low	121 Å²	121	125.1 Å²	125.1	63%	0.634	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-20.5	172.2	-68.8	168.5	0	0	0	112.8	L22	L22-L24 PolarHBondContact O-N 2.86Å
25	W	53.8	Low	56.5	Low	184 Å²	184	126.8 Å²	126.8	70%	0.697	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-17.7	177.8	-73.9	42.2	0	0	0	113.1	L22 A23	L22-W25 WeakPolarHBondContact O-CB 3.4Å; L22-W25 PolarHBondContact O-N 3.36Å; A23-W25 VanDerWaalsContact C-N 3.3Å
26	D	56.1	Low	57	Low	136 Å²	136	126.3 Å²	126.3	73%	0.727	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	3	-175.9	-83.5	-29.7	0	0	0	114.6
27	R	53.1	Low	57.1	Low	184 Å²	184	123.4 Å²	123.4	69%	0.694	64%	0.639	S	S	*	*			trans	-83.2	119.2	174.8	-78.3	-171	176.2	178.4	1.2	111.4	P29	R27-P29 VanDerWaalsContact C-CD 3.43Å
28	R	51.4	Low	57.4	Low	246 Å²	246	129.5 Å²	129.5	93%	0.928	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-4.1	-164.5	-65.6	-174.1	178.6	-174.1	-1.7	120.3
29	P	48.8	Very low	57.6	Low	115 Å²	115	131.8 Å²	131.8	75%	0.747	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-18.5	174.5	12.7	5.8	0	0	0	115.9	R27	R27-P29 VanDerWaalsContact C-CD 3.43Å
30	D	48	Very low	57.9	Low	140 Å²	140	126.7 Å²	126.7	75%	0.749	65%	0.645	S	S	*	*			trans	-150.5	97.2	-177.1	-82	-46.2	0	0	0	111.6	T32	D30-T32 PolarHBondContact O-N 2.93Å
31	T	49.1	Very low	58.1	Low	112 Å²	112	125 Å²	125	69%	0.687	64%	0.64	S	S	*	*			trans	-98.1	63.1	178.2	54.2	0	0	0	0	111.5
32	T	57.3	Low	58.5	Low	122 Å²	122	122 Å²	122	75%	0.748	64%	0.635	S	S	*	*			trans	-128.1	114.4	166.4	54.5	0	0	0	0	109.3	D30	D30-T32 PolarHBondContact O-N 2.93Å
33	A	53.3	Low	59	Low	66 Å²	66	120.7 Å²	120.7	55%	0.545	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-71.1	128.3	168.1	0	0	0	0	0	107.5	L35	A33-L35 PolarHBondContact O-N 3.43Å; A33-L35 VanDerWaalsContact O-N 3.13Å
34	P	61.8	Low	59.6	Low	125 Å²	125	123.3 Å²	123.3	81%	0.812	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-62.6	119.5	173.2	24.3	-30.7	0	0	0	108.7
35	L	61.7	Low	60.1	Low	102 Å²	102	124.4 Å²	124.4	53%	0.534	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-59	138.4	171.5	-73.1	162.6	0	0	0	108.3	A33 Q39 T40	A33-L35 PolarHBondContact O-N 3.43Å; A33-L35 VanDerWaalsContact O-N 3.13Å; L35-Q39 HydrophobicContact CB-CB 4.34Å; L35-Q39 HydrophobicContact CD2-CB 4.05Å; L35-T40 HydrophobicContact CB-CG2 3.98Å; L35-T40 HydrophobicContact CD1-CG2 4.32Å
36	T	65.8	Low	60.4	Low	89 Å²	89	121.6 Å²	121.6	55%	0.546	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-69.2	150.2	175.3	7.8	0	0	0	0	109.6	R38 Q39 T40	T36-R38 PolarHBondContact O-N 3.27Å; T36-Q39 WeakPolarHBondContact O-CA 3.39Å; T36-Q39 WeakPolarHBondContact O-CB 3.32Å; T36-Q39 PolarHBondContact O-N 3.41Å; T36-Q39 PolarHBondContact OG1-OE1 3.37Å; T36-T40 PolarHBondContact O-N 2.94Å; T36-T40 PolarHBondContact O-OG1 3.36Å
37	D	61.9	Low	60.8	Low	134 Å²	134	121.4 Å²	121.4	72%	0.717	63%	0.629	S	S	*	*	H	α-helix	trans	-49.3	-37.4	-177.1	-62.1	-32.4	0	0	0	112.8	T40 D41	D37-T40 VanDerWaalsContact C-OG1 3.24Å; D37-T40 VanDerWaalsContact CA-OG1 3.22Å; D37-T40 WeakPolarHBondContact CA-OG1 3.47Å; D37-T40 PolarHBondContact O-N 2.99Å; D37-T40 PolarHBondContact O-OG1 2.82Å; D37-D41 PolarHBondContact O-N 3.17Å
38	R	64.6	Low	61.4	Low	210 Å²	210	115.5 Å²	115.5	79%	0.792	62%	0.619	S	S	*	*	H	α-helix	trans	-66.6	-35	174.3	-85.6	-174.7	157.7	176.5	-5.3	114.9	T36 S42	T36-R38 PolarHBondContact O-N 3.27Å; R38-S42 WeakPolarHBondContact O-CB 3.22Å; R38-S42 PolarHBondContact O-N 3.04Å; R38-S42 PolarHBondContact O-OG 3.22Å
39	Q	63.2	Low	61.7	Low	96 Å²	96	106.8 Å²	106.8	45%	0.449	60%	0.6	S	S	.	*	H	α-helix	trans	-74.6	-36.7	177.1	-65.5	176.7	-34.3	0	0	110.8	L35 T36 S42 V43	L35-Q39 HydrophobicContact CB-CB 4.34Å; L35-Q39 HydrophobicContact CD2-CB 4.05Å; T36-Q39 WeakPolarHBondContact O-CA 3.39Å; T36-Q39 WeakPolarHBondContact O-CB 3.32Å; T36-Q39 PolarHBondContact O-N 3.41Å; T36-Q39 PolarHBondContact OG1-OE1 3.37Å; Q39-S42 PolarHBondContact O-N 2.83Å; Q39-V43 VanDerWaalsContact O-CG2 3.28Å; Q39-V43 WeakPolarHBondContact O-CG2 3.34Å; Q39-V43 PolarHBondContact O-N 3.05Å
40	T	67.6	Low	62	Low	53 Å²	53	104.6 Å²	104.6	33%	0.325	59%	0.592	S	S	.	*	H	α-helix	trans	-63.9	-42.6	170.2	28.3	0	0	0	0	112.2	L35 T36 D37 S42 V43 L44	L35-T40 HydrophobicContact CB-CG2 3.98Å; L35-T40 HydrophobicContact CD1-CG2 4.32Å; T36-T40 PolarHBondContact O-N 2.94Å; T36-T40 PolarHBondContact O-OG1 3.36Å; D37-T40 VanDerWaalsContact C-OG1 3.24Å; D37-T40 VanDerWaalsContact CA-OG1 3.22Å; D37-T40 WeakPolarHBondContact CA-OG1 3.47Å; D37-T40 PolarHBondContact O-N 2.99Å; D37-T40 PolarHBondContact O-OG1 2.82Å; T40-S42 VanDerWaalsContact C-N 3.34Å; T40-S42 PolarHBondContact O-N 2.73Å; T40-V43 PolarHBondContact O-N 2.62Å; T40-L44 PolarHBondContact O-N 2.8Å
41	D	67.8	Low	62.3	Low	99 Å²	99	104.7 Å²	104.7	53%	0.529	59%	0.588	S	S	.	*	H	α-helix	trans	-63.6	-40.5	175.1	-74.9	-16.4	0	0	0	111.6	D37 V43 L44 E45	D37-D41 PolarHBondContact O-N 3.17Å; D41-V43 VanDerWaalsContact C-N 3.35Å; D41-V43 PolarHBondContact O-N 2.89Å; D41-L44 PolarHBondContact O-N 3.32Å; D41-E45 PolarHBondContact O-N 3.43Å
42	S	68.2	Low	62.5	Low	58 Å²	58	106 Å²	106	41%	0.406	59%	0.591	S	S	.	*	H	α-helix	trans	-66	-35.6	177.6	-58.5	0	0	0	0	112.7	R38 Q39 T40 L46	R38-S42 WeakPolarHBondContact O-CB 3.22Å; R38-S42 PolarHBondContact O-N 3.04Å; R38-S42 PolarHBondContact O-OG 3.22Å; Q39-S42 PolarHBondContact O-N 2.83Å; T40-S42 VanDerWaalsContact C-N 3.34Å; T40-S42 PolarHBondContact O-N 2.73Å; S42-L46 WeakPolarHBondContact O-CB 3.39Å; S42-L46 WeakPolarHBondContact O-CG 3.49Å; S42-L46 PolarHBondContact O-N 3.13Å
43	V	67.9	Low	62.2	Low	85 Å²	85	106.9 Å²	106.9	52%	0.515	59%	0.59	S	S	.	*	H	α-helix	trans	-71.2	-36.2	175.3	170.4	0	0	0	0	111	Q39 T40 D41 K47	Q39-V43 VanDerWaalsContact O-CG2 3.28Å; Q39-V43 WeakPolarHBondContact O-CG2 3.34Å; Q39-V43 PolarHBondContact O-N 3.05Å; T40-V43 PolarHBondContact O-N 2.62Å; D41-V43 VanDerWaalsContact C-N 3.35Å; D41-V43 PolarHBondContact O-N 2.89Å; V43-K47 VanDerWaalsContact O-CB 3.3Å; V43-K47 WeakPolarHBondContact O-CB 3.32Å; V43-K47 PolarHBondContact O-N 3.33Å
44	L	72.1	Confident	61.9	Low	112 Å²	112	109.2 Å²	109.2	59%	0.586	60%	0.6	S	S	*	*	H	α-helix	trans	-66.8	-40.9	173	-91.4	155.2	0	0	0	112.2	T40 D41 K47 A48	T40-L44 PolarHBondContact O-N 2.8Å; D41-L44 PolarHBondContact O-N 3.32Å; L44-K47 PolarHBondContact O-N 3.32Å; L44-A48 WeakPolarHBondContact O-CB 3.4Å; L44-A48 PolarHBondContact O-N 3.34Å
45	E	69.6	Low	61	Low	144 Å²	144	109.4 Å²	109.4	67%	0.673	60%	0.598	S	S	*	*	H	α-helix	trans	-64.6	-42.7	172.6	-90.2	-175	152	0	0	112.4	D41 K47 A48 A49	D41-E45 PolarHBondContact O-N 3.43Å; E45-K47 VanDerWaalsContact C-N 3.34Å; E45-K47 PolarHBondContact O-N 3.19Å; E45-A48 PolarHBondContact O-N 3.34Å; E45-A49 WeakPolarHBondContact O-CB 3.22Å; E45-A49 PolarHBondContact O-N 3.23Å
46	L	59.3	Low	60.1	Low	125 Å²	125	109.7 Å²	109.7	65%	0.654	61%	0.606	S	S	*	*	H	α-helix	trans	-65.1	-36.9	175.5	-84.5	165.4	0	0	0	112.3	S42 A49 A50	S42-L46 WeakPolarHBondContact O-CB 3.39Å; S42-L46 WeakPolarHBondContact O-CG 3.49Å; S42-L46 PolarHBondContact O-N 3.13Å; L46-A49 PolarHBondContact O-N 2.72Å; L46-A50 WeakPolarHBondContact O-CB 3.15Å; L46-A50 PolarHBondContact O-N 3.29Å
47	K	64.6	Low	58.9	Low	133 Å²	133	111.5 Å²	111.5	58%	0.578	62%	0.623	S	S	*	*	H	α-helix	trans	-66.2	-41.9	174.9	-171.3	179.4	178.8	-176.2	0	111.6	V43 L44 E45 A49 A50 E51	V43-K47 VanDerWaalsContact O-CB 3.3Å; V43-K47 WeakPolarHBondContact O-CB 3.32Å; V43-K47 PolarHBondContact O-N 3.33Å; L44-K47 PolarHBondContact O-N 3.32Å; E45-K47 VanDerWaalsContact C-N 3.34Å; E45-K47 PolarHBondContact O-N 3.19Å; K47-A49 VanDerWaalsContact C-N 3.34Å; K47-A50 PolarHBondContact O-N 3.16Å; K47-E51 PolarHBondContact O-N 2.91Å
48	A	65.8	Low	57.8	Low	59 Å²	59	113.9 Å²	113.9	49%	0.488	63%	0.629	S	S	.	*	H	α-helix	trans	-67.3	-33	175.1	0	0	0	0	0	112.8	L44 E45	L44-A48 WeakPolarHBondContact O-CB 3.4Å; L44-A48 PolarHBondContact O-N 3.34Å; E45-A48 PolarHBondContact O-N 3.34Å
49	A	56.5	Low	56.4	Low	64 Å²	64	110.7 Å²	110.7	53%	0.529	63%	0.627	S	S	.	*	H	α-helix	trans	-75.1	-28.9	175	0	0	0	0	0	113.3	E45 L46 K47	E45-A49 WeakPolarHBondContact O-CB 3.22Å; E45-A49 PolarHBondContact O-N 3.23Å; L46-A49 PolarHBondContact O-N 2.72Å; K47-A49 VanDerWaalsContact C-N 3.34Å
50	A	55	Low	55.1	Low	69 Å²	69	112 Å²	112	57%	0.57	64%	0.644	S	S	*	*	H	α-helix	trans	-75.9	-23.5	176.5	0	0	0	0	0	113.5	L46 K47 N52	L46-A50 WeakPolarHBondContact O-CB 3.15Å; L46-A50 PolarHBondContact O-N 3.29Å; K47-A50 PolarHBondContact O-N 3.16Å; A50-N52 VanDerWaalsContact C-N 3.34Å
51	E	54.8	Low	53.7	Low	142 Å²	142	117.3 Å²	117.3	66%	0.664	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-11.5	178.2	-77.8	176.9	179.1	0	0	113.9	K47	K47-E51 PolarHBondContact O-N 2.91Å
52	N	53.6	Low	52.1	Low	139 Å²	139	121 Å²	121	74%	0.743	68%	0.683	S	S	*	*			trans	-134	70.3	-179.6	-73.4	-59.6	0	0	0	113.1	A50	A50-N52 VanDerWaalsContact C-N 3.34Å
53	L	50	Low	50.2	Low	140 Å²	140	125.9 Å²	125.9	73%	0.733	70%	0.704	S	S	*	*			trans	-100.5	114.9	169.3	-92.3	144.9	0	0	0	111.2
54	P	47.8	Very low	48.4	Very low	115 Å²	115	130 Å²	130	75%	0.747	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-73.1	129.1	167.4	27.9	-29.5	0	0	0	110.3
55	V	43.3	Very low	46.4	Very low	129 Å²	129	130.5 Å²	130.5	78%	0.782	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-70.7	129.9	-177.6	-177.2	0	0	0	0	110.7
56	P	42.5	Very low	44.7	Very low	109 Å²	109	128.6 Å²	128.6	71%	0.708	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-66.9	143.7	179.2	-20.4	32.5	0	0	0	114.2	E58	P56-E58 VanDerWaalsContact C-N 3.34Å; P56-E58 PolarHBondContact O-N 3.15Å
57	S	40.5	Very low	43.2	Very low	127 Å²	127	130.6 Å²	130.6	89%	0.888	75%	0.747	S	S	*	*	S	Bend	trans	-83.8	25	-169.8	48.1	0	0	0	0	116.8
58	E	38.5	Very low	41.5	Very low	183 Å²	183	131 Å²	131	86%	0.855	76%	0.761	S	S	*	*			trans	-140.4	84.8	173.1	-73.8	-176.3	171.8	0	0	110.5	P56	P56-E58 VanDerWaalsContact C-N 3.34Å; P56-E58 PolarHBondContact O-N 3.15Å
59	L	35.2	Very low	39.8	Very low	144 Å²	144	133.5 Å²	133.5	75%	0.754	78%	0.775	S	S	*	*			trans	-133.1	129.4	158.1	-79.2	172.4	0	0	0	108.7	I61	L59-I61 PolarHBondContact O-N 3.48Å
60	P	37.3	Very low	38.5	Very low	124 Å²	124	139 Å²	139	81%	0.805	79%	0.79	S	S	*	*			trans	-66.5	127.7	170.3	27.8	-30.8	0	0	0	109.2	E62	P60-E62 PolarHBondContact O-N 3Å
61	I	38	Very low	37.1	Very low	163 Å²	163	140.5 Å²	140.5	84%	0.836	80%	0.796	S	S	*	*			trans	-61.8	110.9	173.4	-60.8	160.3	0	0	0	107.7	L59	L59-I61 PolarHBondContact O-N 3.48Å
62	E	32.8	Very low	35.8	Very low	177 Å²	177	141.4 Å²	141.4	83%	0.827	80%	0.804	S	S	*	*			trans	-174.2	120	139.6	-100.2	160.9	-159.9	0	0	108.4	P60	P60-E62 PolarHBondContact O-N 3Å
63	D	29.9	Very low	34.7	Very low	160 Å²	160	140.4 Å²	140.4	86%	0.856	81%	0.805	S	S	*	*			trans	71.6	74.7	168.4	-63.8	-15.7	0	0	0	119.8
64	L	30.1	Very low	33.7	Very low	171 Å²	171	140.9 Å²	140.9	90%	0.895	81%	0.807	S	S	*	*			trans	-123.7	109.3	141.3	-84.4	169.7	0	0	0	109.5
65	C	30.1	Very low	32.6	Very low	123 Å²	123	144.7 Å²	144.7	83%	0.831	82%	0.815	S	S	*	*			trans	-173.2	109.8	147.9	-93.5	0	0	0	0	105.4
66	S	32.4	Very low	31.9	Very low	104 Å²	104	145.8 Å²	145.8	73%	0.727	82%	0.816	S	S	*	*				-179.8	132.4	85.8	-56.4	0	0	0	0	104.5
67	L	28.6	Very low	31.2	Very low	167 Å²	167	146.4 Å²	146.4	87%	0.874	82%	0.818	S	S	*	*				-174.1	108.2	72.2	-76.5	162.9	0	0	0	107.8
68	T	29.8	Very low	30.7	Very low	142 Å²	142	145.4 Å²	145.4	87%	0.871	81%	0.811	S	S	*	*			trans	-125.1	110.5	146.1	40.9	0	0	0	0	108
69	S	30.2	Very low	30.4	Very low	111 Å²	111	142.9 Å²	142.9	78%	0.776	81%	0.808	S	S	*	*			trans	14.5	119	148.8	-41.3	0	0	0	0	118.5
70	Q	28.4	Very low	30.4	Very low	180 Å²	180	142.4 Å²	142.4	84%	0.841	81%	0.811	S	S	*	*				-172.4	128.6	116.3	-101.4	168.6	21.2	0	0	112.9
71	S	26.3	Very low	30.4	Very low	100 Å²	100	141.3 Å²	141.3	70%	0.699	80%	0.803	S	S	*	*			trans	6.2	127.8	140.9	52.9	0	0	0	0	118.3
72	L	26.8	Very low	30.6	Very low	161 Å²	161	143.1 Å²	143.1	84%	0.843	81%	0.808	S	S	*	*			trans	-117.7	119.6	151.8	-80	169	0	0	0	110.3
73	P	30.8	Very low	31.3	Very low	118 Å²	118	138 Å²	138	77%	0.766	79%	0.792	S	S	*	*			trans	-74.7	132.1	159.9	30.9	-27.6	0	0	0	108.6
74	I	28.9	Very low	32.5	Very low	151 Å²	151	135.8 Å²	135.8	77%	0.774	79%	0.785	S	S	*	*			trans	-109.2	100.7	171	-61.5	172.1	0	0	0	106.9
75	E	24.3	Very low	33.7	Very low	194 Å²	194	134.5 Å²	134.5	91%	0.907	77%	0.774	S	S	*	*			trans	-114.9	109.4	151.1	-87.9	-168.1	160.9	0	0	107.1
76	L	29.3	Very low	34.8	Very low	153 Å²	153	134.2 Å²	134.2	80%	0.801	76%	0.764	S	S	*	*			trans	-118.7	96.6	162.6	-107.5	143.4	0	0	0	107.4	S78	L76-S78 PolarHBondContact O-N 3.4Å
77	T	27.5	Very low	36.1	Very low	121 Å²	121	134.9 Å²	134.9	74%	0.742	76%	0.758	S	S	*	*			trans	-9.9	121.2	140	34.3	0	0	0	0	114.3
78	S	28.6	Very low	37.5	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	74%	0.744	S	S	*	*				-177.3	119.4	110.3	46.6	0	0	0	0	111.7	L76	L76-S78 PolarHBondContact O-N 3.4Å
79	V	32.4	Very low	38.6	Very low	130 Å²	130	130.4 Å²	130.4	79%	0.788	73%	0.729	S	S	*	*				41	113.3	125.5	-170.9	0	0	0	0	116.7	P81	V79-P81 VanDerWaalsContact O-CD 3.3Å; V79-P81 WeakPolarHBondContact O-CD 3.27Å
80	V	36.5	Very low	40	Very low	134 Å²	134	132.9 Å²	132.9	81%	0.812	73%	0.725	S	S	*	*			trans	-47.1	128.9	163.2	179.3	0	0	0	0	111.7
81	P	37.2	Very low	41.5	Very low	101 Å²	101	125.9 Å²	125.9	66%	0.656	70%	0.702	S	S	*	*			trans	-114.2	145.8	155.6	8.8	13.7	0	0	0	111.4	V79 S83	V79-P81 VanDerWaalsContact O-CD 3.3Å; V79-P81 WeakPolarHBondContact O-CD 3.27Å; P81-S83 PolarHBondContact O-N 2.77Å
82	E	41.9	Very low	42.8	Very low	200 Å²	200	126.6 Å²	126.6	94%	0.935	69%	0.693	S	S	*	*	S	Bend	trans	-66	95.7	178.2	-64.6	172.4	146.6	0	0	111.4
83	S	47.1	Very low	44.1	Very low	70 Å²	70	121.4 Å²	121.4	49%	0.49	67%	0.668	S	S	.	*			trans	169.9	116.1	143.9	175.6	0	0	0	0	109.9	P81 E85	P81-S83 PolarHBondContact O-N 2.77Å; S83-E85 PolarHBondContact O-N 2.9Å
84	T	55.4	Low	45.5	Very low	114 Å²	114	121.1 Å²	121.1	70%	0.699	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-8.1	-175.1	31.3	0	0	0	0	115.9
85	E	56.1	Low	46.8	Very low	144 Å²	144	118.4 Å²	118.4	67%	0.673	66%	0.655	S	S	*	*	H	α-helix	trans	-76.7	-33.6	-178.7	-73.3	-175.8	152.6	0	0	112.6	S83 I87 L89	S83-E85 PolarHBondContact O-N 2.9Å; E85-I87 PolarHBondContact O-N 3.48Å; E85-L89 WeakPolarHBondContact O-CD1 3.33Å; E85-L89 PolarHBondContact O-N 3.37Å
86	D	52.5	Low	48.5	Very low	117 Å²	117	112.4 Å²	112.4	63%	0.626	65%	0.646	S	S	*	*	H	α-helix	trans	-74.8	-27.9	-176.2	-90.2	-18.7	0	0	0	114	K90	D86-K90 WeakPolarHBondContact O-CB 3.37Å; D86-K90 PolarHBondContact O-N 3.22Å
87	I	59.7	Low	49.7	Very low	118 Å²	118	108 Å²	108	61%	0.605	62%	0.621	S	S	*	*	H	α-helix	trans	-75	-38.4	179.6	-60.3	170.9	0	0	0	110.5	E85 K90 G91	E85-I87 PolarHBondContact O-N 3.48Å; I87-K90 PolarHBondContact O-N 3.32Å; I87-G91 PolarHBondContact O-N 3.41Å
88	L	57	Low	50.9	Low	108 Å²	108	109.2 Å²	109.2	57%	0.565	62%	0.619	S	S	*	*	H	α-helix	trans	-66.2	-43	174.3	-69.8	175.2	0	0	0	110.1	K90 G91 F92	L88-K90 VanDerWaalsContact C-N 3.31Å; L88-K90 PolarHBondContact O-N 3.41Å; L88-G91 PolarHBondContact O-N 2.94Å; L88-F92 HydrophobicContact CB-CD2 4.35Å; L88-F92 HydrophobicContact CB-CE2 4.19Å; L88-F92 HydrophobicContact CD2-CE2 4.5Å; L88-F92 WeakPolarHBondContact O-CD2 3.48Å; L88-F92 PolarHBondContact O-N 3.47Å
89	L	54.4	Low	51.9	Low	107 Å²	107	113.5 Å²	113.5	56%	0.56	63%	0.627	S	S	*	*	H	α-helix	trans	-60.1	-37.9	172.3	-93.3	95.8	0	0	0	112.8	E85 T93	E85-L89 WeakPolarHBondContact O-CD1 3.33Å; E85-L89 PolarHBondContact O-N 3.37Å; L89-T93 PolarHBondContact O-N 2.95Å; L89-T93 PolarHBondContact O-OG1 3.42Å
90	K	58.8	Low	52.9	Low	162 Å²	162	114.5 Å²	114.5	70%	0.704	62%	0.623	S	S	*	*	H	α-helix	trans	-68.9	-34.6	174.8	-97.5	178.9	177.6	173.9	0	114.5	D86 I87 L88 T93 S94	D86-K90 WeakPolarHBondContact O-CB 3.37Å; D86-K90 PolarHBondContact O-N 3.22Å; I87-K90 PolarHBondContact O-N 3.32Å; L88-K90 VanDerWaalsContact C-N 3.31Å; L88-K90 PolarHBondContact O-N 3.41Å; K90-T93 VanDerWaalsContact C-OG1 3.27Å; K90-T93 WeakPolarHBondContact CA-OG1 3.44Å; K90-T93 PolarHBondContact O-OG1 2.79Å; K90-S94 WeakPolarHBondContact O-CB 3.39Å; K90-S94 PolarHBondContact O-N 3.17Å; K90-S94 VanDerWaalsContact O-N 3.12Å
91	G	59.2	Low	53.6	Low	34 Å²	34	118.4 Å²	118.4	35%	0.351	62%	0.623	S	S	.	*	H	α-helix	trans	-69.3	-41.5	173.6	0	0	0	0	0	112.3	I87 L88 S94 L95	I87-G91 PolarHBondContact O-N 3.41Å; L88-G91 PolarHBondContact O-N 2.94Å; G91-S94 PolarHBondContact O-N 3.34Å; G91-L95 WeakPolarHBondContact O-CB 3.5Å; G91-L95 PolarHBondContact O-N 3.26Å
92	F	54.6	Low	54.6	Low	114 Å²	114	117.1 Å²	117.1	50%	0.5	61%	0.61	S	S	.	*	H	α-helix	trans	-71.9	-28.5	177.3	-70.9	-61.1	0	0	0	113	L88 G96 M97	L88-F92 HydrophobicContact CB-CD2 4.35Å; L88-F92 HydrophobicContact CB-CE2 4.19Å; L88-F92 HydrophobicContact CD2-CE2 4.5Å; L88-F92 WeakPolarHBondContact O-CD2 3.48Å; L88-F92 PolarHBondContact O-N 3.47Å; F92-G96 PolarHBondContact O-N 3.21Å; F92-M97 PolarHBondContact O-N 3.17Å
93	T	54.3	Low	55.1	Low	53 Å²	53	115.4 Å²	115.4	33%	0.325	60%	0.602	S	S	.	*	H	α-helix	trans	-71	-43.7	169.8	25.5	0	0	0	0	112.9	L89 K90 L95 G96 E98	L89-T93 PolarHBondContact O-N 2.95Å; L89-T93 PolarHBondContact O-OG1 3.42Å; K90-T93 VanDerWaalsContact C-OG1 3.27Å; K90-T93 WeakPolarHBondContact CA-OG1 3.44Å; K90-T93 PolarHBondContact O-OG1 2.79Å; T93-L95 PolarHBondContact O-N 3.36Å; T93-G96 PolarHBondContact O-N 3.11Å; T93-E98 HydrophobicContact CG2-CG 3.51Å; T93-E98 WeakPolarHBondContact CG2-OE1 3.37Å
94	S	59.1	Low	55.6	Low	112 Å²	112	115.9 Å²	115.9	78%	0.783	60%	0.602	S	S	*	*	H	α-helix	trans	-69.9	-17.3	179.8	-152.8	0	0	0	0	113	K90 G91	K90-S94 WeakPolarHBondContact O-CB 3.39Å; K90-S94 PolarHBondContact O-N 3.17Å; K90-S94 VanDerWaalsContact O-N 3.12Å; G91-S94 PolarHBondContact O-N 3.34Å
95	L	56.8	Low	55.9	Low	93 Å²	93	113.8 Å²	113.8	49%	0.487	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.9	6.3	171.1	-71.8	164.7	0	0	0	113.2	G91 T93 W111	G91-L95 WeakPolarHBondContact O-CB 3.5Å; G91-L95 PolarHBondContact O-N 3.26Å; T93-L95 PolarHBondContact O-N 3.36Å; L95-W111 HydrophobicContact CD1-CZ2 4.31Å; L95-W111 HydrophobicContact CD2-CZ2 3.99Å
96	G	60	Low	56.3	Low	69 Å²	69	114.7 Å²	114.7	71%	0.711	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.8	36.5	169.2	0	0	0	0	0	115.5	F92 T93	F92-G96 PolarHBondContact O-N 3.21Å; T93-G96 PolarHBondContact O-N 3.11Å
97	M	55.2	Low	56.8	Low	59 Å²	59	112.8 Å²	112.8	29%	0.291	59%	0.588	S	S	.	*			trans	-126.2	58.2	-170.4	-69.3	-166.7	70.1	0	0	113.8	F92 I102	F92-M97 PolarHBondContact O-N 3.17Å; M97-I102 HydrophobicContact CE-CD1 3.27Å; M97-I102 HydrophobicContact CE-CG1 3.39Å; M97-I102 HydrophobicContact SD-CD1 4.05Å
98	E	52.9	Low	57.1	Low	148 Å²	148	111.9 Å²	111.9	69%	0.692	58%	0.58	S	S	*	*	S	Bend	trans	-94.5	-13.1	180	-81.5	-168.1	134.8	0	0	115.9	T93	T93-E98 HydrophobicContact CG2-CG 3.51Å; T93-E98 WeakPolarHBondContact CG2-OE1 3.37Å
99	E	48.2	Very low	57.7	Low	196 Å²	196	113.6 Å²	113.6	92%	0.916	58%	0.583	S	S	*	*	S	Bend	trans	-126.9	-3.9	-177.4	-71.2	-171.4	157.5	0	0	116.2
100	E	53.4	Low	58.5	Low	151 Å²	151	112 Å²	112	71%	0.706	58%	0.581	S	S	*	*			trans	-127	103.8	180	-68.7	-172.8	169.2	0	0	111.5	I102	E100-I102 PolarHBondContact O-N 3.49Å
101	R	51.9	Low	59.2	Low	216 Å²	216	108.3 Å²	108.3	82%	0.815	56%	0.562	S	S	*	*			trans	-64.6	126	169.1	-73.9	-175.6	174.6	178.5	-1.4	108.7	E103	R101-E103 VanDerWaalsContact C-N 3.35Å; R101-E103 HydrophobicContact CB-CG 4.07Å; R101-E103 PolarHBondContact O-N 3.06Å
102	I	58	Low	59.6	Low	74 Å²	74	111.2 Å²	111.2	38%	0.379	57%	0.566	S	S	.	*			trans	-67.7	98.1	169.5	-67.6	164.9	0	0	0	107.6	M97 E100 Q107	M97-I102 HydrophobicContact CE-CD1 3.27Å; M97-I102 HydrophobicContact CE-CG1 3.39Å; M97-I102 HydrophobicContact SD-CD1 4.05Å; E100-I102 PolarHBondContact O-N 3.49Å; I102-Q107 HydrophobicContact CG1-CB 4.19Å; I102-Q107 HydrophobicContact CG2-CB 3.87Å
103	E	53.1	Low	60.5	Low	164 Å²	164	108.5 Å²	108.5	77%	0.766	56%	0.564	S	S	*	*			trans	-95.4	-10.4	178.6	-68.5	-178.2	178.1	0	0	111.3	R101	R101-E103 VanDerWaalsContact C-N 3.35Å; R101-E103 HydrophobicContact CB-CG 4.07Å; R101-E103 PolarHBondContact O-N 3.06Å
104	T	56.5	Low	61.5	Low	81 Å²	81	113 Å²	113	50%	0.497	58%	0.579	S	S	.	*	S	Bend	trans	-129.9	135.4	-175.7	-39.9	0	0	0	0	113.3	Q106 Q107	T104-Q106 PolarHBondContact O-N 3.24Å; T104-Q107 PolarHBondContact O-N 2.95Å
105	A	62.8	Low	62.1	Low	70 Å²	70	110.7 Å²	110.7	58%	0.579	56%	0.558	S	S	*	*	H	α-helix	trans	-56.6	-25.3	-178.4	0	0	0	0	0	115.1	Q107 F108 F109	A105-Q107 VanDerWaalsContact C-N 3.32Å; A105-Q107 PolarHBondContact O-N 3.36Å; A105-F108 PolarHBondContact O-N 3.47Å; A105-F109 VanDerWaalsContact O-CD2 3.29Å; A105-F109 WeakPolarHBondContact O-CD2 3.49Å; A105-F109 PolarHBondContact O-N 3Å
106	Q	64.7	Low	62.6	Low	162 Å²	162	111.3 Å²	111.3	76%	0.757	56%	0.558	S	S	*	*	H	α-helix	trans	-63.4	-35.3	175.2	-104	173.5	-19.1	0	0	113.1	T104 F108 S110	T104-Q106 PolarHBondContact O-N 3.24Å; Q106-F108 VanDerWaalsContact C-N 3.33Å; Q106-F108 PolarHBondContact O-N 3.43Å; Q106-S110 PolarHBondContact O-N 3.23Å
107	Q	62.4	Low	63.3	Low	77 Å²	77	111.7 Å²	111.7	36%	0.36	55%	0.547	S	S	.	.	H	α-helix	trans	-66.8	-37.1	178.5	-71	168.9	-31	0	0	110.6	I102 T104 A105 S110 W111	I102-Q107 HydrophobicContact CG1-CB 4.19Å; I102-Q107 HydrophobicContact CG2-CB 3.87Å; T104-Q107 PolarHBondContact O-N 2.95Å; A105-Q107 VanDerWaalsContact C-N 3.32Å; A105-Q107 PolarHBondContact O-N 3.36Å; Q107-S110 PolarHBondContact O-N 2.86Å; Q107-S110 PolarHBondContact O-OG 3.34Å; Q107-W111 PolarHBondContact O-N 3.03Å; Q107-W111 VanDerWaalsContact O-N 3.15Å
108	F	65.4	Low	64.1	Low	100 Å²	100	114.3 Å²	114.3	44%	0.439	56%	0.558	S	S	.	*	H	α-helix	trans	-64.2	-46.7	176.3	-179.3	-97.9	0	0	0	113.4	A105 Q106 S110 W111 F112	A105-F108 PolarHBondContact O-N 3.47Å; Q106-F108 VanDerWaalsContact C-N 3.33Å; Q106-F108 PolarHBondContact O-N 3.43Å; F108-S110 VanDerWaalsContact C-N 3.31Å; F108-S110 PolarHBondContact O-N 3.35Å; F108-W111 HydrophobicContact CE2-CE3 4.31Å; F108-W111 HydrophobicContact CE2-CZ3 4.34Å; F108-W111 WeakPolarHBondContact O-CB 3.36Å; F108-W111 PolarHBondContact O-N 2.98Å; F108-W111 VanDerWaalsContact O-N 3.17Å; F108-F112 PolarHBondContact O-N 3.08Å
109	F	69	Low	64.9	Low	143 Å²	143	113.2 Å²	113.2	63%	0.627	56%	0.555	S	S	*	*	H	α-helix	trans	-65.5	-34.8	178.8	-74	-67.4	0	0	0	112.7	A105 W111 F112 A113	A105-F109 VanDerWaalsContact O-CD2 3.29Å; A105-F109 WeakPolarHBondContact O-CD2 3.49Å; A105-F109 PolarHBondContact O-N 3Å; F109-W111 VanDerWaalsContact C-N 3.29Å; F109-W111 PolarHBondContact O-N 3.23Å; F109-F112 PolarHBondContact O-N 2.92Å; F109-A113 WeakPolarHBondContact O-CB 3.24Å; F109-A113 PolarHBondContact O-N 3.37Å
110	S	71.7	Confident	66	Low	73 Å²	73	109 Å²	109	51%	0.51	54%	0.538	S	S	.	.	H	α-helix	trans	-65	-34.9	174.8	77	0	0	0	0	112.4	Q106 Q107 F108 K114	Q106-S110 PolarHBondContact O-N 3.23Å; Q107-S110 PolarHBondContact O-N 2.86Å; Q107-S110 PolarHBondContact O-OG 3.34Å; F108-S110 VanDerWaalsContact C-N 3.31Å; F108-S110 PolarHBondContact O-N 3.35Å; S110-K114 PolarHBondContact O-N 2.69Å
111	W	73.3	Confident	66.7	Low	85 Å²	85	107.4 Å²	107.4	32%	0.322	53%	0.531	S	S	.	.	H	α-helix	trans	-71.3	-44.8	175	176.6	86.9	0	0	0	111.8	L95 Q107 F108 F109 A113 K114 L115	L95-W111 HydrophobicContact CD1-CZ2 4.31Å; L95-W111 HydrophobicContact CD2-CZ2 3.99Å; Q107-W111 PolarHBondContact O-N 3.03Å; Q107-W111 VanDerWaalsContact O-N 3.15Å; F108-W111 HydrophobicContact CE2-CE3 4.31Å; F108-W111 HydrophobicContact CE2-CZ3 4.34Å; F108-W111 WeakPolarHBondContact O-CB 3.36Å; F108-W111 PolarHBondContact O-N 2.98Å; F108-W111 VanDerWaalsContact O-N 3.17Å; F109-W111 VanDerWaalsContact C-N 3.29Å; F109-W111 PolarHBondContact O-N 3.23Å; W111-A113 PolarHBondContact O-N 3.33Å; W111-K114 WeakPolarHBondContact O-CB 2.99Å; W111-K114 PolarHBondContact O-N 3.19Å; W111-L115 HydrophobicContact CH2-CD2 4.13Å; W111-L115 HydrophobicContact CZ3-CD2 4.49Å; W111-L115 PolarHBondContact O-N 3.35Å
112	F	68.4	Low	67.6	Low	96 Å²	96	102.4 Å²	102.4	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-39.9	178.6	-173.2	-95	0	0	0	112.7	F108 F109 K114 L115 Q116	F108-F112 PolarHBondContact O-N 3.08Å; F109-F112 PolarHBondContact O-N 2.92Å; F112-K114 VanDerWaalsContact C-N 3.3Å; F112-K114 PolarHBondContact O-N 2.93Å; F112-L115 WeakPolarHBondContact O-CB 3.45Å; F112-L115 PolarHBondContact O-N 2.89Å; F112-L115 VanDerWaalsContact O-N 3.14Å; F112-Q116 PolarHBondContact O-N 3.33Å
113	A	72.4	Confident	68.1	Low	56 Å²	56	106.6 Å²	106.6	46%	0.463	54%	0.538	S	S	.	.	H	α-helix	trans	-63.4	-35.7	175.5	0	0	0	0	0	112.5	F109 W111 T117	F109-A113 WeakPolarHBondContact O-CB 3.24Å; F109-A113 PolarHBondContact O-N 3.37Å; W111-A113 PolarHBondContact O-N 3.33Å; A113-T117 PolarHBondContact O-N 3.49Å; A113-T117 VanDerWaalsContact O-N 3.13Å; A113-T117 PolarHBondContact O-OG1 2.94Å
114	K	75.8	Confident	68.7	Low	148 Å²	148	99.9 Å²	99.9	64%	0.643	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-41.9	171.4	-83.8	-179.9	175.3	178.7	0	111.8	S110 W111 F112 T117 Q118	S110-K114 PolarHBondContact O-N 2.69Å; W111-K114 WeakPolarHBondContact O-CB 2.99Å; W111-K114 PolarHBondContact O-N 3.19Å; F112-K114 VanDerWaalsContact C-N 3.3Å; F112-K114 PolarHBondContact O-N 2.93Å; K114-T117 WeakPolarHBondContact CA-OG1 3.49Å; K114-T117 PolarHBondContact O-N 3.48Å; K114-T117 PolarHBondContact O-OG1 3.5Å; K114-T117 VanDerWaalsContact O-OG1 3.06Å; K114-Q118 WeakPolarHBondContact O-CG 3.45Å; K114-Q118 PolarHBondContact O-N 2.93Å
115	L	72.9	Confident	69.7	Low	63 Å²	63	98.5 Å²	98.5	33%	0.33	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-43	178.5	-166.2	76	0	0	0	111.8	W111 F112 T117 Q118 M119	W111-L115 HydrophobicContact CH2-CD2 4.13Å; W111-L115 HydrophobicContact CZ3-CD2 4.49Å; W111-L115 PolarHBondContact O-N 3.35Å; F112-L115 WeakPolarHBondContact O-CB 3.45Å; F112-L115 PolarHBondContact O-N 2.89Å; F112-L115 VanDerWaalsContact O-N 3.14Å; L115-T117 PolarHBondContact O-N 3.5Å; L115-Q118 WeakPolarHBondContact O-CB 3.4Å; L115-Q118 PolarHBondContact O-N 2.94Å; L115-M119 PolarHBondContact O-N 2.82Å
116	Q	66.9	Low	70.3	Confident	107 Å²	107	102.6 Å²	102.6	50%	0.5	51%	0.51	S	S	.	.	H	α-helix	trans	-66.5	-38.5	179.8	-170.1	167.8	-9.1	0	0	112.3	F112 Q118 M119 D120	F112-Q116 PolarHBondContact O-N 3.33Å; Q116-Q118 VanDerWaalsContact C-N 3.27Å; Q116-Q118 PolarHBondContact O-N 3.35Å; Q116-M119 PolarHBondContact O-N 3Å; Q116-D120 PolarHBondContact O-N 2.88Å
117	T	74.8	Confident	70.8	Confident	76 Å²	76	104 Å²	104	47%	0.466	51%	0.51	S	S	.	.	H	α-helix	trans	-67.3	-26.4	173.8	32.8	0	0	0	0	113.4	A113 K114 L115 Q121	A113-T117 PolarHBondContact O-N 3.49Å; A113-T117 VanDerWaalsContact O-N 3.13Å; A113-T117 PolarHBondContact O-OG1 2.94Å; K114-T117 WeakPolarHBondContact CA-OG1 3.49Å; K114-T117 PolarHBondContact O-N 3.48Å; K114-T117 PolarHBondContact O-OG1 3.5Å; K114-T117 VanDerWaalsContact O-OG1 3.06Å; L115-T117 PolarHBondContact O-N 3.5Å; T117-Q121 VanDerWaalsContact O-CG 3.24Å; T117-Q121 WeakPolarHBondContact O-CG 2.96Å; T117-Q121 PolarHBondContact O-N 3.22Å
118	Q	72.6	Confident	71.7	Confident	115 Å²	115	106.8 Å²	106.8	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-69.8	-40.2	172.4	-76.2	177.6	-32.8	0	0	112	K114 L115 Q116 Q121 D122	K114-Q118 WeakPolarHBondContact O-CG 3.45Å; K114-Q118 PolarHBondContact O-N 2.93Å; L115-Q118 WeakPolarHBondContact O-CB 3.4Å; L115-Q118 PolarHBondContact O-N 2.94Å; Q116-Q118 VanDerWaalsContact C-N 3.27Å; Q116-Q118 PolarHBondContact O-N 3.35Å; Q118-Q121 PolarHBondContact O-N 2.85Å; Q118-D122 PolarHBondContact O-N 3.34Å; Q118-D122 VanDerWaalsContact O-N 3.09Å
119	M	69	Low	72.4	Confident	125 Å²	125	108.2 Å²	108.2	62%	0.616	52%	0.524	S	S	*	.	H	α-helix	trans	-65.4	-42.1	179.6	-68.3	-177.8	62.8	0	0	113.4	L115 Q116 Q121 D122 E123	L115-M119 PolarHBondContact O-N 2.82Å; Q116-M119 PolarHBondContact O-N 3Å; M119-Q121 VanDerWaalsContact C-N 3.27Å; M119-Q121 PolarHBondContact O-N 2.63Å; M119-D122 PolarHBondContact O-N 3.34Å; M119-E123 PolarHBondContact O-N 2.91Å
120	D	70.3	Confident	73	Confident	107 Å²	107	107 Å²	107	57%	0.572	52%	0.522	S	S	*	.	H	α-helix	trans	-67.4	-30.1	177.4	-71.1	-19.9	0	0	0	112.1	Q116	Q116-D120 PolarHBondContact O-N 2.88Å
121	Q	69	Low	73.5	Confident	117 Å²	117	111.2 Å²	111.2	55%	0.547	53%	0.527	S	S	.	.	H	α-helix	trans	-67.8	-39.6	172.8	-74.4	173.4	16.8	0	0	111.1	T117 Q118 M119 G124 T125	T117-Q121 VanDerWaalsContact O-CG 3.24Å; T117-Q121 WeakPolarHBondContact O-CG 2.96Å; T117-Q121 PolarHBondContact O-N 3.22Å; Q118-Q121 PolarHBondContact O-N 2.85Å; M119-Q121 VanDerWaalsContact C-N 3.27Å; M119-Q121 PolarHBondContact O-N 2.63Å; Q121-G124 PolarHBondContact O-N 2.94Å; Q121-T125 WeakPolarHBondContact O-CG2 3.34Å; Q121-T125 PolarHBondContact O-N 3.48Å
122	D	70.7	Confident	74.1	Confident	111 Å²	111	111.2 Å²	111.2	59%	0.594	53%	0.533	S	S	*	.	H	α-helix	trans	-64.9	-44.6	-179.5	-82.1	-8.4	0	0	0	113.3	Q118 M119 G124 T125	Q118-D122 PolarHBondContact O-N 3.34Å; Q118-D122 VanDerWaalsContact O-N 3.09Å; M119-D122 PolarHBondContact O-N 3.34Å; D122-G124 VanDerWaalsContact C-N 3.34Å; D122-G124 PolarHBondContact O-N 3.09Å; D122-T125 PolarHBondContact O-N 2.92Å; D122-T125 PolarHBondContact O-OG1 3Å
123	E	67.7	Low	74.9	Confident	162 Å²	162	113.6 Å²	113.6	76%	0.757	54%	0.54	S	S	*	.	H	α-helix	trans	-65.4	-35.5	178	-83.3	-168.1	159.7	0	0	112.9	M119 T125	M119-E123 PolarHBondContact O-N 2.91Å; E123-T125 VanDerWaalsContact C-N 3.35Å; E123-T125 PolarHBondContact O-N 3.43Å
124	G	67.6	Low	75.5	Confident	24 Å²	24	116 Å²	116	25%	0.247	55%	0.545	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.5	-178.4	0	0	0	0	0	115.5	Q121 D122 R128	Q121-G124 PolarHBondContact O-N 2.94Å; D122-G124 VanDerWaalsContact C-N 3.34Å; D122-G124 PolarHBondContact O-N 3.09Å; G124-R128 PolarHBondContact O-NE 3.43Å; G124-R128 VanDerWaalsContact O-NE 3.17Å
125	T	76.9	Confident	76.1	Confident	51 Å²	51	111.4 Å²	111.4	31%	0.313	53%	0.531	S	S	.	.	H	α-helix	trans	-71.6	-43.6	-177.8	54.9	0	0	0	0	112.9	Q121 D122 E123 Y127 R128 Q129	Q121-T125 WeakPolarHBondContact O-CG2 3.34Å; Q121-T125 PolarHBondContact O-N 3.48Å; D122-T125 PolarHBondContact O-N 2.92Å; D122-T125 PolarHBondContact O-OG1 3Å; E123-T125 VanDerWaalsContact C-N 3.35Å; E123-T125 PolarHBondContact O-N 3.43Å; T125-Y127 PolarHBondContact O-N 2.94Å; T125-R128 PolarHBondContact O-N 3.04Å; T125-Q129 VanDerWaalsContact O-CG 3.32Å; T125-Q129 WeakPolarHBondContact O-CG 3.41Å; T125-Q129 PolarHBondContact O-N 2.91Å
126	K	74.8	Confident	76.7	Confident	157 Å²	157	109.4 Å²	109.4	68%	0.683	53%	0.526	S	S	*	.	H	α-helix	trans	-63.2	-42.2	-174	-65.1	179.5	-176.6	173.4	0	113.2	M130	K126-M130 PolarHBondContact O-N 3.37Å; K126-M130 VanDerWaalsContact O-N 3.16Å
127	Y	76.4	Confident	77.6	Confident	192 Å²	192	109.3 Å²	109.3	75%	0.753	52%	0.524	S	S	*	.	H	α-helix	trans	-72.3	-34.3	178.9	-63.3	-73.6	0	0	0	112.5	T125 M130 R131	T125-Y127 PolarHBondContact O-N 2.94Å; Y127-M130 PolarHBondContact O-N 2.73Å; Y127-R131 WeakPolarHBondContact O-CB 3.31Å; Y127-R131 PolarHBondContact O-N 2.64Å
128	R	79.4	Confident	78.3	Confident	135 Å²	135	111.8 Å²	111.8	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-64.9	-45	172.9	-89.1	-178.5	-87	-170.3	-6.2	111.3	G124 T125 M130 R131 D132	G124-R128 PolarHBondContact O-NE 3.43Å; G124-R128 VanDerWaalsContact O-NE 3.17Å; T125-R128 PolarHBondContact O-N 3.04Å; R128-M130 VanDerWaalsContact C-N 3.34Å; R128-M130 PolarHBondContact O-N 2.88Å; R128-R131 PolarHBondContact O-N 3.16Å; R128-D132 WeakPolarHBondContact O-CB 3.35Å; R128-D132 PolarHBondContact O-N 3.33Å
129	Q	81.2	Confident	79.1	Confident	129 Å²	129	112.4 Å²	112.4	60%	0.603	53%	0.533	S	S	*	.	H	α-helix	trans	-57.7	-43.2	175.6	-72.3	170.6	1	0	0	112.7	T125 Y133	T125-Q129 VanDerWaalsContact O-CG 3.32Å; T125-Q129 WeakPolarHBondContact O-CG 3.41Å; T125-Q129 PolarHBondContact O-N 2.91Å; Q129-Y133 WeakPolarHBondContact O-CB 3.38Å; Q129-Y133 PolarHBondContact O-N 3.35Å
130	M	80.8	Confident	80	Confident	117 Å²	117	112 Å²	112	58%	0.576	53%	0.53	S	S	*	.	H	α-helix	trans	-69.4	-39.4	178.2	-173.8	61.1	120.5	0	0	112.9	K126 Y127 R128 Y133 L134	K126-M130 PolarHBondContact O-N 3.37Å; K126-M130 VanDerWaalsContact O-N 3.16Å; Y127-M130 PolarHBondContact O-N 2.73Å; R128-M130 VanDerWaalsContact C-N 3.34Å; R128-M130 PolarHBondContact O-N 2.88Å; M130-Y133 PolarHBondContact O-N 3.22Å; M130-Y133 HydrophobicContact SD-CD1 4.4Å; M130-L134 HydrophobicContact CG-CD1 4.49Å; M130-L134 WeakPolarHBondContact O-CG 3.32Å; M130-L134 PolarHBondContact O-N 2.9Å
131	R	83.8	Confident	80.8	Confident	163 Å²	163	110.1 Å²	110.1	62%	0.615	52%	0.524	S	S	*	.	H	α-helix	trans	-63.2	-44.9	175	-174.8	-161.5	69.8	167.1	3.1	111	Y127 R128 Y133 L134 S135	Y127-R131 WeakPolarHBondContact O-CB 3.31Å; Y127-R131 PolarHBondContact O-N 2.64Å; R128-R131 PolarHBondContact O-N 3.16Å; R131-Y133 VanDerWaalsContact C-N 3.29Å; R131-Y133 PolarHBondContact O-N 3.41Å; R131-L134 PolarHBondContact O-N 3.17Å; R131-S135 WeakPolarHBondContact O-CB 3.47Å; R131-S135 PolarHBondContact O-N 3.19Å
132	D	84.3	Confident	81.9	Confident	84 Å²	84	108.5 Å²	108.5	45%	0.449	52%	0.519	S	S	.	.	H	α-helix	trans	-67.9	-33.6	-179.3	-60.3	-16.6	0	0	0	110.3	R128 G136	R128-D132 WeakPolarHBondContact O-CB 3.35Å; R128-D132 PolarHBondContact O-N 3.33Å; D132-G136 PolarHBondContact O-N 3.34Å
133	Y	86.3	Confident	82.8	Confident	147 Å²	147	105.5 Å²	105.5	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-47	170.5	-178.6	-96.9	0	0	0	113	Q129 M130 R131 G136 F137	Q129-Y133 WeakPolarHBondContact O-CB 3.38Å; Q129-Y133 PolarHBondContact O-N 3.35Å; M130-Y133 PolarHBondContact O-N 3.22Å; M130-Y133 HydrophobicContact SD-CD1 4.4Å; R131-Y133 VanDerWaalsContact C-N 3.29Å; R131-Y133 PolarHBondContact O-N 3.41Å; Y133-G136 PolarHBondContact O-N 3.06Å; Y133-F137 PolarHBondContact O-N 2.91Å
134	L	84.9	Confident	83.9	Confident	107 Å²	107	102.9 Å²	102.9	56%	0.56	50%	0.5	S	S	*	.	H	α-helix	trans	-68.2	-37.2	177.9	-70.7	172.8	0	0	0	112.4	M130 R131 G136 F137 Q138	M130-L134 HydrophobicContact CG-CD1 4.49Å; M130-L134 WeakPolarHBondContact O-CG 3.32Å; M130-L134 PolarHBondContact O-N 2.9Å; R131-L134 PolarHBondContact O-N 3.17Å; L134-G136 VanDerWaalsContact C-N 3.34Å; L134-F137 PolarHBondContact O-N 3.35Å; L134-Q138 PolarHBondContact O-N 2.89Å
135	S	87.4	Confident	85.1	Confident	51 Å²	51	106.7 Å²	106.7	36%	0.357	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-44.7	172.5	-166.8	0	0	0	0	110.8	R131 F137 Q138 E139	R131-S135 WeakPolarHBondContact O-CB 3.47Å; R131-S135 PolarHBondContact O-N 3.19Å; S135-F137 VanDerWaalsContact C-N 3.31Å; S135-F137 PolarHBondContact O-N 3.38Å; S135-Q138 PolarHBondContact O-N 3.16Å; S135-E139 WeakPolarHBondContact O-CG 3.28Å; S135-E139 PolarHBondContact O-N 2.86Å
136	G	86.8	Confident	85.9	Confident	21 Å²	21	108.8 Å²	108.8	22%	0.216	52%	0.524	C	S	.	.	H	α-helix	trans	-62.3	-37.1	175.5	0	0	0	0	0	112.9	D132 Y133 L134 Q140	D132-G136 PolarHBondContact O-N 3.34Å; Y133-G136 PolarHBondContact O-N 3.06Å; L134-G136 VanDerWaalsContact C-N 3.34Å; G136-Q140 VanDerWaalsContact O-CG 3.26Å; G136-Q140 WeakPolarHBondContact O-CG 3.38Å; G136-Q140 PolarHBondContact O-N 3.4Å
137	F	84.4	Confident	86.7	Confident	105 Å²	105	106.6 Å²	106.6	46%	0.461	52%	0.52	S	S	.	.	H	α-helix	trans	-69.6	-37.8	176.5	-144.1	-85.6	0	0	0	112.3	Y133 L134 S135 Q140 C141	Y133-F137 PolarHBondContact O-N 2.91Å; L134-F137 PolarHBondContact O-N 3.35Å; S135-F137 VanDerWaalsContact C-N 3.31Å; S135-F137 PolarHBondContact O-N 3.38Å; F137-Q140 PolarHBondContact O-N 2.68Å; F137-C141 PolarHBondContact O-N 3.41Å; F137-C141 PolarHBondContact O-SG 2.72Å
138	Q	89.6	Confident	87.3	Confident	128 Å²	128	101.2 Å²	101.2	60%	0.598	51%	0.506	S	S	*	.	H	α-helix	trans	-64.7	-45.2	174	-175	179.4	-9.4	0	0	111.4	L134 S135 Q140 C141 D142	L134-Q138 PolarHBondContact O-N 2.89Å; S135-Q138 PolarHBondContact O-N 3.16Å; Q138-Q140 VanDerWaalsContact C-N 3.27Å; Q138-Q140 PolarHBondContact O-N 2.77Å; Q138-C141 PolarHBondContact O-N 3.02Å; Q138-C141 VanDerWaalsContact O-N 3.15Å; Q138-D142 PolarHBondContact O-N 3.29Å
139	E	88.9	Confident	88	Confident	128 Å²	128	98.3 Å²	98.3	60%	0.598	50%	0.501	S	S	*	.	H	α-helix	trans	-59.6	-37.4	175.6	-74.6	170.6	-161	0	0	112	S135 D142 A143	S135-E139 WeakPolarHBondContact O-CG 3.28Å; S135-E139 PolarHBondContact O-N 2.86Å; E139-D142 PolarHBondContact O-N 3.25Å; E139-A143 WeakPolarHBondContact O-CB 3.48Å; E139-A143 PolarHBondContact O-N 3.46Å
140	Q	88.1	Confident	88.5	Confident	116 Å²	116	94.7 Å²	94.7	54%	0.542	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-43	174.1	-73.8	170.8	24.9	0	0	112.4	G136 F137 Q138 A143 I144	G136-Q140 VanDerWaalsContact O-CG 3.26Å; G136-Q140 WeakPolarHBondContact O-CG 3.38Å; G136-Q140 PolarHBondContact O-N 3.4Å; F137-Q140 PolarHBondContact O-N 2.68Å; Q138-Q140 VanDerWaalsContact C-N 3.27Å; Q138-Q140 PolarHBondContact O-N 2.77Å; Q140-A143 PolarHBondContact O-N 3.14Å; Q140-I144 VanDerWaalsContact O-CG1 3.31Å; Q140-I144 WeakPolarHBondContact O-CG1 3.37Å; Q140-I144 PolarHBondContact O-N 3.02Å
141	C	88.4	Confident	88.9	Confident	67 Å²	67	91.7 Å²	91.7	45%	0.453	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-40.9	175.4	-71	0	0	0	0	112	F137 Q138 I144 L145	F137-C141 PolarHBondContact O-N 3.41Å; F137-C141 PolarHBondContact O-SG 2.72Å; Q138-C141 PolarHBondContact O-N 3.02Å; Q138-C141 VanDerWaalsContact O-N 3.15Å; C141-I144 PolarHBondContact O-N 3Å; C141-L145 WeakPolarHBondContact O-CB 3.34Å; C141-L145 PolarHBondContact O-N 2.89Å
142	D	91.8	Very high	89.2	Confident	83 Å²	83	89 Å²	89	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-66.5	-37.1	176.2	-74.6	-25.3	0	0	0	111.6	Q138 E139 L145 N146	Q138-D142 PolarHBondContact O-N 3.29Å; E139-D142 PolarHBondContact O-N 3.25Å; D142-L145 PolarHBondContact O-N 3.06Å; D142-N146 WeakPolarHBondContact O-CB 3.45Å; D142-N146 VanDerWaalsContact O-CG 3.29Å; D142-N146 PolarHBondContact O-N 3.19Å; D142-N146 PolarHBondContact O-ND2 3.23Å
143	A	90	Very high	89.6	Confident	49 Å²	49	91.4 Å²	91.4	41%	0.405	49%	0.489	S	S	.	.	H	α-helix	trans	-62.1	-48.3	172.9	0	0	0	0	0	111.6	E139 Q140 L145 N146 D147	E139-A143 WeakPolarHBondContact O-CB 3.48Å; E139-A143 PolarHBondContact O-N 3.46Å; Q140-A143 PolarHBondContact O-N 3.14Å; A143-L145 VanDerWaalsContact C-N 3.31Å; A143-L145 PolarHBondContact O-N 3.12Å; A143-N146 PolarHBondContact O-N 3.47Å; A143-D147 PolarHBondContact O-N 3.37Å
144	I	90.6	Very high	89.8	Confident	106 Å²	106	91 Å²	91	54%	0.544	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-41.1	177.4	-67.6	166.4	0	0	0	110.9	Q140 C141 N146 D147 V148	Q140-I144 VanDerWaalsContact O-CG1 3.31Å; Q140-I144 WeakPolarHBondContact O-CG1 3.37Å; Q140-I144 PolarHBondContact O-N 3.02Å; C141-I144 PolarHBondContact O-N 3Å; I144-N146 VanDerWaalsContact C-N 3.33Å; I144-N146 PolarHBondContact O-N 3.42Å; I144-D147 PolarHBondContact O-N 3.07Å; I144-V148 HydrophobicContact CG2-CG2 4.43Å; I144-V148 WeakPolarHBondContact O-CG2 3.24Å; I144-V148 PolarHBondContact O-N 3.42Å
145	L	92.8	Very high	90.1	Very high	104 Å²	104	91.4 Å²	91.4	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-67.1	-36.6	179.7	-161.7	143.8	0	0	0	111.5	C141 D142 A143 N149	C141-L145 WeakPolarHBondContact O-CB 3.34Å; C141-L145 PolarHBondContact O-N 2.89Å; D142-L145 PolarHBondContact O-N 3.06Å; A143-L145 VanDerWaalsContact C-N 3.31Å; A143-L145 PolarHBondContact O-N 3.12Å; L145-N149 WeakPolarHBondContact CD2-ND2 3.48Å; L145-N149 WeakPolarHBondContact O-CB 3.34Å; L145-N149 PolarHBondContact O-N 2.88Å; L145-N149 PolarHBondContact O-ND2 3.42Å
146	N	92.9	Very high	90.2	Very high	96 Å²	96	93.6 Å²	93.6	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-39.4	171.6	-76	-29.9	0	0	0	112.5	D142 A143 I144 N149 S150	D142-N146 WeakPolarHBondContact O-CB 3.45Å; D142-N146 VanDerWaalsContact O-CG 3.29Å; D142-N146 PolarHBondContact O-N 3.19Å; D142-N146 PolarHBondContact O-ND2 3.23Å; A143-N146 PolarHBondContact O-N 3.47Å; I144-N146 VanDerWaalsContact C-N 3.33Å; I144-N146 PolarHBondContact O-N 3.42Å; N146-N149 PolarHBondContact O-N 2.99Å; N146-S150 WeakPolarHBondContact O-CB 3.29Å; N146-S150 PolarHBondContact O-N 3.4Å; N146-S150 PolarHBondContact O-OG 3.39Å
147	D	91.2	Very high	90.4	Very high	111 Å²	111	95.2 Å²	95.2	59%	0.594	51%	0.507	S	S	*	.	H	α-helix	trans	-65.2	-42.2	176.3	-72.8	-14.6	0	0	0	111.3	A143 I144 S150 A151	A143-D147 PolarHBondContact O-N 3.37Å; I144-D147 PolarHBondContact O-N 3.07Å; D147-S150 PolarHBondContact O-N 3.16Å; D147-A151 WeakPolarHBondContact O-CB 3.45Å; D147-A151 PolarHBondContact O-N 3.5Å
148	V	90.8	Very high	90.6	Very high	78 Å²	78	95.4 Å²	95.4	47%	0.473	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-43.2	175.6	171.9	0	0	0	0	111.3	I144 S150 A151 L152	I144-V148 HydrophobicContact CG2-CG2 4.43Å; I144-V148 WeakPolarHBondContact O-CG2 3.24Å; I144-V148 PolarHBondContact O-N 3.42Å; V148-S150 VanDerWaalsContact C-N 3.32Å; V148-S150 PolarHBondContact O-N 2.99Å; V148-A151 PolarHBondContact O-N 2.65Å; V148-L152 HydrophobicContact CG1-CD1 4.26Å; V148-L152 WeakPolarHBondContact O-CG 3.44Å; V148-L152 PolarHBondContact O-N 3.06Å
149	N	92.6	Very high	90.6	Very high	74 Å²	74	95 Å²	95	40%	0.396	51%	0.511	S	S	.	.	H	α-helix	trans	-63.7	-39.5	175.6	-78.9	-31.6	0	0	0	111.9	L145 N146 L152 Q153	L145-N149 WeakPolarHBondContact CD2-ND2 3.48Å; L145-N149 WeakPolarHBondContact O-CB 3.34Å; L145-N149 PolarHBondContact O-N 2.88Å; L145-N149 PolarHBondContact O-ND2 3.42Å; N146-N149 PolarHBondContact O-N 2.99Å; N149-L152 PolarHBondContact O-N 3.37Å; N149-Q153 WeakPolarHBondContact O-CG 3.26Å; N149-Q153 PolarHBondContact O-N 3.26Å
150	S	91.3	Very high	90.6	Very high	53 Å²	53	94.9 Å²	94.9	37%	0.371	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-43.3	174.9	-60.8	0	0	0	0	111.1	N146 D147 V148 L152 Q153 H154	N146-S150 WeakPolarHBondContact O-CB 3.29Å; N146-S150 PolarHBondContact O-N 3.4Å; N146-S150 PolarHBondContact O-OG 3.39Å; D147-S150 PolarHBondContact O-N 3.16Å; V148-S150 VanDerWaalsContact C-N 3.32Å; V148-S150 PolarHBondContact O-N 2.99Å; S150-L152 PolarHBondContact O-N 2.8Å; S150-Q153 PolarHBondContact O-N 2.97Å; S150-H154 PolarHBondContact O-CD2 2.94Å; S150-H154 PolarHBondContact O-N 2.76Å
151	A	89.9	Confident	90.6	Very high	55 Å²	55	95 Å²	95	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-61.5	-42.3	175.4	0	0	0	0	0	112.1	D147 V148 H154 L155	D147-A151 WeakPolarHBondContact O-CB 3.45Å; D147-A151 PolarHBondContact O-N 3.5Å; V148-A151 PolarHBondContact O-N 2.65Å; A151-H154 PolarHBondContact O-N 3.39Å; A151-L155 WeakPolarHBondContact O-CB 3.46Å; A151-L155 PolarHBondContact O-N 3.18Å
152	L	91.1	Very high	90.6	Very high	105 Å²	105	99.8 Å²	99.8	55%	0.55	52%	0.519	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.4	-75.6	170.8	0	0	0	112.1	V148 N149 S150 H154 L155 E156	V148-L152 HydrophobicContact CG1-CD1 4.26Å; V148-L152 WeakPolarHBondContact O-CG 3.44Å; V148-L152 PolarHBondContact O-N 3.06Å; N149-L152 PolarHBondContact O-N 3.37Å; S150-L152 PolarHBondContact O-N 2.8Å; L152-H154 VanDerWaalsContact C-N 3.34Å; L152-H154 PolarHBondContact O-N 3.2Å; L152-L155 PolarHBondContact O-N 3.49Å; L152-E156 PolarHBondContact O-N 3.25Å
153	Q	91.8	Very high	90.4	Very high	135 Å²	135	100 Å²	100	63%	0.631	52%	0.519	S	S	*	.	H	α-helix	trans	-63.1	-40.2	174.2	-74.4	-178.4	1.5	0	0	112.1	N149 S150 L155 E156 S157	N149-Q153 WeakPolarHBondContact O-CG 3.26Å; N149-Q153 PolarHBondContact O-N 3.26Å; S150-Q153 PolarHBondContact O-N 2.97Å; Q153-L155 VanDerWaalsContact C-N 3.32Å; Q153-L155 PolarHBondContact O-N 3.44Å; Q153-E156 PolarHBondContact O-N 3.09Å; Q153-S157 VanDerWaalsContact O-CB 3.31Å; Q153-S157 WeakPolarHBondContact O-CB 3.2Å; Q153-S157 PolarHBondContact O-N 3.44Å
154	H	90.6	Very high	90.3	Very high	138 Å²	138	103.4 Å²	103.4	64%	0.639	53%	0.525	S	S	*	.	H	α-helix	trans	-62.9	-39.8	173.8	-73.7	-51.1	0	0	0	111.9	S150 A151 L152 S157 L158	S150-H154 PolarHBondContact O-CD2 2.94Å; S150-H154 PolarHBondContact O-N 2.76Å; A151-H154 PolarHBondContact O-N 3.39Å; L152-H154 VanDerWaalsContact C-N 3.34Å; L152-H154 PolarHBondContact O-N 3.2Å; H154-S157 PolarHBondContact O-N 3.1Å; H154-L158 VanDerWaalsContact O-CB 3.31Å; H154-L158 WeakPolarHBondContact O-CB 3.5Å; H154-L158 PolarHBondContact O-N 3.47Å
155	L	90.1	Very high	90.3	Very high	117 Å²	117	102.3 Å²	102.3	61%	0.613	52%	0.523	S	S	*	.	H	α-helix	trans	-69.6	-39	179.5	-142.1	143.3	0	0	0	111.7	A151 L152 Q153 L158 Q159	A151-L155 WeakPolarHBondContact O-CB 3.46Å; A151-L155 PolarHBondContact O-N 3.18Å; L152-L155 PolarHBondContact O-N 3.49Å; Q153-L155 VanDerWaalsContact C-N 3.32Å; Q153-L155 PolarHBondContact O-N 3.44Å; L155-L158 PolarHBondContact O-N 3.12Å; L155-Q159 WeakPolarHBondContact O-CB 3.37Å; L155-Q159 PolarHBondContact O-N 3.27Å
156	E	90.1	Very high	90.1	Very high	97 Å²	97	100 Å²	100	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-65.7	-41.6	173	-163.3	-166.2	151.6	0	0	111.6	L152 Q153 Q159 K160	L152-E156 PolarHBondContact O-N 3.25Å; Q153-E156 PolarHBondContact O-N 3.09Å; E156-Q159 PolarHBondContact O-N 2.9Å; E156-K160 WeakPolarHBondContact O-CG 3.47Å; E156-K160 PolarHBondContact O-N 3.08Å; E156-K160 WeakPolarHBondContact OE1-CE 3.23Å; E156-K160 IonicContact OE1-NZ 2.93Å; E156-K160 PolarHBondContact OE1-NZ 2.88Å
157	S	90.6	Very high	89.9	Confident	54 Å²	54	100.5 Å²	100.5	38%	0.378	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-44	174	-174.7	0	0	0	0	111.4	Q153 H154 Q159 K160 Q161	Q153-S157 VanDerWaalsContact O-CB 3.31Å; Q153-S157 WeakPolarHBondContact O-CB 3.2Å; Q153-S157 PolarHBondContact O-N 3.44Å; H154-S157 PolarHBondContact O-N 3.1Å; S157-Q159 PolarHBondContact O-N 2.79Å; S157-K160 PolarHBondContact O-N 3.03Å; S157-Q161 WeakPolarHBondContact O-CG 3.38Å; S157-Q161 PolarHBondContact O-N 3.41Å
158	L	90.4	Very high	89.6	Confident	109 Å²	109	100.9 Å²	100.9	57%	0.571	52%	0.515	S	S	*	.	H	α-helix	trans	-62.9	-42	176.8	-175	67.7	0	0	0	111.2	H154 L155 K160 Q161 Y162	H154-L158 VanDerWaalsContact O-CB 3.31Å; H154-L158 WeakPolarHBondContact O-CB 3.5Å; H154-L158 PolarHBondContact O-N 3.47Å; L155-L158 PolarHBondContact O-N 3.12Å; L158-K160 PolarHBondContact O-N 3.08Å; L158-Q161 PolarHBondContact O-N 3.39Å; L158-Y162 VanDerWaalsContact O-CB 3.31Å; L158-Y162 WeakPolarHBondContact O-CB 3.39Å; L158-Y162 PolarHBondContact O-N 3.22Å
159	Q	88.9	Confident	89.6	Confident	121 Å²	121	101 Å²	101	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-61.5	-43.9	175.4	-173.4	-176.9	8.1	0	0	111.5	L155 E156 S157 Y162 L163	L155-Q159 WeakPolarHBondContact O-CB 3.37Å; L155-Q159 PolarHBondContact O-N 3.27Å; E156-Q159 PolarHBondContact O-N 2.9Å; S157-Q159 PolarHBondContact O-N 2.79Å; Q159-Y162 PolarHBondContact O-N 3.1Å; Q159-L163 HydrophobicContact CG-CD1 4.16Å; Q159-L163 WeakPolarHBondContact O-CB 3.44Å; Q159-L163 PolarHBondContact O-N 3.27Å
160	K	89.2	Confident	89.3	Confident	125 Å²	125	98.9 Å²	98.9	54%	0.543	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-43.5	175.2	-77.5	168.6	172.3	160.6	0	111.7	E156 S157 L158 F164	E156-K160 WeakPolarHBondContact O-CG 3.47Å; E156-K160 PolarHBondContact O-N 3.08Å; E156-K160 WeakPolarHBondContact OE1-CE 3.23Å; E156-K160 IonicContact OE1-NZ 2.93Å; E156-K160 PolarHBondContact OE1-NZ 2.88Å; S157-K160 PolarHBondContact O-N 3.03Å; L158-K160 PolarHBondContact O-N 3.08Å; K160-F164 WeakPolarHBondContact O-CB 3.43Å; K160-F164 PolarHBondContact O-N 2.85Å
161	Q	88.4	Confident	89.2	Confident	117 Å²	117	100.4 Å²	100.4	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-42	176.6	-72.5	-178	4.6	0	0	112	S157 L158 F164 V165	S157-Q161 WeakPolarHBondContact O-CG 3.38Å; S157-Q161 PolarHBondContact O-N 3.41Å; L158-Q161 PolarHBondContact O-N 3.39Å; Q161-F164 PolarHBondContact O-N 3.44Å; Q161-V165 WeakPolarHBondContact O-CB 3.48Å; Q161-V165 VanDerWaalsContact O-CG2 3.31Å; Q161-V165 WeakPolarHBondContact O-CG2 3.45Å; Q161-V165 PolarHBondContact O-N 3.02Å
162	Y	87.4	Confident	89.2	Confident	169 Å²	169	103 Å²	103	66%	0.663	52%	0.524	S	S	*	.	H	α-helix	trans	-61.6	-47.2	176	-179.2	-92.9	0	0	0	111.3	L158 Q159 F164 V165 S166	L158-Y162 VanDerWaalsContact O-CB 3.31Å; L158-Y162 WeakPolarHBondContact O-CB 3.39Å; L158-Y162 PolarHBondContact O-N 3.22Å; Q159-Y162 PolarHBondContact O-N 3.1Å; Y162-F164 VanDerWaalsContact C-N 3.33Å; Y162-F164 PolarHBondContact O-N 2.97Å; Y162-V165 PolarHBondContact O-N 3.09Å; Y162-S166 WeakPolarHBondContact O-CB 3.29Å; Y162-S166 PolarHBondContact O-N 3.42Å
163	L	87.6	Confident	89.1	Confident	88 Å²	88	103.6 Å²	103.6	46%	0.461	52%	0.524	S	S	.	.	H	α-helix	trans	-60.4	-41.9	174.9	-84.1	159.1	0	0	0	111.9	Q159 N167	Q159-L163 HydrophobicContact CG-CD1 4.16Å; Q159-L163 WeakPolarHBondContact O-CB 3.44Å; Q159-L163 PolarHBondContact O-N 3.27Å; L163-N167 VanDerWaalsContact O-CB 3.31Å; L163-N167 WeakPolarHBondContact O-CB 3.39Å; L163-N167 VanDerWaalsContact O-CG 3.3Å; L163-N167 PolarHBondContact O-N 3.3Å
164	F	88.8	Confident	89.1	Confident	120 Å²	120	103.7 Å²	103.7	53%	0.526	53%	0.525	S	S	.	.	H	α-helix	trans	-63.8	-46.2	176.9	176.8	-100.7	0	0	0	112.4	K160 Q161 Y162 K168	K160-F164 WeakPolarHBondContact O-CB 3.43Å; K160-F164 PolarHBondContact O-N 2.85Å; Q161-F164 PolarHBondContact O-N 3.44Å; Y162-F164 VanDerWaalsContact C-N 3.33Å; Y162-F164 PolarHBondContact O-N 2.97Å; F164-K168 HydrophobicContact CD1-CD 4.27Å; F164-K168 HydrophobicContact CE1-CD 3.69Å; F164-K168 HydrophobicContact CE2-CD 4.05Å; F164-K168 VanDerWaalsContact CE2-CE 3.45Å; F164-K168 HydrophobicContact CZ-CD 3.62Å; F164-K168 WeakPolarHBondContact O-CB 3.28Å; F164-K168 WeakPolarHBondContact O-CG 3.39Å; F164-K168 PolarHBondContact O-N 2.92Å
165	V	90.6	Very high	89.1	Confident	83 Å²	83	99.2 Å²	99.2	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-67.3	-42.1	177.6	172.8	0	0	0	0	110.5	Q161 Y162 K168 T169	Q161-V165 WeakPolarHBondContact O-CB 3.48Å; Q161-V165 VanDerWaalsContact O-CG2 3.31Å; Q161-V165 WeakPolarHBondContact O-CG2 3.45Å; Q161-V165 PolarHBondContact O-N 3.02Å; Y162-V165 PolarHBondContact O-N 3.09Å; V165-K168 PolarHBondContact O-N 3.32Å; V165-T169 WeakPolarHBondContact O-CB 3.46Å; V165-T169 PolarHBondContact O-N 2.91Å; V165-T169 PolarHBondContact O-OG1 3.01Å
166	S	88.7	Confident	89	Confident	56 Å²	56	96.3 Å²	96.3	39%	0.392	50%	0.5	S	S	.	.	H	α-helix	trans	-61.6	-46.8	176.9	-174.6	0	0	0	0	111.3	Y162 T169 G170	Y162-S166 WeakPolarHBondContact O-CB 3.29Å; Y162-S166 PolarHBondContact O-N 3.42Å; S166-T169 PolarHBondContact O-N 3.04Å; S166-G170 PolarHBondContact O-N 2.95Å
167	N	87.8	Confident	89	Confident	105 Å²	105	96.5 Å²	96.5	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-64.8	-46.8	177.5	-75.7	-11.8	0	0	0	111.1	L163 T169 G170 T171	L163-N167 VanDerWaalsContact O-CB 3.31Å; L163-N167 WeakPolarHBondContact O-CB 3.39Å; L163-N167 VanDerWaalsContact O-CG 3.3Å; L163-N167 PolarHBondContact O-N 3.3Å; N167-T169 PolarHBondContact O-N 3.41Å; N167-G170 PolarHBondContact O-N 3.22Å; N167-T171 WeakPolarHBondContact O-CG2 3.17Å; N167-T171 PolarHBondContact O-N 3.2Å; N167-T171 PolarHBondContact O-OG1 2.93Å
168	K	86.1	Confident	89.1	Confident	120 Å²	120	99.5 Å²	99.5	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-63.2	-42.1	177.5	-79.8	-167.6	167.9	-171.9	0	112.8	F164 V165 T171 L172	F164-K168 HydrophobicContact CD1-CD 4.27Å; F164-K168 HydrophobicContact CE1-CD 3.69Å; F164-K168 HydrophobicContact CE2-CD 4.05Å; F164-K168 VanDerWaalsContact CE2-CE 3.45Å; F164-K168 HydrophobicContact CZ-CD 3.62Å; F164-K168 WeakPolarHBondContact O-CB 3.28Å; F164-K168 WeakPolarHBondContact O-CG 3.39Å; F164-K168 PolarHBondContact O-N 2.92Å; V165-K168 PolarHBondContact O-N 3.32Å; K168-T171 WeakPolarHBondContact CA-OG1 3.42Å; K168-T171 PolarHBondContact O-N 3.47Å; K168-T171 PolarHBondContact O-OG1 3.2Å; K168-L172 WeakPolarHBondContact O-CB 3.36Å; K168-L172 PolarHBondContact O-N 2.78Å
169	T	89	Confident	89.2	Confident	79 Å²	79	99.5 Å²	99.5	49%	0.485	51%	0.509	S	S	.	.	H	α-helix	trans	-69.1	-38.1	178.4	-52.5	0	0	0	0	110.7	V165 S166 N167 L172 H173	V165-T169 WeakPolarHBondContact O-CB 3.46Å; V165-T169 PolarHBondContact O-N 2.91Å; V165-T169 PolarHBondContact O-OG1 3.01Å; S166-T169 PolarHBondContact O-N 3.04Å; N167-T169 PolarHBondContact O-N 3.41Å; T169-L172 PolarHBondContact O-N 2.86Å; T169-H173 VanDerWaalsContact O-CB 3.24Å; T169-H173 WeakPolarHBondContact O-CB 3.47Å; T169-H173 PolarHBondContact O-N 2.99Å
170	G	88	Confident	89.4	Confident	30 Å²	30	98 Å²	98	31%	0.309	51%	0.505	S	S	.	.	H	α-helix	trans	-59.6	-50.5	171.6	0	0	0	0	0	111.7	S166 N167 L172 H173 E174	S166-G170 PolarHBondContact O-N 2.95Å; N167-G170 PolarHBondContact O-N 3.22Å; G170-L172 VanDerWaalsContact C-N 3.3Å; G170-L172 PolarHBondContact O-N 2.88Å; G170-H173 PolarHBondContact O-N 3.48Å; G170-E174 WeakPolarHBondContact O-CG 3.24Å; G170-E174 PolarHBondContact O-N 2.82Å
171	T	88.6	Confident	89.6	Confident	86 Å²	86	98.2 Å²	98.2	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-35.5	176.2	56.1	0	0	0	0	113.2	N167 K168 A175	N167-T171 WeakPolarHBondContact O-CG2 3.17Å; N167-T171 PolarHBondContact O-N 3.2Å; N167-T171 PolarHBondContact O-OG1 2.93Å; K168-T171 WeakPolarHBondContact CA-OG1 3.42Å; K168-T171 PolarHBondContact O-N 3.47Å; K168-T171 PolarHBondContact O-OG1 3.2Å; T171-A175 WeakPolarHBondContact O-CB 3.19Å; T171-A175 PolarHBondContact O-N 3.1Å
172	L	90.1	Very high	89.8	Confident	109 Å²	109	96.6 Å²	96.6	57%	0.571	50%	0.498	S	S	*	.	H	α-helix	trans	-71	-41.6	177.1	-178.5	69.1	0	0	0	110.8	K168 T169 G170 A175 C176	K168-L172 WeakPolarHBondContact O-CB 3.36Å; K168-L172 PolarHBondContact O-N 2.78Å; T169-L172 PolarHBondContact O-N 2.86Å; G170-L172 VanDerWaalsContact C-N 3.3Å; G170-L172 PolarHBondContact O-N 2.88Å; L172-A175 PolarHBondContact O-N 2.92Å; L172-C176 WeakPolarHBondContact O-CB 3.47Å; L172-C176 PolarHBondContact O-N 3.34Å; L172-C176 PolarHBondContact O-SG 3.03Å
173	H	89.5	Confident	90.1	Very high	117 Å²	117	94 Å²	94	54%	0.542	49%	0.492	S	S	.	.	H	α-helix	trans	-64.4	-45.6	177.4	-176.2	57.7	0	0	0	111	T169 G170 A175 C176 E177	T169-H173 VanDerWaalsContact O-CB 3.24Å; T169-H173 WeakPolarHBondContact O-CB 3.47Å; T169-H173 PolarHBondContact O-N 2.99Å; G170-H173 PolarHBondContact O-N 3.48Å; H173-A175 VanDerWaalsContact C-N 3.33Å; H173-A175 PolarHBondContact O-N 2.67Å; H173-C176 PolarHBondContact O-N 2.85Å; H173-C176 VanDerWaalsContact O-N 3.16Å; H173-E177 IonicContact CE1-OE1 3.16Å; H173-E177 WeakPolarHBondContact O-CB 3.41Å; H173-E177 WeakPolarHBondContact O-CG 3.43Å; H173-E177 PolarHBondContact O-N 2.88Å
174	E	90.2	Very high	90.4	Very high	138 Å²	138	92.6 Å²	92.6	65%	0.645	49%	0.489	S	S	*	.	H	α-helix	trans	-58	-43.8	172.6	-74.7	175.1	-176.3	0	0	111.9	G170 E177 Q178	G170-E174 WeakPolarHBondContact O-CG 3.24Å; G170-E174 PolarHBondContact O-N 2.82Å; E174-E177 PolarHBondContact O-N 3.14Å; E174-Q178 WeakPolarHBondContact O-CB 3.38Å; E174-Q178 PolarHBondContact O-N 2.9Å
175	A	90.6	Very high	90.6	Very high	44 Å²	44	91.9 Å²	91.9	36%	0.364	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-38.1	175.7	0	0	0	0	0	112.6	T171 L172 H173 L179	T171-A175 WeakPolarHBondContact O-CB 3.19Å; T171-A175 PolarHBondContact O-N 3.1Å; L172-A175 PolarHBondContact O-N 2.92Å; H173-A175 VanDerWaalsContact C-N 3.33Å; H173-A175 PolarHBondContact O-N 2.67Å; A175-L179 WeakPolarHBondContact O-CB 3.36Å; A175-L179 VanDerWaalsContact O-CG 3.29Å; A175-L179 WeakPolarHBondContact O-CG 3.27Å; A175-L179 PolarHBondContact O-N 3.27Å
176	C	88.8	Confident	90.8	Very high	55 Å²	55	93.4 Å²	93.4	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-68.9	-41.9	176.3	-68.7	0	0	0	0	111.9	L172 H173 Q178 L179 L180	L172-C176 WeakPolarHBondContact O-CB 3.47Å; L172-C176 PolarHBondContact O-N 3.34Å; L172-C176 PolarHBondContact O-SG 3.03Å; H173-C176 PolarHBondContact O-N 2.85Å; H173-C176 VanDerWaalsContact O-N 3.16Å; C176-Q178 VanDerWaalsContact C-N 3.34Å; C176-L179 PolarHBondContact O-N 3.08Å; C176-L180 WeakPolarHBondContact O-CB 3.25Å; C176-L180 WeakPolarHBondContact O-CG 2.95Å; C176-L180 PolarHBondContact O-N 3.25Å
177	E	89.8	Confident	91	Very high	101 Å²	101	93.9 Å²	93.9	47%	0.472	49%	0.492	S	S	.	.	H	α-helix	trans	-62.3	-42	174.3	-78.3	-64	143.3	0	0	111.2	H173 E174 L180 K181	H173-E177 IonicContact CE1-OE1 3.16Å; H173-E177 WeakPolarHBondContact O-CB 3.41Å; H173-E177 WeakPolarHBondContact O-CG 3.43Å; H173-E177 PolarHBondContact O-N 2.88Å; E174-E177 PolarHBondContact O-N 3.14Å; E177-L180 PolarHBondContact O-N 2.7Å; E177-K181 WeakPolarHBondContact O-CB 3.48Å; E177-K181 PolarHBondContact O-N 2.99Å
178	Q	92.5	Very high	91.3	Very high	118 Å²	118	93.1 Å²	93.1	55%	0.551	49%	0.488	S	S	*	.	H	α-helix	trans	-61.8	-44.6	173.8	-173.5	177.9	-15.6	0	0	111.5	E174 C176 K181 E182	E174-Q178 WeakPolarHBondContact O-CB 3.38Å; E174-Q178 PolarHBondContact O-N 2.9Å; C176-Q178 VanDerWaalsContact C-N 3.34Å; Q178-K181 PolarHBondContact O-N 3.34Å; Q178-E182 PolarHBondContact NE2-OE1 3.44Å; Q178-E182 WeakPolarHBondContact O-CG 3.43Å; Q178-E182 PolarHBondContact O-N 3.49Å
179	L	93.3	Very high	91.6	Very high	108 Å²	108	92 Å²	92	57%	0.565	49%	0.488	S	S	*	.	H	α-helix	trans	-65.3	-38.5	176.9	-75.5	171.4	0	0	0	112.9	A175 C176 K181 E182 Q183	A175-L179 WeakPolarHBondContact O-CB 3.36Å; A175-L179 VanDerWaalsContact O-CG 3.29Å; A175-L179 WeakPolarHBondContact O-CG 3.27Å; A175-L179 PolarHBondContact O-N 3.27Å; C176-L179 PolarHBondContact O-N 3.08Å; L179-K181 VanDerWaalsContact C-N 3.34Å; L179-E182 PolarHBondContact O-N 3.34Å; L179-Q183 VanDerWaalsContact O-CB 3.29Å; L179-Q183 WeakPolarHBondContact O-CB 3.32Å; L179-Q183 PolarHBondContact O-N 3.01Å
180	L	93.6	Very high	91.8	Very high	91 Å²	91	90.9 Å²	90.9	48%	0.476	49%	0.487	S	S	.	.	H	α-helix	trans	-65	-40.3	175	-76.5	171.8	0	0	0	111.1	C176 E177 Q183 S184	C176-L180 WeakPolarHBondContact O-CB 3.25Å; C176-L180 WeakPolarHBondContact O-CG 2.95Å; C176-L180 PolarHBondContact O-N 3.25Å; E177-L180 PolarHBondContact O-N 2.7Å; L180-Q183 PolarHBondContact O-N 3.14Å; L180-S184 PolarHBondContact O-N 3.11Å; L180-S184 PolarHBondContact O-OG 3.47Å
181	K	93.1	Very high	92	Very high	129 Å²	129	94.7 Å²	94.7	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-62.8	-50.3	174.2	-172.2	-179.8	177.4	-173	0	111.2	E177 Q178 L179 Q183 S184 E185	E177-K181 WeakPolarHBondContact O-CB 3.48Å; E177-K181 PolarHBondContact O-N 2.99Å; Q178-K181 PolarHBondContact O-N 3.34Å; L179-K181 VanDerWaalsContact C-N 3.34Å; K181-Q183 VanDerWaalsContact C-N 3.28Å; K181-Q183 PolarHBondContact O-N 2.94Å; K181-S184 PolarHBondContact O-N 3.39Å; K181-S184 VanDerWaalsContact O-N 3.15Å; K181-S184 PolarHBondContact O-OG 3.13Å; K181-E185 WeakPolarHBondContact CE-OE1 3.35Å; K181-E185 WeakPolarHBondContact O-CG 3.47Å; K181-E185 PolarHBondContact O-N 3.01Å
182	E	92.6	Very high	92	Very high	82 Å²	82	94.3 Å²	94.3	38%	0.383	49%	0.491	S	S	.	.	H	α-helix	trans	-58.7	-40.3	175.8	-73.4	174.9	-165.9	0	0	111.7	Q178 L179 E185 L186	Q178-E182 PolarHBondContact NE2-OE1 3.44Å; Q178-E182 WeakPolarHBondContact O-CG 3.43Å; Q178-E182 PolarHBondContact O-N 3.49Å; L179-E182 PolarHBondContact O-N 3.34Å; E182-E185 PolarHBondContact O-N 2.9Å; E182-L186 WeakPolarHBondContact O-CB 3.31Å; E182-L186 WeakPolarHBondContact O-CG 3.33Å; E182-L186 PolarHBondContact O-N 3.5Å
183	Q	93	Very high	91.9	Very high	116 Å²	116	93.6 Å²	93.6	54%	0.542	49%	0.487	S	S	.	.	H	α-helix	trans	-61.5	-46.7	174.7	-176.7	-177	18.8	0	0	111.7	L179 L180 K181 L186 V187	L179-Q183 VanDerWaalsContact O-CB 3.29Å; L179-Q183 WeakPolarHBondContact O-CB 3.32Å; L179-Q183 PolarHBondContact O-N 3.01Å; L180-Q183 PolarHBondContact O-N 3.14Å; K181-Q183 VanDerWaalsContact C-N 3.28Å; K181-Q183 PolarHBondContact O-N 2.94Å; Q183-L186 PolarHBondContact O-N 2.93Å; Q183-V187 VanDerWaalsContact O-CG2 3.28Å; Q183-V187 WeakPolarHBondContact O-CG2 3.46Å; Q183-V187 PolarHBondContact O-N 3.14Å
184	S	92.9	Very high	91.8	Very high	58 Å²	58	93.5 Å²	93.5	41%	0.406	49%	0.487	S	S	.	.	H	α-helix	trans	-62.2	-44.7	178.2	66.4	0	0	0	0	111.8	L180 K181 L186 V187 D188	L180-S184 PolarHBondContact O-N 3.11Å; L180-S184 PolarHBondContact O-OG 3.47Å; K181-S184 PolarHBondContact O-N 3.39Å; K181-S184 VanDerWaalsContact O-N 3.15Å; K181-S184 PolarHBondContact O-OG 3.13Å; S184-L186 VanDerWaalsContact C-N 3.32Å; S184-L186 PolarHBondContact O-N 3.35Å; S184-V187 PolarHBondContact O-N 2.86Å; S184-D188 WeakPolarHBondContact O-CB 3.46Å; S184-D188 VanDerWaalsContact O-CG 3.31Å; S184-D188 PolarHBondContact O-N 3.32Å
185	E	94.2	Very high	91.7	Very high	104 Å²	104	92.5 Å²	92.5	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-62.8	-38.7	177.2	-70.9	178.4	-176.5	0	0	111.8	K181 E182 L189	K181-E185 WeakPolarHBondContact CE-OE1 3.35Å; K181-E185 WeakPolarHBondContact O-CG 3.47Å; K181-E185 PolarHBondContact O-N 3.01Å; E182-E185 PolarHBondContact O-N 2.9Å; E185-L189 VanDerWaalsContact O-CB 3.29Å; E185-L189 WeakPolarHBondContact O-CB 3.41Å; E185-L189 PolarHBondContact O-N 3.27Å
186	L	93.9	Very high	91.4	Very high	115 Å²	115	95.1 Å²	95.1	60%	0.602	49%	0.485	S	S	*	.	H	α-helix	trans	-69.9	-37.6	176.2	-73.7	174.1	0	0	0	112.6	E182 Q183 S184 L189 A190	E182-L186 WeakPolarHBondContact O-CB 3.31Å; E182-L186 WeakPolarHBondContact O-CG 3.33Å; E182-L186 PolarHBondContact O-N 3.5Å; Q183-L186 PolarHBondContact O-N 2.93Å; S184-L186 VanDerWaalsContact C-N 3.32Å; S184-L186 PolarHBondContact O-N 3.35Å; L186-L189 PolarHBondContact O-N 2.86Å; L186-A190 WeakPolarHBondContact O-CB 3.07Å; L186-A190 PolarHBondContact O-N 3.41Å
187	V	94.1	Very high	91.2	Very high	66 Å²	66	96 Å²	96	40%	0.4	49%	0.486	S	S	.	.	H	α-helix	trans	-65.8	-47.4	174.5	170.6	0	0	0	0	110	Q183 S184 L189 A190 E191	Q183-V187 VanDerWaalsContact O-CG2 3.28Å; Q183-V187 WeakPolarHBondContact O-CG2 3.46Å; Q183-V187 PolarHBondContact O-N 3.14Å; S184-V187 PolarHBondContact O-N 2.86Å; V187-L189 VanDerWaalsContact C-N 3.27Å; V187-L189 PolarHBondContact O-N 3.35Å; V187-A190 WeakPolarHBondContact O-CB 3.19Å; V187-A190 PolarHBondContact O-N 3.4Å; V187-A190 VanDerWaalsContact O-N 3.09Å; V187-E191 HydrophobicContact CG1-CG 4.45Å; V187-E191 WeakPolarHBondContact O-CG 3.35Å; V187-E191 PolarHBondContact O-N 3.3Å
188	D	93.1	Very high	91.1	Very high	89 Å²	89	93.5 Å²	93.5	48%	0.476	48%	0.48	S	S	.	.	H	α-helix	trans	-58.6	-41.5	175.7	-71.9	-14.8	0	0	0	111	S184 N192	S184-D188 WeakPolarHBondContact O-CB 3.46Å; S184-D188 VanDerWaalsContact O-CG 3.31Å; S184-D188 PolarHBondContact O-N 3.32Å; D188-N192 WeakPolarHBondContact O-CB 3.3Å; D188-N192 VanDerWaalsContact O-CG 3.29Å; D188-N192 PolarHBondContact O-N 3.01Å; D188-N192 PolarHBondContact O-ND2 3.04Å
189	L	93.2	Very high	90.7	Very high	97 Å²	97	92 Å²	92	51%	0.508	47%	0.47	S	S	.	.	H	α-helix	trans	-64.9	-42.8	175.7	-175.3	64.8	0	0	0	111.8	E185 L186 V187 N192 I193	E185-L189 VanDerWaalsContact O-CB 3.29Å; E185-L189 WeakPolarHBondContact O-CB 3.41Å; E185-L189 PolarHBondContact O-N 3.27Å; L186-L189 PolarHBondContact O-N 2.86Å; V187-L189 VanDerWaalsContact C-N 3.27Å; V187-L189 PolarHBondContact O-N 3.35Å; L189-N192 PolarHBondContact O-N 3.27Å; L189-I193 HydrophobicContact CD1-CD1 4.44Å; L189-I193 HydrophobicContact CG-CD1 4.07Å; L189-I193 VanDerWaalsContact O-CG1 3.27Å; L189-I193 WeakPolarHBondContact O-CG1 3.45Å; L189-I193 PolarHBondContact O-N 2.91Å
190	A	91.8	Very high	90.3	Very high	56 Å²	56	88.6 Å²	88.6	46%	0.463	45%	0.45	S	S	.	.	H	α-helix	trans	-63.8	-43.5	177.9	0	0	0	0	0	111.7	L186 V187 I193 Q194	L186-A190 WeakPolarHBondContact O-CB 3.07Å; L186-A190 PolarHBondContact O-N 3.41Å; V187-A190 WeakPolarHBondContact O-CB 3.19Å; V187-A190 PolarHBondContact O-N 3.4Å; V187-A190 VanDerWaalsContact O-N 3.09Å; A190-I193 PolarHBondContact O-N 3.22Å; A190-Q194 WeakPolarHBondContact O-CB 3.42Å; A190-Q194 PolarHBondContact O-N 3.49Å
191	E	92.4	Very high	90	Very high	109 Å²	109	88.3 Å²	88.3	51%	0.509	45%	0.449	S	S	.	.	H	α-helix	trans	-63.2	-42.9	175.3	-71.5	-172.5	178.9	0	0	111.6	V187 I193 Q194 Q195	V187-E191 HydrophobicContact CG1-CG 4.45Å; V187-E191 WeakPolarHBondContact O-CG 3.35Å; V187-E191 PolarHBondContact O-N 3.3Å; E191-I193 PolarHBondContact O-N 3.02Å; E191-Q194 PolarHBondContact O-N 3.36Å; E191-Q195 WeakPolarHBondContact O-CB 3.45Å; E191-Q195 VanDerWaalsContact O-CG 3.31Å; E191-Q195 WeakPolarHBondContact O-CG 3.13Å; E191-Q195 PolarHBondContact O-N 3.34Å
192	N	89.3	Confident	89.6	Confident	78 Å²	78	84.7 Å²	84.7	42%	0.417	43%	0.434	S	S	.	.	H	α-helix	trans	-60.7	-42.9	174.3	-82	-56.4	0	0	0	112.2	D188 L189 K196	D188-N192 WeakPolarHBondContact O-CB 3.3Å; D188-N192 VanDerWaalsContact O-CG 3.29Å; D188-N192 PolarHBondContact O-N 3.01Å; D188-N192 PolarHBondContact O-ND2 3.04Å; L189-N192 PolarHBondContact O-N 3.27Å; N192-K196 VanDerWaalsContact O-CG 3.24Å; N192-K196 WeakPolarHBondContact O-CG 3.44Å; N192-K196 PolarHBondContact O-N 3.47Å; N192-K196 VanDerWaalsContact O-N 3.12Å
193	I	87.6	Confident	89.4	Confident	95 Å²	95	81.4 Å²	81.4	49%	0.487	42%	0.419	S	S	.	.	H	α-helix	trans	-63.8	-44.6	175.7	-69.4	166.7	0	0	0	110	L189 A190 E191 Q195 K196 L197	L189-I193 HydrophobicContact CD1-CD1 4.44Å; L189-I193 HydrophobicContact CG-CD1 4.07Å; L189-I193 VanDerWaalsContact O-CG1 3.27Å; L189-I193 WeakPolarHBondContact O-CG1 3.45Å; L189-I193 PolarHBondContact O-N 2.91Å; A190-I193 PolarHBondContact O-N 3.22Å; E191-I193 PolarHBondContact O-N 3.02Å; I193-Q195 PolarHBondContact O-N 3.43Å; I193-K196 PolarHBondContact O-N 2.88Å; I193-L197 VanDerWaalsContact O-CB 3.24Å; I193-L197 WeakPolarHBondContact O-CB 3.02Å; I193-L197 PolarHBondContact O-N 3.23Å
194	Q	88.6	Confident	89	Confident	115 Å²	115	82.9 Å²	82.9	54%	0.537	43%	0.426	S	S	.	.	H	α-helix	trans	-62.4	-42.9	180	-175.2	61.9	22.7	0	0	112	A190 E191 L197 S198	A190-Q194 WeakPolarHBondContact O-CB 3.42Å; A190-Q194 PolarHBondContact O-N 3.49Å; E191-Q194 PolarHBondContact O-N 3.36Å; Q194-L197 PolarHBondContact O-N 3.1Å; Q194-S198 PolarHBondContact O-N 3.48Å
195	Q	86.4	Confident	88.7	Confident	116 Å²	116	82.9 Å²	82.9	54%	0.542	42%	0.424	S	S	.	.	H	α-helix	trans	-60.4	-46.2	175.1	-73.6	176.3	10.4	0	0	111.3	E191 I193 L197 S198 Y199	E191-Q195 WeakPolarHBondContact O-CB 3.45Å; E191-Q195 VanDerWaalsContact O-CG 3.31Å; E191-Q195 WeakPolarHBondContact O-CG 3.13Å; E191-Q195 PolarHBondContact O-N 3.34Å; I193-Q195 PolarHBondContact O-N 3.43Å; Q195-L197 VanDerWaalsContact C-N 3.34Å; Q195-L197 PolarHBondContact O-N 3.45Å; Q195-S198 WeakPolarHBondContact O-CB 3.4Å; Q195-S198 PolarHBondContact O-N 2.97Å; Q195-S198 PolarHBondContact O-OG 2.89Å; Q195-Y199 WeakPolarHBondContact O-CD2 3.17Å
196	K	84.6	Confident	88.3	Confident	100 Å²	100	78.1 Å²	78.1	44%	0.435	40%	0.401	S	S	.	.	H	α-helix	trans	-64	-40.2	177.6	-66.2	178.9	-179.9	175.7	0	111.9	N192 I193 S198 F200 Y235	N192-K196 VanDerWaalsContact O-CG 3.24Å; N192-K196 WeakPolarHBondContact O-CG 3.44Å; N192-K196 PolarHBondContact O-N 3.47Å; N192-K196 VanDerWaalsContact O-N 3.12Å; I193-K196 PolarHBondContact O-N 2.88Å; K196-S198 VanDerWaalsContact C-N 3.34Å; K196-F200 VanDerWaalsContact O-CD2 3.22Å; K196-F200 WeakPolarHBondContact O-CD2 3.38Å; K196-Y235 WeakPolarHBondContact CG-OH 3.34Å
197	L	85.2	Confident	88	Confident	74 Å²	74	75.3 Å²	75.3	39%	0.387	39%	0.387	S	S	.	.	H	α-helix	trans	-72.3	-26.9	-178.9	-166.4	139.8	0	0	0	112.3	I193 Q194 Q195 Y199 F200 N201	I193-L197 VanDerWaalsContact O-CB 3.24Å; I193-L197 WeakPolarHBondContact O-CB 3.02Å; I193-L197 PolarHBondContact O-N 3.23Å; Q194-L197 PolarHBondContact O-N 3.1Å; Q195-L197 VanDerWaalsContact C-N 3.34Å; Q195-L197 PolarHBondContact O-N 3.45Å; L197-Y199 VanDerWaalsContact C-N 3.31Å; L197-Y199 PolarHBondContact O-N 3.44Å; L197-F200 PolarHBondContact O-N 2.67Å; L197-N201 WeakPolarHBondContact CD2-ND2 3.37Å; L197-N201 WeakPolarHBondContact CD2-OD1 3.44Å; L197-N201 PolarHBondContact O-N 2.89Å
198	S	87.4	Confident	87.5	Confident	48 Å²	48	76.7 Å²	76.7	34%	0.336	40%	0.396	S	S	.	.	H	α-helix	trans	-55.5	-42.5	176.4	76.2	0	0	0	0	112.9	Q194 Q195 K196 F200 N201 E202	Q194-S198 PolarHBondContact O-N 3.48Å; Q195-S198 WeakPolarHBondContact O-CB 3.4Å; Q195-S198 PolarHBondContact O-N 2.97Å; Q195-S198 PolarHBondContact O-OG 2.89Å; K196-S198 VanDerWaalsContact C-N 3.34Å; S198-F200 VanDerWaalsContact C-N 3.25Å; S198-F200 PolarHBondContact O-N 3.35Å; S198-N201 PolarHBondContact O-N 3.38Å; S198-E202 WeakPolarHBondContact O-CG 3.09Å; S198-E202 PolarHBondContact O-N 3.48Å
199	Y	85.1	Confident	87.1	Confident	87 Å²	87	77.3 Å²	77.3	34%	0.341	39%	0.394	S	S	.	.	H	α-helix	trans	-61.7	-31.4	176.8	-66.8	-77.8	0	0	0	113.1	Q195 L197 C232 Y235 F252	Q195-Y199 WeakPolarHBondContact O-CD2 3.17Å; L197-Y199 VanDerWaalsContact C-N 3.31Å; L197-Y199 PolarHBondContact O-N 3.44Å; Y199-C232 PolarHBondContact O-SG 3.43Å; Y199-Y235 HydrophobicContact CD1-CD1 4.11Å; Y199-Y235 HydrophobicContact CD1-CG 4.15Å; Y199-Y235 AromaticContact CD2-CD1 3.6Å; Y199-Y235 HydrophobicContact CD2-CD1 3.6Å; Y199-Y235 HydrophobicContact CD2-CD2 4.24Å; Y199-Y235 AromaticContact CD2-CE1 3.55Å; Y199-Y235 HydrophobicContact CD2-CE1 3.55Å; Y199-Y235 HydrophobicContact CD2-CE2 4.2Å; Y199-Y235 AromaticContact CD2-CG 3.96Å; Y199-Y235 HydrophobicContact CD2-CG 3.96Å; Y199-Y235 AromaticContact CD2-CZ 3.87Å; Y199-Y235 HydrophobicContact CE1-CG 4.27Å; Y199-Y235 HydrophobicContact CE2-CD1 4.19Å; Y199-Y235 AromaticContact CE2-CD2 4Å; Y199-Y235 HydrophobicContact CE2-CD2 4Å; Y199-Y235 HydrophobicContact CE2-CE1 4.21Å; Y199-Y235 HydrophobicContact CE2-CE2 4.02Å; Y199-Y235 HydrophobicContact CE2-CG 4.09Å; Y199-Y235 AromaticContact CG-CD1 3.55Å; Y199-Y235 HydrophobicContact CG-CD1 3.55Å; Y199-Y235 AromaticContact CG-CE1 3.92Å; Y199-Y235 HydrophobicContact CG-CE1 3.92Å; Y199-Y235 AromaticContact CG-CG 4Å; Y199-Y235 HydrophobicContact CG-CG 4Å; Y199-F252 VanDerWaalsContact O-CZ 3.28Å; Y199-F252 WeakPolarHBondContact O-CZ 3.46Å
200	F	85.1	Confident	86.6	Confident	36 Å²	36	73.3 Å²	73.3	16%	0.158	37%	0.373	C	S	.	.	H	α-helix	trans	-80.1	-38.3	177.7	-65.3	-85.6	0	0	0	111.8	K196 L197 S198 E202 L203 I236 F242 Y248	K196-F200 VanDerWaalsContact O-CD2 3.22Å; K196-F200 WeakPolarHBondContact O-CD2 3.38Å; L197-F200 PolarHBondContact O-N 2.67Å; S198-F200 VanDerWaalsContact C-N 3.25Å; S198-F200 PolarHBondContact O-N 3.35Å; F200-E202 VanDerWaalsContact C-N 3.3Å; F200-E202 PolarHBondContact O-N 2.86Å; F200-L203 VanDerWaalsContact O-CB 3.24Å; F200-L203 WeakPolarHBondContact O-CB 3.04Å; F200-L203 PolarHBondContact O-N 3.12Å; F200-I236 HydrophobicContact CE1-CD1 4.29Å; F200-I236 HydrophobicContact CE1-CG1 4.39Å; F200-I236 HydrophobicContact CZ-CG1 4.48Å; F200-F242 HydrophobicContact CZ-CD2 4.11Å; F200-F242 HydrophobicContact CZ-CE2 4.46Å; F200-Y248 HydrophobicContact CB-CE1 4.28Å; F200-Y248 AromaticContact CD1-CD1 3.66Å; F200-Y248 HydrophobicContact CD1-CD1 3.66Å; F200-Y248 AromaticContact CD1-CD2 3.84Å; F200-Y248 HydrophobicContact CD1-CD2 3.84Å; F200-Y248 AromaticContact CD1-CE1 3.96Å; F200-Y248 HydrophobicContact CD1-CE1 3.96Å; F200-Y248 HydrophobicContact CD1-CE2 4.12Å; F200-Y248 AromaticContact CD1-CG 3.6Å; F200-Y248 HydrophobicContact CD1-CG 3.6Å; F200-Y248 HydrophobicContact CE1-CD1 4.43Å; F200-Y248 AromaticContact CE1-CD2 4Å; F200-Y248 HydrophobicContact CE1-CD2 4Å; F200-Y248 AromaticContact CE1-CG 3.93Å; F200-Y248 HydrophobicContact CE1-CG 3.93Å
201	N	86.1	Confident	86.1	Confident	84 Å²	84	74.9 Å²	74.9	45%	0.449	37%	0.374	S	S	.	.	H	α-helix	trans	-66.3	-31.8	177	-73	-4.6	0	0	0	112.8	L197 S198 L203 E204	L197-N201 WeakPolarHBondContact CD2-ND2 3.37Å; L197-N201 WeakPolarHBondContact CD2-OD1 3.44Å; L197-N201 PolarHBondContact O-N 2.89Å; S198-N201 PolarHBondContact O-N 3.38Å; N201-L203 PolarHBondContact O-N 2.85Å; N201-L203 VanDerWaalsContact O-N 3.14Å; N201-E204 PolarHBondContact O-N 2.87Å
202	E	86.2	Confident	85.6	Confident	53 Å²	53	71.6 Å²	71.6	25%	0.248	36%	0.363	C	S	.	.	H	α-helix	trans	-60.2	-21.9	175.9	-74.6	-74.4	-174.5	0	0	112.4	S198 F200 E204 T205 I206 K228	S198-E202 WeakPolarHBondContact O-CG 3.09Å; S198-E202 PolarHBondContact O-N 3.48Å; F200-E202 VanDerWaalsContact C-N 3.3Å; F200-E202 PolarHBondContact O-N 2.86Å; E202-E204 VanDerWaalsContact C-N 3.35Å; E202-E204 PolarHBondContact O-N 3.34Å; E202-T205 PolarHBondContact O-N 2.87Å; E202-I206 HydrophobicContact CB-CD1 4.37Å; E202-I206 WeakPolarHBondContact O-CB 3.46Å; E202-I206 VanDerWaalsContact O-CG1 3.27Å; E202-I206 WeakPolarHBondContact O-CG1 3.34Å; E202-I206 PolarHBondContact O-N 3.16Å; E202-K228 IonicContact OE1-NZ 2.7Å
203	L	87.2	Confident	84.6	Confident	13 Å²	13	74.4 Å²	74.4	7%	0.068	39%	0.386	C	S	.	.	H	α-helix	trans	-56.4	-46.8	175.2	-176.6	64.5	0	0	0	112.3	F200 N201 I206 N207 Y248 K251 F252	F200-L203 VanDerWaalsContact O-CB 3.24Å; F200-L203 WeakPolarHBondContact O-CB 3.04Å; F200-L203 PolarHBondContact O-N 3.12Å; N201-L203 PolarHBondContact O-N 2.85Å; N201-L203 VanDerWaalsContact O-N 3.14Å; L203-I206 PolarHBondContact O-N 3.24Å; L203-N207 WeakPolarHBondContact O-CB 3.39Å; L203-N207 PolarHBondContact O-N 3.36Å; L203-Y248 HydrophobicContact CD2-CD1 3.71Å; L203-Y248 HydrophobicContact CD2-CE1 3.95Å; L203-K251 HydrophobicContact CD1-CB 4.07Å; L203-K251 HydrophobicContact CD2-CB 3.83Å; L203-K251 HydrophobicContact CD2-CD 3.79Å; L203-K251 HydrophobicContact CD2-CG 4.49Å; L203-F252 HydrophobicContact CB-CE1 3.75Å; L203-F252 HydrophobicContact CB-CE2 4.1Å; L203-F252 HydrophobicContact CB-CZ 3.47Å; L203-F252 VanDerWaalsContact CB-CZ 3.47Å; L203-F252 HydrophobicContact CD1-CD1 3.51Å; L203-F252 HydrophobicContact CD1-CD2 4.15Å; L203-F252 HydrophobicContact CD1-CE1 3.55Å; L203-F252 HydrophobicContact CD1-CE2 4.12Å; L203-F252 HydrophobicContact CD1-CG 3.85Å; L203-F252 HydrophobicContact CD1-CZ 3.86Å; L203-F252 HydrophobicContact CG-CE1 4.23Å; L203-F252 HydrophobicContact CG-CE2 4.47Å; L203-F252 HydrophobicContact CG-CZ 4.16Å
204	E	84.9	Confident	83.6	Confident	148 Å²	148	76 Å²	76	69%	0.692	40%	0.4	S	S	*	.	H	α-helix	trans	-69.1	-39.4	-177.4	-64	-170.7	165.8	0	0	110.8	N201 E202 N207 T208	N201-E204 PolarHBondContact O-N 2.87Å; E202-E204 VanDerWaalsContact C-N 3.35Å; E202-E204 PolarHBondContact O-N 3.34Å; E204-N207 PolarHBondContact O-N 3.48Å; E204-T208 WeakPolarHBondContact O-CB 3.27Å; E204-T208 VanDerWaalsContact O-CG2 3.26Å; E204-T208 WeakPolarHBondContact O-CG2 3.44Å; E204-T208 PolarHBondContact O-N 3.38Å; E204-T208 PolarHBondContact O-OG1 3.43Å
205	T	85.9	Confident	82.9	Confident	58 Å²	58	72.7 Å²	72.7	36%	0.356	39%	0.385	S	S	.	.	H	α-helix	trans	-63.9	-42.7	176.5	-56.4	0	0	0	0	111.7	E202 T208 K209	E202-T205 PolarHBondContact O-N 2.87Å; T205-T208 PolarHBondContact O-OG1 3.3Å; T205-K209 HydrophobicContact CG2-CD 4.45Å; T205-K209 VanDerWaalsContact O-CG 3.29Å; T205-K209 WeakPolarHBondContact O-CG 3.47Å; T205-K209 PolarHBondContact O-N 3.49Å
206	I	86.6	Confident	82.3	Confident	3 Å²	3	70.3 Å²	70.3	2%	0.015	38%	0.382	C	S	.	.	H	α-helix	trans	-71.2	-44.2	178.3	-67.1	164.9	0	0	0	110.5	E202 L203 T208 K209 L210 M225 L229 C255	E202-I206 HydrophobicContact CB-CD1 4.37Å; E202-I206 WeakPolarHBondContact O-CB 3.46Å; E202-I206 VanDerWaalsContact O-CG1 3.27Å; E202-I206 WeakPolarHBondContact O-CG1 3.34Å; E202-I206 PolarHBondContact O-N 3.16Å; L203-I206 PolarHBondContact O-N 3.24Å; I206-T208 PolarHBondContact O-N 3.49Å; I206-K209 PolarHBondContact O-N 2.96Å; I206-L210 HydrophobicContact CG2-CD1 3.71Å; I206-L210 HydrophobicContact CG2-CG 4.23Å; I206-L210 WeakPolarHBondContact O-CB 3.43Å; I206-L210 WeakPolarHBondContact O-CG 3.33Å; I206-L210 PolarHBondContact O-N 2.95Å; I206-M225 HydrophobicContact CG1-CG 4.25Å; I206-M225 HydrophobicContact CG2-CG 4.36Å; I206-M225 HydrophobicContact CG2-SD 4.48Å; I206-L229 HydrophobicContact CD1-CB 4.17Å; I206-L229 HydrophobicContact CD1-CD1 4.21Å; I206-L229 HydrophobicContact CG2-CD1 4.34Å; I206-L229 HydrophobicContact CG2-CD2 4.5Å; I206-C255 HydrophobicContact CG2-CB 4.5Å
207	N	86.6	Confident	82	Confident	57 Å²	57	66.1 Å²	66.1	31%	0.305	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-39.8	-178.9	-171.9	30.3	0	0	0	112	L203 E204 L210 N211	L203-N207 WeakPolarHBondContact O-CB 3.39Å; L203-N207 PolarHBondContact O-N 3.36Å; E204-N207 PolarHBondContact O-N 3.48Å; N207-L210 PolarHBondContact O-N 3.24Å; N207-N211 VanDerWaalsContact O-CG 3.23Å; N207-N211 PolarHBondContact O-N 3.43Å; N207-N211 PolarHBondContact O-ND2 2.99Å; N207-N211 PolarHBondContact OD1-ND2 3.01Å
208	T	85.3	Confident	81.3	Confident	95 Å²	95	66.3 Å²	66.3	58%	0.583	37%	0.366	S	S	*	.	H	α-helix	trans	-63.9	-42.4	175.2	49.2	0	0	0	0	112.2	E204 T205 I206 N211 S212	E204-T208 WeakPolarHBondContact O-CB 3.27Å; E204-T208 VanDerWaalsContact O-CG2 3.26Å; E204-T208 WeakPolarHBondContact O-CG2 3.44Å; E204-T208 PolarHBondContact O-N 3.38Å; E204-T208 PolarHBondContact O-OG1 3.43Å; T205-T208 PolarHBondContact O-OG1 3.3Å; I206-T208 PolarHBondContact O-N 3.49Å; T208-N211 PolarHBondContact O-N 3.01Å; T208-S212 PolarHBondContact O-N 2.88Å
209	K	83.6	Confident	80.9	Confident	102 Å²	102	65.8 Å²	65.8	44%	0.443	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-43.9	175.1	-72.6	173.9	-177.7	176.4	0	112.3	T205 I206 N211 S212 M225	T205-K209 HydrophobicContact CG2-CD 4.45Å; T205-K209 VanDerWaalsContact O-CG 3.29Å; T205-K209 WeakPolarHBondContact O-CG 3.47Å; T205-K209 PolarHBondContact O-N 3.49Å; I206-K209 PolarHBondContact O-N 2.96Å; K209-N211 PolarHBondContact O-N 2.99Å; K209-S212 WeakPolarHBondContact O-CB 3.41Å; K209-S212 PolarHBondContact O-N 3.38Å; K209-S212 PolarHBondContact O-OG 3.39Å; K209-M225 HydrophobicContact CB-SD 3.8Å; K209-M225 HydrophobicContact CD-SD 4.07Å
210	L	82.9	Confident	80.4	Confident	12 Å²	12	69.2 Å²	69.2	6%	0.063	39%	0.387	C	S	.	.	H	α-helix	trans	-68.8	-30.1	-179.7	-73.6	173.8	0	0	0	113.9	I206 N207 S212 L215 F222 M225 C255 A259 L262	I206-L210 HydrophobicContact CG2-CD1 3.71Å; I206-L210 HydrophobicContact CG2-CG 4.23Å; I206-L210 WeakPolarHBondContact O-CB 3.43Å; I206-L210 WeakPolarHBondContact O-CG 3.33Å; I206-L210 PolarHBondContact O-N 2.95Å; N207-L210 PolarHBondContact O-N 3.24Å; L210-S212 VanDerWaalsContact C-N 3.27Å; L210-L215 HydrophobicContact CD2-CD2 4.07Å; L210-F222 HydrophobicContact CD2-CE2 4.34Å; L210-M225 HydrophobicContact CD2-CE 3.59Å; L210-M225 HydrophobicContact CG-CE 4.17Å; L210-M225 HydrophobicContact CG-SD 4.47Å; L210-C255 HydrophobicContact CD1-CB 3.84Å; L210-C255 WeakPolarHBondContact CD1-O 3.29Å; L210-A259 HydrophobicContact CD1-CB 4.36Å; L210-A259 HydrophobicContact CD2-CB 3.78Å; L210-L262 HydrophobicContact CD2-CD1 4.42Å
211	N	81.8	Confident	80.2	Confident	89 Å²	89	69.9 Å²	69.9	48%	0.476	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-0.8	176.8	-61.9	-41.1	0	0	0	112.7	N207 T208 K209 K258	N207-N211 VanDerWaalsContact O-CG 3.23Å; N207-N211 PolarHBondContact O-N 3.43Å; N207-N211 PolarHBondContact O-ND2 2.99Å; N207-N211 PolarHBondContact OD1-ND2 3.01Å; T208-N211 PolarHBondContact O-N 3.01Å; K209-N211 PolarHBondContact O-N 2.99Å; N211-K258 PolarHBondContact OD1-NZ 2.84Å; N211-K258 VanDerWaalsContact OD1-NZ 3.11Å
212	S	81.8	Confident	80.1	Confident	41 Å²	41	65.9 Å²	65.9	29%	0.287	38%	0.382	S	S	.	.			trans	-76	126.3	177.4	72.8	0	0	0	0	111.2	T208 K209 L210 T214 L215	T208-S212 PolarHBondContact O-N 2.88Å; K209-S212 WeakPolarHBondContact O-CB 3.41Å; K209-S212 PolarHBondContact O-N 3.38Å; K209-S212 PolarHBondContact O-OG 3.39Å; L210-S212 VanDerWaalsContact C-N 3.27Å; S212-T214 PolarHBondContact O-N 3.03Å; S212-L215 PolarHBondContact O-N 3.2Å
213	P	67.3	Low	80.2	Confident	137 Å²	137	65.6 Å²	65.6	89%	0.89	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.5	-176.2	28.1	-34.8	0	0	0	113.8
214	T	67.6	Low	80.3	Confident	128 Å²	128	68.3 Å²	68.3	79%	0.785	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	0.8	178.2	41	0	0	0	0	113.8	S212 S216	S212-T214 PolarHBondContact O-N 3.03Å; T214-S216 PolarHBondContact O-N 2.83Å; T214-S216 VanDerWaalsContact O-N 3.16Å
215	L	72.4	Confident	80.5	Confident	45 Å²	45	61.9 Å²	61.9	24%	0.236	37%	0.37	C	S	.	.			trans	-67.9	113.9	-179.5	-173.5	69.8	0	0	0	110.3	L210 S212 F222 M225 L262	L210-L215 HydrophobicContact CD2-CD2 4.07Å; S212-L215 PolarHBondContact O-N 3.2Å; L215-F222 HydrophobicContact CD1-CD2 4.33Å; L215-F222 HydrophobicContact CD2-CD2 3.98Å; L215-F222 HydrophobicContact CD2-CE2 3.94Å; L215-F222 HydrophobicContact CG-CD2 4.3Å; L215-M225 HydrophobicContact CD2-CE 4.46Å; L215-L262 HydrophobicContact CD2-CD1 4.18Å
216	S	74.9	Confident	80.6	Confident	67 Å²	67	59.1 Å²	59.1	47%	0.469	35%	0.354	S	S	.	.			trans	-93.4	133.6	167.5	64.4	0	0	0	0	109.8	T214 N218 S219	T214-S216 PolarHBondContact O-N 2.83Å; T214-S216 VanDerWaalsContact O-N 3.16Å; S216-N218 PolarHBondContact O-N 2.94Å; S216-S219 WeakPolarHBondContact O-CB 3.41Å; S216-S219 PolarHBondContact O-N 2.97Å; S216-S219 VanDerWaalsContact O-N 3.07Å; S216-S219 PolarHBondContact O-OG 3.34Å
217	V	77.1	Confident	80.7	Confident	11 Å²	11	60.7 Å²	60.7	7%	0.067	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.2	179.2	-173.1	0	0	0	0	111.2	S219 F222 L262 M263 Y266 L310	V217-S219 VanDerWaalsContact C-N 3.3Å; V217-S219 PolarHBondContact O-N 2.89Å; V217-F222 HydrophobicContact CG1-CD1 3.87Å; V217-F222 HydrophobicContact CG1-CE1 3.59Å; V217-F222 HydrophobicContact CG1-CZ 4.15Å; V217-F222 WeakPolarHBondContact O-CD1 3.45Å; V217-L262 HydrophobicContact CG2-CB 4.18Å; V217-M263 HydrophobicContact CG1-CB 4.46Å; V217-M263 HydrophobicContact CG1-CG 3.76Å; V217-Y266 HydrophobicContact CB-CG 4.39Å; V217-Y266 HydrophobicContact CG2-CG 4.47Å; V217-L310 HydrophobicContact CB-CD1 4.31Å; V217-L310 HydrophobicContact CG1-CD1 3.56Å; V217-L310 HydrophobicContact CG1-CD2 3.71Å; V217-L310 HydrophobicContact CG1-CG 4.29Å
218	N	72.4	Confident	80.8	Confident	79 Å²	79	63 Å²	63	42%	0.422	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	2.2	175.8	-61.7	-6.3	0	0	0	114.2	S216 Y266	S216-N218 PolarHBondContact O-N 2.94Å; N218-Y266 PolarHBondContact ND2-OH 3.41Å; N218-Y266 WeakPolarHBondContact OD1-CE1 3.29Å; N218-Y266 PolarHBondContact OD1-OH 3.02Å
219	S	78.5	Confident	81	Confident	37 Å²	37	58.6 Å²	58.6	26%	0.259	35%	0.347	S	S	.	.	S	Bend	trans	-69.1	140.3	178.3	59.7	0	0	0	0	111	S216 V217 G221 F222	S216-S219 WeakPolarHBondContact O-CB 3.41Å; S216-S219 PolarHBondContact O-N 2.97Å; S216-S219 VanDerWaalsContact O-N 3.07Å; S216-S219 PolarHBondContact O-OG 3.34Å; V217-S219 VanDerWaalsContact C-N 3.3Å; V217-S219 PolarHBondContact O-N 2.89Å; S219-G221 PolarHBondContact O-N 3.47Å; S219-F222 WeakPolarHBondContact O-CB 3.4Å; S219-F222 PolarHBondContact O-N 3.07Å
220	D	73.6	Confident	81.3	Confident	159 Å²	159	54.5 Å²	54.5	85%	0.85	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.9	-179.7	-62	-38.6	0	0	0	113	P224	D220-P224 WeakPolarHBondContact O-CD 3.36Å
221	G	80.6	Confident	81.6	Confident	50 Å²	50	58.6 Å²	58.6	52%	0.515	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.4	177.3	0	0	0	0	0	115.6	S219 M225	S219-G221 PolarHBondContact O-N 3.47Å; G221-M225 WeakPolarHBondContact O-CB 3.46Å; G221-M225 PolarHBondContact O-N 2.94Å
222	F	85.8	Confident	81.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-74.3	-42.9	-175.7	-173.4	-101.9	0	0	0	112.5	L210 L215 V217 S219 M225 L226 A259 M263	L210-F222 HydrophobicContact CD2-CE2 4.34Å; L215-F222 HydrophobicContact CD1-CD2 4.33Å; L215-F222 HydrophobicContact CD2-CD2 3.98Å; L215-F222 HydrophobicContact CD2-CE2 3.94Å; L215-F222 HydrophobicContact CG-CD2 4.3Å; V217-F222 HydrophobicContact CG1-CD1 3.87Å; V217-F222 HydrophobicContact CG1-CE1 3.59Å; V217-F222 HydrophobicContact CG1-CZ 4.15Å; V217-F222 WeakPolarHBondContact O-CD1 3.45Å; S219-F222 WeakPolarHBondContact O-CB 3.4Å; S219-F222 PolarHBondContact O-N 3.07Å; F222-M225 HydrophobicContact CD2-CE 3.46Å; F222-M225 VanDerWaalsContact CD2-CE 3.46Å; F222-M225 HydrophobicContact CE2-CE 3.6Å; F222-M225 HydrophobicContact CG-CE 4.4Å; F222-M225 WeakPolarHBondContact O-CB 3.25Å; F222-M225 PolarHBondContact O-N 2.92Å; F222-L226 HydrophobicContact CD1-CD1 3.87Å; F222-L226 HydrophobicContact CD1-CG 4.38Å; F222-L226 HydrophobicContact CE1-CD1 3.39Å; F222-L226 HydrophobicContact CE1-CG 4.01Å; F222-L226 HydrophobicContact CZ-CD1 4.03Å; F222-L226 HydrophobicContact CZ-CD2 4.42Å; F222-L226 HydrophobicContact CZ-CG 4.25Å; F222-L226 PolarHBondContact O-N 3.19Å; F222-A259 HydrophobicContact CZ-CB 4.35Å; F222-M263 HydrophobicContact CE1-CE 4.48Å; F222-M263 HydrophobicContact CE1-CG 3.65Å; F222-M263 HydrophobicContact CE1-SD 3.88Å; F222-M263 HydrophobicContact CZ-CG 3.9Å; F222-M263 HydrophobicContact CZ-SD 4.36Å
223	I	87.4	Confident	82.2	Confident	47 Å²	47	53.2 Å²	53.2	24%	0.241	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-46.3	179.5	-59.8	168.8	0	0	0	111.9	M225 L226 A227 T309 Q313 R317	I223-M225 VanDerWaalsContact C-N 3.32Å; I223-M225 PolarHBondContact O-N 3.47Å; I223-L226 PolarHBondContact O-N 3.3Å; I223-A227 PolarHBondContact O-N 3.4Å; I223-T309 HydrophobicContact CD1-CG2 4.05Å; I223-Q313 HydrophobicContact CD1-CG 4.09Å; I223-Q313 HydrophobicContact CG1-CG 4.33Å; I223-Q313 HydrophobicContact CG2-CG 4.05Å; I223-R317 PolarHBondContact O-NH2 2.9Å; I223-R317 VanDerWaalsContact O-NH2 3.16Å
224	P	88.9	Confident	83.3	Confident	70 Å²	70	50.7 Å²	50.7	46%	0.455	30%	0.302	S	S	.	.	H	α-helix	trans	-62.7	-35.6	174	-24	34.6	0	0	0	113.3	D220 A227 K228	D220-P224 WeakPolarHBondContact O-CD 3.36Å; P224-A227 PolarHBondContact O-N 3.06Å; P224-K228 WeakPolarHBondContact O-CG 3.46Å; P224-K228 PolarHBondContact O-N 2.97Å
225	M	88.6	Confident	84.3	Confident	13 Å²	13	46.3 Å²	46.3	6%	0.064	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-41.7	175.1	180	-172.4	70.1	0	0	111.5	I206 K209 L210 L215 G221 F222 I223 K228 L229	I206-M225 HydrophobicContact CG1-CG 4.25Å; I206-M225 HydrophobicContact CG2-CG 4.36Å; I206-M225 HydrophobicContact CG2-SD 4.48Å; K209-M225 HydrophobicContact CB-SD 3.8Å; K209-M225 HydrophobicContact CD-SD 4.07Å; L210-M225 HydrophobicContact CD2-CE 3.59Å; L210-M225 HydrophobicContact CG-CE 4.17Å; L210-M225 HydrophobicContact CG-SD 4.47Å; L215-M225 HydrophobicContact CD2-CE 4.46Å; G221-M225 WeakPolarHBondContact O-CB 3.46Å; G221-M225 PolarHBondContact O-N 2.94Å; F222-M225 HydrophobicContact CD2-CE 3.46Å; F222-M225 VanDerWaalsContact CD2-CE 3.46Å; F222-M225 HydrophobicContact CE2-CE 3.6Å; F222-M225 HydrophobicContact CG-CE 4.4Å; F222-M225 WeakPolarHBondContact O-CB 3.25Å; F222-M225 PolarHBondContact O-N 2.92Å; I223-M225 VanDerWaalsContact C-N 3.32Å; I223-M225 PolarHBondContact O-N 3.47Å; M225-K228 PolarHBondContact O-N 3.2Å; M225-L229 WeakPolarHBondContact O-CB 3.41Å; M225-L229 PolarHBondContact O-N 3.33Å
226	L	87.9	Confident	84.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-42.2	173.7	-76	176.6	0	0	0	112.2	F222 I223 K228 L229 D230 A259 M263	F222-L226 HydrophobicContact CD1-CD1 3.87Å; F222-L226 HydrophobicContact CD1-CG 4.38Å; F222-L226 HydrophobicContact CE1-CD1 3.39Å; F222-L226 HydrophobicContact CE1-CG 4.01Å; F222-L226 HydrophobicContact CZ-CD1 4.03Å; F222-L226 HydrophobicContact CZ-CD2 4.42Å; F222-L226 HydrophobicContact CZ-CG 4.25Å; F222-L226 PolarHBondContact O-N 3.19Å; I223-L226 PolarHBondContact O-N 3.3Å; L226-K228 VanDerWaalsContact C-N 3.35Å; L226-K228 PolarHBondContact O-N 3.46Å; L226-L229 HydrophobicContact CD2-CD2 4.46Å; L226-L229 WeakPolarHBondContact O-CB 3.34Å; L226-L229 PolarHBondContact O-N 3.42Å; L226-L229 VanDerWaalsContact O-N 3.13Å; L226-D230 PolarHBondContact O-N 3.07Å; L226-A259 HydrophobicContact CD2-CB 3.7Å; L226-M263 HydrophobicContact CD1-CE 4.24Å; L226-M263 HydrophobicContact CD1-SD 3.71Å
227	A	89.3	Confident	85.5	Confident	36 Å²	36	43.5 Å²	43.5	30%	0.298	26%	0.256	S	S	.	.	H	α-helix	trans	-59.7	-46.6	177.1	0	0	0	0	0	111.3	I223 P224 L229 D230 D231	I223-A227 PolarHBondContact O-N 3.4Å; P224-A227 PolarHBondContact O-N 3.06Å; A227-L229 VanDerWaalsContact C-N 3.3Å; A227-L229 PolarHBondContact O-N 3.38Å; A227-D230 PolarHBondContact O-N 3.05Å; A227-D231 VanDerWaalsContact O-CG 3.27Å; A227-D231 PolarHBondContact O-N 3.17Å
228	K	88.8	Confident	86	Confident	106 Å²	106	46.6 Å²	46.6	46%	0.461	28%	0.278	S	S	.	.	H	α-helix	trans	-59.9	-39.3	174.1	-72.8	-174.7	171.2	-158.5	0	112.7	E202 P224 M225 L226 D231 C232	E202-K228 IonicContact OE1-NZ 2.7Å; P224-K228 WeakPolarHBondContact O-CG 3.46Å; P224-K228 PolarHBondContact O-N 2.97Å; M225-K228 PolarHBondContact O-N 3.2Å; L226-K228 VanDerWaalsContact C-N 3.35Å; L226-K228 PolarHBondContact O-N 3.46Å; K228-D231 PolarHBondContact O-N 2.8Å; K228-C232 WeakPolarHBondContact O-CB 3.36Å; K228-C232 PolarHBondContact O-N 3.45Å; K228-C232 PolarHBondContact O-SG 2.95Å
229	L	89.6	Confident	86.6	Confident	2 Å²	2	46 Å²	46	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-44.2	176.8	-179.8	59	0	0	0	111.6	I206 M225 L226 A227 C232 I233 F252 C255 L256	I206-L229 HydrophobicContact CD1-CB 4.17Å; I206-L229 HydrophobicContact CD1-CD1 4.21Å; I206-L229 HydrophobicContact CG2-CD1 4.34Å; I206-L229 HydrophobicContact CG2-CD2 4.5Å; M225-L229 WeakPolarHBondContact O-CB 3.41Å; M225-L229 PolarHBondContact O-N 3.33Å; L226-L229 HydrophobicContact CD2-CD2 4.46Å; L226-L229 WeakPolarHBondContact O-CB 3.34Å; L226-L229 PolarHBondContact O-N 3.42Å; L226-L229 VanDerWaalsContact O-N 3.13Å; A227-L229 VanDerWaalsContact C-N 3.3Å; A227-L229 PolarHBondContact O-N 3.38Å; L229-C232 PolarHBondContact O-N 3.07Å; L229-I233 HydrophobicContact CD1-CD1 4.23Å; L229-I233 HydrophobicContact CG-CD1 4.14Å; L229-I233 VanDerWaalsContact O-CG1 3.28Å; L229-I233 WeakPolarHBondContact O-CG1 3.21Å; L229-I233 PolarHBondContact O-N 3.49Å; L229-F252 HydrophobicContact CD1-CB 4.43Å; L229-F252 HydrophobicContact CD1-CD1 3.56Å; L229-F252 HydrophobicContact CD1-CE1 4.32Å; L229-F252 HydrophobicContact CD1-CG 4.47Å; L229-C255 HydrophobicContact CD1-CB 4.28Å; L229-C255 HydrophobicContact CD2-CB 4.47Å; L229-L256 HydrophobicContact CD2-CB 4.02Å; L229-L256 HydrophobicContact CD2-CD1 4.11Å
230	D	89.4	Confident	86.8	Confident	15 Å²	15	48 Å²	48	8%	0.08	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-41.3	176.8	-60.9	-28.1	0	0	0	111.2	L226 A227 I233 T234 R317 I321 Y324	L226-D230 PolarHBondContact O-N 3.07Å; A227-D230 PolarHBondContact O-N 3.05Å; D230-I233 PolarHBondContact O-N 3.42Å; D230-T234 WeakPolarHBondContact O-CB 3.35Å; D230-T234 PolarHBondContact O-N 2.98Å; D230-T234 PolarHBondContact O-OG1 3.01Å; D230-R317 WeakPolarHBondContact OD2-CD 3.24Å; D230-R317 IonicContact OD2-CZ 2.72Å; D230-R317 IonicContact OD2-NE 3.08Å; D230-R317 PolarHBondContact OD2-NE 3.48Å; D230-I321 HydrophobicContact CB-CD1 4.19Å; D230-Y324 WeakPolarHBondContact OD1-CE2 3.48Å; D230-Y324 PolarHBondContact OD1-OH 3.42Å; D230-Y324 PolarHBondContact OD2-OH 2.69Å
231	D	89.1	Confident	87.2	Confident	98 Å²	98	48 Å²	48	52%	0.524	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-45.3	175.4	-69.1	-23.6	0	0	0	111.2	A227 K228 I233 T234 Y235	A227-D231 VanDerWaalsContact O-CG 3.27Å; A227-D231 PolarHBondContact O-N 3.17Å; K228-D231 PolarHBondContact O-N 2.8Å; D231-I233 PolarHBondContact O-N 3.3Å; D231-T234 PolarHBondContact O-N 2.99Å; D231-Y235 VanDerWaalsContact O-CB 3.27Å; D231-Y235 WeakPolarHBondContact O-CB 3.1Å; D231-Y235 PolarHBondContact O-N 3.37Å
232	C	88.8	Confident	87.3	Confident	4 Å²	4	49 Å²	49	3%	0.027	28%	0.275	C	S	.	.	H	α-helix	trans	-59	-44.9	174	-76.8	0	0	0	0	111.7	Y199 K228 L229 I236 F252	Y199-C232 PolarHBondContact O-SG 3.43Å; K228-C232 WeakPolarHBondContact O-CB 3.36Å; K228-C232 PolarHBondContact O-N 3.45Å; K228-C232 PolarHBondContact O-SG 2.95Å; L229-C232 PolarHBondContact O-N 3.07Å; C232-I236 VanDerWaalsContact O-CB 3.25Å; C232-I236 WeakPolarHBondContact O-CB 3.27Å; C232-I236 WeakPolarHBondContact O-CD1 3.14Å; C232-I236 WeakPolarHBondContact O-CG1 3.4Å; C232-I236 PolarHBondContact O-N 2.8Å; C232-F252 HydrophobicContact CB-CD1 4.23Å; C232-F252 HydrophobicContact CB-CE1 3.83Å; C232-F252 HydrophobicContact CB-CZ 4.06Å
233	I	88.6	Confident	87.1	Confident	13 Å²	13	58.2 Å²	58.2	7%	0.067	32%	0.315	C	S	.	.	H	α-helix	trans	-63.7	-43.6	178.2	-71	167.4	0	0	0	110.7	L229 D230 D231 S237 L249 F252 L256	L229-I233 HydrophobicContact CD1-CD1 4.23Å; L229-I233 HydrophobicContact CG-CD1 4.14Å; L229-I233 VanDerWaalsContact O-CG1 3.28Å; L229-I233 WeakPolarHBondContact O-CG1 3.21Å; L229-I233 PolarHBondContact O-N 3.49Å; D230-I233 PolarHBondContact O-N 3.42Å; D231-I233 PolarHBondContact O-N 3.3Å; I233-S237 VanDerWaalsContact O-CB 3.23Å; I233-S237 WeakPolarHBondContact O-CB 3.48Å; I233-S237 PolarHBondContact O-N 2.86Å; I233-S237 PolarHBondContact O-OG 3.43Å; I233-L249 HydrophobicContact CG2-CD1 4.41Å; I233-F252 HydrophobicContact CD1-CB 4.35Å; I233-F252 HydrophobicContact CG1-CB 3.73Å; I233-F252 HydrophobicContact CG1-CG 4.47Å; I233-L256 HydrophobicContact CD1-CB 4.03Å; I233-L256 HydrophobicContact CD1-CD2 3.83Å; I233-L256 HydrophobicContact CD1-CG 4.42Å
234	T	89.4	Confident	86.9	Confident	85 Å²	85	60.2 Å²	60.2	52%	0.521	33%	0.326	S	S	.	.	H	α-helix	trans	-65.1	-47.4	179.1	-55.6	0	0	0	0	111.1	D230 D231 I236 S237 S238	D230-T234 WeakPolarHBondContact O-CB 3.35Å; D230-T234 PolarHBondContact O-N 2.98Å; D230-T234 PolarHBondContact O-OG1 3.01Å; D231-T234 PolarHBondContact O-N 2.99Å; T234-I236 PolarHBondContact O-N 2.86Å; T234-S237 PolarHBondContact O-N 3.23Å; T234-S238 PolarHBondContact O-N 2.94Å; T234-S238 PolarHBondContact O-OG 2.96Å
235	Y	88.5	Confident	86.7	Confident	35 Å²	35	59 Å²	59	14%	0.137	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-49	177.9	174.8	-99.6	0	0	0	111.6	K196 Y199 D231 S237 S238 H239	K196-Y235 WeakPolarHBondContact CG-OH 3.34Å; Y199-Y235 HydrophobicContact CD1-CD1 4.11Å; Y199-Y235 HydrophobicContact CD1-CG 4.15Å; Y199-Y235 AromaticContact CD2-CD1 3.6Å; Y199-Y235 HydrophobicContact CD2-CD1 3.6Å; Y199-Y235 HydrophobicContact CD2-CD2 4.24Å; Y199-Y235 AromaticContact CD2-CE1 3.55Å; Y199-Y235 HydrophobicContact CD2-CE1 3.55Å; Y199-Y235 HydrophobicContact CD2-CE2 4.2Å; Y199-Y235 AromaticContact CD2-CG 3.96Å; Y199-Y235 HydrophobicContact CD2-CG 3.96Å; Y199-Y235 AromaticContact CD2-CZ 3.87Å; Y199-Y235 HydrophobicContact CE1-CG 4.27Å; Y199-Y235 HydrophobicContact CE2-CD1 4.19Å; Y199-Y235 AromaticContact CE2-CD2 4Å; Y199-Y235 HydrophobicContact CE2-CD2 4Å; Y199-Y235 HydrophobicContact CE2-CE1 4.21Å; Y199-Y235 HydrophobicContact CE2-CE2 4.02Å; Y199-Y235 HydrophobicContact CE2-CG 4.09Å; Y199-Y235 AromaticContact CG-CD1 3.55Å; Y199-Y235 HydrophobicContact CG-CD1 3.55Å; Y199-Y235 AromaticContact CG-CE1 3.92Å; Y199-Y235 HydrophobicContact CG-CE1 3.92Å; Y199-Y235 AromaticContact CG-CG 4Å; Y199-Y235 HydrophobicContact CG-CG 4Å; D231-Y235 VanDerWaalsContact O-CB 3.27Å; D231-Y235 WeakPolarHBondContact O-CB 3.1Å; D231-Y235 PolarHBondContact O-N 3.37Å; Y235-S237 PolarHBondContact O-N 2.92Å; Y235-S238 PolarHBondContact O-N 3.31Å; Y235-S238 PolarHBondContact O-OG 3.22Å; Y235-H239 AromaticContact CD2-CE1 3.83Å; Y235-H239 AromaticContact CD2-ND1 3.96Å; Y235-H239 AromaticContact CE2-CE1 3.42Å; Y235-H239 VanDerWaalsContact CE2-CE1 3.42Å; Y235-H239 WeakPolarHBondContact CE2-CE1 3.48Å; Y235-H239 AromaticContact CE2-ND1 3.75Å; Y235-H239 AromaticContact CZ-CE1 3.98Å; Y235-H239 PolarHBondContact O-N 3.04Å; Y235-H239 PolarHBondContact O-ND1 3.35Å
236	I	86.6	Confident	86.6	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.2	-48.1	178.6	-72.3	171.4	0	0	0	108.8	F200 C232 T234 S238 H239 Y245 L249 F252	F200-I236 HydrophobicContact CE1-CD1 4.29Å; F200-I236 HydrophobicContact CE1-CG1 4.39Å; F200-I236 HydrophobicContact CZ-CG1 4.48Å; C232-I236 VanDerWaalsContact O-CB 3.25Å; C232-I236 WeakPolarHBondContact O-CB 3.27Å; C232-I236 WeakPolarHBondContact O-CD1 3.14Å; C232-I236 WeakPolarHBondContact O-CG1 3.4Å; C232-I236 PolarHBondContact O-N 2.8Å; T234-I236 PolarHBondContact O-N 2.86Å; I236-S238 VanDerWaalsContact C-N 3.25Å; I236-S238 PolarHBondContact O-N 3.49Å; I236-H239 CarbonylContact O-C 3.5Å; I236-H239 PolarHBondContact O-N 3.43Å; I236-Y245 HydrophobicContact CB-CD2 4.42Å; I236-Y245 HydrophobicContact CB-CE2 4.34Å; I236-Y245 HydrophobicContact CG2-CD2 3.35Å; I236-Y245 HydrophobicContact CG2-CE2 3.4Å; I236-Y245 VanDerWaalsContact O-CD2 3.25Å; I236-Y245 WeakPolarHBondContact O-CD2 3.44Å; I236-Y245 WeakPolarHBondContact O-CE2 3.35Å; I236-L249 HydrophobicContact CG2-CB 4.01Å; I236-L249 HydrophobicContact CG2-CD1 4.06Å; I236-F252 HydrophobicContact CD1-CD2 3.29Å; I236-F252 HydrophobicContact CD1-CE2 3.06Å; I236-F252 HydrophobicContact CD1-CG 4.4Å; I236-F252 HydrophobicContact CD1-CZ 4Å
237	S	85.9	Confident	86.6	Confident	53 Å²	53	65.5 Å²	65.5	37%	0.371	35%	0.354	S	S	.	.	H	α-helix	trans	-59.6	-31.8	-179.4	-58.5	0	0	0	0	114.1	I233 T234 Y235 H239 Y245	I233-S237 VanDerWaalsContact O-CB 3.23Å; I233-S237 WeakPolarHBondContact O-CB 3.48Å; I233-S237 PolarHBondContact O-N 2.86Å; I233-S237 PolarHBondContact O-OG 3.43Å; T234-S237 PolarHBondContact O-N 3.23Å; Y235-S237 PolarHBondContact O-N 2.92Å; S237-H239 VanDerWaalsContact C-N 3.28Å; S237-H239 PolarHBondContact O-N 2.9Å; S237-Y245 WeakPolarHBondContact CA-OH 3.26Å
238	S	87.8	Confident	86.5	Confident	76 Å²	76	67.2 Å²	67.2	53%	0.531	35%	0.354	S	S	.	.	H	α-helix	trans	-74.9	-13.2	175.6	66.5	0	0	0	0	114.3	T234 Y235 I236 P240	T234-S238 PolarHBondContact O-N 2.94Å; T234-S238 PolarHBondContact O-OG 2.96Å; Y235-S238 PolarHBondContact O-N 3.31Å; Y235-S238 PolarHBondContact O-OG 3.22Å; I236-S238 VanDerWaalsContact C-N 3.25Å; I236-S238 PolarHBondContact O-N 3.49Å; S238-P240 VanDerWaalsContact C-CD 3.42Å; S238-P240 VanDerWaalsContact O-CD 3.3Å; S238-P240 WeakPolarHBondContact O-CD 3.34Å
239	H	86	Confident	86.5	Confident	68 Å²	68	63.4 Å²	63.4	32%	0.315	34%	0.338	S	S	.	.			trans	-121.5	69.2	-178.3	-62.3	84.7	0	0	0	112.9	Y235 I236 S237 N241 F242	Y235-H239 AromaticContact CD2-CE1 3.83Å; Y235-H239 AromaticContact CD2-ND1 3.96Å; Y235-H239 AromaticContact CE2-CE1 3.42Å; Y235-H239 VanDerWaalsContact CE2-CE1 3.42Å; Y235-H239 WeakPolarHBondContact CE2-CE1 3.48Å; Y235-H239 AromaticContact CE2-ND1 3.75Å; Y235-H239 AromaticContact CZ-CE1 3.98Å; Y235-H239 PolarHBondContact O-N 3.04Å; Y235-H239 PolarHBondContact O-ND1 3.35Å; I236-H239 CarbonylContact O-C 3.5Å; I236-H239 PolarHBondContact O-N 3.43Å; S237-H239 VanDerWaalsContact C-N 3.28Å; S237-H239 PolarHBondContact O-N 2.9Å; H239-N241 PolarHBondContact O-N 2.89Å; H239-N241 VanDerWaalsContact O-N 3.16Å; H239-F242 HydrophobicContact CB-CD2 3.55Å; H239-F242 HydrophobicContact CB-CE2 3.26Å; H239-F242 HydrophobicContact CB-CZ 4.12Å; H239-F242 AromaticContact CG-CE2 3.72Å; H239-F242 WeakPolarHBondContact O-CD2 3.11Å
240	P	82.6	Confident	86.4	Confident	78 Å²	78	68.2 Å²	68.2	51%	0.506	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-10.8	179.4	29	-35.7	0	0	0	114.1	S238 F242 Y245	S238-P240 VanDerWaalsContact C-CD 3.42Å; S238-P240 VanDerWaalsContact O-CD 3.3Å; S238-P240 WeakPolarHBondContact O-CD 3.34Å; P240-F242 VanDerWaalsContact C-N 3.28Å; P240-F242 PolarHBondContact O-N 3.42Å; P240-Y245 HydrophobicContact CB-CD1 4.49Å; P240-Y245 HydrophobicContact CB-CE1 4.25Å
241	N	81	Confident	86.4	Confident	160 Å²	160	72 Å²	72	86%	0.856	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-7.7	-176.6	-62.9	-14.5	0	0	0	113.7	H239	H239-N241 PolarHBondContact O-N 2.89Å; H239-N241 VanDerWaalsContact O-N 3.16Å
242	F	83.8	Confident	86.4	Confident	70 Å²	70	67.4 Å²	67.4	31%	0.307	36%	0.355	S	S	.	.	S	Bend	trans	-77.6	140.8	178	-63.5	-50.7	0	0	0	112.1	F200 H239 P240 D244 Y245	F200-F242 HydrophobicContact CZ-CD2 4.11Å; F200-F242 HydrophobicContact CZ-CE2 4.46Å; H239-F242 HydrophobicContact CB-CD2 3.55Å; H239-F242 HydrophobicContact CB-CE2 3.26Å; H239-F242 HydrophobicContact CB-CZ 4.12Å; H239-F242 AromaticContact CG-CE2 3.72Å; H239-F242 WeakPolarHBondContact O-CD2 3.11Å; P240-F242 VanDerWaalsContact C-N 3.28Å; P240-F242 PolarHBondContact O-N 3.42Å; F242-D244 PolarHBondContact O-N 3.38Å; F242-Y245 WeakPolarHBondContact O-CB 3.49Å; F242-Y245 PolarHBondContact O-N 3.2Å
243	K	81.1	Confident	86.4	Confident	194 Å²	194	71 Å²	71	84%	0.843	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-46.9	-174.7	-174.5	-179.8	176.2	-175.8	0	113.8
244	D	83.6	Confident	86.5	Confident	89 Å²	89	75.3 Å²	75.3	48%	0.476	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	9.7	-176.7	-61.3	-35.9	0	0	0	113.1	F242 P246 V247 Y248	F242-D244 PolarHBondContact O-N 3.38Å; D244-P246 VanDerWaalsContact C-CD 3.43Å; D244-V247 PolarHBondContact O-N 3.5Å; D244-V247 VanDerWaalsContact O-N 3.11Å; D244-Y248 HydrophobicContact CB-CD2 3.88Å; D244-Y248 HydrophobicContact CB-CE2 3.89Å; D244-Y248 WeakPolarHBondContact O-CD2 3.37Å; D244-Y248 PolarHBondContact O-N 2.91Å; D244-Y248 VanDerWaalsContact O-N 3.14Å
245	Y	85.3	Confident	86.5	Confident	43 Å²	43	71.5 Å²	71.5	17%	0.169	37%	0.366	C	S	.	.	H	α-helix	trans	-42.4	-53.5	176.4	164.3	-105.9	0	0	0	114.1	I236 S237 P240 F242 V247 Y248 L249	I236-Y245 HydrophobicContact CB-CD2 4.42Å; I236-Y245 HydrophobicContact CB-CE2 4.34Å; I236-Y245 HydrophobicContact CG2-CD2 3.35Å; I236-Y245 HydrophobicContact CG2-CE2 3.4Å; I236-Y245 VanDerWaalsContact O-CD2 3.25Å; I236-Y245 WeakPolarHBondContact O-CD2 3.44Å; I236-Y245 WeakPolarHBondContact O-CE2 3.35Å; S237-Y245 WeakPolarHBondContact CA-OH 3.26Å; P240-Y245 HydrophobicContact CB-CD1 4.49Å; P240-Y245 HydrophobicContact CB-CE1 4.25Å; F242-Y245 WeakPolarHBondContact O-CB 3.49Å; F242-Y245 PolarHBondContact O-N 3.2Å; Y245-V247 VanDerWaalsContact C-N 3.27Å; Y245-V247 PolarHBondContact O-N 3.49Å; Y245-Y248 PolarHBondContact O-N 3.43Å; Y245-L249 HydrophobicContact CE1-CD2 4.32Å; Y245-L249 HydrophobicContact CE2-CB 4.28Å; Y245-L249 HydrophobicContact CE2-CD1 4.47Å; Y245-L249 HydrophobicContact CE2-CD2 4.24Å; Y245-L249 WeakPolarHBondContact O-CB 3.38Å; Y245-L249 PolarHBondContact O-N 3.38Å; Y245-L249 WeakPolarHBondContact OH-CD2 3.31Å
246	P	85.5	Confident	86.6	Confident	77 Å²	77	69.9 Å²	69.9	50%	0.5	36%	0.36	S	S	.	.	H	α-helix	trans	-66.3	-30.4	-173.7	25.9	-34.5	0	0	0	112.6	D244 L250	D244-P246 VanDerWaalsContact C-CD 3.43Å; P246-L250 WeakPolarHBondContact O-CB 3.32Å; P246-L250 PolarHBondContact O-N 3.49Å; P246-L250 VanDerWaalsContact O-N 3.09Å
247	V	88.8	Confident	86.8	Confident	73 Å²	73	73.1 Å²	73.1	44%	0.442	38%	0.383	S	S	.	.	H	α-helix	trans	-72.4	-46	178.7	179.9	0	0	0	0	110.5	D244 Y245 L250 K251	D244-V247 PolarHBondContact O-N 3.5Å; D244-V247 VanDerWaalsContact O-N 3.11Å; Y245-V247 VanDerWaalsContact C-N 3.27Å; Y245-V247 PolarHBondContact O-N 3.49Å; V247-L250 PolarHBondContact O-N 3.18Å; V247-K251 WeakPolarHBondContact O-CG 3.31Å; V247-K251 PolarHBondContact O-N 3.34Å; V247-K251 VanDerWaalsContact O-N 3.08Å
248	Y	86.9	Confident	86.9	Confident	72 Å²	72	75 Å²	75	28%	0.282	38%	0.384	S	S	.	.	H	α-helix	trans	-66.2	-44	177.4	-81.1	-83.8	0	0	0	111.5	F200 L203 D244 Y245 L250 K251 F252	F200-Y248 HydrophobicContact CB-CE1 4.28Å; F200-Y248 AromaticContact CD1-CD1 3.66Å; F200-Y248 HydrophobicContact CD1-CD1 3.66Å; F200-Y248 AromaticContact CD1-CD2 3.84Å; F200-Y248 HydrophobicContact CD1-CD2 3.84Å; F200-Y248 AromaticContact CD1-CE1 3.96Å; F200-Y248 HydrophobicContact CD1-CE1 3.96Å; F200-Y248 HydrophobicContact CD1-CE2 4.12Å; F200-Y248 AromaticContact CD1-CG 3.6Å; F200-Y248 HydrophobicContact CD1-CG 3.6Å; F200-Y248 HydrophobicContact CE1-CD1 4.43Å; F200-Y248 AromaticContact CE1-CD2 4Å; F200-Y248 HydrophobicContact CE1-CD2 4Å; F200-Y248 AromaticContact CE1-CG 3.93Å; F200-Y248 HydrophobicContact CE1-CG 3.93Å; L203-Y248 HydrophobicContact CD2-CD1 3.71Å; L203-Y248 HydrophobicContact CD2-CE1 3.95Å; D244-Y248 HydrophobicContact CB-CD2 3.88Å; D244-Y248 HydrophobicContact CB-CE2 3.89Å; D244-Y248 WeakPolarHBondContact O-CD2 3.37Å; D244-Y248 PolarHBondContact O-N 2.91Å; D244-Y248 VanDerWaalsContact O-N 3.14Å; Y245-Y248 PolarHBondContact O-N 3.43Å; Y248-L250 VanDerWaalsContact C-N 3.3Å; Y248-L250 PolarHBondContact O-N 3.11Å; Y248-K251 PolarHBondContact O-N 3.21Å; Y248-K251 VanDerWaalsContact O-N 3.13Å; Y248-F252 HydrophobicContact CD1-CE2 4.31Å; Y248-F252 WeakPolarHBondContact O-CD2 3.41Å; Y248-F252 PolarHBondContact O-N 3.43Å
249	L	87.9	Confident	87	Confident	26 Å²	26	71.4 Å²	71.4	14%	0.136	36%	0.359	C	S	.	.	H	α-helix	trans	-56.7	-45.4	175.8	-175.4	72.1	0	0	0	111.4	I233 I236 Y245 K251 F252 K253	I233-L249 HydrophobicContact CG2-CD1 4.41Å; I236-L249 HydrophobicContact CG2-CB 4.01Å; I236-L249 HydrophobicContact CG2-CD1 4.06Å; Y245-L249 HydrophobicContact CE1-CD2 4.32Å; Y245-L249 HydrophobicContact CE2-CB 4.28Å; Y245-L249 HydrophobicContact CE2-CD1 4.47Å; Y245-L249 HydrophobicContact CE2-CD2 4.24Å; Y245-L249 WeakPolarHBondContact O-CB 3.38Å; Y245-L249 PolarHBondContact O-N 3.38Å; Y245-L249 WeakPolarHBondContact OH-CD2 3.31Å; L249-K251 PolarHBondContact O-N 3.34Å; L249-F252 PolarHBondContact O-N 3.42Å; L249-K253 WeakPolarHBondContact O-CB 3.28Å; L249-K253 WeakPolarHBondContact O-CG 3.32Å; L249-K253 PolarHBondContact O-N 2.93Å
250	L	87.9	Confident	87.2	Confident	104 Å²	104	68.8 Å²	68.8	55%	0.545	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-44.3	177.3	-171.6	74.3	0	0	0	111.5	P246 V247 Y248 K253 Q254	P246-L250 WeakPolarHBondContact O-CB 3.32Å; P246-L250 PolarHBondContact O-N 3.49Å; P246-L250 VanDerWaalsContact O-N 3.09Å; V247-L250 PolarHBondContact O-N 3.18Å; Y248-L250 VanDerWaalsContact C-N 3.3Å; Y248-L250 PolarHBondContact O-N 3.11Å; L250-K253 PolarHBondContact O-N 2.97Å; L250-Q254 VanDerWaalsContact O-CG 3.31Å; L250-Q254 WeakPolarHBondContact O-CG 3.32Å; L250-Q254 PolarHBondContact O-N 3.2Å
251	K	89.3	Confident	87.5	Confident	95 Å²	95	70.5 Å²	70.5	41%	0.413	35%	0.348	S	S	.	.	H	α-helix	trans	-65.3	-40.3	177.8	-70.6	179	-177.5	178.9	0	112.5	L203 V247 Y248 L249 Q254 C255	L203-K251 HydrophobicContact CD1-CB 4.07Å; L203-K251 HydrophobicContact CD2-CB 3.83Å; L203-K251 HydrophobicContact CD2-CD 3.79Å; L203-K251 HydrophobicContact CD2-CG 4.49Å; V247-K251 WeakPolarHBondContact O-CG 3.31Å; V247-K251 PolarHBondContact O-N 3.34Å; V247-K251 VanDerWaalsContact O-N 3.08Å; Y248-K251 PolarHBondContact O-N 3.21Å; Y248-K251 VanDerWaalsContact O-N 3.13Å; L249-K251 PolarHBondContact O-N 3.34Å; K251-Q254 WeakPolarHBondContact O-CB 3.24Å; K251-Q254 PolarHBondContact O-N 3.39Å; K251-C255 PolarHBondContact O-N 2.97Å; K251-C255 PolarHBondContact O-SG 3.24Å
252	F	89.6	Confident	87.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-65.2	-42.3	174.3	-80	-66.1	0	0	0	111.7	Y199 L203 L229 C232 I233 I236 Y248 L249 Q254 C255 L256	Y199-F252 VanDerWaalsContact O-CZ 3.28Å; Y199-F252 WeakPolarHBondContact O-CZ 3.46Å; L203-F252 HydrophobicContact CB-CE1 3.75Å; L203-F252 HydrophobicContact CB-CE2 4.1Å; L203-F252 HydrophobicContact CB-CZ 3.47Å; L203-F252 VanDerWaalsContact CB-CZ 3.47Å; L203-F252 HydrophobicContact CD1-CD1 3.51Å; L203-F252 HydrophobicContact CD1-CD2 4.15Å; L203-F252 HydrophobicContact CD1-CE1 3.55Å; L203-F252 HydrophobicContact CD1-CE2 4.12Å; L203-F252 HydrophobicContact CD1-CG 3.85Å; L203-F252 HydrophobicContact CD1-CZ 3.86Å; L203-F252 HydrophobicContact CG-CE1 4.23Å; L203-F252 HydrophobicContact CG-CE2 4.47Å; L203-F252 HydrophobicContact CG-CZ 4.16Å; L229-F252 HydrophobicContact CD1-CB 4.43Å; L229-F252 HydrophobicContact CD1-CD1 3.56Å; L229-F252 HydrophobicContact CD1-CE1 4.32Å; L229-F252 HydrophobicContact CD1-CG 4.47Å; C232-F252 HydrophobicContact CB-CD1 4.23Å; C232-F252 HydrophobicContact CB-CE1 3.83Å; C232-F252 HydrophobicContact CB-CZ 4.06Å; I233-F252 HydrophobicContact CD1-CB 4.35Å; I233-F252 HydrophobicContact CG1-CB 3.73Å; I233-F252 HydrophobicContact CG1-CG 4.47Å; I236-F252 HydrophobicContact CD1-CD2 3.29Å; I236-F252 HydrophobicContact CD1-CE2 3.06Å; I236-F252 HydrophobicContact CD1-CG 4.4Å; I236-F252 HydrophobicContact CD1-CZ 4Å; Y248-F252 HydrophobicContact CD1-CE2 4.31Å; Y248-F252 WeakPolarHBondContact O-CD2 3.41Å; Y248-F252 PolarHBondContact O-N 3.43Å; L249-F252 PolarHBondContact O-N 3.42Å; F252-Q254 VanDerWaalsContact C-N 3.32Å; F252-Q254 PolarHBondContact O-N 2.88Å; F252-C255 WeakPolarHBondContact O-CB 3.35Å; F252-C255 PolarHBondContact O-N 3Å; F252-L256 WeakPolarHBondContact O-CB 3.29Å; F252-L256 PolarHBondContact O-N 3.01Å
253	K	89.3	Confident	88.1	Confident	79 Å²	79	62.6 Å²	62.6	34%	0.343	31%	0.309	S	S	.	.	H	α-helix	trans	-61.2	-38.7	172.8	-75.2	-168.2	172.5	-134.2	0	112.5	L249 L250 L256 S257 E323	L249-K253 WeakPolarHBondContact O-CB 3.28Å; L249-K253 WeakPolarHBondContact O-CG 3.32Å; L249-K253 PolarHBondContact O-N 2.93Å; L250-K253 PolarHBondContact O-N 2.97Å; K253-L256 WeakPolarHBondContact O-CB 3.37Å; K253-L256 PolarHBondContact O-N 3.03Å; K253-S257 PolarHBondContact O-N 2.91Å; K253-S257 PolarHBondContact O-OG 2.78Å; K253-S257 VanDerWaalsContact O-OG 3.11Å; K253-E323 IonicContact NZ-OE1 3.28Å; K253-E323 PolarHBondContact NZ-OE1 3.41Å; K253-E323 VanDerWaalsContact NZ-OE1 3.09Å
254	Q	90.3	Very high	88.6	Confident	104 Å²	104	56.7 Å²	56.7	49%	0.486	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-42.5	173.2	-74.2	173.5	-1.7	0	0	112.2	L250 K251 F252 L256 S257 K258	L250-Q254 VanDerWaalsContact O-CG 3.31Å; L250-Q254 WeakPolarHBondContact O-CG 3.32Å; L250-Q254 PolarHBondContact O-N 3.2Å; K251-Q254 WeakPolarHBondContact O-CB 3.24Å; K251-Q254 PolarHBondContact O-N 3.39Å; F252-Q254 VanDerWaalsContact C-N 3.32Å; F252-Q254 PolarHBondContact O-N 2.88Å; Q254-L256 VanDerWaalsContact C-N 3.3Å; Q254-L256 PolarHBondContact O-N 3.38Å; Q254-S257 PolarHBondContact O-N 3.47Å; Q254-K258 WeakPolarHBondContact O-CG 3.25Å; Q254-K258 PolarHBondContact O-N 2.89Å
255	C	89.5	Confident	88.9	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.034	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-41.3	174	-66	0	0	0	0	111.1	I206 L210 L229 K251 F252 K258 A259	I206-C255 HydrophobicContact CG2-CB 4.5Å; L210-C255 HydrophobicContact CD1-CB 3.84Å; L210-C255 WeakPolarHBondContact CD1-O 3.29Å; L229-C255 HydrophobicContact CD1-CB 4.28Å; L229-C255 HydrophobicContact CD2-CB 4.47Å; K251-C255 PolarHBondContact O-N 2.97Å; K251-C255 PolarHBondContact O-SG 3.24Å; F252-C255 WeakPolarHBondContact O-CB 3.35Å; F252-C255 PolarHBondContact O-N 3Å; C255-K258 PolarHBondContact O-N 3.45Å; C255-A259 WeakPolarHBondContact O-CB 3.43Å; C255-A259 PolarHBondContact O-N 3.15Å
256	L	90.3	Very high	89.1	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-51.9	175	179.7	64.5	0	0	0	111	L229 I233 F252 K253 Q254 K258 A259 L260 I321 E323 Y324	L229-L256 HydrophobicContact CD2-CB 4.02Å; L229-L256 HydrophobicContact CD2-CD1 4.11Å; I233-L256 HydrophobicContact CD1-CB 4.03Å; I233-L256 HydrophobicContact CD1-CD2 3.83Å; I233-L256 HydrophobicContact CD1-CG 4.42Å; F252-L256 WeakPolarHBondContact O-CB 3.29Å; F252-L256 PolarHBondContact O-N 3.01Å; K253-L256 WeakPolarHBondContact O-CB 3.37Å; K253-L256 PolarHBondContact O-N 3.03Å; Q254-L256 VanDerWaalsContact C-N 3.3Å; Q254-L256 PolarHBondContact O-N 3.38Å; L256-K258 VanDerWaalsContact C-N 3.27Å; L256-K258 PolarHBondContact O-N 3.35Å; L256-A259 PolarHBondContact O-N 3.26Å; L256-L260 HydrophobicContact CD1-CD1 4.23Å; L256-L260 HydrophobicContact CD1-CD2 4.29Å; L256-L260 HydrophobicContact CD1-CG 4.05Å; L256-L260 HydrophobicContact CG-CD1 3.93Å; L256-L260 HydrophobicContact CG-CG 4.17Å; L256-L260 WeakPolarHBondContact O-CB 3.3Å; L256-L260 VanDerWaalsContact O-CG 3.25Å; L256-L260 WeakPolarHBondContact O-CG 3.27Å; L256-L260 PolarHBondContact O-N 2.93Å; L256-I321 HydrophobicContact CD2-CG2 4.11Å; L256-E323 HydrophobicContact CD2-CB 4.44Å; L256-Y324 HydrophobicContact CD1-CE2 3.72Å; L256-Y324 WeakPolarHBondContact CD1-OH 3.41Å; L256-Y324 HydrophobicContact CD2-CE2 4.32Å
257	S	90.3	Very high	89.3	Confident	67 Å²	67	51.9 Å²	51.9	47%	0.469	25%	0.254	S	S	.	.	H	α-helix	trans	-55.3	-40.2	176.5	-63.1	0	0	0	0	112.9	K253 Q254 H261	K253-S257 PolarHBondContact O-N 2.91Å; K253-S257 PolarHBondContact O-OG 2.78Å; K253-S257 VanDerWaalsContact O-OG 3.11Å; Q254-S257 PolarHBondContact O-N 3.47Å; S257-H261 VanDerWaalsContact O-CB 3.29Å; S257-H261 WeakPolarHBondContact O-CB 3.22Å; S257-H261 PolarHBondContact O-N 3.49Å
258	K	89.2	Confident	89.4	Confident	93 Å²	93	49.4 Å²	49.4	40%	0.404	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-47.3	174	-74.1	177	177	-173	0	111.9	N211 Q254 C255 L256 H261 L262	N211-K258 PolarHBondContact OD1-NZ 2.84Å; N211-K258 VanDerWaalsContact OD1-NZ 3.11Å; Q254-K258 WeakPolarHBondContact O-CG 3.25Å; Q254-K258 PolarHBondContact O-N 2.89Å; C255-K258 PolarHBondContact O-N 3.45Å; L256-K258 VanDerWaalsContact C-N 3.27Å; L256-K258 PolarHBondContact O-N 3.35Å; K258-H261 PolarHBondContact O-N 3.48Å; K258-L262 WeakPolarHBondContact O-CG 3.2Å; K258-L262 PolarHBondContact O-N 3.31Å
259	A	89.3	Confident	89.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-44.6	179.2	0	0	0	0	0	111.6	L210 F222 L226 C255 L256 H261 L262 M263	L210-A259 HydrophobicContact CD1-CB 4.36Å; L210-A259 HydrophobicContact CD2-CB 3.78Å; F222-A259 HydrophobicContact CZ-CB 4.35Å; L226-A259 HydrophobicContact CD2-CB 3.7Å; C255-A259 WeakPolarHBondContact O-CB 3.43Å; C255-A259 PolarHBondContact O-N 3.15Å; L256-A259 PolarHBondContact O-N 3.26Å; A259-H261 VanDerWaalsContact C-N 3.32Å; A259-H261 PolarHBondContact O-N 2.86Å; A259-L262 PolarHBondContact O-N 3.37Å; A259-M263 WeakPolarHBondContact O-CG 3.26Å; A259-M263 PolarHBondContact O-N 2.83Å
260	L	90.1	Very high	89.6	Confident	13 Å²	13	50 Å²	50	7%	0.068	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-40.7	174.1	-65.3	179.1	0	0	0	111.7	L256 M263 K264 E323 Y324 L327	L256-L260 HydrophobicContact CD1-CD1 4.23Å; L256-L260 HydrophobicContact CD1-CD2 4.29Å; L256-L260 HydrophobicContact CD1-CG 4.05Å; L256-L260 HydrophobicContact CG-CD1 3.93Å; L256-L260 HydrophobicContact CG-CG 4.17Å; L256-L260 WeakPolarHBondContact O-CB 3.3Å; L256-L260 VanDerWaalsContact O-CG 3.25Å; L256-L260 WeakPolarHBondContact O-CG 3.27Å; L256-L260 PolarHBondContact O-N 2.93Å; L260-M263 PolarHBondContact O-N 3.36Å; L260-K264 WeakPolarHBondContact O-CB 3.43Å; L260-K264 PolarHBondContact O-N 2.78Å; L260-E323 HydrophobicContact CD1-CB 3.74Å; L260-Y324 HydrophobicContact CD2-CD1 3.42Å; L260-Y324 VanDerWaalsContact CD2-CD1 3.42Å; L260-Y324 HydrophobicContact CD2-CD2 4.43Å; L260-Y324 HydrophobicContact CD2-CE1 3.3Å; L260-Y324 HydrophobicContact CD2-CE2 4.38Å; L260-Y324 HydrophobicContact CD2-CG 4.03Å; L260-L327 HydrophobicContact CB-CD2 4.14Å; L260-L327 HydrophobicContact CD2-CD2 3.63Å; L260-L327 HydrophobicContact CG-CD2 4.44Å
261	H	89.7	Confident	89.7	Confident	115 Å²	115	45.2 Å²	45.2	53%	0.532	22%	0.223	S	C	.	.	H	α-helix	trans	-64.4	-39.7	176.2	-179.3	71.8	0	0	0	112.4	S257 K258 A259 K264 T265	S257-H261 VanDerWaalsContact O-CB 3.29Å; S257-H261 WeakPolarHBondContact O-CB 3.22Å; S257-H261 PolarHBondContact O-N 3.49Å; K258-H261 PolarHBondContact O-N 3.48Å; A259-H261 VanDerWaalsContact C-N 3.32Å; A259-H261 PolarHBondContact O-N 2.86Å; H261-K264 PolarHBondContact O-N 3.33Å; H261-T265 PolarHBondContact CE1-OG1 3.35Å; H261-T265 PolarHBondContact NE2-OG1 3.17Å; H261-T265 VanDerWaalsContact O-CB 3.3Å; H261-T265 WeakPolarHBondContact O-CB 3.37Å; H261-T265 PolarHBondContact O-N 2.84Å; H261-T265 PolarHBondContact O-OG1 3.49Å
262	L	88.2	Confident	89.7	Confident	63 Å²	63	44 Å²	44	33%	0.33	22%	0.219	S	C	.	.	H	α-helix	trans	-62.8	-43.4	174.2	-69.3	173	0	0	0	111.3	L210 L215 V217 K258 A259 T265 Y266	L210-L262 HydrophobicContact CD2-CD1 4.42Å; L215-L262 HydrophobicContact CD2-CD1 4.18Å; V217-L262 HydrophobicContact CG2-CB 4.18Å; K258-L262 WeakPolarHBondContact O-CG 3.2Å; K258-L262 PolarHBondContact O-N 3.31Å; A259-L262 PolarHBondContact O-N 3.37Å; L262-T265 PolarHBondContact O-N 3.29Å; L262-Y266 WeakPolarHBondContact O-CB 3.42Å; L262-Y266 PolarHBondContact O-N 3.26Å
263	M	89	Confident	89.7	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-62.3	-45.1	175.2	-66.4	177.7	83.3	0	0	112.1	V217 F222 L226 A259 L260 T267 L310 I314 L327	V217-M263 HydrophobicContact CG1-CB 4.46Å; V217-M263 HydrophobicContact CG1-CG 3.76Å; F222-M263 HydrophobicContact CE1-CE 4.48Å; F222-M263 HydrophobicContact CE1-CG 3.65Å; F222-M263 HydrophobicContact CE1-SD 3.88Å; F222-M263 HydrophobicContact CZ-CG 3.9Å; F222-M263 HydrophobicContact CZ-SD 4.36Å; L226-M263 HydrophobicContact CD1-CE 4.24Å; L226-M263 HydrophobicContact CD1-SD 3.71Å; A259-M263 WeakPolarHBondContact O-CG 3.26Å; A259-M263 PolarHBondContact O-N 2.83Å; L260-M263 PolarHBondContact O-N 3.36Å; M263-T267 WeakPolarHBondContact O-CB 3.42Å; M263-T267 PolarHBondContact O-N 2.95Å; M263-T267 PolarHBondContact O-OG1 3.42Å; M263-L310 HydrophobicContact CE-CB 4.24Å; M263-L310 HydrophobicContact CE-CD2 4.23Å; M263-I314 HydrophobicContact CE-CD1 3.72Å; M263-I314 HydrophobicContact CE-CG1 3.57Å; M263-L327 HydrophobicContact CB-CD2 4.31Å
264	K	90.6	Very high	89.6	Confident	69 Å²	69	44.8 Å²	44.8	30%	0.3	23%	0.229	S	C	.	.	H	α-helix	trans	-57.1	-56.2	175.5	-171.9	173.3	174.7	170.7	0	110.4	L260 H261 Y266 T267 V268 L327 D330	L260-K264 WeakPolarHBondContact O-CB 3.43Å; L260-K264 PolarHBondContact O-N 2.78Å; H261-K264 PolarHBondContact O-N 3.33Å; K264-Y266 VanDerWaalsContact C-N 3.32Å; K264-Y266 PolarHBondContact O-N 2.73Å; K264-T267 PolarHBondContact O-N 3.32Å; K264-V268 HydrophobicContact CG-CG2 4.04Å; K264-V268 VanDerWaalsContact O-CB 3.26Å; K264-V268 WeakPolarHBondContact O-CB 3.11Å; K264-V268 VanDerWaalsContact O-CG2 3.23Å; K264-V268 WeakPolarHBondContact O-CG2 3.34Å; K264-V268 PolarHBondContact O-N 2.83Å; K264-L327 HydrophobicContact CB-CD1 3.49Å; K264-L327 VanDerWaalsContact CB-CD1 3.49Å; K264-L327 HydrophobicContact CD-CD1 4.16Å; K264-L327 HydrophobicContact CG-CD1 3.88Å; K264-D330 HydrophobicContact CD-CB 4.5Å; K264-D330 IonicContact NZ-OD2 2.87Å; K264-D330 PolarHBondContact NZ-OD2 3.45Å
265	T	90.5	Very high	89.4	Confident	49 Å²	49	39.8 Å²	39.8	30%	0.301	21%	0.206	S	C	.	.	H	α-helix	trans	-60.7	-42.3	-176.3	-63.7	0	0	0	0	111.2	H261 L262 N269	H261-T265 PolarHBondContact CE1-OG1 3.35Å; H261-T265 PolarHBondContact NE2-OG1 3.17Å; H261-T265 VanDerWaalsContact O-CB 3.3Å; H261-T265 WeakPolarHBondContact O-CB 3.37Å; H261-T265 PolarHBondContact O-N 2.84Å; H261-T265 PolarHBondContact O-OG1 3.49Å; L262-T265 PolarHBondContact O-N 3.29Å; T265-N269 VanDerWaalsContact CG2-ND2 3.27Å; T265-N269 WeakPolarHBondContact CG2-ND2 3.42Å; T265-N269 WeakPolarHBondContact O-CB 3.29Å; T265-N269 PolarHBondContact O-N 2.89Å; T265-N269 PolarHBondContact O-ND2 3.15Å; T265-N269 VanDerWaalsContact O-ND2 3.17Å
266	Y	89.5	Confident	89.3	Confident	60 Å²	60	43.1 Å²	43.1	24%	0.235	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-48.3	176	175.3	-99.5	0	0	0	112.4	V217 N218 L262 K264 T270 L310	V217-Y266 HydrophobicContact CB-CG 4.39Å; V217-Y266 HydrophobicContact CG2-CG 4.47Å; N218-Y266 PolarHBondContact ND2-OH 3.41Å; N218-Y266 WeakPolarHBondContact OD1-CE1 3.29Å; N218-Y266 PolarHBondContact OD1-OH 3.02Å; L262-Y266 WeakPolarHBondContact O-CB 3.42Å; L262-Y266 PolarHBondContact O-N 3.26Å; K264-Y266 VanDerWaalsContact C-N 3.32Å; K264-Y266 PolarHBondContact O-N 2.73Å; Y266-T270 WeakPolarHBondContact O-CB 3.32Å; Y266-T270 PolarHBondContact O-N 3.29Å; Y266-T270 PolarHBondContact O-OG1 3.49Å; Y266-L310 HydrophobicContact CD1-CD1 3.62Å; Y266-L310 HydrophobicContact CE1-CD1 3.71Å
267	T	88.6	Confident	88.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-50.4	-178.4	-57.4	0	0	0	0	111.5	M263 K264 T270 L271 V307 I331	M263-T267 WeakPolarHBondContact O-CB 3.42Å; M263-T267 PolarHBondContact O-N 2.95Å; M263-T267 PolarHBondContact O-OG1 3.42Å; K264-T267 PolarHBondContact O-N 3.32Å; T267-T270 PolarHBondContact O-N 3.5Å; T267-L271 HydrophobicContact CG2-CD1 4.28Å; T267-L271 WeakPolarHBondContact O-CG 3.23Å; T267-L271 PolarHBondContact O-N 2.91Å; T267-V307 HydrophobicContact CG2-CG1 3.47Å; T267-V307 VanDerWaalsContact CG2-CG1 3.47Å; T267-I331 HydrophobicContact CG2-CD1 4.37Å; T267-I331 HydrophobicContact CG2-CG1 4.24Å; T267-I331 HydrophobicContact CG2-CG2 3.81Å
268	V	90.6	Very high	88.5	Confident	21 Å²	21	46.1 Å²	46.1	13%	0.127	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-46.8	178.7	170.1	0	0	0	0	111	K264 T270 L271 Q272 C334	K264-V268 HydrophobicContact CG-CG2 4.04Å; K264-V268 VanDerWaalsContact O-CB 3.26Å; K264-V268 WeakPolarHBondContact O-CB 3.11Å; K264-V268 VanDerWaalsContact O-CG2 3.23Å; K264-V268 WeakPolarHBondContact O-CG2 3.34Å; K264-V268 PolarHBondContact O-N 2.83Å; V268-T270 VanDerWaalsContact C-N 3.29Å; V268-T270 PolarHBondContact O-N 3.41Å; V268-L271 PolarHBondContact O-N 3.33Å; V268-Q272 HydrophobicContact CG1-CG 4.14Å; V268-Q272 WeakPolarHBondContact O-CB 3.45Å; V268-Q272 WeakPolarHBondContact O-CG 3.43Å; V268-Q272 PolarHBondContact O-N 3.49Å; V268-C334 HydrophobicContact CG2-CB 4.1Å
269	N	90.4	Very high	88	Confident	80 Å²	80	45.7 Å²	45.7	43%	0.428	23%	0.233	S	C	.	.	H	α-helix	trans	-63.4	-37.1	178.3	-72.8	-16.8	0	0	0	111.7	T265 T273	T265-N269 VanDerWaalsContact CG2-ND2 3.27Å; T265-N269 WeakPolarHBondContact CG2-ND2 3.42Å; T265-N269 WeakPolarHBondContact O-CB 3.29Å; T265-N269 PolarHBondContact O-N 2.89Å; T265-N269 PolarHBondContact O-ND2 3.15Å; T265-N269 VanDerWaalsContact O-ND2 3.17Å; N269-T273 WeakPolarHBondContact O-CB 3.28Å; N269-T273 PolarHBondContact O-N 2.93Å; N269-T273 PolarHBondContact O-OG1 3.33Å
270	T	89.3	Confident	87.1	Confident	30 Å²	30	54 Å²	54	18%	0.184	27%	0.269	C	S	.	.	H	α-helix	trans	-62.4	-50.5	176.5	-59.4	0	0	0	0	110.3	Y266 T267 V268 T273 L274 V307	Y266-T270 WeakPolarHBondContact O-CB 3.32Å; Y266-T270 PolarHBondContact O-N 3.29Å; Y266-T270 PolarHBondContact O-OG1 3.49Å; T267-T270 PolarHBondContact O-N 3.5Å; V268-T270 VanDerWaalsContact C-N 3.29Å; V268-T270 PolarHBondContact O-N 3.41Å; T270-T273 PolarHBondContact O-N 2.92Å; T270-L274 HydrophobicContact CG2-CD1 4.23Å; T270-L274 WeakPolarHBondContact O-CD1 3.2Å; T270-L274 VanDerWaalsContact O-CG 3.22Å; T270-L274 WeakPolarHBondContact O-CG 3.46Å; T270-L274 PolarHBondContact O-N 2.83Å; T270-L274 VanDerWaalsContact O-N 3.12Å; T270-V307 HydrophobicContact CG2-CG2 4.02Å
271	L	89.6	Confident	85.7	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-48.7	179	-65.8	174.1	0	0	0	112.1	T267 V268 T273 L274 T275 F300 Y335 Q338 F387	T267-L271 HydrophobicContact CG2-CD1 4.28Å; T267-L271 WeakPolarHBondContact O-CG 3.23Å; T267-L271 PolarHBondContact O-N 2.91Å; V268-L271 PolarHBondContact O-N 3.33Å; L271-T273 VanDerWaalsContact C-N 3.35Å; L271-T273 PolarHBondContact O-N 3.19Å; L271-L274 WeakPolarHBondContact O-CB 3.43Å; L271-L274 PolarHBondContact O-N 3.49Å; L271-T275 PolarHBondContact O-N 2.97Å; L271-T275 PolarHBondContact O-OG1 3.46Å; L271-F300 HydrophobicContact CD2-CE1 4.19Å; L271-Y335 HydrophobicContact CD1-CD2 4.34Å; L271-Y335 HydrophobicContact CD2-CD2 4.21Å; L271-Q338 HydrophobicContact CB-CG 4.3Å; L271-F387 HydrophobicContact CD2-CE1 4.02Å; L271-F387 HydrophobicContact CD2-CZ 4.46Å
272	Q	90.5	Very high	83.6	Confident	70 Å²	70	60.9 Å²	60.9	33%	0.327	30%	0.298	S	S	.	.	H	α-helix	trans	-64.6	-37.1	179.2	-71.9	179.5	-9.5	0	0	112.6	V268 L274 T275 N276 Q338	V268-Q272 HydrophobicContact CG1-CG 4.14Å; V268-Q272 WeakPolarHBondContact O-CB 3.45Å; V268-Q272 WeakPolarHBondContact O-CG 3.43Å; V268-Q272 PolarHBondContact O-N 3.49Å; Q272-L274 VanDerWaalsContact C-N 3.34Å; Q272-T275 PolarHBondContact O-N 3.32Å; Q272-N276 VanDerWaalsContact O-CB 3.31Å; Q272-N276 WeakPolarHBondContact O-CB 3.23Å; Q272-N276 VanDerWaalsContact O-CG 3.28Å; Q272-N276 PolarHBondContact O-N 3.03Å; Q272-N276 PolarHBondContact O-ND2 3.12Å; Q272-Q338 HydrophobicContact CG-CG 4.3Å
273	T	89.3	Confident	81.9	Confident	71 Å²	71	64 Å²	64	44%	0.436	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-40.6	176.9	-61	0	0	0	0	110.7	N269 T270 L271 N276 Q277	N269-T273 WeakPolarHBondContact O-CB 3.28Å; N269-T273 PolarHBondContact O-N 2.93Å; N269-T273 PolarHBondContact O-OG1 3.33Å; T270-T273 PolarHBondContact O-N 2.92Å; L271-T273 VanDerWaalsContact C-N 3.35Å; L271-T273 PolarHBondContact O-N 3.19Å; T273-N276 PolarHBondContact O-N 3.45Å; T273-Q277 HydrophobicContact CG2-CG 4.43Å; T273-Q277 WeakPolarHBondContact O-CB 3.21Å; T273-Q277 WeakPolarHBondContact O-CG 3.39Å; T273-Q277 PolarHBondContact O-N 3.46Å
274	L	86.7	Confident	79.8	Confident	24 Å²	24	69 Å²	69	13%	0.126	36%	0.356	C	S	.	.	H	α-helix	trans	-62.6	-47.1	175.9	-68.8	164.7	0	0	0	111.5	T270 L271 Q272 Q277 L278 F300 A303	T270-L274 HydrophobicContact CG2-CD1 4.23Å; T270-L274 WeakPolarHBondContact O-CD1 3.2Å; T270-L274 VanDerWaalsContact O-CG 3.22Å; T270-L274 WeakPolarHBondContact O-CG 3.46Å; T270-L274 PolarHBondContact O-N 2.83Å; T270-L274 VanDerWaalsContact O-N 3.12Å; L271-L274 WeakPolarHBondContact O-CB 3.43Å; L271-L274 PolarHBondContact O-N 3.49Å; Q272-L274 VanDerWaalsContact C-N 3.34Å; L274-Q277 PolarHBondContact O-N 3.23Å; L274-L278 WeakPolarHBondContact O-CG 3.38Å; L274-L278 PolarHBondContact O-N 2.77Å; L274-L278 VanDerWaalsContact O-N 3.12Å; L274-F300 HydrophobicContact CB-CE2 4.43Å; L274-F300 HydrophobicContact CB-CZ 4.38Å; L274-A303 HydrophobicContact CD1-CB 3.35Å; L274-A303 HydrophobicContact CD2-CB 4.23Å; L274-A303 HydrophobicContact CG-CB 4.41Å
275	T	86.9	Confident	77.9	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-48.3	176.3	-59.9	0	0	0	0	111.7	L271 Q272 Q277 L278 L279 Q338 L341 L342	L271-T275 PolarHBondContact O-N 2.97Å; L271-T275 PolarHBondContact O-OG1 3.46Å; Q272-T275 PolarHBondContact O-N 3.32Å; T275-Q277 VanDerWaalsContact C-N 3.32Å; T275-Q277 PolarHBondContact O-N 3.32Å; T275-L278 PolarHBondContact O-N 3.37Å; T275-L278 VanDerWaalsContact O-N 3.07Å; T275-L279 HydrophobicContact CG2-CD1 3.68Å; T275-L279 HydrophobicContact CG2-CG 4.29Å; T275-L279 WeakPolarHBondContact O-CG 3.48Å; T275-L279 PolarHBondContact O-N 3.18Å; T275-Q338 VanDerWaalsContact CB-OE1 3.24Å; T275-Q338 VanDerWaalsContact CG2-OE1 3.32Å; T275-Q338 WeakPolarHBondContact OG1-CB 3.48Å; T275-Q338 PolarHBondContact OG1-OE1 3.47Å; T275-L341 HydrophobicContact CG2-CD2 4.05Å; T275-L342 HydrophobicContact CG2-CD1 4.08Å; T275-L342 HydrophobicContact CG2-CD2 3.92Å; T275-L342 HydrophobicContact CG2-CG 3.81Å
276	N	86.1	Confident	75.8	Confident	75 Å²	75	72.1 Å²	72.1	40%	0.401	38%	0.383	S	S	.	.	H	α-helix	trans	-63.4	-35.4	178.6	-77	-45.5	0	0	0	113.1	Q272 T273 L278 K280	Q272-N276 VanDerWaalsContact O-CB 3.31Å; Q272-N276 WeakPolarHBondContact O-CB 3.23Å; Q272-N276 VanDerWaalsContact O-CG 3.28Å; Q272-N276 PolarHBondContact O-N 3.03Å; Q272-N276 PolarHBondContact O-ND2 3.12Å; T273-N276 PolarHBondContact O-N 3.45Å; N276-L278 VanDerWaalsContact C-N 3.27Å; N276-L278 PolarHBondContact O-N 2.93Å; N276-K280 WeakPolarHBondContact O-CB 3.09Å; N276-K280 VanDerWaalsContact O-CG 3.25Å; N276-K280 WeakPolarHBondContact O-CG 3.31Å; N276-K280 PolarHBondContact O-N 2.91Å; N276-K280 VanDerWaalsContact O-N 3.07Å
277	Q	83.2	Confident	73.9	Confident	113 Å²	113	72.2 Å²	72.2	53%	0.528	39%	0.391	S	S	.	.	H	α-helix	trans	-68.4	-27.1	174.8	-76.1	175.2	6	0	0	112.9	T273 L274 T275	T273-Q277 HydrophobicContact CG2-CG 4.43Å; T273-Q277 WeakPolarHBondContact O-CB 3.21Å; T273-Q277 WeakPolarHBondContact O-CG 3.39Å; T273-Q277 PolarHBondContact O-N 3.46Å; L274-Q277 PolarHBondContact O-N 3.23Å; T275-Q277 VanDerWaalsContact C-N 3.32Å; T275-Q277 PolarHBondContact O-N 3.32Å
278	L	81.2	Confident	72.4	Confident	19 Å²	19	77.7 Å²	77.7	10%	0.099	42%	0.42	C	S	.	.	H	α-helix	trans	-83.9	-37.6	176.8	-74.1	168.4	0	0	0	112.1	L274 T275 N276 F296 K299 F300 L342	L274-L278 WeakPolarHBondContact O-CG 3.38Å; L274-L278 PolarHBondContact O-N 2.77Å; L274-L278 VanDerWaalsContact O-N 3.12Å; T275-L278 PolarHBondContact O-N 3.37Å; T275-L278 VanDerWaalsContact O-N 3.07Å; N276-L278 VanDerWaalsContact C-N 3.27Å; N276-L278 PolarHBondContact O-N 2.93Å; L278-F296 HydrophobicContact CB-CD1 4.42Å; L278-F296 HydrophobicContact CB-CE1 4.35Å; L278-F296 HydrophobicContact CD1-CD1 4.01Å; L278-F296 HydrophobicContact CD2-CD1 3.95Å; L278-F296 HydrophobicContact CD2-CE1 4.29Å; L278-F296 HydrophobicContact CG-CD1 4.36Å; L278-K299 HydrophobicContact CD2-CD 3.73Å; L278-K299 HydrophobicContact CG-CD 4.32Å; L278-F300 HydrophobicContact CD1-CD2 4.11Å; L278-F300 HydrophobicContact CD1-CE2 3.72Å; L278-L342 HydrophobicContact CB-CD2 4.08Å; L278-L342 HydrophobicContact CD1-CD1 4.33Å
279	L	79.6	Confident	70.8	Confident	84 Å²	84	78 Å²	78	44%	0.44	43%	0.425	S	S	.	.	H	α-helix	trans	-73.2	-34.7	178.4	-72.3	170.4	0	0	0	113.8	T275 R281 L341 L342	T275-L279 HydrophobicContact CG2-CD1 3.68Å; T275-L279 HydrophobicContact CG2-CG 4.29Å; T275-L279 WeakPolarHBondContact O-CG 3.48Å; T275-L279 PolarHBondContact O-N 3.18Å; L279-R281 PolarHBondContact O-N 2.9Å; L279-R281 VanDerWaalsContact O-N 3.15Å; L279-L341 HydrophobicContact CD1-CD2 3.75Å; L279-L341 HydrophobicContact CD1-CG 4.08Å; L279-L342 HydrophobicContact CD2-CD2 4.02Å; L279-L342 HydrophobicContact CG-CD2 3.9Å
280	K	69.8	Low	69.3	Low	174 Å²	174	79.4 Å²	79.4	76%	0.757	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	6	-177.5	-74.3	179.9	-179.3	-177.3	0	114.8	N276	N276-K280 WeakPolarHBondContact O-CB 3.09Å; N276-K280 VanDerWaalsContact O-CG 3.25Å; N276-K280 WeakPolarHBondContact O-CG 3.31Å; N276-K280 PolarHBondContact O-N 2.91Å; N276-K280 VanDerWaalsContact O-N 3.07Å
281	R	60.9	Low	68.3	Low	155 Å²	155	82.5 Å²	82.5	59%	0.585	45%	0.448	S	S	*	.	S	Bend	trans	-81.5	133.1	-178.4	-175.2	168.7	157.8	137.7	-6.2	110.7	L279 S285	L279-R281 PolarHBondContact O-N 2.9Å; L279-R281 VanDerWaalsContact O-N 3.15Å; R281-S285 PolarHBondContact NH2-OG 2.71Å
282	D	45.5	Very low	67.5	Low	117 Å²	117	83.3 Å²	83.3	63%	0.626	46%	0.455	S	S	*	.			trans	-54.8	141.9	-171.9	-83.3	-50.2	0	0	0	114.9	S284	D282-S284 PolarHBondContact O-N 3.4Å; D282-S284 VanDerWaalsContact O-N 3.12Å
283	P	52.4	Low	67	Low	130 Å²	130	80.8 Å²	80.8	84%	0.844	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	3.1	172.7	27.7	-32.7	0	0	0	114.7
284	S	45.2	Very low	66.6	Low	104 Å²	104	81.4 Å²	81.4	73%	0.727	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-13.5	-176.2	60.2	0	0	0	0	114.6	D282	D282-S284 PolarHBondContact O-N 3.4Å; D282-S284 VanDerWaalsContact O-N 3.12Å
285	S	49.5	Very low	66.4	Low	50 Å²	50	83.5 Å²	83.5	35%	0.35	46%	0.458	S	S	.	.	S	Bend	trans	-96.2	99.9	165.2	76.4	0	0	0	0	107.5	R281 P287	R281-S285 PolarHBondContact NH2-OG 2.71Å; S285-P287 WeakPolarHBondContact O-CD 3.44Å; S285-P287 WeakPolarHBondContact O-CG 3.49Å
286	V	46.3	Very low	66.4	Low	135 Å²	135	84.7 Å²	84.7	82%	0.818	46%	0.463	S	S	*	.			trans	-63.8	104.5	169	-176.3	0	0	0	0	106.6
287	P	49.6	Very low	66.5	Low	62 Å²	62	82.1 Å²	82.1	40%	0.403	45%	0.448	S	S	.	.			trans	-81.2	140.5	170.1	6.6	16.7	0	0	0	105.5	S285 A289 N291 A292	S285-P287 WeakPolarHBondContact O-CD 3.44Å; S285-P287 WeakPolarHBondContact O-CG 3.49Å; P287-A289 PolarHBondContact O-N 3.37Å; P287-N291 HydrophobicContact CB-CB 4.4Å; P287-A292 HydrophobicContact CB-CB 4.49Å
288	N	56.9	Low	66.7	Low	114 Å²	114	80.8 Å²	80.8	61%	0.61	45%	0.448	S	S	*	.			trans	-51.8	135.1	152.2	-75.6	1.5	0	0	0	107.1	D290 N291	N288-D290 PolarHBondContact O-N 2.9Å; N288-N291 WeakPolarHBondContact O-CB 3.5Å; N288-N291 PolarHBondContact O-N 3.44Å
289	A	57.6	Low	67	Low	27 Å²	27	83.5 Å²	83.5	22%	0.223	46%	0.459	C	S	.	.	H	α-helix	trans	-47.9	-37.9	-178.2	0	0	0	0	0	112	P287 N291 A292 F293 T350	P287-A289 PolarHBondContact O-N 3.37Å; A289-N291 VanDerWaalsContact C-N 3.31Å; A289-N291 PolarHBondContact O-N 3.3Å; A289-A292 WeakPolarHBondContact O-CB 3.33Å; A289-A292 PolarHBondContact O-N 3.43Å; A289-F293 VanDerWaalsContact O-CD2 3.26Å; A289-F293 WeakPolarHBondContact O-CD2 2.95Å; A289-F293 PolarHBondContact O-N 3.44Å; A289-F293 VanDerWaalsContact O-N 3.12Å; A289-T350 HydrophobicContact CB-CG2 4.39Å
290	D	59.1	Low	67.4	Low	110 Å²	110	79.5 Å²	79.5	59%	0.588	44%	0.438	S	S	*	.	H	α-helix	trans	-56.9	-37.1	176.3	-60	-22.5	0	0	0	114.2	N288 A292 T294	N288-D290 PolarHBondContact O-N 2.9Å; D290-A292 VanDerWaalsContact C-N 3.33Å; D290-T294 WeakPolarHBondContact O-CB 3.33Å; D290-T294 PolarHBondContact O-N 3.02Å; D290-T294 VanDerWaalsContact O-N 3.1Å; D290-T294 PolarHBondContact O-OG1 3.27Å
291	N	68.1	Low	68.4	Low	95 Å²	95	76.7 Å²	76.7	51%	0.508	42%	0.422	S	S	.	.	H	α-helix	trans	-72.5	-30.1	178	-73.6	-17.4	0	0	0	111.4	P287 N288 A289 L295	P287-N291 HydrophobicContact CB-CB 4.4Å; N288-N291 WeakPolarHBondContact O-CB 3.5Å; N288-N291 PolarHBondContact O-N 3.44Å; A289-N291 VanDerWaalsContact C-N 3.31Å; A289-N291 PolarHBondContact O-N 3.3Å; N291-L295 WeakPolarHBondContact O-CB 3.32Å; N291-L295 VanDerWaalsContact O-CD1 3.31Å; N291-L295 WeakPolarHBondContact O-CD1 3.29Å; N291-L295 WeakPolarHBondContact O-CG 3.27Å; N291-L295 PolarHBondContact O-N 3.02Å
292	A	73	Confident	69.7	Low	20 Å²	20	72.5 Å²	72.5	17%	0.165	42%	0.421	C	S	.	.	H	α-helix	trans	-71.7	-47.5	176.8	0	0	0	0	0	111.2	P287 A289 D290 T294 L295 F296	P287-A292 HydrophobicContact CB-CB 4.49Å; A289-A292 WeakPolarHBondContact O-CB 3.33Å; A289-A292 PolarHBondContact O-N 3.43Å; D290-A292 VanDerWaalsContact C-N 3.33Å; A292-T294 PolarHBondContact O-N 3.19Å; A292-L295 PolarHBondContact O-N 3.43Å; A292-F296 HydrophobicContact CB-CE2 4.3Å; A292-F296 HydrophobicContact CB-CZ 4.17Å; A292-F296 WeakPolarHBondContact O-CD1 3.23Å; A292-F296 WeakPolarHBondContact O-CD2 3.46Å; A292-F296 WeakPolarHBondContact O-CG 3.49Å; A292-F296 PolarHBondContact O-N 2.86Å
293	F	79.1	Confident	71.7	Confident	17 Å²	17	67.2 Å²	67.2	8%	0.075	39%	0.394	C	S	.	.	H	α-helix	trans	-59.6	-48.4	176.1	-76.1	-74.4	0	0	0	111.7	A289 L295 F296 Y297 L343 I347 F372	A289-F293 VanDerWaalsContact O-CD2 3.26Å; A289-F293 WeakPolarHBondContact O-CD2 2.95Å; A289-F293 PolarHBondContact O-N 3.44Å; A289-F293 VanDerWaalsContact O-N 3.12Å; F293-L295 VanDerWaalsContact C-N 3.25Å; F293-L295 PolarHBondContact O-N 3.03Å; F293-F296 HydrophobicContact CD1-CD2 4.33Å; F293-F296 WeakPolarHBondContact O-CB 3.35Å; F293-F296 PolarHBondContact O-N 2.86Å; F293-Y297 HydrophobicContact CB-CE2 4.39Å; F293-Y297 HydrophobicContact CD1-CE2 4.27Å; F293-Y297 WeakPolarHBondContact O-CD2 3.4Å; F293-Y297 PolarHBondContact O-N 3.04Å; F293-L343 HydrophobicContact CD1-CD2 4.12Å; F293-L343 HydrophobicContact CE1-CD2 3.9Å; F293-I347 HydrophobicContact CE1-CG1 4.17Å; F293-I347 HydrophobicContact CZ-CG1 4.07Å; F293-F372 HydrophobicContact CD2-CE2 4.42Å; F293-F372 HydrophobicContact CE1-CZ 4.43Å; F293-F372 AromaticContact CE2-CE2 4Å; F293-F372 HydrophobicContact CE2-CE2 4Å; F293-F372 AromaticContact CE2-CZ 3.82Å; F293-F372 HydrophobicContact CE2-CZ 3.82Å; F293-F372 HydrophobicContact CZ-CE2 4.27Å; F293-F372 AromaticContact CZ-CZ 3.71Å; F293-F372 HydrophobicContact CZ-CZ 3.71Å
294	T	82.3	Confident	73.4	Confident	84 Å²	84	61.2 Å²	61.2	52%	0.515	36%	0.355	S	S	.	.	H	α-helix	trans	-55.2	-42.8	177.1	-56.5	0	0	0	0	111.5	D290 A292 Y297 V298	D290-T294 WeakPolarHBondContact O-CB 3.33Å; D290-T294 PolarHBondContact O-N 3.02Å; D290-T294 VanDerWaalsContact O-N 3.1Å; D290-T294 PolarHBondContact O-OG1 3.27Å; A292-T294 PolarHBondContact O-N 3.19Å; T294-Y297 PolarHBondContact O-N 2.9Å; T294-V298 HydrophobicContact CG2-CG2 4.17Å; T294-V298 WeakPolarHBondContact O-CB 3.2Å; T294-V298 WeakPolarHBondContact O-CG2 3.48Å; T294-V298 PolarHBondContact O-N 3.44Å
295	L	82.9	Confident	75.4	Confident	69 Å²	69	60.3 Å²	60.3	36%	0.361	35%	0.346	S	S	.	.	H	α-helix	trans	-66.3	-37.9	176.8	-76	167.8	0	0	0	112.9	N291 A292 F293 K299	N291-L295 WeakPolarHBondContact O-CB 3.32Å; N291-L295 VanDerWaalsContact O-CD1 3.31Å; N291-L295 WeakPolarHBondContact O-CD1 3.29Å; N291-L295 WeakPolarHBondContact O-CG 3.27Å; N291-L295 PolarHBondContact O-N 3.02Å; A292-L295 PolarHBondContact O-N 3.43Å; F293-L295 VanDerWaalsContact C-N 3.25Å; F293-L295 PolarHBondContact O-N 3.03Å; L295-K299 WeakPolarHBondContact O-CG 3.44Å; L295-K299 PolarHBondContact O-N 3.28Å
296	F	85.6	Confident	77.1	Confident	24 Å²	24	64.1 Å²	64.1	11%	0.105	36%	0.357	C	S	.	.	H	α-helix	trans	-61.7	-48.4	176.1	-59.3	-25.7	0	0	0	110.9	L278 A292 F293 F300	L278-F296 HydrophobicContact CB-CD1 4.42Å; L278-F296 HydrophobicContact CB-CE1 4.35Å; L278-F296 HydrophobicContact CD1-CD1 4.01Å; L278-F296 HydrophobicContact CD2-CD1 3.95Å; L278-F296 HydrophobicContact CD2-CE1 4.29Å; L278-F296 HydrophobicContact CG-CD1 4.36Å; A292-F296 HydrophobicContact CB-CE2 4.3Å; A292-F296 HydrophobicContact CB-CZ 4.17Å; A292-F296 WeakPolarHBondContact O-CD1 3.23Å; A292-F296 WeakPolarHBondContact O-CD2 3.46Å; A292-F296 WeakPolarHBondContact O-CG 3.49Å; A292-F296 PolarHBondContact O-N 2.86Å; F293-F296 HydrophobicContact CD1-CD2 4.33Å; F293-F296 WeakPolarHBondContact O-CB 3.35Å; F293-F296 PolarHBondContact O-N 2.86Å; F296-F300 VanDerWaalsContact O-CD2 3.27Å; F296-F300 WeakPolarHBondContact O-CD2 3.47Å; F296-F300 PolarHBondContact O-N 3.47Å
297	Y	88.4	Confident	79	Confident	21 Å²	21	57.7 Å²	57.7	8%	0.082	32%	0.318	C	S	.	.	H	α-helix	trans	-69.3	-45.2	-179.5	-69.4	-73.9	0	0	0	112.3	F293 T294 K299 F300 R301 R339 D379 L383	F293-Y297 HydrophobicContact CB-CE2 4.39Å; F293-Y297 HydrophobicContact CD1-CE2 4.27Å; F293-Y297 WeakPolarHBondContact O-CD2 3.4Å; F293-Y297 PolarHBondContact O-N 3.04Å; T294-Y297 PolarHBondContact O-N 2.9Å; Y297-K299 PolarHBondContact O-N 3.31Å; Y297-F300 PolarHBondContact O-N 3.13Å; Y297-R301 VanDerWaalsContact O-CB 3.24Å; Y297-R301 WeakPolarHBondContact O-CB 3.47Å; Y297-R301 PolarHBondContact O-N 3.27Å; Y297-R339 VanDerWaalsContact CE1-NH2 3.3Å; Y297-D379 HydrophobicContact CD1-CB 4.25Å; Y297-D379 HydrophobicContact CE1-CB 3.72Å; Y297-D379 HydrophobicContact CE2-CB 4.14Å; Y297-L383 HydrophobicContact CD1-CB 4.31Å; Y297-L383 HydrophobicContact CD1-CD2 3.89Å; Y297-L383 HydrophobicContact CE1-CD2 4.21Å
298	V	88.3	Confident	80.9	Confident	86 Å²	86	59.2 Å²	59.2	52%	0.521	32%	0.316	S	S	.	.	H	α-helix	trans	-60.8	-43.1	-178.6	169.7	0	0	0	0	112.1	T294 A302	T294-V298 HydrophobicContact CG2-CG2 4.17Å; T294-V298 WeakPolarHBondContact O-CB 3.2Å; T294-V298 WeakPolarHBondContact O-CG2 3.48Å; T294-V298 PolarHBondContact O-N 3.44Å; V298-A302 WeakPolarHBondContact O-CB 3.37Å; V298-A302 PolarHBondContact O-N 3.44Å
299	K	86.1	Confident	82.4	Confident	76 Å²	76	57.3 Å²	57.3	33%	0.33	31%	0.308	S	S	.	.	H	α-helix	trans	-70.5	-37.5	-179.4	-69.5	-161.9	-163.4	175.1	0	113	L278 L295 Y297 A303	L278-K299 HydrophobicContact CD2-CD 3.73Å; L278-K299 HydrophobicContact CG-CD 4.32Å; L295-K299 WeakPolarHBondContact O-CG 3.44Å; L295-K299 PolarHBondContact O-N 3.28Å; Y297-K299 PolarHBondContact O-N 3.31Å; K299-A303 PolarHBondContact O-N 2.84Å
300	F	89.6	Confident	83.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-69.2	-44.5	175.8	-88.5	-101.4	0	0	0	111.3	L271 L274 L278 F296 Y297 A302 A303 A304 L342 L383 F387	L271-F300 HydrophobicContact CD2-CE1 4.19Å; L274-F300 HydrophobicContact CB-CE2 4.43Å; L274-F300 HydrophobicContact CB-CZ 4.38Å; L278-F300 HydrophobicContact CD1-CD2 4.11Å; L278-F300 HydrophobicContact CD1-CE2 3.72Å; F296-F300 VanDerWaalsContact O-CD2 3.27Å; F296-F300 WeakPolarHBondContact O-CD2 3.47Å; F296-F300 PolarHBondContact O-N 3.47Å; Y297-F300 PolarHBondContact O-N 3.13Å; F300-A302 VanDerWaalsContact C-N 3.29Å; F300-A302 PolarHBondContact O-N 2.96Å; F300-A303 PolarHBondContact O-N 3.5Å; F300-A304 PolarHBondContact O-N 2.88Å; F300-L342 HydrophobicContact CE2-CD1 3.46Å; F300-L342 VanDerWaalsContact CE2-CD1 3.46Å; F300-L342 HydrophobicContact CZ-CD1 3.64Å; F300-L383 HydrophobicContact CB-CD1 3.97Å; F300-L383 HydrophobicContact CB-CD2 3.89Å; F300-L383 HydrophobicContact CB-CG 4.49Å; F300-L383 HydrophobicContact CG-CD2 4.43Å; F300-F387 HydrophobicContact CB-CE2 4.42Å; F300-F387 HydrophobicContact CB-CZ 4.49Å; F300-F387 HydrophobicContact CD1-CE2 4.48Å; F300-F387 HydrophobicContact CD1-CZ 4.23Å; F300-F387 WeakPolarHBondContact O-CZ 3.42Å
301	R	89.9	Confident	85.2	Confident	114 Å²	114	51.2 Å²	51.2	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-56.5	-40.9	173.6	174	168	-71.1	168.3	-4.8	112.4	Y297 A303 A304 P305 L383 E386	Y297-R301 VanDerWaalsContact O-CB 3.24Å; Y297-R301 WeakPolarHBondContact O-CB 3.47Å; Y297-R301 PolarHBondContact O-N 3.27Å; R301-A303 VanDerWaalsContact C-N 3.27Å; R301-A303 PolarHBondContact O-N 2.84Å; R301-A304 WeakPolarHBondContact O-CB 3.41Å; R301-A304 PolarHBondContact O-N 3.43Å; R301-P305 WeakPolarHBondContact O-CD 3.42Å; R301-L383 HydrophobicContact CB-CD1 4.26Å; R301-E386 WeakPolarHBondContact CB-OE2 3.45Å; R301-E386 WeakPolarHBondContact CG-OE2 3.44Å; R301-E386 IonicContact CZ-OE1 3.94Å; R301-E386 VanDerWaalsContact NE-CD 3.27Å; R301-E386 IonicContact NE-OE1 3.52Å; R301-E386 PolarHBondContact NE-OE1 3.26Å; R301-E386 IonicContact NE-OE2 3.71Å; R301-E386 PolarHBondContact NE-OE2 3.3Å; R301-E386 VanDerWaalsContact NE-OE2 3.07Å; R301-E386 IonicContact NH2-OE1 3.91Å; R301-E386 PolarHBondContact NH2-OE1 2.95Å
302	A	88.6	Confident	86.2	Confident	67 Å²	67	50.4 Å²	50.4	55%	0.554	27%	0.265	S	S	*	.	H	α-helix	trans	-67	-25.1	176	0	0	0	0	0	113.9	V298 F300	V298-A302 WeakPolarHBondContact O-CB 3.37Å; V298-A302 PolarHBondContact O-N 3.44Å; F300-A302 VanDerWaalsContact C-N 3.29Å; F300-A302 PolarHBondContact O-N 2.96Å
303	A	87.1	Confident	86.8	Confident	7 Å²	7	51.5 Å²	51.5	6%	0.058	27%	0.267	C	S	.	.	H	α-helix	trans	-91.6	-23.7	178.4	0	0	0	0	0	113.5	L274 K299 F300 R301 P305 K306	L274-A303 HydrophobicContact CD1-CB 3.35Å; L274-A303 HydrophobicContact CD2-CB 4.23Å; L274-A303 HydrophobicContact CG-CB 4.41Å; K299-A303 PolarHBondContact O-N 2.84Å; F300-A303 PolarHBondContact O-N 3.5Å; R301-A303 VanDerWaalsContact C-N 3.27Å; R301-A303 PolarHBondContact O-N 2.84Å; A303-P305 VanDerWaalsContact C-CD 3.49Å; A303-K306 WeakPolarHBondContact O-CB 3.25Å; A303-K306 PolarHBondContact O-N 3.2Å; A303-K306 VanDerWaalsContact O-N 3.08Å
304	A	88.8	Confident	87.3	Confident	4 Å²	4	50.7 Å²	50.7	3%	0.033	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.9	-51.6	178.4	0	0	0	0	0	114.5	F300 R301 K306 V307 R308 E386 F387	F300-A304 PolarHBondContact O-N 2.88Å; R301-A304 WeakPolarHBondContact O-CB 3.41Å; R301-A304 PolarHBondContact O-N 3.43Å; A304-K306 PolarHBondContact O-N 3.02Å; A304-V307 PolarHBondContact O-N 3.29Å; A304-V307 VanDerWaalsContact O-N 3.08Å; A304-R308 VanDerWaalsContact O-CB 3.32Å; A304-R308 WeakPolarHBondContact O-CB 3.39Å; A304-R308 PolarHBondContact O-N 2.84Å; A304-E386 HydrophobicContact CB-CB 4.1Å; A304-F387 HydrophobicContact CB-CD1 4.27Å; A304-F387 HydrophobicContact CB-CD2 3.98Å; A304-F387 HydrophobicContact CB-CE1 4Å; A304-F387 HydrophobicContact CB-CE2 3.67Å; A304-F387 HydrophobicContact CB-CG 4.27Å; A304-F387 HydrophobicContact CB-CZ 3.68Å
305	P	87.4	Confident	87.7	Confident	84 Å²	84	46.8 Å²	46.8	55%	0.545	24%	0.239	S	C	.	.	H	α-helix	trans	-62.5	-23.4	-176.4	24	-34.9	0	0	0	113.7	R301 A303 V307	R301-P305 WeakPolarHBondContact O-CD 3.42Å; A303-P305 VanDerWaalsContact C-CD 3.49Å; P305-V307 VanDerWaalsContact C-N 3.28Å; P305-V307 PolarHBondContact O-N 3.34Å
306	K	83.9	Confident	87.9	Confident	130 Å²	130	48.3 Å²	48.3	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-73.6	-20	-180	-59.5	-179.4	-179.3	177.4	0	113.6	A303 A304	A303-K306 WeakPolarHBondContact O-CB 3.25Å; A303-K306 PolarHBondContact O-N 3.2Å; A303-K306 VanDerWaalsContact O-N 3.08Å; A304-K306 PolarHBondContact O-N 3.02Å
307	V	87.6	Confident	88	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-117.6	-28.2	-174.9	-171.5	0	0	0	0	110.7	T267 T270 A304 P305 T309 L310 I311	T267-V307 HydrophobicContact CG2-CG1 3.47Å; T267-V307 VanDerWaalsContact CG2-CG1 3.47Å; T270-V307 HydrophobicContact CG2-CG2 4.02Å; A304-V307 PolarHBondContact O-N 3.29Å; A304-V307 VanDerWaalsContact O-N 3.08Å; P305-V307 VanDerWaalsContact C-N 3.28Å; P305-V307 PolarHBondContact O-N 3.34Å; V307-T309 VanDerWaalsContact C-N 3.35Å; V307-T309 PolarHBondContact O-N 3.11Å; V307-L310 WeakPolarHBondContact O-CB 3.33Å; V307-L310 PolarHBondContact O-N 3.25Å; V307-I311 HydrophobicContact CB-CD1 4.38Å; V307-I311 HydrophobicContact CG1-CD1 3.59Å; V307-I311 HydrophobicContact CG1-CG1 3.95Å; V307-I311 PolarHBondContact O-N 3.43Å
308	R	88.8	Confident	87.9	Confident	93 Å²	93	48.1 Å²	48.1	35%	0.351	25%	0.248	S	C	.	.	H	α-helix	trans	-50.1	-49	-179.2	-175.2	-176.5	179	113.3	-0.4	113	A304 L310 I311 E312 N385 E386	A304-R308 VanDerWaalsContact O-CB 3.32Å; A304-R308 WeakPolarHBondContact O-CB 3.39Å; A304-R308 PolarHBondContact O-N 2.84Å; R308-L310 PolarHBondContact O-N 2.81Å; R308-I311 PolarHBondContact O-N 3.01Å; R308-I311 VanDerWaalsContact O-N 3.17Å; R308-E312 WeakPolarHBondContact O-CB 3.34Å; R308-E312 PolarHBondContact O-N 3.32Å; R308-N385 PolarHBondContact NH1-O 2.95Å; R308-E386 WeakPolarHBondContact CD-O 3.31Å; R308-E386 PolarHBondContact NH1-O 3.38Å
309	T	87.4	Confident	87.6	Confident	75 Å²	75	51.1 Å²	51.1	46%	0.46	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-34.8	-180	-49.6	0	0	0	0	112.1	I223 V307 Q313	I223-T309 HydrophobicContact CD1-CG2 4.05Å; V307-T309 VanDerWaalsContact C-N 3.35Å; V307-T309 PolarHBondContact O-N 3.11Å; T309-Q313 VanDerWaalsContact O-CG 3.29Å; T309-Q313 WeakPolarHBondContact O-CG 3.35Å; T309-Q313 PolarHBondContact O-N 3.26Å
310	L	86.1	Confident	87.3	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-73.7	-42.5	177	-62.7	175	0	0	0	111.7	V217 M263 Y266 V307 R308 Q313 I314	V217-L310 HydrophobicContact CB-CD1 4.31Å; V217-L310 HydrophobicContact CG1-CD1 3.56Å; V217-L310 HydrophobicContact CG1-CD2 3.71Å; V217-L310 HydrophobicContact CG1-CG 4.29Å; M263-L310 HydrophobicContact CE-CB 4.24Å; M263-L310 HydrophobicContact CE-CD2 4.23Å; Y266-L310 HydrophobicContact CD1-CD1 3.62Å; Y266-L310 HydrophobicContact CE1-CD1 3.71Å; V307-L310 WeakPolarHBondContact O-CB 3.33Å; V307-L310 PolarHBondContact O-N 3.25Å; R308-L310 PolarHBondContact O-N 2.81Å; L310-Q313 PolarHBondContact O-N 2.88Å; L310-I314 VanDerWaalsContact O-CG1 3.31Å; L310-I314 WeakPolarHBondContact O-CG1 3.42Å; L310-I314 PolarHBondContact O-N 3.26Å
311	I	89.9	Confident	87	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-45.8	177.6	-69.9	167.3	0	0	0	110.4	V307 R308 Q313 I314 E315 F387 F388	V307-I311 HydrophobicContact CB-CD1 4.38Å; V307-I311 HydrophobicContact CG1-CD1 3.59Å; V307-I311 HydrophobicContact CG1-CG1 3.95Å; V307-I311 PolarHBondContact O-N 3.43Å; R308-I311 PolarHBondContact O-N 3.01Å; R308-I311 VanDerWaalsContact O-N 3.17Å; I311-Q313 VanDerWaalsContact C-N 3.29Å; I311-Q313 PolarHBondContact O-N 3.44Å; I311-I314 CarbonylContact O-C 3.57Å; I311-I314 WeakPolarHBondContact O-CA 3.4Å; I311-I314 WeakPolarHBondContact O-CB 3.44Å; I311-I314 PolarHBondContact O-N 3.42Å; I311-E315 HydrophobicContact CG2-CG 4.19Å; I311-E315 WeakPolarHBondContact O-CG 3.28Å; I311-E315 PolarHBondContact O-N 3.38Å; I311-F387 HydrophobicContact CD1-CB 4.39Å; I311-F387 HydrophobicContact CD1-CD1 4.41Å; I311-F387 WeakPolarHBondContact CG2-O 3.18Å; I311-F388 HydrophobicContact CD1-CD1 4.4Å; I311-F388 HydrophobicContact CD1-CE1 3.86Å; I311-F388 HydrophobicContact CD1-CZ 4.12Å; I311-F388 HydrophobicContact CG1-CE1 4.32Å; I311-F388 HydrophobicContact CG2-CD1 3.42Å; I311-F388 VanDerWaalsContact CG2-CD1 3.42Å; I311-F388 HydrophobicContact CG2-CE1 3.7Å; I311-F388 HydrophobicContact CG2-CG 4.36Å
312	E	89.4	Confident	86.8	Confident	78 Å²	78	55.4 Å²	55.4	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-58.1	-41.9	178.2	-175.8	175.9	-167.6	0	0	111.4	R308 I314 E315 L316	R308-E312 WeakPolarHBondContact O-CB 3.34Å; R308-E312 PolarHBondContact O-N 3.32Å; E312-I314 VanDerWaalsContact C-N 3.34Å; E312-I314 PolarHBondContact O-N 3.14Å; E312-E315 PolarHBondContact O-N 3.17Å; E312-L316 HydrophobicContact CG-CD1 4.46Å; E312-L316 VanDerWaalsContact O-CG 3.3Å; E312-L316 WeakPolarHBondContact O-CG 2.92Å; E312-L316 PolarHBondContact O-N 3.26Å
313	Q	86	Confident	86.7	Confident	43 Å²	43	54.4 Å²	54.4	20%	0.201	27%	0.271	C	S	.	.	H	α-helix	trans	-67.3	-32.3	174.9	-65.6	-57.7	-57.1	0	0	113	I223 T309 L310 I311 R317	I223-Q313 HydrophobicContact CD1-CG 4.09Å; I223-Q313 HydrophobicContact CG1-CG 4.33Å; I223-Q313 HydrophobicContact CG2-CG 4.05Å; T309-Q313 VanDerWaalsContact O-CG 3.29Å; T309-Q313 WeakPolarHBondContact O-CG 3.35Å; T309-Q313 PolarHBondContact O-N 3.26Å; L310-Q313 PolarHBondContact O-N 2.88Å; I311-Q313 VanDerWaalsContact C-N 3.29Å; I311-Q313 PolarHBondContact O-N 3.44Å; Q313-R317 WeakPolarHBondContact O-CB 3.23Å; Q313-R317 WeakPolarHBondContact O-CD 3.4Å; Q313-R317 VanDerWaalsContact O-CG 3.27Å; Q313-R317 WeakPolarHBondContact O-CG 3.47Å; Q313-R317 PolarHBondContact O-N 3.12Å
314	I	89.1	Confident	86.8	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-69.1	-44.2	173.5	-65.1	164.6	0	0	0	110.1	M263 L310 I311 E312 L316 R317 S318 Y324 L327 L328 I331	M263-I314 HydrophobicContact CE-CD1 3.72Å; M263-I314 HydrophobicContact CE-CG1 3.57Å; L310-I314 VanDerWaalsContact O-CG1 3.31Å; L310-I314 WeakPolarHBondContact O-CG1 3.42Å; L310-I314 PolarHBondContact O-N 3.26Å; I311-I314 CarbonylContact O-C 3.57Å; I311-I314 WeakPolarHBondContact O-CA 3.4Å; I311-I314 WeakPolarHBondContact O-CB 3.44Å; I311-I314 PolarHBondContact O-N 3.42Å; E312-I314 VanDerWaalsContact C-N 3.34Å; E312-I314 PolarHBondContact O-N 3.14Å; I314-L316 VanDerWaalsContact C-N 3.34Å; I314-L316 PolarHBondContact O-N 3.01Å; I314-R317 PolarHBondContact O-N 2.72Å; I314-S318 WeakPolarHBondContact O-CB 3.43Å; I314-S318 PolarHBondContact O-N 3.13Å; I314-Y324 HydrophobicContact CG2-CD1 4.44Å; I314-L327 HydrophobicContact CD1-CD2 3.68Å; I314-L327 HydrophobicContact CD1-CG 4.23Å; I314-L327 HydrophobicContact CG1-CD2 4.1Å; I314-L327 HydrophobicContact CG2-CD2 4.49Å; I314-L328 HydrophobicContact CG2-CB 3.93Å; I314-L328 HydrophobicContact CG2-CD1 4.22Å; I314-I331 HydrophobicContact CD1-CD1 3.59Å
315	E	89.8	Confident	86.8	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-34.2	179.8	-72.1	177.1	137.1	0	0	113	I311 E312 S318 L328 T389 K390	I311-E315 HydrophobicContact CG2-CG 4.19Å; I311-E315 WeakPolarHBondContact O-CG 3.28Å; I311-E315 PolarHBondContact O-N 3.38Å; E312-E315 PolarHBondContact O-N 3.17Å; E315-S318 PolarHBondContact O-OG 3.33Å; E315-L328 HydrophobicContact CG-CD1 3.93Å; E315-L328 HydrophobicContact CG-CD2 4.22Å; E315-T389 PolarHBondContact OE1-N 2.85Å; E315-T389 WeakPolarHBondContact OE2-CB 3.28Å; E315-T389 PolarHBondContact OE2-N 3.18Å; E315-T389 PolarHBondContact OE2-OG1 2.92Å; E315-K390 HydrophobicContact CB-CD 4.33Å; E315-K390 PolarHBondContact O-NZ 3.18Å; E315-K390 PolarHBondContact OE1-N 2.68Å
316	L	88.6	Confident	86.9	Confident	100 Å²	100	61.4 Å²	61.4	52%	0.524	29%	0.294	S	S	.	.	H	α-helix	trans	-71.4	-35.7	174.2	-71.7	171.7	0	0	0	112.1	E312 I314	E312-L316 HydrophobicContact CG-CD1 4.46Å; E312-L316 VanDerWaalsContact O-CG 3.3Å; E312-L316 WeakPolarHBondContact O-CG 2.92Å; E312-L316 PolarHBondContact O-N 3.26Å; I314-L316 VanDerWaalsContact C-N 3.34Å; I314-L316 PolarHBondContact O-N 3.01Å
317	R	86.7	Confident	87.2	Confident	24 Å²	24	55.6 Å²	55.6	9%	0.091	27%	0.269	C	S	.	.	H	α-helix	trans	-88	-21	-176.8	-70	174.2	172.2	139.1	3.7	113.7	I223 D230 Q313 I314 E319 K320 I321 Y324	I223-R317 PolarHBondContact O-NH2 2.9Å; I223-R317 VanDerWaalsContact O-NH2 3.16Å; D230-R317 WeakPolarHBondContact OD2-CD 3.24Å; D230-R317 IonicContact OD2-CZ 2.72Å; D230-R317 IonicContact OD2-NE 3.08Å; D230-R317 PolarHBondContact OD2-NE 3.48Å; Q313-R317 WeakPolarHBondContact O-CB 3.23Å; Q313-R317 WeakPolarHBondContact O-CD 3.4Å; Q313-R317 VanDerWaalsContact O-CG 3.27Å; Q313-R317 WeakPolarHBondContact O-CG 3.47Å; Q313-R317 PolarHBondContact O-N 3.12Å; I314-R317 PolarHBondContact O-N 2.72Å; R317-E319 PolarHBondContact O-N 2.87Å; R317-E319 VanDerWaalsContact O-N 3.14Å; R317-K320 PolarHBondContact O-N 2.9Å; R317-K320 VanDerWaalsContact O-N 3.07Å; R317-I321 PolarHBondContact O-N 3.35Å; R317-Y324 HydrophobicContact CB-CD1 4.04Å; R317-Y324 HydrophobicContact CB-CD2 4.17Å; R317-Y324 HydrophobicContact CB-CE1 4.16Å; R317-Y324 HydrophobicContact CB-CE2 4.26Å; R317-Y324 HydrophobicContact CB-CG 4.03Å
318	S	85.9	Confident	87.4	Confident	18 Å²	18	56.3 Å²	56.3	13%	0.126	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.9	-178.2	64.5	0	0	0	0	114.1	I314 E315	I314-S318 WeakPolarHBondContact O-CB 3.43Å; I314-S318 PolarHBondContact O-N 3.13Å; E315-S318 PolarHBondContact O-OG 3.33Å
319	E	81.9	Confident	87.5	Confident	149 Å²	149	54.8 Å²	54.8	70%	0.696	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-26.6	177.6	-68.5	175.5	-161.8	0	0	112.9	R317 K390	R317-E319 PolarHBondContact O-N 2.87Å; R317-E319 VanDerWaalsContact O-N 3.14Å; E319-K390 IonicContact OE1-NZ 3.33Å; E319-K390 PolarHBondContact OE1-NZ 3.19Å
320	K	80.9	Confident	87.6	Confident	183 Å²	183	54.5 Å²	54.5	80%	0.796	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-33.2	-174.2	-63.8	-177.1	-178.8	179.7	0	113	R317	R317-K320 PolarHBondContact O-N 2.9Å; R317-K320 VanDerWaalsContact O-N 3.07Å
321	I	82.8	Confident	87.8	Confident	19 Å²	19	54.2 Å²	54.2	10%	0.097	27%	0.266	C	S	.	.			trans	-133.7	123.1	-170	-64.8	172.4	0	0	0	109.6	D230 L256 R317 E323 Y324	D230-I321 HydrophobicContact CB-CD1 4.19Å; L256-I321 HydrophobicContact CD2-CG2 4.11Å; R317-I321 PolarHBondContact O-N 3.35Å; I321-E323 VanDerWaalsContact C-N 3.32Å; I321-E323 HydrophobicContact CG2-CB 4.16Å; I321-E323 WeakPolarHBondContact CG2-OE2 3.33Å; I321-E323 PolarHBondContact O-N 3.09Å; I321-Y324 HydrophobicContact CB-CD2 3.73Å; I321-Y324 HydrophobicContact CB-CE2 4.21Å; I321-Y324 HydrophobicContact CD1-CD2 4.37Å; I321-Y324 HydrophobicContact CD1-CE2 3.97Å; I321-Y324 HydrophobicContact CG2-CD2 3.7Å; I321-Y324 HydrophobicContact CG2-CE2 4.13Å; I321-Y324 PolarHBondContact O-N 2.99Å
322	P	86.4	Confident	87.9	Confident	78 Å²	78	54.4 Å²	54.4	51%	0.506	27%	0.267	S	S	.	.	H	α-helix	trans	-67.8	-27.1	-174	26.6	-33.7	0	0	0	113.7	Y324 Q325 Q326	P322-Y324 PolarHBondContact O-N 3.27Å; P322-Q325 WeakPolarHBondContact O-CB 3.32Å; P322-Q325 PolarHBondContact O-N 2.86Å; P322-Q325 VanDerWaalsContact O-N 3.09Å; P322-Q326 PolarHBondContact O-N 2.84Å; P322-Q326 VanDerWaalsContact O-N 3.13Å
323	E	86.9	Confident	88	Confident	46 Å²	46	54.4 Å²	54.4	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-32.5	176.3	-66.3	86.2	162.5	0	0	112.1	K253 L256 L260 I321 L327	K253-E323 IonicContact NZ-OE1 3.28Å; K253-E323 PolarHBondContact NZ-OE1 3.41Å; K253-E323 VanDerWaalsContact NZ-OE1 3.09Å; L256-E323 HydrophobicContact CD2-CB 4.44Å; L260-E323 HydrophobicContact CD1-CB 3.74Å; I321-E323 VanDerWaalsContact C-N 3.32Å; I321-E323 HydrophobicContact CG2-CB 4.16Å; I321-E323 WeakPolarHBondContact CG2-OE2 3.33Å; I321-E323 PolarHBondContact O-N 3.09Å; E323-L327 PolarHBondContact O-N 2.88Å
324	Y	88.4	Confident	88.3	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-74.6	-31.7	173.9	-73.3	-90.1	0	0	0	112.5	D230 L256 L260 I314 R317 I321 P322 Q326 L327 L328	D230-Y324 WeakPolarHBondContact OD1-CE2 3.48Å; D230-Y324 PolarHBondContact OD1-OH 3.42Å; D230-Y324 PolarHBondContact OD2-OH 2.69Å; L256-Y324 HydrophobicContact CD1-CE2 3.72Å; L256-Y324 WeakPolarHBondContact CD1-OH 3.41Å; L256-Y324 HydrophobicContact CD2-CE2 4.32Å; L260-Y324 HydrophobicContact CD2-CD1 3.42Å; L260-Y324 VanDerWaalsContact CD2-CD1 3.42Å; L260-Y324 HydrophobicContact CD2-CD2 4.43Å; L260-Y324 HydrophobicContact CD2-CE1 3.3Å; L260-Y324 HydrophobicContact CD2-CE2 4.38Å; L260-Y324 HydrophobicContact CD2-CG 4.03Å; I314-Y324 HydrophobicContact CG2-CD1 4.44Å; R317-Y324 HydrophobicContact CB-CD1 4.04Å; R317-Y324 HydrophobicContact CB-CD2 4.17Å; R317-Y324 HydrophobicContact CB-CE1 4.16Å; R317-Y324 HydrophobicContact CB-CE2 4.26Å; R317-Y324 HydrophobicContact CB-CG 4.03Å; I321-Y324 HydrophobicContact CB-CD2 3.73Å; I321-Y324 HydrophobicContact CB-CE2 4.21Å; I321-Y324 HydrophobicContact CD1-CD2 4.37Å; I321-Y324 HydrophobicContact CD1-CE2 3.97Å; I321-Y324 HydrophobicContact CG2-CD2 3.7Å; I321-Y324 HydrophobicContact CG2-CE2 4.13Å; I321-Y324 PolarHBondContact O-N 2.99Å; P322-Y324 PolarHBondContact O-N 3.27Å; Y324-Q326 VanDerWaalsContact C-N 3.35Å; Y324-L327 PolarHBondContact O-N 2.72Å; Y324-L328 WeakPolarHBondContact O-CB 3.21Å; Y324-L328 PolarHBondContact O-N 3.27Å
325	Q	88.5	Confident	88.5	Confident	110 Å²	110	52.9 Å²	52.9	51%	0.514	26%	0.261	S	S	.	.	H	α-helix	trans	-65.8	-38.6	175	-170.6	-176.4	8.6	0	0	111.6	P322 L328 N329	P322-Q325 WeakPolarHBondContact O-CB 3.32Å; P322-Q325 PolarHBondContact O-N 2.86Å; P322-Q325 VanDerWaalsContact O-N 3.09Å; Q325-L328 PolarHBondContact O-N 3.47Å; Q325-N329 WeakPolarHBondContact O-CB 3.31Å; Q325-N329 PolarHBondContact O-N 3.11Å; Q325-N329 PolarHBondContact O-ND2 3.33Å
326	Q	90.4	Very high	88.6	Confident	131 Å²	131	53.1 Å²	53.1	61%	0.612	26%	0.263	S	S	*	.	H	α-helix	trans	-63.8	-45.3	173	-67.8	-179.1	-6	0	0	111.4	P322 Y324 L328 N329 D330	P322-Q326 PolarHBondContact O-N 2.84Å; P322-Q326 VanDerWaalsContact O-N 3.13Å; Y324-Q326 VanDerWaalsContact C-N 3.35Å; Q326-L328 PolarHBondContact O-N 3.07Å; Q326-N329 WeakPolarHBondContact O-CB 3.35Å; Q326-N329 PolarHBondContact O-N 3.33Å; Q326-D330 PolarHBondContact O-N 3.23Å
327	L	90.2	Very high	88.7	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-59.3	-45.4	175.5	176.3	61.6	0	0	0	112.2	L260 M263 K264 I314 E323 Y324 N329 D330 I331	L260-L327 HydrophobicContact CB-CD2 4.14Å; L260-L327 HydrophobicContact CD2-CD2 3.63Å; L260-L327 HydrophobicContact CG-CD2 4.44Å; M263-L327 HydrophobicContact CB-CD2 4.31Å; K264-L327 HydrophobicContact CB-CD1 3.49Å; K264-L327 VanDerWaalsContact CB-CD1 3.49Å; K264-L327 HydrophobicContact CD-CD1 4.16Å; K264-L327 HydrophobicContact CG-CD1 3.88Å; I314-L327 HydrophobicContact CD1-CD2 3.68Å; I314-L327 HydrophobicContact CD1-CG 4.23Å; I314-L327 HydrophobicContact CG1-CD2 4.1Å; I314-L327 HydrophobicContact CG2-CD2 4.49Å; E323-L327 PolarHBondContact O-N 2.88Å; Y324-L327 PolarHBondContact O-N 2.72Å; L327-N329 VanDerWaalsContact C-N 3.31Å; L327-N329 PolarHBondContact O-N 2.94Å; L327-D330 WeakPolarHBondContact O-CB 3.44Å; L327-D330 PolarHBondContact O-N 2.83Å; L327-I331 HydrophobicContact CD1-CD1 3.92Å; L327-I331 HydrophobicContact CD1-CG1 4.19Å; L327-I331 HydrophobicContact CD2-CD1 4.47Å; L327-I331 HydrophobicContact CG-CD1 3.86Å; L327-I331 WeakPolarHBondContact O-CG1 3.31Å; L327-I331 PolarHBondContact O-N 2.82Å
328	L	90.9	Very high	88.9	Confident	17 Å²	17	52.2 Å²	52.2	9%	0.089	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-43.4	178.3	-175.7	62.2	0	0	0	111.1	I314 E315 Y324 Q325 Q326 D330 I331 H332	I314-L328 HydrophobicContact CG2-CB 3.93Å; I314-L328 HydrophobicContact CG2-CD1 4.22Å; E315-L328 HydrophobicContact CG-CD1 3.93Å; E315-L328 HydrophobicContact CG-CD2 4.22Å; Y324-L328 WeakPolarHBondContact O-CB 3.21Å; Y324-L328 PolarHBondContact O-N 3.27Å; Q325-L328 PolarHBondContact O-N 3.47Å; Q326-L328 PolarHBondContact O-N 3.07Å; L328-D330 VanDerWaalsContact C-N 3.34Å; L328-D330 PolarHBondContact O-N 3.37Å; L328-I331 PolarHBondContact O-N 3.27Å; L328-H332 PolarHBondContact O-N 2.93Å
329	N	90.3	Very high	89.2	Confident	60 Å²	60	51.4 Å²	51.4	32%	0.321	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-41.2	175.7	-81.8	-40.4	0	0	0	112.9	Q325 Q326 L327 H332 Q333 K394	Q325-N329 WeakPolarHBondContact O-CB 3.31Å; Q325-N329 PolarHBondContact O-N 3.11Å; Q325-N329 PolarHBondContact O-ND2 3.33Å; Q326-N329 WeakPolarHBondContact O-CB 3.35Å; Q326-N329 PolarHBondContact O-N 3.33Å; L327-N329 VanDerWaalsContact C-N 3.31Å; L327-N329 PolarHBondContact O-N 2.94Å; N329-H332 PolarHBondContact O-N 3.18Å; N329-Q333 WeakPolarHBondContact O-CG 3.21Å; N329-Q333 PolarHBondContact O-N 2.73Å; N329-K394 PolarHBondContact OD1-NZ 3.44Å
330	D	89.9	Confident	89.6	Confident	70 Å²	70	47.5 Å²	47.5	37%	0.374	24%	0.235	S	C	.	.	H	α-helix	trans	-65.9	-38.8	176.6	-71.7	-15.7	0	0	0	112	K264 Q326 L327 L328 C334	K264-D330 HydrophobicContact CD-CB 4.5Å; K264-D330 IonicContact NZ-OD2 2.87Å; K264-D330 PolarHBondContact NZ-OD2 3.45Å; Q326-D330 PolarHBondContact O-N 3.23Å; L327-D330 WeakPolarHBondContact O-CB 3.44Å; L327-D330 PolarHBondContact O-N 2.83Å; L328-D330 VanDerWaalsContact C-N 3.34Å; L328-D330 PolarHBondContact O-N 3.37Å; D330-C334 VanDerWaalsContact O-CB 3.31Å; D330-C334 WeakPolarHBondContact O-CB 3.38Å; D330-C334 PolarHBondContact O-N 3.17Å
331	I	91.2	Very high	90	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.5	-44.4	176.9	-68	167.2	0	0	0	110.2	T267 I314 L327 L328 C334 Y335 F388	T267-I331 HydrophobicContact CG2-CD1 4.37Å; T267-I331 HydrophobicContact CG2-CG1 4.24Å; T267-I331 HydrophobicContact CG2-CG2 3.81Å; I314-I331 HydrophobicContact CD1-CD1 3.59Å; L327-I331 HydrophobicContact CD1-CD1 3.92Å; L327-I331 HydrophobicContact CD1-CG1 4.19Å; L327-I331 HydrophobicContact CD2-CD1 4.47Å; L327-I331 HydrophobicContact CG-CD1 3.86Å; L327-I331 WeakPolarHBondContact O-CG1 3.31Å; L327-I331 PolarHBondContact O-N 2.82Å; L328-I331 PolarHBondContact O-N 3.27Å; I331-C334 PolarHBondContact O-N 3.33Å; I331-Y335 WeakPolarHBondContact O-CB 3.29Å; I331-Y335 PolarHBondContact O-N 3.27Å; I331-F388 HydrophobicContact CG2-CE1 3.99Å; I331-F388 HydrophobicContact CG2-CZ 4.01Å
332	H	91.7	Very high	90.2	Very high	5 Å²	5	42.4 Å²	42.4	2%	0.023	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-51.6	173.9	-72.3	167.8	0	0	0	111	L328 N329 C334 Y335 L336 Y384 F388 T392 K394	L328-H332 PolarHBondContact O-N 2.93Å; N329-H332 PolarHBondContact O-N 3.18Å; H332-C334 PolarHBondContact O-N 2.74Å; H332-Y335 PolarHBondContact O-N 3.46Å; H332-L336 VanDerWaalsContact O-CG 3.22Å; H332-L336 WeakPolarHBondContact O-CG 3.5Å; H332-L336 PolarHBondContact O-N 2.96Å; H332-Y384 PolarHBondContact NE2-OH 2.84Å; H332-F388 AromaticContact CD2-CD1 3.54Å; H332-F388 AromaticContact CD2-CE1 3.22Å; H332-F388 WeakPolarHBondContact CD2-CE1 3.26Å; H332-F388 AromaticContact CD2-CZ 3.62Å; H332-F388 AromaticContact NE2-CD1 3.26Å; H332-F388 VanDerWaalsContact NE2-CD1 3.26Å; H332-F388 WeakPolarHBondContact NE2-CD1 3.4Å; H332-F388 AromaticContact NE2-CE1 3.46Å; H332-F388 WeakPolarHBondContact NE2-CE1 3.24Å; H332-F388 AromaticContact NE2-CG 3.95Å; H332-T392 PolarHBondContact CE1-OG1 3.42Å; H332-T392 VanDerWaalsContact CE1-OG1 3.29Å; H332-K394 HydrophobicContact CB-CD 4.36Å
333	Q	91.9	Very high	90.3	Very high	78 Å²	78	38.7 Å²	38.7	36%	0.364	19%	0.192	S	C	.	.	H	α-helix	trans	-60.9	-45.5	179.2	-70.7	-60.7	-8.8	0	0	111.8	N329 Y335 L336 D337	N329-Q333 WeakPolarHBondContact O-CG 3.21Å; N329-Q333 PolarHBondContact O-N 2.73Å; Q333-Y335 VanDerWaalsContact C-N 3.35Å; Q333-Y335 PolarHBondContact O-N 3.48Å; Q333-L336 PolarHBondContact O-N 3.32Å; Q333-D337 WeakPolarHBondContact O-CB 3.33Å; Q333-D337 PolarHBondContact O-N 3.35Å
334	C	92	Very high	90.3	Very high	13 Å²	13	37.4 Å²	37.4	9%	0.088	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-43	177.7	-178.4	0	0	0	0	112.4	V268 D330 I331 H332 Q338	V268-C334 HydrophobicContact CG2-CB 4.1Å; D330-C334 VanDerWaalsContact O-CB 3.31Å; D330-C334 WeakPolarHBondContact O-CB 3.38Å; D330-C334 PolarHBondContact O-N 3.17Å; I331-C334 PolarHBondContact O-N 3.33Å; H332-C334 PolarHBondContact O-N 2.74Å; C334-Q338 WeakPolarHBondContact O-CB 3.32Å; C334-Q338 VanDerWaalsContact O-CG 3.26Å; C334-Q338 WeakPolarHBondContact O-CG 3.25Å; C334-Q338 PolarHBondContact O-N 2.9Å
335	Y	92.6	Very high	90.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-52.1	175.4	175.4	-88.3	0	0	0	110.4	L271 I331 H332 Q333 D337 Q338 R339 E380 L383 Y384 F387 F388	L271-Y335 HydrophobicContact CD1-CD2 4.34Å; L271-Y335 HydrophobicContact CD2-CD2 4.21Å; I331-Y335 WeakPolarHBondContact O-CB 3.29Å; I331-Y335 PolarHBondContact O-N 3.27Å; H332-Y335 PolarHBondContact O-N 3.46Å; Q333-Y335 VanDerWaalsContact C-N 3.35Å; Q333-Y335 PolarHBondContact O-N 3.48Å; Y335-D337 PolarHBondContact O-N 3.31Å; Y335-Q338 PolarHBondContact O-N 3.47Å; Y335-R339 HydrophobicContact CD1-CG 4.08Å; Y335-R339 HydrophobicContact CE1-CG 3.61Å; Y335-R339 HydrophobicContact CE2-CG 4.21Å; Y335-R339 WeakPolarHBondContact O-CG 3.4Å; Y335-R339 PolarHBondContact O-N 3.38Å; Y335-E380 PolarHBondContact OH-OE1 2.93Å; Y335-L383 WeakPolarHBondContact OH-CD2 3.27Å; Y335-Y384 HydrophobicContact CD1-CD2 4.33Å; Y335-Y384 AromaticContact CE1-CD2 3.98Å; Y335-Y384 HydrophobicContact CE1-CD2 3.98Å; Y335-F387 AromaticContact CE2-CD2 3.89Å; Y335-F387 HydrophobicContact CE2-CD2 3.89Å; Y335-F387 HydrophobicContact CE2-CE2 4.09Å; Y335-F387 HydrophobicContact CE2-CG 4.21Å; Y335-F388 HydrophobicContact CD1-CE2 4.22Å; Y335-F388 HydrophobicContact CD2-CE2 4.14Å; Y335-F388 AromaticContact CG-CE2 3.95Å; Y335-F388 HydrophobicContact CG-CE2 3.95Å; Y335-F388 HydrophobicContact CG-CZ 4.41Å
336	L	91.9	Very high	90.1	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-44.4	-178	-63.5	168.7	0	0	0	111.8	H332 Q333 Q338 R339 E340 K394 L395 L398	H332-L336 VanDerWaalsContact O-CG 3.22Å; H332-L336 WeakPolarHBondContact O-CG 3.5Å; H332-L336 PolarHBondContact O-N 2.96Å; Q333-L336 PolarHBondContact O-N 3.32Å; L336-Q338 VanDerWaalsContact C-N 3.32Å; L336-Q338 PolarHBondContact O-N 3.4Å; L336-R339 PolarHBondContact O-N 2.78Å; L336-R339 VanDerWaalsContact O-N 3.13Å; L336-E340 WeakPolarHBondContact O-CB 2.91Å; L336-E340 PolarHBondContact O-N 3.32Å; L336-K394 HydrophobicContact CD1-CB 3.5Å; L336-K394 WeakPolarHBondContact CD1-O 3.4Å; L336-L395 HydrophobicContact CD2-CD1 4.09Å; L336-L398 HydrophobicContact CB-CD2 4.25Å; L336-L398 HydrophobicContact CD2-CB 3.97Å; L336-L398 HydrophobicContact CD2-CD2 3.52Å; L336-L398 HydrophobicContact CD2-CG 4.37Å; L336-L398 HydrophobicContact CG-CD2 4.48Å
337	D	91.6	Very high	90	Very high	82 Å²	82	31 Å²	31	44%	0.439	17%	0.172	S	C	.	.	H	α-helix	trans	-59.3	-42.3	176.2	-69.8	-22.7	0	0	0	112	Q333 Y335 R339 L341	Q333-D337 WeakPolarHBondContact O-CB 3.33Å; Q333-D337 PolarHBondContact O-N 3.35Å; Y335-D337 PolarHBondContact O-N 3.31Å; D337-R339 VanDerWaalsContact C-N 3.33Å; D337-L341 WeakPolarHBondContact O-CB 3.46Å; D337-L341 PolarHBondContact O-N 3.44Å
338	Q	91.1	Very high	89.9	Confident	23 Å²	23	32.4 Å²	32.4	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-36.4	177.3	-71.6	-37.2	-75.8	0	0	112	L271 Q272 T275 C334 Y335 L336 L342	L271-Q338 HydrophobicContact CB-CG 4.3Å; Q272-Q338 HydrophobicContact CG-CG 4.3Å; T275-Q338 VanDerWaalsContact CB-OE1 3.24Å; T275-Q338 VanDerWaalsContact CG2-OE1 3.32Å; T275-Q338 WeakPolarHBondContact OG1-CB 3.48Å; T275-Q338 PolarHBondContact OG1-OE1 3.47Å; C334-Q338 WeakPolarHBondContact O-CB 3.32Å; C334-Q338 VanDerWaalsContact O-CG 3.26Å; C334-Q338 WeakPolarHBondContact O-CG 3.25Å; C334-Q338 PolarHBondContact O-N 2.9Å; Y335-Q338 PolarHBondContact O-N 3.47Å; L336-Q338 VanDerWaalsContact C-N 3.32Å; L336-Q338 PolarHBondContact O-N 3.4Å; Q338-L342 WeakPolarHBondContact O-CG 3.37Å; Q338-L342 PolarHBondContact O-N 2.97Å
339	R	90.8	Very high	89.7	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-73.1	-42.5	176.8	-64.1	-58.5	-65	165.1	0.2	111.6	Y297 Y335 L336 D337 L341 L342 L343 E380 L398	Y297-R339 VanDerWaalsContact CE1-NH2 3.3Å; Y335-R339 HydrophobicContact CD1-CG 4.08Å; Y335-R339 HydrophobicContact CE1-CG 3.61Å; Y335-R339 HydrophobicContact CE2-CG 4.21Å; Y335-R339 WeakPolarHBondContact O-CG 3.4Å; Y335-R339 PolarHBondContact O-N 3.38Å; L336-R339 PolarHBondContact O-N 2.78Å; L336-R339 VanDerWaalsContact O-N 3.13Å; D337-R339 VanDerWaalsContact C-N 3.33Å; R339-L341 VanDerWaalsContact C-N 3.29Å; R339-L341 PolarHBondContact O-N 3.45Å; R339-L342 PolarHBondContact O-N 2.95Å; R339-L342 VanDerWaalsContact O-N 3.15Å; R339-L343 WeakPolarHBondContact O-CB 3.28Å; R339-L343 PolarHBondContact O-N 3.4Å; R339-E380 WeakPolarHBondContact CG-OE1 3.27Å; R339-E380 IonicContact CZ-OE2 3.45Å; R339-E380 IonicContact NE-OE1 3.7Å; R339-E380 PolarHBondContact NE-OE1 3.13Å; R339-E380 VanDerWaalsContact NE-OE1 3.16Å; R339-E380 IonicContact NE-OE2 3.09Å; R339-E380 PolarHBondContact NE-OE2 2.95Å; R339-E380 VanDerWaalsContact NE-OE2 3.08Å; R339-E380 IonicContact NH2-OE2 2.84Å; R339-E380 PolarHBondContact NH2-OE2 2.89Å; R339-L398 HydrophobicContact CB-CD2 4.07Å
340	E	90.3	Very high	89.4	Confident	68 Å²	68	32.8 Å²	32.8	32%	0.318	19%	0.192	S	C	.	.	H	α-helix	trans	-56	-45.5	174.9	-165	173.5	154.5	0	0	110.7	L336 L342 G344 L398 K401	L336-E340 WeakPolarHBondContact O-CB 2.91Å; L336-E340 PolarHBondContact O-N 3.32Å; E340-L342 VanDerWaalsContact C-N 3.3Å; E340-L342 PolarHBondContact O-N 3.42Å; E340-G344 PolarHBondContact O-N 3.46Å; E340-L398 HydrophobicContact CB-CD1 3.61Å; E340-L398 HydrophobicContact CG-CD1 3.85Å; E340-K401 IonicContact OE1-NZ 2.94Å; E340-K401 IonicContact OE2-NZ 2.67Å; E340-K401 PolarHBondContact OE2-NZ 2.87Å
341	L	89.6	Confident	89.3	Confident	90 Å²	90	29.5 Å²	29.5	47%	0.471	17%	0.174	S	C	.	.	H	α-helix	trans	-62.7	-32.2	178.9	-174.7	64.5	0	0	0	113.7	T275 L279 D337 R339	T275-L341 HydrophobicContact CG2-CD2 4.05Å; L279-L341 HydrophobicContact CD1-CD2 3.75Å; L279-L341 HydrophobicContact CD1-CG 4.08Å; D337-L341 WeakPolarHBondContact O-CB 3.46Å; D337-L341 PolarHBondContact O-N 3.44Å; R339-L341 VanDerWaalsContact C-N 3.29Å; R339-L341 PolarHBondContact O-N 3.45Å
342	L	87.6	Confident	89.1	Confident	4 Å²	4	32 Å²	32	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-86	-47.3	-179.9	-72.4	171.4	0	0	0	112.5	T275 L278 L279 F300 Q338 R339 E340 S346	T275-L342 HydrophobicContact CG2-CD1 4.08Å; T275-L342 HydrophobicContact CG2-CD2 3.92Å; T275-L342 HydrophobicContact CG2-CG 3.81Å; L278-L342 HydrophobicContact CB-CD2 4.08Å; L278-L342 HydrophobicContact CD1-CD1 4.33Å; L279-L342 HydrophobicContact CD2-CD2 4.02Å; L279-L342 HydrophobicContact CG-CD2 3.9Å; F300-L342 HydrophobicContact CE2-CD1 3.46Å; F300-L342 VanDerWaalsContact CE2-CD1 3.46Å; F300-L342 HydrophobicContact CZ-CD1 3.64Å; Q338-L342 WeakPolarHBondContact O-CG 3.37Å; Q338-L342 PolarHBondContact O-N 2.97Å; R339-L342 PolarHBondContact O-N 2.95Å; R339-L342 VanDerWaalsContact O-N 3.15Å; E340-L342 VanDerWaalsContact C-N 3.3Å; E340-L342 PolarHBondContact O-N 3.42Å; L342-S346 PolarHBondContact O-OG 3.47Å
343	L	88.8	Confident	88.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-82	-40.3	-171.2	-66.5	178.8	0	0	0	112.1	F293 R339 S346 I347 E380 L402	F293-L343 HydrophobicContact CD1-CD2 4.12Å; F293-L343 HydrophobicContact CE1-CD2 3.9Å; R339-L343 WeakPolarHBondContact O-CB 3.28Å; R339-L343 PolarHBondContact O-N 3.4Å; L343-S346 PolarHBondContact O-N 3.06Å; L343-I347 HydrophobicContact CB-CD1 3.92Å; L343-I347 WeakPolarHBondContact O-CB 3.47Å; L343-I347 VanDerWaalsContact O-CG1 3.27Å; L343-I347 WeakPolarHBondContact O-CG1 3.3Å; L343-I347 PolarHBondContact O-N 2.98Å; L343-E380 WeakPolarHBondContact CD1-OE2 3.33Å; L343-L402 HydrophobicContact CB-CD1 4.23Å; L343-L402 HydrophobicContact CB-CD2 4.32Å; L343-L402 HydrophobicContact CD1-CD1 4.04Å
344	G	87.6	Confident	88.5	Confident	20 Å²	20	34.6 Å²	34.6	21%	0.206	21%	0.208	C	C	.	.	H	α-helix	trans	-52.8	-57.8	-174.6	0	0	0	0	0	113.3	E340 S346 I347 A348	E340-G344 PolarHBondContact O-N 3.46Å; G344-S346 VanDerWaalsContact C-N 3.33Å; G344-S346 PolarHBondContact O-N 3.46Å; G344-I347 PolarHBondContact O-N 3.17Å; G344-A348 WeakPolarHBondContact O-CB 3.41Å; G344-A348 PolarHBondContact O-N 2.9Å
345	P	86.7	Confident	88.2	Confident	77 Å²	77	35.1 Å²	35.1	50%	0.5	21%	0.211	S	C	.	.	H	α-helix	trans	-63.4	-36.5	178.9	-22.8	33.8	0	0	0	113.5	C349	P345-C349 WeakPolarHBondContact O-CB 3.39Å; P345-C349 PolarHBondContact O-N 3.01Å; P345-C349 PolarHBondContact O-SG 3.44Å
346	S	85.4	Confident	87.8	Confident	29 Å²	29	39.3 Å²	39.3	20%	0.203	24%	0.24	C	C	.	.	H	α-helix	trans	-69.6	-41.8	-178.2	-55.5	0	0	0	0	111.8	L342 L343 G344 T350	L342-S346 PolarHBondContact O-OG 3.47Å; L343-S346 PolarHBondContact O-N 3.06Å; G344-S346 VanDerWaalsContact C-N 3.33Å; G344-S346 PolarHBondContact O-N 3.46Å; S346-T350 WeakPolarHBondContact O-CB 3.35Å; S346-T350 PolarHBondContact O-N 3.46Å; S346-T350 PolarHBondContact O-OG1 2.93Å
347	I	88.9	Confident	87.2	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.7	-48.8	175.4	-70	166.1	0	0	0	109.7	F293 L343 G344 C349 T350 V351 F372 M373 V376 L402	F293-I347 HydrophobicContact CE1-CG1 4.17Å; F293-I347 HydrophobicContact CZ-CG1 4.07Å; L343-I347 HydrophobicContact CB-CD1 3.92Å; L343-I347 WeakPolarHBondContact O-CB 3.47Å; L343-I347 VanDerWaalsContact O-CG1 3.27Å; L343-I347 WeakPolarHBondContact O-CG1 3.3Å; L343-I347 PolarHBondContact O-N 2.98Å; G344-I347 PolarHBondContact O-N 3.17Å; I347-C349 VanDerWaalsContact C-N 3.3Å; I347-C349 PolarHBondContact O-N 3.47Å; I347-T350 PolarHBondContact O-N 3.46Å; I347-T350 VanDerWaalsContact O-N 3.15Å; I347-V351 HydrophobicContact CG2-CG2 4.13Å; I347-V351 WeakPolarHBondContact O-CB 3.31Å; I347-V351 VanDerWaalsContact O-CG2 3.28Å; I347-V351 WeakPolarHBondContact O-CG2 3.44Å; I347-V351 PolarHBondContact O-N 3.26Å; I347-F372 HydrophobicContact CG1-CE1 4.34Å; I347-F372 HydrophobicContact CG1-CZ 4.39Å; I347-F372 HydrophobicContact CG2-CE1 4.29Å; I347-M373 HydrophobicContact CG2-SD 3.77Å; I347-V376 HydrophobicContact CD1-CG1 3.88Å; I347-L402 HydrophobicContact CD1-CB 4.26Å; I347-L402 HydrophobicContact CD1-CD1 4.11Å; I347-L402 HydrophobicContact CD1-CD2 4.13Å; I347-L402 HydrophobicContact CD1-CG 4.39Å
348	A	87.1	Confident	86.4	Confident	37 Å²	37	44.3 Å²	44.3	31%	0.306	26%	0.262	S	S	.	.	H	α-helix	trans	-57.3	-43	178.4	0	0	0	0	0	112.1	G344 A352	G344-A348 WeakPolarHBondContact O-CB 3.41Å; G344-A348 PolarHBondContact O-N 2.9Å; A348-A352 WeakPolarHBondContact O-CB 3.45Å; A348-A352 PolarHBondContact O-N 3.21Å
349	C	85.9	Confident	85.5	Confident	71 Å²	71	48.1 Å²	48.1	48%	0.48	28%	0.283	S	S	.	.	H	α-helix	trans	-64.4	-47.3	174.8	-69.6	0	0	0	0	112.1	P345 I347 V351 A352 E353	P345-C349 WeakPolarHBondContact O-CB 3.39Å; P345-C349 PolarHBondContact O-N 3.01Å; P345-C349 PolarHBondContact O-SG 3.44Å; I347-C349 VanDerWaalsContact C-N 3.3Å; I347-C349 PolarHBondContact O-N 3.47Å; C349-V351 VanDerWaalsContact C-N 3.35Å; C349-V351 PolarHBondContact O-N 2.9Å; C349-A352 PolarHBondContact O-N 3.12Å; C349-E353 WeakPolarHBondContact O-CG 3.42Å; C349-E353 PolarHBondContact O-N 3.28Å
350	T	85.7	Confident	84.7	Confident	14 Å²	14	60 Å²	60	9%	0.086	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-42.2	-179	-53.4	0	0	0	0	111.3	A289 S346 I347 E353 L354 F372	A289-T350 HydrophobicContact CB-CG2 4.39Å; S346-T350 WeakPolarHBondContact O-CB 3.35Å; S346-T350 PolarHBondContact O-N 3.46Å; S346-T350 PolarHBondContact O-OG1 2.93Å; I347-T350 PolarHBondContact O-N 3.46Å; I347-T350 VanDerWaalsContact O-N 3.15Å; T350-E353 PolarHBondContact O-N 3.1Å; T350-L354 HydrophobicContact CG2-CD1 4.42Å; T350-L354 WeakPolarHBondContact O-CB 3.16Å; T350-L354 VanDerWaalsContact O-CG 3.31Å; T350-L354 WeakPolarHBondContact O-CG 3.49Å; T350-L354 PolarHBondContact O-N 2.86Å; T350-F372 HydrophobicContact CG2-CE1 4.25Å; T350-F372 HydrophobicContact CG2-CE2 4.09Å; T350-F372 HydrophobicContact CG2-CZ 3.92Å
351	V	86.9	Confident	84.4	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-66.1	-38.9	176.8	174.9	0	0	0	0	111.2	I347 C349 T355 F372 L406 V409 F410	I347-V351 HydrophobicContact CG2-CG2 4.13Å; I347-V351 WeakPolarHBondContact O-CB 3.31Å; I347-V351 VanDerWaalsContact O-CG2 3.28Å; I347-V351 WeakPolarHBondContact O-CG2 3.44Å; I347-V351 PolarHBondContact O-N 3.26Å; C349-V351 VanDerWaalsContact C-N 3.35Å; C349-V351 PolarHBondContact O-N 2.9Å; V351-T355 WeakPolarHBondContact O-CB 3.33Å; V351-T355 PolarHBondContact O-N 3.43Å; V351-T355 PolarHBondContact O-OG1 2.66Å; V351-F372 HydrophobicContact CG2-CE1 4.49Å; V351-L406 HydrophobicContact CG1-CD1 3.85Å; V351-L406 HydrophobicContact CG2-CD1 3.75Å; V351-V409 HydrophobicContact CG1-CB 3.71Å; V351-V409 HydrophobicContact CG1-CG1 3.84Å; V351-V409 HydrophobicContact CG1-CG2 3.84Å; V351-F410 HydrophobicContact CG1-CE1 4.48Å
352	A	86.6	Confident	84.3	Confident	52 Å²	52	58.4 Å²	58.4	43%	0.43	32%	0.321	S	S	.	.	H	α-helix	trans	-65.6	-39.9	173.9	0	0	0	0	0	112.1	A348 C349 T355 S356	A348-A352 WeakPolarHBondContact O-CB 3.45Å; A348-A352 PolarHBondContact O-N 3.21Å; C349-A352 PolarHBondContact O-N 3.12Å; A352-T355 WeakPolarHBondContact O-CB 3.32Å; A352-T355 PolarHBondContact O-N 3.02Å; A352-S356 PolarHBondContact O-N 2.91Å
353	E	86.3	Confident	84.3	Confident	99 Å²	99	58.5 Å²	58.5	46%	0.463	32%	0.321	S	S	.	.	H	α-helix	trans	-63.3	-48.6	174.8	-75.6	176.3	-169.2	0	0	111.6	C349 T350 T355 S356 Q357	C349-E353 WeakPolarHBondContact O-CG 3.42Å; C349-E353 PolarHBondContact O-N 3.28Å; T350-E353 PolarHBondContact O-N 3.1Å; E353-T355 PolarHBondContact O-N 3Å; E353-S356 PolarHBondContact O-N 2.82Å; E353-S356 PolarHBondContact O-OG 3.39Å; E353-Q357 WeakPolarHBondContact O-CG 3.17Å; E353-Q357 PolarHBondContact O-N 3.4Å
354	L	85.8	Confident	84.2	Confident	40 Å²	40	59.7 Å²	59.7	21%	0.209	33%	0.331	C	S	.	.	H	α-helix	trans	-55.8	-41.7	174.8	-73.2	172.7	0	0	0	111.3	T350 Q357 N358 L365	T350-L354 HydrophobicContact CG2-CD1 4.42Å; T350-L354 WeakPolarHBondContact O-CB 3.16Å; T350-L354 VanDerWaalsContact O-CG 3.31Å; T350-L354 WeakPolarHBondContact O-CG 3.49Å; T350-L354 PolarHBondContact O-N 2.86Å; L354-Q357 PolarHBondContact O-N 3.33Å; L354-N358 PolarHBondContact O-N 3.19Å; L354-L365 HydrophobicContact CB-CD1 3.97Å; L354-L365 WeakPolarHBondContact O-CD1 3.44Å
355	T	85	Confident	84.3	Confident	24 Å²	24	58.9 Å²	58.9	15%	0.147	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-41.5	176.9	-60.1	0	0	0	0	112	V351 A352 E353 Q357 N359 L365 V409 L413	V351-T355 WeakPolarHBondContact O-CB 3.33Å; V351-T355 PolarHBondContact O-N 3.43Å; V351-T355 PolarHBondContact O-OG1 2.66Å; A352-T355 WeakPolarHBondContact O-CB 3.32Å; A352-T355 PolarHBondContact O-N 3.02Å; E353-T355 PolarHBondContact O-N 3Å; T355-Q357 VanDerWaalsContact C-N 3.35Å; T355-Q357 PolarHBondContact O-N 2.95Å; T355-N359 PolarHBondContact O-N 2.74Å; T355-L365 HydrophobicContact CG2-CD2 4.38Å; T355-V409 HydrophobicContact CG2-CG1 4.35Å; T355-V409 VanDerWaalsContact OG1-CG1 3.3Å; T355-V409 WeakPolarHBondContact OG1-CG1 3.27Å; T355-L413 HydrophobicContact CG2-CD1 3.86Å; T355-L413 HydrophobicContact CG2-CD2 4.46Å
356	S	83.9	Confident	84.4	Confident	87 Å²	87	55.6 Å²	55.6	61%	0.608	30%	0.3	S	S	*	.	H	α-helix	trans	-66.3	-35.8	178	76.5	0	0	0	0	112.9	A352 E353	A352-S356 PolarHBondContact O-N 2.91Å; E353-S356 PolarHBondContact O-N 2.82Å; E353-S356 PolarHBondContact O-OG 3.39Å
357	Q	80.1	Confident	84.7	Confident	147 Å²	147	58.9 Å²	58.9	69%	0.687	31%	0.308	S	S	*	.	H	α-helix	trans	-77.1	-35.1	-178	-69	175.4	18.4	0	0	112.3	E353 L354 T355	E353-Q357 WeakPolarHBondContact O-CG 3.17Å; E353-Q357 PolarHBondContact O-N 3.4Å; L354-Q357 PolarHBondContact O-N 3.33Å; T355-Q357 VanDerWaalsContact C-N 3.35Å; T355-Q357 PolarHBondContact O-N 2.95Å
358	N	75.2	Confident	84.6	Confident	48 Å²	48	61.4 Å²	61.4	26%	0.257	33%	0.326	S	S	.	.			trans	-114.3	30	-169.2	-146.7	17.1	0	0	0	114.7	L354 R360 D361 A364 L365	L354-N358 PolarHBondContact O-N 3.19Å; N358-R360 PolarHBondContact O-N 2.97Å; N358-D361 PolarHBondContact O-N 3.15Å; N358-A364 VanDerWaalsContact ND2-C 3.29Å; N358-A364 VanDerWaalsContact ND2-CB 3.25Å; N358-A364 WeakPolarHBondContact ND2-CB 3.46Å; N358-L365 HydrophobicContact CB-CB 4.19Å; N358-L365 HydrophobicContact CB-CD1 4.32Å; N358-L365 PolarHBondContact ND2-N 2.88Å
359	N	71.3	Confident	84.7	Confident	103 Å²	103	59.7 Å²	59.7	55%	0.551	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-12.8	-174.7	-163.7	12.1	0	0	0	114.7	T355	T355-N359 PolarHBondContact O-N 2.74Å
360	R	73.3	Confident	84.9	Confident	249 Å²	249	56.4 Å²	56.4	94%	0.94	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-25.5	178.8	-66.6	-173	178.9	-175.8	0.6	114	N358	N358-R360 PolarHBondContact O-N 2.97Å
361	D	85	Confident	85.1	Confident	74 Å²	74	57.6 Å²	57.6	40%	0.396	30%	0.301	S	S	.	.			trans	-121.2	92.7	-178.3	-172.8	-10.8	0	0	0	110.3	N358 C363 A364 L365	N358-D361 PolarHBondContact O-N 3.15Å; D361-C363 PolarHBondContact O-N 3.48Å; D361-C363 WeakPolarHBondContact OD1-CB 3.27Å; D361-C363 PolarHBondContact OD1-N 3.33Å; D361-A364 HydrophobicContact CB-CB 4.06Å; D361-A364 VanDerWaalsContact CG-CB 3.47Å; D361-A364 PolarHBondContact O-N 3.21Å; D361-A364 PolarHBondContact OD1-N 3.29Å; D361-A364 VanDerWaalsContact OD2-CB 3.27Å; D361-A364 WeakPolarHBondContact OD2-CB 3.3Å; D361-L365 WeakPolarHBondContact O-CB 3.38Å; D361-L365 PolarHBondContact O-N 2.85Å
362	H	86.6	Confident	85.2	Confident	51 Å²	51	59.1 Å²	59.1	24%	0.236	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-32.6	177.5	-59.8	-58.2	0	0	0	112.4	V366 T422 L426	H362-V366 WeakPolarHBondContact O-CG2 2.93Å; H362-V366 PolarHBondContact O-N 3.49Å; H362-T422 HydrophobicContact CB-CG2 4.1Å; H362-L426 HydrophobicContact CB-CD1 4.47Å
363	C	87.6	Confident	85.4	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.034	29%	0.287	C	S	.	.	H	α-helix	trans	-73.7	-45.4	-177.3	-67.4	0	0	0	0	111.2	D361 L365 V366 R367 I429	D361-C363 PolarHBondContact O-N 3.48Å; D361-C363 WeakPolarHBondContact OD1-CB 3.27Å; D361-C363 PolarHBondContact OD1-N 3.33Å; C363-L365 VanDerWaalsContact C-N 3.29Å; C363-L365 PolarHBondContact O-N 3.06Å; C363-V366 PolarHBondContact O-N 2.82Å; C363-R367 WeakPolarHBondContact O-CG 3.45Å; C363-R367 PolarHBondContact O-N 3.04Å; C363-I429 HydrophobicContact CB-CD1 3.66Å
364	A	87.8	Confident	85.6	Confident	25 Å²	25	52.1 Å²	52.1	21%	0.207	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-34.6	174.6	0	0	0	0	0	112.1	N358 D361 S368	N358-A364 VanDerWaalsContact ND2-C 3.29Å; N358-A364 VanDerWaalsContact ND2-CB 3.25Å; N358-A364 WeakPolarHBondContact ND2-CB 3.46Å; D361-A364 HydrophobicContact CB-CB 4.06Å; D361-A364 VanDerWaalsContact CG-CB 3.47Å; D361-A364 PolarHBondContact O-N 3.21Å; D361-A364 PolarHBondContact OD1-N 3.29Å; D361-A364 VanDerWaalsContact OD2-CB 3.27Å; D361-A364 WeakPolarHBondContact OD2-CB 3.3Å; A364-S368 WeakPolarHBondContact O-CB 3.3Å; A364-S368 PolarHBondContact O-N 3.45Å; A364-S368 PolarHBondContact O-OG 2.94Å
365	L	89.9	Confident	85.7	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-49.5	175.3	177.3	58.9	0	0	0	111.7	L354 T355 N358 D361 C363 S368 G369 F410 L413	L354-L365 HydrophobicContact CB-CD1 3.97Å; L354-L365 WeakPolarHBondContact O-CD1 3.44Å; T355-L365 HydrophobicContact CG2-CD2 4.38Å; N358-L365 HydrophobicContact CB-CB 4.19Å; N358-L365 HydrophobicContact CB-CD1 4.32Å; N358-L365 PolarHBondContact ND2-N 2.88Å; D361-L365 WeakPolarHBondContact O-CB 3.38Å; D361-L365 PolarHBondContact O-N 2.85Å; C363-L365 VanDerWaalsContact C-N 3.29Å; C363-L365 PolarHBondContact O-N 3.06Å; L365-S368 PolarHBondContact O-N 2.84Å; L365-G369 PolarHBondContact O-N 2.91Å; L365-F410 HydrophobicContact CD1-CE1 4.07Å; L365-F410 HydrophobicContact CD1-CZ 4.41Å; L365-F410 HydrophobicContact CD2-CE1 4.11Å; L365-F410 HydrophobicContact CG-CE1 3.77Å; L365-F410 HydrophobicContact CG-CZ 4.14Å; L365-L413 HydrophobicContact CD2-CD1 3.55Å
366	V	89.1	Confident	85.9	Confident	8 Å²	8	54.5 Å²	54.5	5%	0.048	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-43.3	179	169.6	0	0	0	0	111	H362 C363 S368 G369 C370 F410 L426 I429 L430 M456	H362-V366 WeakPolarHBondContact O-CG2 2.93Å; H362-V366 PolarHBondContact O-N 3.49Å; C363-V366 PolarHBondContact O-N 2.82Å; V366-S368 PolarHBondContact O-N 3.39Å; V366-G369 PolarHBondContact O-N 3.48Å; V366-C370 VanDerWaalsContact O-CB 3.26Å; V366-C370 WeakPolarHBondContact O-CB 3.26Å; V366-C370 PolarHBondContact O-N 3.39Å; V366-C370 PolarHBondContact O-SG 2.96Å; V366-C370 VanDerWaalsContact O-SG 3.32Å; V366-F410 HydrophobicContact CG2-CD2 4.28Å; V366-F410 HydrophobicContact CG2-CE2 4.21Å; V366-L426 HydrophobicContact CB-CD2 3.93Å; V366-L426 HydrophobicContact CG1-CD2 4.36Å; V366-L426 HydrophobicContact CG2-CD2 3.72Å; V366-I429 HydrophobicContact CG1-CG2 4.41Å; V366-L430 HydrophobicContact CG1-CD2 3.71Å; V366-L430 HydrophobicContact CG1-CG 4.3Å; V366-M456 HydrophobicContact CG1-CE 4.46Å
367	R	90.1	Very high	86.2	Confident	98 Å²	98	50.4 Å²	50.4	37%	0.37	25%	0.246	S	C	.	.	H	α-helix	trans	-58	-48.2	174.4	-74.4	-175.8	-178.4	105.2	-3.3	112.3	C363 A371 I429 E433	C363-R367 WeakPolarHBondContact O-CG 3.45Å; C363-R367 PolarHBondContact O-N 3.04Å; R367-A371 WeakPolarHBondContact O-CB 3.48Å; R367-A371 PolarHBondContact O-N 3.21Å; R367-I429 HydrophobicContact CG-CD1 4.26Å; R367-I429 HydrophobicContact CG-CG1 4.44Å; R367-I429 HydrophobicContact CG-CG2 3.68Å; R367-I429 VanDerWaalsContact CZ-CG1 3.49Å; R367-E433 WeakPolarHBondContact CD-OE2 3.43Å; R367-E433 IonicContact CZ-OE1 3.98Å; R367-E433 IonicContact CZ-OE2 3.67Å; R367-E433 IonicContact NE-OE1 2.78Å; R367-E433 PolarHBondContact NE-OE1 2.94Å; R367-E433 IonicContact NE-OE2 2.85Å; R367-E433 PolarHBondContact NE-OE2 3.3Å; R367-E433 IonicContact NH2-OE1 3.73Å; R367-E433 PolarHBondContact NH2-OE1 2.97Å; R367-E433 IonicContact NH2-OE2 3.53Å
368	S	88.3	Confident	86.7	Confident	54 Å²	54	45.1 Å²	45.1	38%	0.378	22%	0.222	S	C	.	.	H	α-helix	trans	-67.3	-41.8	-178	-54.6	0	0	0	0	111.8	A364 L365 V366 F372	A364-S368 WeakPolarHBondContact O-CB 3.3Å; A364-S368 PolarHBondContact O-N 3.45Å; A364-S368 PolarHBondContact O-OG 2.94Å; L365-S368 PolarHBondContact O-N 2.84Å; V366-S368 PolarHBondContact O-N 3.39Å; S368-F372 VanDerWaalsContact O-CB 3.28Å; S368-F372 WeakPolarHBondContact O-CB 3.43Å; S368-F372 PolarHBondContact O-N 3.01Å
369	G	89.1	Confident	87.3	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-68.3	-41	177.5	0	0	0	0	0	113.3	L365 V366 M373	L365-G369 PolarHBondContact O-N 2.91Å; V366-G369 PolarHBondContact O-N 3.48Å; G369-M373 PolarHBondContact O-N 3.05Å
370	C	89.6	Confident	88.3	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.014	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-44.8	174	-72.3	0	0	0	0	111.6	V366 F372 M373 V374 V434 F449	V366-C370 VanDerWaalsContact O-CB 3.26Å; V366-C370 WeakPolarHBondContact O-CB 3.26Å; V366-C370 PolarHBondContact O-N 3.39Å; V366-C370 PolarHBondContact O-SG 2.96Å; V366-C370 VanDerWaalsContact O-SG 3.32Å; C370-F372 VanDerWaalsContact C-N 3.33Å; C370-F372 PolarHBondContact O-N 3.03Å; C370-M373 PolarHBondContact O-N 3.15Å; C370-V374 VanDerWaalsContact O-CG2 3.27Å; C370-V374 WeakPolarHBondContact O-CG2 3.43Å; C370-V374 PolarHBondContact O-N 3.36Å; C370-V434 HydrophobicContact CB-CG1 4.34Å; C370-V434 HydrophobicContact CB-CG2 3.93Å; C370-F449 HydrophobicContact CB-CZ 4.06Å
371	A	89.2	Confident	89.1	Confident	39 Å²	39	30 Å²	30	32%	0.322	16%	0.159	S	C	.	.	H	α-helix	trans	-60.3	-43.5	176.5	0	0	0	0	0	111.8	R367 V374 H375	R367-A371 WeakPolarHBondContact O-CB 3.48Å; R367-A371 PolarHBondContact O-N 3.21Å; A371-V374 PolarHBondContact O-N 3.12Å; A371-H375 PolarHBondContact O-CD2 3.22Å; A371-H375 PolarHBondContact O-N 3.39Å; A371-H375 VanDerWaalsContact O-N 3.09Å
372	F	89.8	Confident	89.3	Confident	32 Å²	32	30.6 Å²	30.6	14%	0.14	16%	0.159	C	C	.	.	H	α-helix	trans	-58.2	-49.8	173.9	170.5	-106	0	0	0	111.9	F293 I347 T350 V351 S368 C370 V374 H375 V376	F293-F372 HydrophobicContact CD2-CE2 4.42Å; F293-F372 HydrophobicContact CE1-CZ 4.43Å; F293-F372 AromaticContact CE2-CE2 4Å; F293-F372 HydrophobicContact CE2-CE2 4Å; F293-F372 AromaticContact CE2-CZ 3.82Å; F293-F372 HydrophobicContact CE2-CZ 3.82Å; F293-F372 HydrophobicContact CZ-CE2 4.27Å; F293-F372 AromaticContact CZ-CZ 3.71Å; F293-F372 HydrophobicContact CZ-CZ 3.71Å; I347-F372 HydrophobicContact CG1-CE1 4.34Å; I347-F372 HydrophobicContact CG1-CZ 4.39Å; I347-F372 HydrophobicContact CG2-CE1 4.29Å; T350-F372 HydrophobicContact CG2-CE1 4.25Å; T350-F372 HydrophobicContact CG2-CE2 4.09Å; T350-F372 HydrophobicContact CG2-CZ 3.92Å; V351-F372 HydrophobicContact CG2-CE1 4.49Å; S368-F372 VanDerWaalsContact O-CB 3.28Å; S368-F372 WeakPolarHBondContact O-CB 3.43Å; S368-F372 PolarHBondContact O-N 3.01Å; C370-F372 VanDerWaalsContact C-N 3.33Å; C370-F372 PolarHBondContact O-N 3.03Å; F372-V374 VanDerWaalsContact C-N 3.34Å; F372-V374 PolarHBondContact O-N 3.48Å; F372-H375 PolarHBondContact O-N 2.83Å; F372-V376 HydrophobicContact CD2-CG2 4.36Å; F372-V376 HydrophobicContact CE1-CG2 4.08Å; F372-V376 HydrophobicContact CE2-CG2 3.9Å; F372-V376 HydrophobicContact CZ-CG2 3.75Å; F372-V376 WeakPolarHBondContact O-CG2 3.41Å; F372-V376 PolarHBondContact O-N 3.13Å
373	M	90.4	Very high	89.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.5	-33.7	179.3	-75.1	-53.7	-59.2	0	0	113.2	I347 G369 C370 H375 V376 C377 L402 L406 F449	I347-M373 HydrophobicContact CG2-SD 3.77Å; G369-M373 PolarHBondContact O-N 3.05Å; C370-M373 PolarHBondContact O-N 3.15Å; M373-H375 VanDerWaalsContact C-N 3.33Å; M373-H375 PolarHBondContact O-N 3.13Å; M373-V376 PolarHBondContact O-N 3.12Å; M373-C377 WeakPolarHBondContact O-CB 3.47Å; M373-C377 PolarHBondContact O-N 3.25Å; M373-C377 PolarHBondContact O-SG 3.12Å; M373-L402 HydrophobicContact CE-CB 4.39Å; M373-L406 HydrophobicContact CB-CD2 4.32Å; M373-L406 HydrophobicContact CG-CB 4.13Å; M373-L406 HydrophobicContact CG-CD1 4.14Å; M373-L406 HydrophobicContact CG-CD2 3.74Å; M373-L406 HydrophobicContact CG-CG 4.21Å; M373-F449 HydrophobicContact CB-CD2 4.03Å; M373-F449 HydrophobicContact CB-CE2 3.62Å; M373-F449 HydrophobicContact CB-CZ 4.47Å
374	V	90.1	Very high	89.7	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-59.2	-46.1	172.4	167.4	0	0	0	0	110.4	C370 A371 F372 C377 Q378 H438 L446 F449	C370-V374 VanDerWaalsContact O-CG2 3.27Å; C370-V374 WeakPolarHBondContact O-CG2 3.43Å; C370-V374 PolarHBondContact O-N 3.36Å; A371-V374 PolarHBondContact O-N 3.12Å; F372-V374 VanDerWaalsContact C-N 3.34Å; F372-V374 PolarHBondContact O-N 3.48Å; V374-C377 PolarHBondContact O-N 2.93Å; V374-Q378 WeakPolarHBondContact O-CB 3.39Å; V374-Q378 VanDerWaalsContact O-CG 3.29Å; V374-Q378 WeakPolarHBondContact O-CG 3.12Å; V374-Q378 PolarHBondContact O-N 3.03Å; V374-H438 HydrophobicContact CG2-CB 4.38Å; V374-L446 HydrophobicContact CG1-CD1 4.2Å; V374-L446 HydrophobicContact CG1-CD2 4.38Å; V374-F449 HydrophobicContact CG2-CD1 4.08Å; V374-F449 HydrophobicContact CG2-CE1 3.49Å; V374-F449 VanDerWaalsContact CG2-CE1 3.49Å; V374-F449 HydrophobicContact CG2-CZ 3.87Å
375	H	88.8	Confident	89.8	Confident	109 Å²	109	30.6 Å²	30.6	51%	0.505	16%	0.157	S	C	.	.	H	α-helix	trans	-62.7	-45.1	176.5	-73.2	-54.1	0	0	0	112.4	A371 F372 M373 C377 Q378 D379	A371-H375 PolarHBondContact O-CD2 3.22Å; A371-H375 PolarHBondContact O-N 3.39Å; A371-H375 VanDerWaalsContact O-N 3.09Å; F372-H375 PolarHBondContact O-N 2.83Å; M373-H375 VanDerWaalsContact C-N 3.33Å; M373-H375 PolarHBondContact O-N 3.13Å; H375-C377 VanDerWaalsContact C-N 3.35Å; H375-C377 PolarHBondContact O-N 3.03Å; H375-Q378 PolarHBondContact O-N 3.08Å; H375-D379 WeakPolarHBondContact O-CB 3.41Å; H375-D379 PolarHBondContact O-N 3.47Å
376	V	89.8	Confident	89.8	Confident	6 Å²	6	32.5 Å²	32.5	4%	0.036	17%	0.166	C	C	.	.	H	α-helix	trans	-59.4	-44.5	177.4	172.3	0	0	0	0	111.7	I347 F372 M373 D379 E380	I347-V376 HydrophobicContact CD1-CG1 3.88Å; F372-V376 HydrophobicContact CD2-CG2 4.36Å; F372-V376 HydrophobicContact CE1-CG2 4.08Å; F372-V376 HydrophobicContact CE2-CG2 3.9Å; F372-V376 HydrophobicContact CZ-CG2 3.75Å; F372-V376 WeakPolarHBondContact O-CG2 3.41Å; F372-V376 PolarHBondContact O-N 3.13Å; M373-V376 PolarHBondContact O-N 3.12Å; V376-D379 PolarHBondContact O-N 3.16Å; V376-E380 WeakPolarHBondContact O-CB 3.28Å; V376-E380 PolarHBondContact O-N 3.16Å
377	C	90	Very high	89.8	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.007	16%	0.164	C	C	.	.	H	α-helix	trans	-65.3	-39.8	178.4	-70.4	0	0	0	0	112.4	M373 V374 H375 H381 L446	M373-C377 WeakPolarHBondContact O-CB 3.47Å; M373-C377 PolarHBondContact O-N 3.25Å; M373-C377 PolarHBondContact O-SG 3.12Å; V374-C377 PolarHBondContact O-N 2.93Å; H375-C377 VanDerWaalsContact C-N 3.35Å; H375-C377 PolarHBondContact O-N 3.03Å; C377-H381 WeakPolarHBondContact O-CB 3.44Å; C377-H381 PolarHBondContact O-N 3.46Å; C377-H381 VanDerWaalsContact O-N 3.08Å; C377-H381 PolarHBondContact O-ND1 3Å; C377-L446 HydrophobicContact CB-CD2 3.68Å
378	Q	89.1	Confident	89.9	Confident	36 Å²	36	27.7 Å²	27.7	17%	0.168	15%	0.147	C	C	.	.	H	α-helix	trans	-66.5	-47.1	175.9	-74.4	174.2	-16.4	0	0	111.6	V374 H375 E380 H381 Q382 N442 L446	V374-Q378 WeakPolarHBondContact O-CB 3.39Å; V374-Q378 VanDerWaalsContact O-CG 3.29Å; V374-Q378 WeakPolarHBondContact O-CG 3.12Å; V374-Q378 PolarHBondContact O-N 3.03Å; H375-Q378 PolarHBondContact O-N 3.08Å; Q378-E380 VanDerWaalsContact C-N 3.33Å; Q378-E380 PolarHBondContact O-N 2.92Å; Q378-H381 PolarHBondContact O-N 3.41Å; Q378-Q382 WeakPolarHBondContact O-CG 3.34Å; Q378-Q382 PolarHBondContact O-N 3.09Å; Q378-N442 PolarHBondContact NE2-ND2 3.09Å; Q378-L446 HydrophobicContact CG-CD2 4.46Å
379	D	89.3	Confident	89.8	Confident	62 Å²	62	28.4 Å²	28.4	33%	0.332	15%	0.149	S	C	.	.	H	α-helix	trans	-64.9	-37.9	-179.8	-74.2	-16.6	0	0	0	111.6	Y297 H375 V376 Q382 L383	Y297-D379 HydrophobicContact CD1-CB 4.25Å; Y297-D379 HydrophobicContact CE1-CB 3.72Å; Y297-D379 HydrophobicContact CE2-CB 4.14Å; H375-D379 WeakPolarHBondContact O-CB 3.41Å; H375-D379 PolarHBondContact O-N 3.47Å; V376-D379 PolarHBondContact O-N 3.16Å; D379-Q382 PolarHBondContact O-N 3.33Å; D379-L383 WeakPolarHBondContact O-CB 3.22Å; D379-L383 PolarHBondContact O-N 3.38Å
380	E	91.2	Very high	89.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-70.3	-38.2	176.3	-167.5	60.5	-151.1	0	0	112.2	Y335 R339 L343 V376 Q378 L383 Y384 L395 L399	Y335-E380 PolarHBondContact OH-OE1 2.93Å; R339-E380 WeakPolarHBondContact CG-OE1 3.27Å; R339-E380 IonicContact CZ-OE2 3.45Å; R339-E380 IonicContact NE-OE1 3.7Å; R339-E380 PolarHBondContact NE-OE1 3.13Å; R339-E380 VanDerWaalsContact NE-OE1 3.16Å; R339-E380 IonicContact NE-OE2 3.09Å; R339-E380 PolarHBondContact NE-OE2 2.95Å; R339-E380 VanDerWaalsContact NE-OE2 3.08Å; R339-E380 IonicContact NH2-OE2 2.84Å; R339-E380 PolarHBondContact NH2-OE2 2.89Å; L343-E380 WeakPolarHBondContact CD1-OE2 3.33Å; V376-E380 WeakPolarHBondContact O-CB 3.28Å; V376-E380 PolarHBondContact O-N 3.16Å; Q378-E380 VanDerWaalsContact C-N 3.33Å; Q378-E380 PolarHBondContact O-N 2.92Å; E380-L383 PolarHBondContact O-N 3.49Å; E380-Y384 VanDerWaalsContact O-CB 3.28Å; E380-Y384 WeakPolarHBondContact O-CB 3.26Å; E380-Y384 PolarHBondContact O-N 3.43Å; E380-L395 HydrophobicContact CG-CD1 4.22Å; E380-L399 HydrophobicContact CB-CD2 4.11Å; E380-L399 HydrophobicContact CG-CD2 4.2Å
381	H	89.8	Confident	88.9	Confident	21 Å²	21	37.2 Å²	37.2	10%	0.097	20%	0.199	C	C	.	.	H	α-helix	trans	-61.4	-44.9	171.4	-99.4	92.4	0	0	0	112.1	C377 Q378 Y384 N385 L399 Q445	C377-H381 WeakPolarHBondContact O-CB 3.44Å; C377-H381 PolarHBondContact O-N 3.46Å; C377-H381 VanDerWaalsContact O-N 3.08Å; C377-H381 PolarHBondContact O-ND1 3Å; Q378-H381 PolarHBondContact O-N 3.41Å; H381-Y384 PolarHBondContact O-N 3.36Å; H381-N385 VanDerWaalsContact O-CG 3.24Å; H381-N385 PolarHBondContact O-N 3.48Å; H381-N385 VanDerWaalsContact O-N 3.08Å; H381-N385 PolarHBondContact O-ND2 2.87Å; H381-L399 WeakPolarHBondContact CE1-CD1 3.28Å; H381-L399 WeakPolarHBondContact ND1-CD1 3.5Å; H381-Q445 HydrophobicContact CB-CB 4.28Å; H381-Q445 HydrophobicContact CB-CG 4.03Å; H381-Q445 PolarHBondContact CE1-O 3.02Å; H381-Q445 PolarHBondContact ND1-O 2.93Å; H381-Q445 VanDerWaalsContact ND1-O 3.16Å
382	Q	89.9	Confident	88.5	Confident	85 Å²	85	37 Å²	37	40%	0.397	19%	0.194	S	C	.	.	H	α-helix	trans	-62.1	-45.5	176.8	-72.5	178.1	25.2	0	0	111.5	Q378 D379 N385 E386	Q378-Q382 WeakPolarHBondContact O-CG 3.34Å; Q378-Q382 PolarHBondContact O-N 3.09Å; D379-Q382 PolarHBondContact O-N 3.33Å; Q382-N385 PolarHBondContact O-N 3.35Å; Q382-E386 PolarHBondContact O-N 3.01Å
383	L	91	Very high	88.2	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-43.3	177.9	-174.6	66.3	0	0	0	111.2	Y297 F300 R301 Y335 D379 E380 N385 E386 F387	Y297-L383 HydrophobicContact CD1-CB 4.31Å; Y297-L383 HydrophobicContact CD1-CD2 3.89Å; Y297-L383 HydrophobicContact CE1-CD2 4.21Å; F300-L383 HydrophobicContact CB-CD1 3.97Å; F300-L383 HydrophobicContact CB-CD2 3.89Å; F300-L383 HydrophobicContact CB-CG 4.49Å; F300-L383 HydrophobicContact CG-CD2 4.43Å; R301-L383 HydrophobicContact CB-CD1 4.26Å; Y335-L383 WeakPolarHBondContact OH-CD2 3.27Å; D379-L383 WeakPolarHBondContact O-CB 3.22Å; D379-L383 PolarHBondContact O-N 3.38Å; E380-L383 PolarHBondContact O-N 3.49Å; L383-N385 VanDerWaalsContact C-N 3.3Å; L383-N385 PolarHBondContact O-N 3.2Å; L383-E386 WeakPolarHBondContact O-CB 3.3Å; L383-E386 PolarHBondContact O-N 3.09Å; L383-F387 HydrophobicContact CD1-CE2 3.96Å; L383-F387 HydrophobicContact CG-CD2 4.48Å; L383-F387 HydrophobicContact CG-CE2 4.21Å; L383-F387 WeakPolarHBondContact O-CD2 3.18Å
384	Y	91.3	Very high	88	Confident	4 Å²	4	41 Å²	41	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-57.5	-44.6	177.2	-177.1	-89.5	0	0	0	111.5	H332 Y335 E380 H381 E386 F387 F388 T392 L395	H332-Y384 PolarHBondContact NE2-OH 2.84Å; Y335-Y384 HydrophobicContact CD1-CD2 4.33Å; Y335-Y384 AromaticContact CE1-CD2 3.98Å; Y335-Y384 HydrophobicContact CE1-CD2 3.98Å; E380-Y384 VanDerWaalsContact O-CB 3.28Å; E380-Y384 WeakPolarHBondContact O-CB 3.26Å; E380-Y384 PolarHBondContact O-N 3.43Å; H381-Y384 PolarHBondContact O-N 3.36Å; Y384-E386 PolarHBondContact O-N 2.94Å; Y384-F387 PolarHBondContact O-N 3.26Å; Y384-F388 HydrophobicContact CD1-CB 4.22Å; Y384-F388 HydrophobicContact CD1-CD2 4.3Å; Y384-F388 AromaticContact CD2-CD2 3.62Å; Y384-F388 HydrophobicContact CD2-CD2 3.62Å; Y384-F388 HydrophobicContact CD2-CE2 4.08Å; Y384-F388 HydrophobicContact CE1-CB 3.64Å; Y384-F388 HydrophobicContact CE1-CD2 4.03Å; Y384-F388 HydrophobicContact CE1-CG 4.11Å; Y384-F388 HydrophobicContact CE2-CB 4.44Å; Y384-F388 AromaticContact CE2-CD2 3.32Å; Y384-F388 HydrophobicContact CE2-CD2 3.32Å; Y384-F388 AromaticContact CE2-CE2 3.76Å; Y384-F388 HydrophobicContact CE2-CE2 3.76Å; Y384-F388 HydrophobicContact CE2-CG 4Å; Y384-F388 HydrophobicContact CG-CD2 4.1Å; Y384-F388 AromaticContact CZ-CD2 3.53Å; Y384-F388 AromaticContact CZ-CG 3.72Å; Y384-F388 PolarHBondContact O-N 2.96Å; Y384-T392 WeakPolarHBondContact OH-CB 3.26Å; Y384-T392 PolarHBondContact OH-OG1 3.13Å; Y384-L395 HydrophobicContact CD1-CD2 3.94Å; Y384-L395 HydrophobicContact CD2-CD1 4.08Å; Y384-L395 HydrophobicContact CD2-CD2 4.11Å; Y384-L395 HydrophobicContact CG-CD1 4.36Å; Y384-L395 HydrophobicContact CG-CD2 3.7Å
385	N	89.7	Confident	87.8	Confident	77 Å²	77	41 Å²	41	41%	0.412	22%	0.221	S	C	.	.	H	α-helix	trans	-66.6	-14.3	177.3	-68.4	-23.5	0	0	0	113.9	R308 H381 Q382 L383 F388	R308-N385 PolarHBondContact NH1-O 2.95Å; H381-N385 VanDerWaalsContact O-CG 3.24Å; H381-N385 PolarHBondContact O-N 3.48Å; H381-N385 VanDerWaalsContact O-N 3.08Å; H381-N385 PolarHBondContact O-ND2 2.87Å; Q382-N385 PolarHBondContact O-N 3.35Å; L383-N385 VanDerWaalsContact C-N 3.3Å; L383-N385 PolarHBondContact O-N 3.2Å; N385-F388 CarbonylContact C-O 3.59Å
386	E	89.6	Confident	87.8	Confident	43 Å²	43	38.6 Å²	38.6	20%	0.201	21%	0.212	C	C	.	.	H	α-helix	trans	-78.8	-28.6	171.4	-71.6	170.3	-163.5	0	0	112.5	R301 A304 R308 Q382 L383 Y384	R301-E386 WeakPolarHBondContact CB-OE2 3.45Å; R301-E386 WeakPolarHBondContact CG-OE2 3.44Å; R301-E386 IonicContact CZ-OE1 3.94Å; R301-E386 VanDerWaalsContact NE-CD 3.27Å; R301-E386 IonicContact NE-OE1 3.52Å; R301-E386 PolarHBondContact NE-OE1 3.26Å; R301-E386 IonicContact NE-OE2 3.71Å; R301-E386 PolarHBondContact NE-OE2 3.3Å; R301-E386 VanDerWaalsContact NE-OE2 3.07Å; R301-E386 IonicContact NH2-OE1 3.91Å; R301-E386 PolarHBondContact NH2-OE1 2.95Å; A304-E386 HydrophobicContact CB-CB 4.1Å; R308-E386 WeakPolarHBondContact CD-O 3.31Å; R308-E386 PolarHBondContact NH1-O 3.38Å; Q382-E386 PolarHBondContact O-N 3.01Å; L383-E386 WeakPolarHBondContact O-CB 3.3Å; L383-E386 PolarHBondContact O-N 3.09Å; Y384-E386 PolarHBondContact O-N 2.94Å
387	F	89.9	Confident	87.8	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.009	23%	0.233	C	C	.	.	H	α-helix	trans	-93.2	-42.3	178.4	-75.6	-92.5	0	0	0	113.1	L271 F300 A304 I311 Y335 L383 Y384	L271-F387 HydrophobicContact CD2-CE1 4.02Å; L271-F387 HydrophobicContact CD2-CZ 4.46Å; F300-F387 HydrophobicContact CB-CE2 4.42Å; F300-F387 HydrophobicContact CB-CZ 4.49Å; F300-F387 HydrophobicContact CD1-CE2 4.48Å; F300-F387 HydrophobicContact CD1-CZ 4.23Å; F300-F387 WeakPolarHBondContact O-CZ 3.42Å; A304-F387 HydrophobicContact CB-CD1 4.27Å; A304-F387 HydrophobicContact CB-CD2 3.98Å; A304-F387 HydrophobicContact CB-CE1 4Å; A304-F387 HydrophobicContact CB-CE2 3.67Å; A304-F387 HydrophobicContact CB-CG 4.27Å; A304-F387 HydrophobicContact CB-CZ 3.68Å; I311-F387 HydrophobicContact CD1-CB 4.39Å; I311-F387 HydrophobicContact CD1-CD1 4.41Å; I311-F387 WeakPolarHBondContact CG2-O 3.18Å; Y335-F387 AromaticContact CE2-CD2 3.89Å; Y335-F387 HydrophobicContact CE2-CD2 3.89Å; Y335-F387 HydrophobicContact CE2-CE2 4.09Å; Y335-F387 HydrophobicContact CE2-CG 4.21Å; L383-F387 HydrophobicContact CD1-CE2 3.96Å; L383-F387 HydrophobicContact CG-CD2 4.48Å; L383-F387 HydrophobicContact CG-CE2 4.21Å; L383-F387 WeakPolarHBondContact O-CD2 3.18Å; Y384-F387 PolarHBondContact O-N 3.26Å
388	F	91.3	Very high	87.7	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.009	23%	0.234	C	C	.	.			trans	-117.4	148	-171.8	-58.2	-79.1	0	0	0	111	I311 I331 H332 Y335 Y384 N385	I311-F388 HydrophobicContact CD1-CD1 4.4Å; I311-F388 HydrophobicContact CD1-CE1 3.86Å; I311-F388 HydrophobicContact CD1-CZ 4.12Å; I311-F388 HydrophobicContact CG1-CE1 4.32Å; I311-F388 HydrophobicContact CG2-CD1 3.42Å; I311-F388 VanDerWaalsContact CG2-CD1 3.42Å; I311-F388 HydrophobicContact CG2-CE1 3.7Å; I311-F388 HydrophobicContact CG2-CG 4.36Å; I331-F388 HydrophobicContact CG2-CE1 3.99Å; I331-F388 HydrophobicContact CG2-CZ 4.01Å; H332-F388 AromaticContact CD2-CD1 3.54Å; H332-F388 AromaticContact CD2-CE1 3.22Å; H332-F388 WeakPolarHBondContact CD2-CE1 3.26Å; H332-F388 AromaticContact CD2-CZ 3.62Å; H332-F388 AromaticContact NE2-CD1 3.26Å; H332-F388 VanDerWaalsContact NE2-CD1 3.26Å; H332-F388 WeakPolarHBondContact NE2-CD1 3.4Å; H332-F388 AromaticContact NE2-CE1 3.46Å; H332-F388 WeakPolarHBondContact NE2-CE1 3.24Å; H332-F388 AromaticContact NE2-CG 3.95Å; Y335-F388 HydrophobicContact CD1-CE2 4.22Å; Y335-F388 HydrophobicContact CD2-CE2 4.14Å; Y335-F388 AromaticContact CG-CE2 3.95Å; Y335-F388 HydrophobicContact CG-CE2 3.95Å; Y335-F388 HydrophobicContact CG-CZ 4.41Å; Y384-F388 HydrophobicContact CD1-CB 4.22Å; Y384-F388 HydrophobicContact CD1-CD2 4.3Å; Y384-F388 AromaticContact CD2-CD2 3.62Å; Y384-F388 HydrophobicContact CD2-CD2 3.62Å; Y384-F388 HydrophobicContact CD2-CE2 4.08Å; Y384-F388 HydrophobicContact CE1-CB 3.64Å; Y384-F388 HydrophobicContact CE1-CD2 4.03Å; Y384-F388 HydrophobicContact CE1-CG 4.11Å; Y384-F388 HydrophobicContact CE2-CB 4.44Å; Y384-F388 AromaticContact CE2-CD2 3.32Å; Y384-F388 HydrophobicContact CE2-CD2 3.32Å; Y384-F388 AromaticContact CE2-CE2 3.76Å; Y384-F388 HydrophobicContact CE2-CE2 3.76Å; Y384-F388 HydrophobicContact CE2-CG 4Å; Y384-F388 HydrophobicContact CG-CD2 4.1Å; Y384-F388 AromaticContact CZ-CD2 3.53Å; Y384-F388 AromaticContact CZ-CG 3.72Å; Y384-F388 PolarHBondContact O-N 2.96Å; N385-F388 CarbonylContact C-O 3.59Å
389	T	86	Confident	87.8	Confident	69 Å²	69	41.8 Å²	41.8	42%	0.423	23%	0.226	S	C	.	.	S	Bend	trans	-100.5	-22.6	177.8	67.1	0	0	0	0	112.6	E315	E315-T389 PolarHBondContact OE1-N 2.85Å; E315-T389 WeakPolarHBondContact OE2-CB 3.28Å; E315-T389 PolarHBondContact OE2-N 3.18Å; E315-T389 PolarHBondContact OE2-OG1 2.92Å
390	K	82.1	Confident	87.8	Confident	67 Å²	67	43.4 Å²	43.4	29%	0.291	23%	0.232	S	C	.	.	S	Bend	trans	-103.1	133.3	-179.1	-64.1	-178	176.9	178.5	0	111.8	E315 E319	E315-K390 HydrophobicContact CB-CD 4.33Å; E315-K390 PolarHBondContact O-NZ 3.18Å; E315-K390 PolarHBondContact OE1-N 2.68Å; E319-K390 IonicContact OE1-NZ 3.33Å; E319-K390 PolarHBondContact OE1-NZ 3.19Å
391	P	78.4	Confident	87.7	Confident	122 Å²	122	48.8 Å²	48.8	79%	0.792	26%	0.256	S	S	*	.			trans	-67.6	145	175.5	29.1	-34.1	0	0	0	110.7
392	T	80.8	Confident	87.7	Confident	35 Å²	35	48.1 Å²	48.1	22%	0.215	25%	0.253	C	S	.	.			trans	-138.6	133	-177.6	-62.1	0	0	0	0	110.7	H332 Y384 K394 L395	H332-T392 PolarHBondContact CE1-OG1 3.42Å; H332-T392 VanDerWaalsContact CE1-OG1 3.29Å; Y384-T392 WeakPolarHBondContact OH-CB 3.26Å; Y384-T392 PolarHBondContact OH-OG1 3.13Å; T392-K394 HydrophobicContact CG2-CB 3.87Å; T392-K394 HydrophobicContact CG2-CD 4.08Å; T392-K394 HydrophobicContact CG2-CG 3.89Å; T392-K394 PolarHBondContact O-N 2.85Å; T392-K394 VanDerWaalsContact O-N 3.16Å; T392-L395 WeakPolarHBondContact O-CB 3.42Å; T392-L395 PolarHBondContact O-N 3.4Å; T392-L395 VanDerWaalsContact O-N 3.13Å
393	S	83.8	Confident	87.6	Confident	78 Å²	78	44.4 Å²	44.4	55%	0.545	24%	0.236	S	C	.	.	H	α-helix	trans	-62	-22	179.8	61.8	0	0	0	0	114.4	L395 D396 E397	S393-L395 PolarHBondContact O-N 2.98Å; S393-D396 WeakPolarHBondContact O-CB 3.38Å; S393-D396 PolarHBondContact O-N 3.02Å; S393-D396 VanDerWaalsContact O-N 3.13Å; S393-E397 PolarHBondContact O-N 2.97Å
394	K	85.4	Confident	87.6	Confident	36 Å²	36	47.3 Å²	47.3	16%	0.157	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-25.8	176.3	-61.2	175.7	170.9	176.2	0	112.9	N329 H332 L336 T392 L398	N329-K394 PolarHBondContact OD1-NZ 3.44Å; H332-K394 HydrophobicContact CB-CD 4.36Å; L336-K394 HydrophobicContact CD1-CB 3.5Å; L336-K394 WeakPolarHBondContact CD1-O 3.4Å; T392-K394 HydrophobicContact CG2-CB 3.87Å; T392-K394 HydrophobicContact CG2-CD 4.08Å; T392-K394 HydrophobicContact CG2-CG 3.89Å; T392-K394 PolarHBondContact O-N 2.85Å; T392-K394 VanDerWaalsContact O-N 3.16Å; K394-L398 PolarHBondContact O-N 3.17Å
395	L	87.8	Confident	87.3	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-67.3	-42.9	173.2	180	63.5	0	0	0	110.3	L336 E380 Y384 T392 S393 E397 L398 L399	L336-L395 HydrophobicContact CD2-CD1 4.09Å; E380-L395 HydrophobicContact CG-CD1 4.22Å; Y384-L395 HydrophobicContact CD1-CD2 3.94Å; Y384-L395 HydrophobicContact CD2-CD1 4.08Å; Y384-L395 HydrophobicContact CD2-CD2 4.11Å; Y384-L395 HydrophobicContact CG-CD1 4.36Å; Y384-L395 HydrophobicContact CG-CD2 3.7Å; T392-L395 WeakPolarHBondContact O-CB 3.42Å; T392-L395 PolarHBondContact O-N 3.4Å; T392-L395 VanDerWaalsContact O-N 3.13Å; S393-L395 PolarHBondContact O-N 2.98Å; L395-E397 VanDerWaalsContact C-N 3.3Å; L395-E397 PolarHBondContact O-N 3.42Å; L395-L398 PolarHBondContact O-N 3.44Å; L395-L398 VanDerWaalsContact O-N 3.16Å; L395-L399 HydrophobicContact CG-CD1 4.22Å; L395-L399 HydrophobicContact CG-CG 4.49Å; L395-L399 WeakPolarHBondContact O-CG 3.44Å; L395-L399 PolarHBondContact O-N 3.36Å
396	D	87.3	Confident	87.3	Confident	59 Å²	59	45 Å²	45	32%	0.316	24%	0.244	S	C	.	.	H	α-helix	trans	-61.2	-40.6	176.3	-60.9	-46.1	0	0	0	111.3	S393 L398 L399 E400 A448	S393-D396 WeakPolarHBondContact O-CB 3.38Å; S393-D396 PolarHBondContact O-N 3.02Å; S393-D396 VanDerWaalsContact O-N 3.13Å; D396-L398 VanDerWaalsContact C-N 3.34Å; D396-L398 PolarHBondContact O-N 3.22Å; D396-L399 PolarHBondContact O-N 3.12Å; D396-E400 WeakPolarHBondContact O-CB 3.41Å; D396-E400 PolarHBondContact O-N 3.03Å; D396-A448 HydrophobicContact CB-CB 4.28Å; D396-A448 VanDerWaalsContact O-CB 3.3Å; D396-A448 WeakPolarHBondContact O-CB 3.4Å
397	E	89.4	Confident	87.3	Confident	104 Å²	104	43.7 Å²	43.7	49%	0.486	24%	0.237	S	C	.	.	H	α-helix	trans	-59.7	-41.1	174.6	-67.5	173.3	-159.8	0	0	112.3	S393 L395 K401	S393-E397 PolarHBondContact O-N 2.97Å; L395-E397 VanDerWaalsContact C-N 3.3Å; L395-E397 PolarHBondContact O-N 3.42Å; E397-K401 WeakPolarHBondContact O-CG 3.31Å; E397-K401 PolarHBondContact O-N 3.01Å; E397-K401 VanDerWaalsContact O-N 3.15Å
398	L	89.2	Confident	87.2	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-47.5	175.1	174.7	65.5	0	0	0	111	L336 R339 E340 K394 L395 D396 E400 K401 L402	L336-L398 HydrophobicContact CB-CD2 4.25Å; L336-L398 HydrophobicContact CD2-CB 3.97Å; L336-L398 HydrophobicContact CD2-CD2 3.52Å; L336-L398 HydrophobicContact CD2-CG 4.37Å; L336-L398 HydrophobicContact CG-CD2 4.48Å; R339-L398 HydrophobicContact CB-CD2 4.07Å; E340-L398 HydrophobicContact CB-CD1 3.61Å; E340-L398 HydrophobicContact CG-CD1 3.85Å; K394-L398 PolarHBondContact O-N 3.17Å; L395-L398 PolarHBondContact O-N 3.44Å; L395-L398 VanDerWaalsContact O-N 3.16Å; D396-L398 VanDerWaalsContact C-N 3.34Å; D396-L398 PolarHBondContact O-N 3.22Å; L398-E400 VanDerWaalsContact C-N 3.27Å; L398-E400 PolarHBondContact O-N 3.24Å; L398-K401 WeakPolarHBondContact O-CB 3.43Å; L398-K401 PolarHBondContact O-N 3.49Å; L398-L402 HydrophobicContact CD1-CG 4.39Å; L398-L402 HydrophobicContact CG-CD1 4.34Å; L398-L402 WeakPolarHBondContact O-CG 3.46Å; L398-L402 PolarHBondContact O-N 3.42Å
399	L	90.3	Very high	87	Confident	1 Å²	1	50 Å²	50	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-38.3	-179.9	-68.2	177.4	0	0	0	111.4	E380 H381 L395 D396 L402 C403 A448	E380-L399 HydrophobicContact CB-CD2 4.11Å; E380-L399 HydrophobicContact CG-CD2 4.2Å; H381-L399 WeakPolarHBondContact CE1-CD1 3.28Å; H381-L399 WeakPolarHBondContact ND1-CD1 3.5Å; L395-L399 HydrophobicContact CG-CD1 4.22Å; L395-L399 HydrophobicContact CG-CG 4.49Å; L395-L399 WeakPolarHBondContact O-CG 3.44Å; L395-L399 PolarHBondContact O-N 3.36Å; D396-L399 PolarHBondContact O-N 3.12Å; L399-L402 PolarHBondContact O-N 2.84Å; L399-C403 WeakPolarHBondContact O-CB 3.28Å; L399-C403 PolarHBondContact O-N 2.82Å; L399-C403 PolarHBondContact O-SG 3.4Å; L399-A448 HydrophobicContact CB-CB 3.73Å
400	E	89.4	Confident	87.1	Confident	97 Å²	97	46.9 Å²	46.9	45%	0.453	25%	0.253	S	S	.	.	H	α-helix	trans	-60.5	-48.9	174.5	-171.3	174.1	-172.5	0	0	110.8	D396 L398 L402 C403 V404 A448	D396-E400 WeakPolarHBondContact O-CB 3.41Å; D396-E400 PolarHBondContact O-N 3.03Å; L398-E400 VanDerWaalsContact C-N 3.27Å; L398-E400 PolarHBondContact O-N 3.24Å; E400-L402 VanDerWaalsContact C-N 3.31Å; E400-L402 PolarHBondContact O-N 3.17Å; E400-C403 WeakPolarHBondContact O-CB 3.43Å; E400-C403 PolarHBondContact O-N 3.28Å; E400-C403 VanDerWaalsContact O-N 3.1Å; E400-V404 WeakPolarHBondContact O-CG2 3.3Å; E400-V404 PolarHBondContact O-N 3.05Å; E400-A448 HydrophobicContact CB-CB 4.18Å
401	K	88.9	Confident	87.4	Confident	113 Å²	113	49.2 Å²	49.2	49%	0.491	26%	0.26	S	S	.	.	H	α-helix	trans	-56.9	-41.6	174.6	-70.1	173.2	178.9	-178.4	0	112.8	E340 E397 L398 C403 V404	E340-K401 IonicContact OE1-NZ 2.94Å; E340-K401 IonicContact OE2-NZ 2.67Å; E340-K401 PolarHBondContact OE2-NZ 2.87Å; E397-K401 WeakPolarHBondContact O-CG 3.31Å; E397-K401 PolarHBondContact O-N 3.01Å; E397-K401 VanDerWaalsContact O-N 3.15Å; L398-K401 WeakPolarHBondContact O-CB 3.43Å; L398-K401 PolarHBondContact O-N 3.49Å; K401-C403 VanDerWaalsContact C-N 3.35Å; K401-V404 WeakPolarHBondContact O-CB 3.46Å; K401-V404 PolarHBondContact O-N 3.32Å
402	L	89.6	Confident	87.9	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-67.3	-37.8	177.6	-64.4	-180	0	0	0	111.4	L343 I347 M373 L398 L399 E400 V404 S405	L343-L402 HydrophobicContact CB-CD1 4.23Å; L343-L402 HydrophobicContact CB-CD2 4.32Å; L343-L402 HydrophobicContact CD1-CD1 4.04Å; I347-L402 HydrophobicContact CD1-CB 4.26Å; I347-L402 HydrophobicContact CD1-CD1 4.11Å; I347-L402 HydrophobicContact CD1-CD2 4.13Å; I347-L402 HydrophobicContact CD1-CG 4.39Å; M373-L402 HydrophobicContact CE-CB 4.39Å; L398-L402 HydrophobicContact CD1-CG 4.39Å; L398-L402 HydrophobicContact CG-CD1 4.34Å; L398-L402 WeakPolarHBondContact O-CG 3.46Å; L398-L402 PolarHBondContact O-N 3.42Å; L399-L402 PolarHBondContact O-N 2.84Å; E400-L402 VanDerWaalsContact C-N 3.31Å; E400-L402 PolarHBondContact O-N 3.17Å; L402-V404 VanDerWaalsContact C-N 3.33Å; L402-V404 PolarHBondContact O-N 2.92Å; L402-S405 WeakPolarHBondContact O-CB 3.48Å; L402-S405 PolarHBondContact O-N 3.41Å
403	C	89.5	Confident	88.1	Confident	7 Å²	7	46.5 Å²	46.5	5%	0.047	24%	0.241	C	C	.	.	H	α-helix	trans	-67.4	-31.4	175.7	-66	0	0	0	0	112.7	L399 E400 K401 S405 L406 Y407	L399-C403 WeakPolarHBondContact O-CB 3.28Å; L399-C403 PolarHBondContact O-N 2.82Å; L399-C403 PolarHBondContact O-SG 3.4Å; E400-C403 WeakPolarHBondContact O-CB 3.43Å; E400-C403 PolarHBondContact O-N 3.28Å; E400-C403 VanDerWaalsContact O-N 3.1Å; K401-C403 VanDerWaalsContact C-N 3.35Å; C403-S405 PolarHBondContact O-N 3.16Å; C403-L406 WeakPolarHBondContact O-CB 3.49Å; C403-L406 PolarHBondContact O-N 3.46Å; C403-Y407 PolarHBondContact O-N 3.5Å; C403-Y407 VanDerWaalsContact O-N 3.14Å
404	V	89.1	Confident	88.3	Confident	62 Å²	62	43.2 Å²	43.2	38%	0.376	22%	0.217	S	C	.	.	H	α-helix	trans	-58.2	-35.4	173.4	171.3	0	0	0	0	111.1	E400 K401 L402 L406 Y407 D408	E400-V404 WeakPolarHBondContact O-CG2 3.3Å; E400-V404 PolarHBondContact O-N 3.05Å; K401-V404 WeakPolarHBondContact O-CB 3.46Å; K401-V404 PolarHBondContact O-N 3.32Å; L402-V404 VanDerWaalsContact C-N 3.33Å; L402-V404 PolarHBondContact O-N 2.92Å; V404-L406 VanDerWaalsContact C-N 3.27Å; V404-L406 PolarHBondContact O-N 2.89Å; V404-Y407 PolarHBondContact O-N 3.25Å; V404-Y407 VanDerWaalsContact O-N 3.13Å; V404-D408 PolarHBondContact O-N 3.38Å
405	S	87	Confident	88.4	Confident	28 Å²	28	45.7 Å²	45.7	20%	0.196	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-33.5	175.6	-175.3	0	0	0	0	113.2	L402 C403 V409	L402-S405 WeakPolarHBondContact O-CB 3.48Å; L402-S405 PolarHBondContact O-N 3.41Å; C403-S405 PolarHBondContact O-N 3.16Å; S405-V409 WeakPolarHBondContact O-CG2 3.05Å
406	L	88.3	Confident	88.4	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-69.5	-46.2	173.9	-176.7	76.4	0	0	0	110	V351 M373 C403 V404 D408 V409 F410 F449	V351-L406 HydrophobicContact CG1-CD1 3.85Å; V351-L406 HydrophobicContact CG2-CD1 3.75Å; M373-L406 HydrophobicContact CB-CD2 4.32Å; M373-L406 HydrophobicContact CG-CB 4.13Å; M373-L406 HydrophobicContact CG-CD1 4.14Å; M373-L406 HydrophobicContact CG-CD2 3.74Å; M373-L406 HydrophobicContact CG-CG 4.21Å; C403-L406 WeakPolarHBondContact O-CB 3.49Å; C403-L406 PolarHBondContact O-N 3.46Å; V404-L406 VanDerWaalsContact C-N 3.27Å; V404-L406 PolarHBondContact O-N 2.89Å; L406-D408 PolarHBondContact O-N 2.84Å; L406-V409 PolarHBondContact O-N 3.47Å; L406-F410 HydrophobicContact CD1-CD2 4.08Å; L406-F410 HydrophobicContact CD1-CE1 4.29Å; L406-F410 HydrophobicContact CD1-CE2 3.52Å; L406-F410 HydrophobicContact CD1-CZ 3.65Å; L406-F410 HydrophobicContact CD2-CD2 4.27Å; L406-F410 HydrophobicContact CD2-CE2 3.97Å; L406-F410 HydrophobicContact CG-CD2 3.85Å; L406-F410 HydrophobicContact CG-CE2 3.72Å; L406-F410 HydrophobicContact CG-CZ 4.34Å; L406-F410 PolarHBondContact O-N 3.17Å; L406-F449 HydrophobicContact CD2-CE2 4.41Å
407	Y	89.3	Confident	88.4	Confident	15 Å²	15	49.7 Å²	49.7	6%	0.059	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-43.4	-179.9	174.3	-99.8	0	0	0	112.3	C403 V404 V409 F410 R411 Q455 M456 D459	C403-Y407 PolarHBondContact O-N 3.5Å; C403-Y407 VanDerWaalsContact O-N 3.14Å; V404-Y407 PolarHBondContact O-N 3.25Å; V404-Y407 VanDerWaalsContact O-N 3.13Å; Y407-V409 PolarHBondContact O-N 3.13Å; Y407-F410 PolarHBondContact O-N 3.04Å; Y407-R411 HydrophobicContact CE1-CB 4.47Å; Y407-R411 HydrophobicContact CE2-CB 4.46Å; Y407-R411 WeakPolarHBondContact O-CB 3.21Å; Y407-R411 PolarHBondContact O-N 3.29Å; Y407-R411 WeakPolarHBondContact OH-CD 3.35Å; Y407-R411 PolarHBondContact OH-NE 2.53Å; Y407-Q455 HydrophobicContact CE2-CG 4.14Å; Y407-Q455 PolarHBondContact OH-NE2 3.14Å; Y407-M456 HydrophobicContact CD2-CB 4Å; Y407-M456 HydrophobicContact CD2-CG 4.28Å; Y407-M456 HydrophobicContact CE2-CB 4.31Å; Y407-D459 WeakPolarHBondContact CE2-OD2 3.39Å; Y407-D459 VanDerWaalsContact CZ-OD2 3.32Å; Y407-D459 PolarHBondContact OH-OD2 3.23Å
408	D	89.1	Confident	88.2	Confident	95 Å²	95	49.4 Å²	49.4	51%	0.508	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-30.7	179.6	-77.9	-21.1	0	0	0	113	V404 L406 P412	V404-D408 PolarHBondContact O-N 3.38Å; L406-D408 PolarHBondContact O-N 2.84Å; D408-P412 WeakPolarHBondContact O-CD 3.38Å
409	V	86.6	Confident	88.1	Confident	42 Å²	42	55.1 Å²	55.1	26%	0.255	28%	0.275	S	S	.	.	H	α-helix	trans	-81.3	-39.1	176.3	179	0	0	0	0	111.6	V351 T355 S405 L406 Y407 P412	V351-V409 HydrophobicContact CG1-CB 3.71Å; V351-V409 HydrophobicContact CG1-CG1 3.84Å; V351-V409 HydrophobicContact CG1-CG2 3.84Å; T355-V409 HydrophobicContact CG2-CG1 4.35Å; T355-V409 VanDerWaalsContact OG1-CG1 3.3Å; T355-V409 WeakPolarHBondContact OG1-CG1 3.27Å; S405-V409 WeakPolarHBondContact O-CG2 3.05Å; L406-V409 PolarHBondContact O-N 3.47Å; Y407-V409 PolarHBondContact O-N 3.13Å; V409-P412 WeakPolarHBondContact O-CD 3.05Å
410	F	87.3	Confident	87.9	Confident	3 Å²	3	55.8 Å²	55.8	1%	0.013	28%	0.279	C	S	.	.	H	α-helix	trans	-78.2	-31	-177.9	-72.5	-7.6	0	0	0	113.6	V351 L365 V366 L406 Y407 L413 I414 M456	V351-F410 HydrophobicContact CG1-CE1 4.48Å; L365-F410 HydrophobicContact CD1-CE1 4.07Å; L365-F410 HydrophobicContact CD1-CZ 4.41Å; L365-F410 HydrophobicContact CD2-CE1 4.11Å; L365-F410 HydrophobicContact CG-CE1 3.77Å; L365-F410 HydrophobicContact CG-CZ 4.14Å; V366-F410 HydrophobicContact CG2-CD2 4.28Å; V366-F410 HydrophobicContact CG2-CE2 4.21Å; L406-F410 HydrophobicContact CD1-CD2 4.08Å; L406-F410 HydrophobicContact CD1-CE1 4.29Å; L406-F410 HydrophobicContact CD1-CE2 3.52Å; L406-F410 HydrophobicContact CD1-CZ 3.65Å; L406-F410 HydrophobicContact CD2-CD2 4.27Å; L406-F410 HydrophobicContact CD2-CE2 3.97Å; L406-F410 HydrophobicContact CG-CD2 3.85Å; L406-F410 HydrophobicContact CG-CE2 3.72Å; L406-F410 HydrophobicContact CG-CZ 4.34Å; L406-F410 PolarHBondContact O-N 3.17Å; Y407-F410 PolarHBondContact O-N 3.04Å; F410-L413 HydrophobicContact CD1-CD1 4.17Å; F410-L413 WeakPolarHBondContact O-CB 3.4Å; F410-L413 PolarHBondContact O-N 3.31Å; F410-I414 HydrophobicContact CB-CD1 4.4Å; F410-I414 WeakPolarHBondContact O-CG1 3.34Å; F410-I414 PolarHBondContact O-N 2.89Å; F410-M456 HydrophobicContact CB-SD 3.83Å; F410-M456 HydrophobicContact CD2-CE 4.19Å; F410-M456 HydrophobicContact CD2-SD 3.72Å; F410-M456 HydrophobicContact CG-SD 4.3Å
411	R	89.6	Confident	87.7	Confident	115 Å²	115	55.2 Å²	55.2	43%	0.434	28%	0.276	S	S	.	.	H	α-helix	trans	-57.6	-48.5	-178.1	-178.7	-174.3	-165.2	-165.8	2.4	113	Y407 L413 I414 I415 D459	Y407-R411 HydrophobicContact CE1-CB 4.47Å; Y407-R411 HydrophobicContact CE2-CB 4.46Å; Y407-R411 WeakPolarHBondContact O-CB 3.21Å; Y407-R411 PolarHBondContact O-N 3.29Å; Y407-R411 WeakPolarHBondContact OH-CD 3.35Å; Y407-R411 PolarHBondContact OH-NE 2.53Å; R411-L413 VanDerWaalsContact C-N 3.29Å; R411-L413 PolarHBondContact O-N 2.82Å; R411-I414 PolarHBondContact O-N 3.39Å; R411-I415 HydrophobicContact CG-CD1 4.08Å; R411-I415 WeakPolarHBondContact O-CG1 3.47Å; R411-I415 PolarHBondContact O-N 2.83Å; R411-I415 VanDerWaalsContact O-N 3.12Å; R411-D459 IonicContact NE-OD2 2.68Å
412	P	88.6	Confident	87.7	Confident	65 Å²	65	51.4 Å²	51.4	42%	0.422	26%	0.262	S	S	.	.	H	α-helix	trans	-57.5	-39.5	173.1	-25	33.7	0	0	0	113.1	D408 V409 I415 H416	D408-P412 WeakPolarHBondContact O-CD 3.38Å; V409-P412 WeakPolarHBondContact O-CD 3.05Å; P412-I415 PolarHBondContact O-N 3.41Å; P412-H416 PolarHBondContact O-N 3.11Å; P412-H416 PolarHBondContact O-ND1 3.33Å
413	L	85.6	Confident	87.8	Confident	36 Å²	36	51.1 Å²	51.1	19%	0.188	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-47.4	179.3	-62.7	171.9	0	0	0	110.9	T355 L365 F410 R411 I415 H416 V417	T355-L413 HydrophobicContact CG2-CD1 3.86Å; T355-L413 HydrophobicContact CG2-CD2 4.46Å; L365-L413 HydrophobicContact CD2-CD1 3.55Å; F410-L413 HydrophobicContact CD1-CD1 4.17Å; F410-L413 WeakPolarHBondContact O-CB 3.4Å; F410-L413 PolarHBondContact O-N 3.31Å; R411-L413 VanDerWaalsContact C-N 3.29Å; R411-L413 PolarHBondContact O-N 2.82Å; L413-I415 VanDerWaalsContact C-N 3.33Å; L413-I415 PolarHBondContact O-N 3.07Å; L413-H416 PolarHBondContact O-N 3.48Å; L413-H416 VanDerWaalsContact O-N 3.11Å; L413-V417 WeakPolarHBondContact O-CG2 3.47Å; L413-V417 PolarHBondContact O-N 3.07Å
414	I	87.4	Confident	87.7	Confident	8 Å²	8	51 Å²	51	4%	0.041	26%	0.26	C	S	.	.	H	α-helix	trans	-57.8	-44.7	179.2	-68.4	161.6	0	0	0	111.2	F410 R411 H416 V417 M456 V460 R463	F410-I414 HydrophobicContact CB-CD1 4.4Å; F410-I414 WeakPolarHBondContact O-CG1 3.34Å; F410-I414 PolarHBondContact O-N 2.89Å; R411-I414 PolarHBondContact O-N 3.39Å; I414-H416 PolarHBondContact O-N 2.96Å; I414-V417 PolarHBondContact O-N 3.35Å; I414-M456 HydrophobicContact CD1-CG 3.56Å; I414-M456 HydrophobicContact CD1-SD 4.03Å; I414-V460 HydrophobicContact CB-CG2 4.42Å; I414-V460 HydrophobicContact CD1-CG2 3.57Å; I414-V460 HydrophobicContact CG1-CG2 3.86Å; I414-V460 HydrophobicContact CG2-CB 4.35Å; I414-V460 HydrophobicContact CG2-CG2 3.65Å; I414-R463 HydrophobicContact CG2-CB 4.47Å
415	I	87.8	Confident	87.7	Confident	88 Å²	88	52.6 Å²	52.6	45%	0.451	26%	0.263	S	S	.	.	H	α-helix	trans	-61.6	-32.7	179.9	-67.2	166.3	0	0	0	111.7	R411 P412 L413 R463	R411-I415 HydrophobicContact CG-CD1 4.08Å; R411-I415 WeakPolarHBondContact O-CG1 3.47Å; R411-I415 PolarHBondContact O-N 2.83Å; R411-I415 VanDerWaalsContact O-N 3.12Å; P412-I415 PolarHBondContact O-N 3.41Å; L413-I415 VanDerWaalsContact C-N 3.33Å; L413-I415 PolarHBondContact O-N 3.07Å; I415-R463 PolarHBondContact O-NE 3.08Å; I415-R463 PolarHBondContact O-NH2 3.24Å
416	H	87.4	Confident	87.9	Confident	143 Å²	143	51.4 Å²	51.4	66%	0.662	26%	0.255	S	S	*	.	H	α-helix	trans	-86.7	-8.6	-178.7	-69.1	85.4	0	0	0	113.6	P412 L413 I414 I418	P412-H416 PolarHBondContact O-N 3.11Å; P412-H416 PolarHBondContact O-ND1 3.33Å; L413-H416 PolarHBondContact O-N 3.48Å; L413-H416 VanDerWaalsContact O-N 3.11Å; I414-H416 PolarHBondContact O-N 2.96Å; H416-I418 WeakPolarHBondContact O-CG1 3.2Å; H416-I418 PolarHBondContact O-N 3.2Å
417	V	86.9	Confident	87.9	Confident	6 Å²	6	51.1 Å²	51.1	4%	0.036	25%	0.253	C	S	.	.			trans	-66.2	130.4	175.5	-174.4	0	0	0	0	110.3	L413 I414 T422 L423 R463	L413-V417 WeakPolarHBondContact O-CG2 3.47Å; L413-V417 PolarHBondContact O-N 3.07Å; I414-V417 PolarHBondContact O-N 3.35Å; V417-T422 HydrophobicContact CG1-CG2 4.14Å; V417-L423 HydrophobicContact CB-CD2 3.94Å; V417-L423 HydrophobicContact CB-CG 4.2Å; V417-L423 HydrophobicContact CG1-CD1 4.4Å; V417-L423 HydrophobicContact CG1-CD2 3.99Å; V417-L423 HydrophobicContact CG1-CG 3.75Å; V417-R463 PolarHBondContact O-NE 3.14Å; V417-R463 PolarHBondContact O-NH2 2.72Å; V417-R463 VanDerWaalsContact O-NH2 3.14Å
418	I	85.9	Confident	87.8	Confident	98 Å²	98	51.3 Å²	51.3	50%	0.503	26%	0.26	S	S	.	.			trans	-106	-36.4	-176.5	-57	-177.9	0	0	0	111.3	H416 R467	H416-I418 WeakPolarHBondContact O-CG1 3.2Å; H416-I418 PolarHBondContact O-N 3.2Å; I418-R467 PolarHBondContact O-NE 3.38Å; I418-R467 PolarHBondContact O-NH2 3.27Å
419	H	86	Confident	87.8	Confident	124 Å²	124	46.9 Å²	46.9	57%	0.574	24%	0.236	S	C	*	.			trans	-76.2	129.5	-173.4	-63.8	-70.7	0	0	0	111.8	E421 L423	H419-E421 VanDerWaalsContact C-N 3.32Å; H419-L423 PolarHBondContact O-N 3.32Å
420	L	85.9	Confident	87.9	Confident	15 Å²	15	45 Å²	45	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-67.1	-36.9	-179.3	-168.9	78.4	0	0	0	111.1	L423 S424 L464 T468 C564	L420-L423 PolarHBondContact O-N 3.39Å; L420-S424 WeakPolarHBondContact O-CB 3.4Å; L420-S424 PolarHBondContact O-N 3Å; L420-S424 PolarHBondContact O-OG 3Å; L420-L464 HydrophobicContact CD1-CD1 3.46Å; L420-L464 VanDerWaalsContact CD1-CD1 3.46Å; L420-L464 HydrophobicContact CG-CD1 4.06Å; L420-T468 VanDerWaalsContact CD1-OG1 3.29Å; L420-T468 WeakPolarHBondContact CD1-OG1 3.42Å; L420-C564 HydrophobicContact CD2-CB 4.46Å
421	E	86.9	Confident	87.9	Confident	85 Å²	85	47.8 Å²	47.8	40%	0.397	24%	0.237	S	C	.	.	H	α-helix	trans	-61.2	-51.1	-179.5	-64.2	74.5	-162	0	0	110.6	H419 L423 S424 E425	H419-E421 VanDerWaalsContact C-N 3.32Å; E421-L423 VanDerWaalsContact C-N 3.34Å; E421-L423 PolarHBondContact O-N 2.69Å; E421-S424 PolarHBondContact O-N 2.85Å; E421-S424 PolarHBondContact O-OG 3.36Å; E421-E425 WeakPolarHBondContact O-CG 3.45Å; E421-E425 PolarHBondContact O-N 3.33Å
422	T	88.8	Confident	87.6	Confident	33 Å²	33	45.5 Å²	45.5	20%	0.202	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-43	178.2	-47.5	0	0	0	0	111.5	H362 V417 E425 L426	H362-T422 HydrophobicContact CB-CG2 4.1Å; V417-T422 HydrophobicContact CG1-CG2 4.14Å; T422-E425 PolarHBondContact O-N 3.07Å; T422-L426 HydrophobicContact CG2-CD1 4.33Å; T422-L426 WeakPolarHBondContact O-CB 3.42Å; T422-L426 VanDerWaalsContact O-CG 3.23Å; T422-L426 WeakPolarHBondContact O-CG 3.4Å; T422-L426 PolarHBondContact O-N 3.17Å
423	L	90	Very high	87.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.1	-41	176.7	-71.9	168.4	0	0	0	112.2	V417 H419 L420 E421 E425 L426 C427 V460 R463 L464 R467	V417-L423 HydrophobicContact CB-CD2 3.94Å; V417-L423 HydrophobicContact CB-CG 4.2Å; V417-L423 HydrophobicContact CG1-CD1 4.4Å; V417-L423 HydrophobicContact CG1-CD2 3.99Å; V417-L423 HydrophobicContact CG1-CG 3.75Å; H419-L423 PolarHBondContact O-N 3.32Å; L420-L423 PolarHBondContact O-N 3.39Å; E421-L423 VanDerWaalsContact C-N 3.34Å; E421-L423 PolarHBondContact O-N 2.69Å; L423-E425 VanDerWaalsContact C-N 3.35Å; L423-L426 PolarHBondContact O-N 3.37Å; L423-C427 PolarHBondContact O-N 3.47Å; L423-C427 PolarHBondContact O-SG 2.85Å; L423-V460 HydrophobicContact CD2-CG1 4.07Å; L423-R463 HydrophobicContact CD1-CG 3.96Å; L423-R463 HydrophobicContact CD2-CB 4.39Å; L423-R463 HydrophobicContact CD2-CG 3.93Å; L423-L464 HydrophobicContact CB-CB 4.27Å; L423-L464 HydrophobicContact CB-CD1 3.64Å; L423-R467 HydrophobicContact CD1-CB 4.12Å; L423-R467 HydrophobicContact CD1-CG 3.81Å
424	S	88.1	Confident	87.2	Confident	6 Å²	6	44.3 Å²	44.3	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-65.5	-38.4	177.3	72	0	0	0	0	112.4	L420 E421 C427 G428 C571	L420-S424 WeakPolarHBondContact O-CB 3.4Å; L420-S424 PolarHBondContact O-N 3Å; L420-S424 PolarHBondContact O-OG 3Å; E421-S424 PolarHBondContact O-N 2.85Å; E421-S424 PolarHBondContact O-OG 3.36Å; S424-C427 PolarHBondContact O-N 2.95Å; S424-G428 PolarHBondContact O-N 3.49Å; S424-C571 PolarHBondContact O-SG 3.45Å
425	E	89.6	Confident	86.9	Confident	94 Å²	94	45 Å²	45	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-68.6	-42.1	175.8	-73.8	174.8	-169.2	0	0	111.4	E421 T422 L423 C427 G428 I429	E421-E425 WeakPolarHBondContact O-CG 3.45Å; E421-E425 PolarHBondContact O-N 3.33Å; T422-E425 PolarHBondContact O-N 3.07Å; L423-E425 VanDerWaalsContact C-N 3.35Å; E425-C427 PolarHBondContact O-N 2.89Å; E425-G428 CarbonylContact O-C 3.58Å; E425-G428 WeakPolarHBondContact O-CA 3.2Å; E425-G428 PolarHBondContact O-N 3.34Å; E425-I429 VanDerWaalsContact O-CG1 3.27Å; E425-I429 WeakPolarHBondContact O-CG1 3.39Å; E425-I429 PolarHBondContact O-N 3.32Å
426	L	90.3	Very high	86.5	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-58.7	-44.5	173.1	-73.1	175.3	0	0	0	112	H362 V366 T422 L423 G428 I429 L430 V460	H362-L426 HydrophobicContact CB-CD1 4.47Å; V366-L426 HydrophobicContact CB-CD2 3.93Å; V366-L426 HydrophobicContact CG1-CD2 4.36Å; V366-L426 HydrophobicContact CG2-CD2 3.72Å; T422-L426 HydrophobicContact CG2-CD1 4.33Å; T422-L426 WeakPolarHBondContact O-CB 3.42Å; T422-L426 VanDerWaalsContact O-CG 3.23Å; T422-L426 WeakPolarHBondContact O-CG 3.4Å; T422-L426 PolarHBondContact O-N 3.17Å; L423-L426 PolarHBondContact O-N 3.37Å; L426-G428 VanDerWaalsContact C-N 3.3Å; L426-G428 PolarHBondContact O-N 2.89Å; L426-I429 HydrophobicContact CD2-CD1 4.5Å; L426-I429 PolarHBondContact O-N 3.26Å; L426-L430 WeakPolarHBondContact O-CG 3.17Å; L426-L430 PolarHBondContact O-N 3.43Å; L426-V460 HydrophobicContact CB-CG1 4.01Å
427	C	89.6	Confident	86.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-42.7	172.2	-73.2	0	0	0	0	111.8	L423 S424 E425 K431 L457 V460 C571	L423-C427 PolarHBondContact O-N 3.47Å; L423-C427 PolarHBondContact O-SG 2.85Å; S424-C427 PolarHBondContact O-N 2.95Å; E425-C427 PolarHBondContact O-N 2.89Å; C427-K431 WeakPolarHBondContact O-CB 3.34Å; C427-K431 PolarHBondContact O-N 3.01Å; C427-L457 HydrophobicContact CB-CD1 4.24Å; C427-V460 WeakPolarHBondContact SG-CG1 3.47Å; C427-C571 HydrophobicContact CB-CB 3.64Å
428	G	87	Confident	85.5	Confident	19 Å²	19	46.6 Å²	46.6	20%	0.196	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-42.2	178	0	0	0	0	0	112.9	S424 E425 L426 N432	S424-G428 PolarHBondContact O-N 3.49Å; E425-G428 CarbonylContact O-C 3.58Å; E425-G428 WeakPolarHBondContact O-CA 3.2Å; E425-G428 PolarHBondContact O-N 3.34Å; L426-G428 VanDerWaalsContact C-N 3.3Å; L426-G428 PolarHBondContact O-N 2.89Å; G428-N432 VanDerWaalsContact O-CB 3.26Å; G428-N432 WeakPolarHBondContact O-CB 3.48Å; G428-N432 PolarHBondContact O-N 2.93Å
429	I	89.3	Confident	84.9	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.215	C	C	.	.	I	π-helix	trans	-63.7	-52.6	176.7	-67.4	161.4	0	0	0	110.1	C363 V366 R367 E425 L426 K431 E433 V434	C363-I429 HydrophobicContact CB-CD1 3.66Å; V366-I429 HydrophobicContact CG1-CG2 4.41Å; R367-I429 HydrophobicContact CG-CD1 4.26Å; R367-I429 HydrophobicContact CG-CG1 4.44Å; R367-I429 HydrophobicContact CG-CG2 3.68Å; R367-I429 VanDerWaalsContact CZ-CG1 3.49Å; E425-I429 VanDerWaalsContact O-CG1 3.27Å; E425-I429 WeakPolarHBondContact O-CG1 3.39Å; E425-I429 PolarHBondContact O-N 3.32Å; L426-I429 HydrophobicContact CD2-CD1 4.5Å; L426-I429 PolarHBondContact O-N 3.26Å; I429-K431 VanDerWaalsContact C-N 3.34Å; I429-K431 PolarHBondContact O-N 3.41Å; I429-E433 WeakPolarHBondContact O-CA 3.29Å; I429-E433 VanDerWaalsContact O-CB 3.3Å; I429-E433 WeakPolarHBondContact O-CB 3.41Å; I429-E433 PolarHBondContact O-N 3.08Å; I429-V434 HydrophobicContact CG2-CG2 4.33Å; I429-V434 PolarHBondContact O-N 3.13Å
430	L	88.8	Confident	84.3	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	22%	0.218	C	C	.	.	I	π-helix	trans	-65.4	-38.6	-175.9	-66.9	173.3	0	0	0	112.2	V366 L426 V434 L435 V453 M456 L457 V460	V366-L430 HydrophobicContact CG1-CD2 3.71Å; V366-L430 HydrophobicContact CG1-CG 4.3Å; L426-L430 WeakPolarHBondContact O-CG 3.17Å; L426-L430 PolarHBondContact O-N 3.43Å; L430-V434 HydrophobicContact CD2-CG2 4.47Å; L430-L435 WeakPolarHBondContact O-CB 3.2Å; L430-L435 VanDerWaalsContact O-CG 3.29Å; L430-L435 WeakPolarHBondContact O-CG 3.17Å; L430-L435 PolarHBondContact O-N 3.1Å; L430-V453 HydrophobicContact CB-CG1 4.48Å; L430-V453 HydrophobicContact CD2-CG1 4.07Å; L430-M456 HydrophobicContact CD1-CE 3.98Å; L430-M456 HydrophobicContact CD1-CG 4.35Å; L430-M456 HydrophobicContact CD2-CE 3.34Å; L430-M456 HydrophobicContact CG-CE 4.31Å; L430-L457 HydrophobicContact CB-CB 4.41Å; L430-L457 HydrophobicContact CB-CD1 4.09Å; L430-L457 HydrophobicContact CD1-CB 4.47Å; L430-V460 HydrophobicContact CD1-CG2 4.08Å
431	K	86.3	Confident	83.8	Confident	62 Å²	62	48.7 Å²	48.7	27%	0.27	25%	0.246	S	C	.	.	I	π-helix	trans	-77.3	-55.7	179.9	-171.8	176.6	175.7	179	0	112.5	C427 I429 L435 E436 L457 R570	C427-K431 WeakPolarHBondContact O-CB 3.34Å; C427-K431 PolarHBondContact O-N 3.01Å; I429-K431 VanDerWaalsContact C-N 3.34Å; I429-K431 PolarHBondContact O-N 3.41Å; K431-L435 WeakPolarHBondContact O-CB 3.44Å; K431-E436 WeakPolarHBondContact O-CG 3.43Å; K431-E436 PolarHBondContact O-N 3.36Å; K431-L457 HydrophobicContact CB-CD2 4.32Å; K431-R570 PolarHBondContact NZ-O 2.83Å
432	N	83.8	Confident	83.4	Confident	68 Å²	68	47.4 Å²	47.4	36%	0.364	24%	0.242	S	C	.	.	I	π-helix	trans	-87.1	-45.9	-170.1	-52.9	-20.3	0	0	0	111.7	G428 E436 D437	G428-N432 VanDerWaalsContact O-CB 3.26Å; G428-N432 WeakPolarHBondContact O-CB 3.48Å; G428-N432 PolarHBondContact O-N 2.93Å; N432-E436 WeakPolarHBondContact O-CB 3.27Å; N432-D437 PolarHBondContact O-N 3.19Å
433	E	83.1	Confident	82.6	Confident	70 Å²	70	49 Å²	49	33%	0.327	26%	0.259	S	S	.	.	I	π-helix	trans	-80.2	-43.6	-176.4	-56.7	176.1	-157.5	0	0	111.4	R367 I429 D437 H438	R367-E433 WeakPolarHBondContact CD-OE2 3.43Å; R367-E433 IonicContact CZ-OE1 3.98Å; R367-E433 IonicContact CZ-OE2 3.67Å; R367-E433 IonicContact NE-OE1 2.78Å; R367-E433 PolarHBondContact NE-OE1 2.94Å; R367-E433 IonicContact NE-OE2 2.85Å; R367-E433 PolarHBondContact NE-OE2 3.3Å; R367-E433 IonicContact NH2-OE1 3.73Å; R367-E433 PolarHBondContact NH2-OE1 2.97Å; R367-E433 IonicContact NH2-OE2 3.53Å; I429-E433 WeakPolarHBondContact O-CA 3.29Å; I429-E433 VanDerWaalsContact O-CB 3.3Å; I429-E433 WeakPolarHBondContact O-CB 3.41Å; I429-E433 PolarHBondContact O-N 3.08Å; E433-D437 WeakPolarHBondContact O-CB 3.4Å; E433-H438 PolarHBondContact O-CD2 3.22Å; E433-H438 PolarHBondContact O-N 3.41Å
434	V	82.7	Confident	81.8	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.03	30%	0.298	C	S	.	.	I	π-helix	trans	-88.6	-54.6	-173.8	-174.7	0	0	0	0	112.2	C370 I429 L430 H438 V439 F449 V453	C370-V434 HydrophobicContact CB-CG1 4.34Å; C370-V434 HydrophobicContact CB-CG2 3.93Å; I429-V434 HydrophobicContact CG2-CG2 4.33Å; I429-V434 PolarHBondContact O-N 3.13Å; L430-V434 HydrophobicContact CD2-CG2 4.47Å; V434-H438 WeakPolarHBondContact O-CB 3.39Å; V434-H438 PolarHBondContact O-N 3.48Å; V434-V439 WeakPolarHBondContact O-CG2 3.49Å; V434-V439 PolarHBondContact O-N 3.13Å; V434-V439 VanDerWaalsContact O-N 3.17Å; V434-F449 HydrophobicContact CG1-CE1 3.57Å; V434-F449 HydrophobicContact CG1-CZ 3.91Å; V434-V453 HydrophobicContact CB-CG1 4.43Å; V434-V453 HydrophobicContact CG1-CG1 3.95Å; V434-V453 HydrophobicContact CG1-CG2 4.07Å
435	L	81.1	Confident	81.2	Confident	24 Å²	24	59.6 Å²	59.6	13%	0.126	31%	0.308	C	S	.	.	I	π-helix	trans	-77.2	-41.6	-175.9	-73.6	167	0	0	0	113.4	L430 K431 V439 A450 V453 K454 L457	L430-L435 WeakPolarHBondContact O-CB 3.2Å; L430-L435 VanDerWaalsContact O-CG 3.29Å; L430-L435 WeakPolarHBondContact O-CG 3.17Å; L430-L435 PolarHBondContact O-N 3.1Å; K431-L435 WeakPolarHBondContact O-CB 3.44Å; L435-V439 HydrophobicContact CD2-CG2 4.41Å; L435-V439 WeakPolarHBondContact O-CB 3.41Å; L435-A450 HydrophobicContact CD2-CB 4.3Å; L435-V453 HydrophobicContact CD1-CG1 4.19Å; L435-V453 HydrophobicContact CD2-CB 4.42Å; L435-V453 HydrophobicContact CD2-CG1 4.08Å; L435-V453 HydrophobicContact CG-CG1 3.84Å; L435-K454 HydrophobicContact CD1-CG 4.17Å; L435-K454 HydrophobicContact CD2-CG 4.05Å; L435-L457 HydrophobicContact CD1-CD2 3.81Å
436	E	79.4	Confident	80.9	Confident	84 Å²	84	55.1 Å²	55.1	39%	0.393	29%	0.287	S	S	.	.	I	π-helix	trans	-79.5	-52.8	179.3	-69.3	174.2	-176.5	0	0	111.8	K431 N432 Q440	K431-E436 WeakPolarHBondContact O-CG 3.43Å; K431-E436 PolarHBondContact O-N 3.36Å; N432-E436 WeakPolarHBondContact O-CB 3.27Å; E436-Q440 VanDerWaalsContact O-CB 3.27Å; E436-Q440 WeakPolarHBondContact O-CB 3.21Å; E436-Q440 WeakPolarHBondContact O-CG 3.43Å
437	D	77.9	Confident	80.5	Confident	100 Å²	100	56.8 Å²	56.8	54%	0.535	30%	0.304	S	S	.	.	I	π-helix	trans	-78.2	-46.4	-175.6	-69.3	-27.3	0	0	0	114.1	N432 E433 N441	N432-D437 PolarHBondContact O-N 3.19Å; E433-D437 WeakPolarHBondContact O-CB 3.4Å; D437-N441 PolarHBondContact O-ND2 3.1Å
438	H	74.3	Confident	80.2	Confident	85 Å²	85	57.1 Å²	57.1	39%	0.394	31%	0.307	S	S	.	.	I	π-helix	trans	-84.4	-45.1	-174.5	-71	-66.9	0	0	0	113.6	V374 E433 V434 L446	V374-H438 HydrophobicContact CG2-CB 4.38Å; E433-H438 PolarHBondContact O-CD2 3.22Å; E433-H438 PolarHBondContact O-N 3.41Å; V434-H438 WeakPolarHBondContact O-CB 3.39Å; V434-H438 PolarHBondContact O-N 3.48Å; H438-L446 WeakPolarHBondContact O-CD1 3.44Å
439	V	75.1	Confident	80.3	Confident	18 Å²	18	56.3 Å²	56.3	11%	0.109	30%	0.298	C	S	.	.	I	π-helix	trans	-77.2	-39.6	-173.6	173.4	0	0	0	0	112.5	V434 L435 N441 N442 A443 L446 F449 A450	V434-V439 WeakPolarHBondContact O-CG2 3.49Å; V434-V439 PolarHBondContact O-N 3.13Å; V434-V439 VanDerWaalsContact O-N 3.17Å; L435-V439 HydrophobicContact CD2-CG2 4.41Å; L435-V439 WeakPolarHBondContact O-CB 3.41Å; V439-N441 VanDerWaalsContact C-N 3.26Å; V439-N441 PolarHBondContact O-N 3.49Å; V439-N442 CarbonylContact O-C 3.36Å; V439-N442 PolarHBondContact O-N 3.29Å; V439-A443 WeakPolarHBondContact O-CA 3.19Å; V439-A443 PolarHBondContact O-N 3.45Å; V439-A443 VanDerWaalsContact O-N 3.11Å; V439-L446 HydrophobicContact CG2-CB 4.28Å; V439-L446 HydrophobicContact CG2-CD1 4.46Å; V439-F449 HydrophobicContact CG2-CD1 4.26Å; V439-A450 HydrophobicContact CB-CB 4.48Å; V439-A450 HydrophobicContact CG1-CB 3.6Å; V439-A450 HydrophobicContact CG2-CB 4.06Å
440	Q	72.5	Confident	80.2	Confident	138 Å²	138	56.6 Å²	56.6	65%	0.645	30%	0.3	S	S	*	.	H	α-helix	trans	-65.7	-31.6	179.8	-63.8	-178.9	3.5	0	0	112.5	E436	E436-Q440 VanDerWaalsContact O-CB 3.27Å; E436-Q440 WeakPolarHBondContact O-CB 3.21Å; E436-Q440 WeakPolarHBondContact O-CG 3.43Å
441	N	76.3	Confident	80.1	Confident	126 Å²	126	58.6 Å²	58.6	67%	0.674	32%	0.317	S	S	*	.	H	α-helix	trans	-73.9	-24.4	178.4	-74.6	-34.7	0	0	0	113.3	D437 V439	D437-N441 PolarHBondContact O-ND2 3.1Å; V439-N441 VanDerWaalsContact C-N 3.26Å; V439-N441 PolarHBondContact O-N 3.49Å
442	N	78.1	Confident	80.1	Confident	57 Å²	57	56.4 Å²	56.4	31%	0.305	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	51.5	-178.5	-60.2	-68.2	0	0	0	111.9	Q378 V439 E444 Q445 L446	Q378-N442 PolarHBondContact NE2-ND2 3.09Å; V439-N442 CarbonylContact O-C 3.36Å; V439-N442 PolarHBondContact O-N 3.29Å; N442-E444 VanDerWaalsContact C-N 3.28Å; N442-E444 PolarHBondContact O-N 3.31Å; N442-Q445 PolarHBondContact O-N 2.72Å; N442-Q445 VanDerWaalsContact O-N 3.14Å; N442-L446 HydrophobicContact CB-CD1 3.9Å; N442-L446 HydrophobicContact CB-CG 4.16Å; N442-L446 PolarHBondContact O-N 3.08Å; N442-L446 VanDerWaalsContact O-N 3.08Å
443	A	72.1	Confident	80.4	Confident	67 Å²	67	53.3 Å²	53.3	55%	0.554	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-34.1	-169.9	0	0	0	0	0	114.3	V439	V439-A443 WeakPolarHBondContact O-CA 3.19Å; V439-A443 PolarHBondContact O-N 3.45Å; V439-A443 VanDerWaalsContact O-N 3.11Å
444	E	71.8	Confident	80.7	Confident	178 Å²	178	55.5 Å²	55.5	83%	0.832	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-35.6	179	-66.2	-174.3	169.4	0	0	112.7	N442	N442-E444 VanDerWaalsContact C-N 3.28Å; N442-E444 PolarHBondContact O-N 3.31Å
445	Q	77.4	Confident	81.1	Confident	51 Å²	51	59.6 Å²	59.6	24%	0.238	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-24	-174.4	-62.7	178.7	-6.9	0	0	113.2	H381 N442	H381-Q445 HydrophobicContact CB-CB 4.28Å; H381-Q445 HydrophobicContact CB-CG 4.03Å; H381-Q445 PolarHBondContact CE1-O 3.02Å; H381-Q445 PolarHBondContact ND1-O 2.93Å; H381-Q445 VanDerWaalsContact ND1-O 3.16Å; N442-Q445 PolarHBondContact O-N 2.72Å; N442-Q445 VanDerWaalsContact O-N 3.14Å
446	L	82.3	Confident	81.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.318	C	S	.	.	S	Bend	trans	-110.1	13.2	-172.9	-62.5	177.8	0	0	0	113.3	V374 C377 Q378 H438 V439 N442 A448 F449 A450	V374-L446 HydrophobicContact CG1-CD1 4.2Å; V374-L446 HydrophobicContact CG1-CD2 4.38Å; C377-L446 HydrophobicContact CB-CD2 3.68Å; Q378-L446 HydrophobicContact CG-CD2 4.46Å; H438-L446 WeakPolarHBondContact O-CD1 3.44Å; V439-L446 HydrophobicContact CG2-CB 4.28Å; V439-L446 HydrophobicContact CG2-CD1 4.46Å; N442-L446 HydrophobicContact CB-CD1 3.9Å; N442-L446 HydrophobicContact CB-CG 4.16Å; N442-L446 PolarHBondContact O-N 3.08Å; N442-L446 VanDerWaalsContact O-N 3.08Å; L446-A448 PolarHBondContact O-N 3.46Å; L446-F449 PolarHBondContact O-N 3.23Å; L446-A450 WeakPolarHBondContact O-CB 3.11Å; L446-A450 PolarHBondContact O-N 3.37Å
447	G	81.8	Confident	82.1	Confident	37 Å²	37	55.4 Å²	55.4	38%	0.381	30%	0.304	S	S	.	.	H	α-helix	trans	-55.8	-49.7	-179.2	0	0	0	0	0	113.3	A450 A451	G447-A450 WeakPolarHBondContact O-CB 3.42Å; G447-A450 PolarHBondContact O-N 2.95Å; G447-A451 PolarHBondContact O-N 3.34Å
448	A	83.9	Confident	82.7	Confident	7 Å²	7	56 Å²	56	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-64.4	-42	178.2	0	0	0	0	0	113	D396 L399 E400 L446 A450 A451 G452	D396-A448 HydrophobicContact CB-CB 4.28Å; D396-A448 VanDerWaalsContact O-CB 3.3Å; D396-A448 WeakPolarHBondContact O-CB 3.4Å; L399-A448 HydrophobicContact CB-CB 3.73Å; E400-A448 HydrophobicContact CB-CB 4.18Å; L446-A448 PolarHBondContact O-N 3.46Å; A448-A450 VanDerWaalsContact C-N 3.33Å; A448-A450 PolarHBondContact O-N 3.32Å; A448-A451 WeakPolarHBondContact O-CB 3.44Å; A448-A451 PolarHBondContact O-N 3.07Å; A448-G452 PolarHBondContact O-N 3.3Å
449	F	88.1	Confident	83.5	Confident	3 Å²	3	53.7 Å²	53.7	1%	0.013	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-39.6	175.6	175	-107	0	0	0	111.9	C370 M373 V374 L406 V434 V439 L446 A451 G452 V453	C370-F449 HydrophobicContact CB-CZ 4.06Å; M373-F449 HydrophobicContact CB-CD2 4.03Å; M373-F449 HydrophobicContact CB-CE2 3.62Å; M373-F449 HydrophobicContact CB-CZ 4.47Å; V374-F449 HydrophobicContact CG2-CD1 4.08Å; V374-F449 HydrophobicContact CG2-CE1 3.49Å; V374-F449 VanDerWaalsContact CG2-CE1 3.49Å; V374-F449 HydrophobicContact CG2-CZ 3.87Å; L406-F449 HydrophobicContact CD2-CE2 4.41Å; V434-F449 HydrophobicContact CG1-CE1 3.57Å; V434-F449 HydrophobicContact CG1-CZ 3.91Å; V439-F449 HydrophobicContact CG2-CD1 4.26Å; L446-F449 PolarHBondContact O-N 3.23Å; F449-A451 VanDerWaalsContact C-N 3.27Å; F449-A451 PolarHBondContact O-N 3.28Å; F449-G452 PolarHBondContact O-N 3.12Å; F449-V453 HydrophobicContact CD1-CG2 4.05Å; F449-V453 HydrophobicContact CD2-CG2 4.1Å; F449-V453 HydrophobicContact CE1-CG2 3.59Å; F449-V453 HydrophobicContact CE2-CG2 3.64Å; F449-V453 HydrophobicContact CG-CG2 4.3Å; F449-V453 HydrophobicContact CZ-CG2 3.37Å; F449-V453 WeakPolarHBondContact O-CG2 3.48Å; F449-V453 PolarHBondContact O-N 3.38Å
450	A	87.2	Confident	84.2	Confident	6 Å²	6	52.9 Å²	52.9	5%	0.05	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-35.1	177.4	0	0	0	0	0	112.3	L435 V439 L446 G447 A448 K454	L435-A450 HydrophobicContact CD2-CB 4.3Å; V439-A450 HydrophobicContact CB-CB 4.48Å; V439-A450 HydrophobicContact CG1-CB 3.6Å; V439-A450 HydrophobicContact CG2-CB 4.06Å; L446-A450 WeakPolarHBondContact O-CB 3.11Å; L446-A450 PolarHBondContact O-N 3.37Å; G447-A450 WeakPolarHBondContact O-CB 3.42Å; G447-A450 PolarHBondContact O-N 2.95Å; A448-A450 VanDerWaalsContact C-N 3.33Å; A448-A450 PolarHBondContact O-N 3.32Å; A450-K454 WeakPolarHBondContact O-CB 3.24Å; A450-K454 WeakPolarHBondContact O-CG 3.38Å; A450-K454 PolarHBondContact O-N 3.47Å
451	A	87.2	Confident	85.1	Confident	45 Å²	45	47.7 Å²	47.7	37%	0.372	26%	0.264	S	S	.	.	H	α-helix	trans	-63.7	-49	174.7	0	0	0	0	0	111.5	G447 A448 F449 V453 K454 Q455	G447-A451 PolarHBondContact O-N 3.34Å; A448-A451 WeakPolarHBondContact O-CB 3.44Å; A448-A451 PolarHBondContact O-N 3.07Å; F449-A451 VanDerWaalsContact C-N 3.27Å; F449-A451 PolarHBondContact O-N 3.28Å; A451-V453 PolarHBondContact O-N 3.27Å; A451-K454 PolarHBondContact O-N 3.37Å; A451-Q455 PolarHBondContact O-N 3.29Å; A451-Q455 VanDerWaalsContact O-N 3.07Å
452	G	86.5	Confident	85.8	Confident	16 Å²	16	48.3 Å²	48.3	17%	0.165	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-40.2	177.2	0	0	0	0	0	113.4	A448 F449 Q455 M456	A448-G452 PolarHBondContact O-N 3.3Å; F449-G452 PolarHBondContact O-N 3.12Å; G452-Q455 PolarHBondContact O-N 2.86Å; G452-M456 PolarHBondContact O-N 3.15Å
453	V	89.4	Confident	86.5	Confident	3 Å²	3	48 Å²	48	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-68.2	-37.3	176.5	172.1	0	0	0	0	112.1	L430 V434 L435 F449 A451 M456 L457	L430-V453 HydrophobicContact CB-CG1 4.48Å; L430-V453 HydrophobicContact CD2-CG1 4.07Å; V434-V453 HydrophobicContact CB-CG1 4.43Å; V434-V453 HydrophobicContact CG1-CG1 3.95Å; V434-V453 HydrophobicContact CG1-CG2 4.07Å; L435-V453 HydrophobicContact CD1-CG1 4.19Å; L435-V453 HydrophobicContact CD2-CB 4.42Å; L435-V453 HydrophobicContact CD2-CG1 4.08Å; L435-V453 HydrophobicContact CG-CG1 3.84Å; F449-V453 HydrophobicContact CD1-CG2 4.05Å; F449-V453 HydrophobicContact CD2-CG2 4.1Å; F449-V453 HydrophobicContact CE1-CG2 3.59Å; F449-V453 HydrophobicContact CE2-CG2 3.64Å; F449-V453 HydrophobicContact CG-CG2 4.3Å; F449-V453 HydrophobicContact CZ-CG2 3.37Å; F449-V453 WeakPolarHBondContact O-CG2 3.48Å; F449-V453 PolarHBondContact O-N 3.38Å; A451-V453 PolarHBondContact O-N 3.27Å; V453-M456 PolarHBondContact O-N 2.99Å; V453-L457 WeakPolarHBondContact O-CB 3.48Å; V453-L457 PolarHBondContact O-N 3.36Å
454	K	89.3	Confident	87.4	Confident	115 Å²	115	44.9 Å²	44.9	50%	0.5	23%	0.232	S	C	.	.	H	α-helix	trans	-62.2	-46.6	174.5	-78.9	170.7	-176.1	177.4	0	111.4	L435 A450 A451 M456 L457 E458	L435-K454 HydrophobicContact CD1-CG 4.17Å; L435-K454 HydrophobicContact CD2-CG 4.05Å; A450-K454 WeakPolarHBondContact O-CB 3.24Å; A450-K454 WeakPolarHBondContact O-CG 3.38Å; A450-K454 PolarHBondContact O-N 3.47Å; A451-K454 PolarHBondContact O-N 3.37Å; K454-M456 VanDerWaalsContact C-N 3.27Å; K454-M456 PolarHBondContact O-N 3.33Å; K454-L457 WeakPolarHBondContact O-CB 3.44Å; K454-L457 PolarHBondContact O-N 3.1Å; K454-L457 VanDerWaalsContact O-N 3.12Å; K454-E458 WeakPolarHBondContact O-CG 3.22Å; K454-E458 PolarHBondContact O-N 3.36Å
455	Q	90.9	Very high	88.3	Confident	92 Å²	92	38.3 Å²	38.3	43%	0.43	20%	0.204	S	C	.	.	H	α-helix	trans	-59.4	-40.8	175.3	-174.8	-179.9	-13.1	0	0	111.4	Y407 A451 G452 E458 D459	Y407-Q455 HydrophobicContact CE2-CG 4.14Å; Y407-Q455 PolarHBondContact OH-NE2 3.14Å; A451-Q455 PolarHBondContact O-N 3.29Å; A451-Q455 VanDerWaalsContact O-N 3.07Å; G452-Q455 PolarHBondContact O-N 2.86Å; Q455-E458 PolarHBondContact O-N 3.46Å; Q455-D459 PolarHBondContact O-N 3.25Å; Q455-D459 VanDerWaalsContact O-N 3.11Å
456	M	90.2	Very high	88.9	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-38.8	175.1	-165.9	167.3	65.2	0	0	112.7	V366 Y407 F410 I414 L430 G452 V453 K454 D459 V460	V366-M456 HydrophobicContact CG1-CE 4.46Å; Y407-M456 HydrophobicContact CD2-CB 4Å; Y407-M456 HydrophobicContact CD2-CG 4.28Å; Y407-M456 HydrophobicContact CE2-CB 4.31Å; F410-M456 HydrophobicContact CB-SD 3.83Å; F410-M456 HydrophobicContact CD2-CE 4.19Å; F410-M456 HydrophobicContact CD2-SD 3.72Å; F410-M456 HydrophobicContact CG-SD 4.3Å; I414-M456 HydrophobicContact CD1-CG 3.56Å; I414-M456 HydrophobicContact CD1-SD 4.03Å; L430-M456 HydrophobicContact CD1-CE 3.98Å; L430-M456 HydrophobicContact CD1-CG 4.35Å; L430-M456 HydrophobicContact CD2-CE 3.34Å; L430-M456 HydrophobicContact CG-CE 4.31Å; G452-M456 PolarHBondContact O-N 3.15Å; V453-M456 PolarHBondContact O-N 2.99Å; K454-M456 VanDerWaalsContact C-N 3.27Å; K454-M456 PolarHBondContact O-N 3.33Å; M456-D459 PolarHBondContact O-N 2.9Å; M456-V460 VanDerWaalsContact O-CG2 3.24Å; M456-V460 WeakPolarHBondContact O-CG2 3.39Å; M456-V460 PolarHBondContact O-N 2.93Å
457	L	91	Very high	89.3	Confident	16 Å²	16	44.7 Å²	44.7	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-43.2	175.6	175	63	0	0	0	111.1	C427 L430 K431 L435 V453 K454 V460 Q461	C427-L457 HydrophobicContact CB-CD1 4.24Å; L430-L457 HydrophobicContact CB-CB 4.41Å; L430-L457 HydrophobicContact CB-CD1 4.09Å; L430-L457 HydrophobicContact CD1-CB 4.47Å; K431-L457 HydrophobicContact CB-CD2 4.32Å; L435-L457 HydrophobicContact CD1-CD2 3.81Å; V453-L457 WeakPolarHBondContact O-CB 3.48Å; V453-L457 PolarHBondContact O-N 3.36Å; K454-L457 WeakPolarHBondContact O-CB 3.44Å; K454-L457 PolarHBondContact O-N 3.1Å; K454-L457 VanDerWaalsContact O-N 3.12Å; L457-V460 PolarHBondContact O-N 2.95Å; L457-Q461 HydrophobicContact CD1-CG 4.12Å; L457-Q461 HydrophobicContact CG-CG 4.37Å; L457-Q461 WeakPolarHBondContact O-CB 3.4Å; L457-Q461 VanDerWaalsContact O-CG 3.24Å; L457-Q461 WeakPolarHBondContact O-CG 3.32Å; L457-Q461 PolarHBondContact O-N 3.4Å
458	E	90.8	Very high	89.7	Confident	113 Å²	113	43 Å²	43	53%	0.528	21%	0.208	S	C	.	.	H	α-helix	trans	-59	-46.8	175.8	-72.2	172.8	-172.6	0	0	111	K454 Q455 V460 Q461 E462	K454-E458 WeakPolarHBondContact O-CG 3.22Å; K454-E458 PolarHBondContact O-N 3.36Å; Q455-E458 PolarHBondContact O-N 3.46Å; E458-V460 PolarHBondContact O-N 3.16Å; E458-Q461 WeakPolarHBondContact O-CB 3.45Å; E458-Q461 PolarHBondContact O-N 3.33Å; E458-E462 WeakPolarHBondContact O-CG 3.27Å; E458-E462 PolarHBondContact O-N 2.91Å
459	D	90.8	Very high	90	Very high	36 Å²	36	45.8 Å²	45.8	19%	0.193	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-42.2	176	-82.9	-5	0	0	0	112.6	Y407 R411 Q455 M456 Q461 R463	Y407-D459 WeakPolarHBondContact CE2-OD2 3.39Å; Y407-D459 VanDerWaalsContact CZ-OD2 3.32Å; Y407-D459 PolarHBondContact OH-OD2 3.23Å; R411-D459 IonicContact NE-OD2 2.68Å; Q455-D459 PolarHBondContact O-N 3.25Å; Q455-D459 VanDerWaalsContact O-N 3.11Å; M456-D459 PolarHBondContact O-N 2.9Å; D459-Q461 VanDerWaalsContact C-N 3.34Å; D459-R463 VanDerWaalsContact O-CB 3.3Å; D459-R463 WeakPolarHBondContact O-CB 3.44Å; D459-R463 PolarHBondContact O-N 3.11Å
460	V	91.4	Very high	90	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-66.1	-39.7	176.7	179.6	0	0	0	0	110.3	I414 L423 L426 C427 L430 M456 L457 E458 R463 L464	I414-V460 HydrophobicContact CB-CG2 4.42Å; I414-V460 HydrophobicContact CD1-CG2 3.57Å; I414-V460 HydrophobicContact CG1-CG2 3.86Å; I414-V460 HydrophobicContact CG2-CB 4.35Å; I414-V460 HydrophobicContact CG2-CG2 3.65Å; L423-V460 HydrophobicContact CD2-CG1 4.07Å; L426-V460 HydrophobicContact CB-CG1 4.01Å; C427-V460 WeakPolarHBondContact SG-CG1 3.47Å; L430-V460 HydrophobicContact CD1-CG2 4.08Å; M456-V460 VanDerWaalsContact O-CG2 3.24Å; M456-V460 WeakPolarHBondContact O-CG2 3.39Å; M456-V460 PolarHBondContact O-N 2.93Å; L457-V460 PolarHBondContact O-N 2.95Å; E458-V460 PolarHBondContact O-N 3.16Å; V460-R463 PolarHBondContact O-N 3.04Å; V460-L464 VanDerWaalsContact O-CB 3.28Å; V460-L464 WeakPolarHBondContact O-CB 3.39Å; V460-L464 PolarHBondContact O-N 3.46Å
461	Q	91.1	Very high	90.1	Very high	28 Å²	28	49.5 Å²	49.5	13%	0.131	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-46.4	176.7	-75.9	175	-27.7	0	0	111.7	L457 E458 D459 R463 L464 V465 C571	L457-Q461 HydrophobicContact CD1-CG 4.12Å; L457-Q461 HydrophobicContact CG-CG 4.37Å; L457-Q461 WeakPolarHBondContact O-CB 3.4Å; L457-Q461 VanDerWaalsContact O-CG 3.24Å; L457-Q461 WeakPolarHBondContact O-CG 3.32Å; L457-Q461 PolarHBondContact O-N 3.4Å; E458-Q461 WeakPolarHBondContact O-CB 3.45Å; E458-Q461 PolarHBondContact O-N 3.33Å; D459-Q461 VanDerWaalsContact C-N 3.34Å; Q461-R463 VanDerWaalsContact C-N 3.29Å; Q461-R463 PolarHBondContact O-N 3.06Å; Q461-L464 WeakPolarHBondContact O-CB 3.49Å; Q461-L464 PolarHBondContact O-N 2.79Å; Q461-L464 VanDerWaalsContact O-N 3.16Å; Q461-V465 VanDerWaalsContact O-CG2 3.22Å; Q461-V465 WeakPolarHBondContact O-CG2 3.25Å; Q461-V465 PolarHBondContact O-N 2.84Å; Q461-C571 PolarHBondContact NE2-O 3.34Å
462	E	90.6	Very high	90.2	Very high	139 Å²	139	47.3 Å²	47.3	65%	0.65	22%	0.218	S	C	*	.	H	α-helix	trans	-58.4	-44	174.3	-74.5	-170.6	176.9	0	0	111.2	E458 L464 V465 Y466	E458-E462 WeakPolarHBondContact O-CG 3.27Å; E458-E462 PolarHBondContact O-N 2.91Å; E462-L464 VanDerWaalsContact C-N 3.35Å; E462-L464 PolarHBondContact O-N 3.43Å; E462-V465 PolarHBondContact O-N 3.01Å; E462-Y466 WeakPolarHBondContact O-CB 3.36Å; E462-Y466 PolarHBondContact O-N 2.7Å
463	R	92.1	Very high	90.3	Very high	52 Å²	52	51.2 Å²	51.2	20%	0.196	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-41.9	176	-176.8	59.4	179.8	-175.2	-3.4	111.7	I414 I415 V417 L423 D459 V460 Q461 Y466 R467	I414-R463 HydrophobicContact CG2-CB 4.47Å; I415-R463 PolarHBondContact O-NE 3.08Å; I415-R463 PolarHBondContact O-NH2 3.24Å; V417-R463 PolarHBondContact O-NE 3.14Å; V417-R463 PolarHBondContact O-NH2 2.72Å; V417-R463 VanDerWaalsContact O-NH2 3.14Å; L423-R463 HydrophobicContact CD1-CG 3.96Å; L423-R463 HydrophobicContact CD2-CB 4.39Å; L423-R463 HydrophobicContact CD2-CG 3.93Å; D459-R463 VanDerWaalsContact O-CB 3.3Å; D459-R463 WeakPolarHBondContact O-CB 3.44Å; D459-R463 PolarHBondContact O-N 3.11Å; V460-R463 PolarHBondContact O-N 3.04Å; Q461-R463 VanDerWaalsContact C-N 3.29Å; Q461-R463 PolarHBondContact O-N 3.06Å; R463-Y466 PolarHBondContact O-N 3.21Å; R463-R467 HydrophobicContact CG-CG 4.44Å; R463-R467 WeakPolarHBondContact O-CB 3.29Å; R463-R467 VanDerWaalsContact O-CG 3.31Å; R463-R467 WeakPolarHBondContact O-CG 3.47Å; R463-R467 PolarHBondContact O-N 3.37Å
464	L	90.9	Very high	90.2	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-45.2	176.3	-179.9	67.4	0	0	0	111	L420 L423 V460 Q461 E462 R467 T468 L568 C571 I572	L420-L464 HydrophobicContact CD1-CD1 3.46Å; L420-L464 VanDerWaalsContact CD1-CD1 3.46Å; L420-L464 HydrophobicContact CG-CD1 4.06Å; L423-L464 HydrophobicContact CB-CB 4.27Å; L423-L464 HydrophobicContact CB-CD1 3.64Å; V460-L464 VanDerWaalsContact O-CB 3.28Å; V460-L464 WeakPolarHBondContact O-CB 3.39Å; V460-L464 PolarHBondContact O-N 3.46Å; Q461-L464 WeakPolarHBondContact O-CB 3.49Å; Q461-L464 PolarHBondContact O-N 2.79Å; Q461-L464 VanDerWaalsContact O-N 3.16Å; E462-L464 VanDerWaalsContact C-N 3.35Å; E462-L464 PolarHBondContact O-N 3.43Å; L464-R467 PolarHBondContact O-N 3.35Å; L464-T468 VanDerWaalsContact O-CB 3.26Å; L464-T468 WeakPolarHBondContact O-CB 3.27Å; L464-T468 PolarHBondContact O-N 3.34Å; L464-T468 PolarHBondContact O-OG1 3.4Å; L464-L568 HydrophobicContact CD1-CD2 4.23Å; L464-L568 HydrophobicContact CD2-CD2 4.06Å; L464-L568 HydrophobicContact CG-CD2 3.93Å; L464-C571 HydrophobicContact CD2-CB 3.8Å; L464-I572 HydrophobicContact CD2-CD1 3.84Å; L464-I572 HydrophobicContact CD2-CG1 3.86Å; L464-I572 HydrophobicContact CG-CD1 4.18Å
465	V	90.8	Very high	90.1	Very high	41 Å²	41	52.1 Å²	52.1	25%	0.248	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-48.9	175.9	171.1	0	0	0	0	110.6	Q461 E462 R467 T468 H469 I572 V576 L580	Q461-V465 VanDerWaalsContact O-CG2 3.22Å; Q461-V465 WeakPolarHBondContact O-CG2 3.25Å; Q461-V465 PolarHBondContact O-N 2.84Å; E462-V465 PolarHBondContact O-N 3.01Å; V465-R467 PolarHBondContact O-N 3.41Å; V465-T468 WeakPolarHBondContact O-CB 3.39Å; V465-T468 PolarHBondContact O-N 3.08Å; V465-H469 PolarHBondContact O-N 2.86Å; V465-I572 HydrophobicContact CG2-CD1 3.96Å; V465-V576 HydrophobicContact CG1-CG1 4.29Å; V465-V576 HydrophobicContact CG2-CG1 3.61Å; V465-L580 HydrophobicContact CB-CD1 4.4Å; V465-L580 HydrophobicContact CG1-CD1 4.19Å; V465-L580 HydrophobicContact CG1-CD2 4.33Å; V465-L580 HydrophobicContact CG2-CD1 4.06Å
466	Y	90.9	Very high	89.9	Confident	130 Å²	130	47.8 Å²	47.8	51%	0.51	23%	0.225	S	C	.	.	H	α-helix	trans	-60.5	-47.4	178.4	174.6	-103.6	0	0	0	112.5	E462 R463 T468 H469 I470	E462-Y466 WeakPolarHBondContact O-CB 3.36Å; E462-Y466 PolarHBondContact O-N 2.7Å; R463-Y466 PolarHBondContact O-N 3.21Å; Y466-T468 VanDerWaalsContact C-N 3.31Å; Y466-T468 PolarHBondContact O-N 3.17Å; Y466-H469 PolarHBondContact O-N 3.19Å; Y466-I470 HydrophobicContact CD1-CD1 3.97Å; Y466-I470 HydrophobicContact CE1-CD1 3.33Å; Y466-I470 HydrophobicContact CE1-CG1 4.49Å; Y466-I470 HydrophobicContact CE2-CD1 4.05Å; Y466-I470 PolarHBondContact O-N 2.99Å; Y466-I470 VanDerWaalsContact O-N 3.13Å
467	R	90.8	Very high	89.7	Confident	55 Å²	55	51.1 Å²	51.1	21%	0.208	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-35	178	-68.9	-57.9	-59.4	159.6	6.3	112	I418 L423 R463 L464 V465 I470 Y471	I418-R467 PolarHBondContact O-NE 3.38Å; I418-R467 PolarHBondContact O-NH2 3.27Å; L423-R467 HydrophobicContact CD1-CB 4.12Å; L423-R467 HydrophobicContact CD1-CG 3.81Å; R463-R467 HydrophobicContact CG-CG 4.44Å; R463-R467 WeakPolarHBondContact O-CB 3.29Å; R463-R467 VanDerWaalsContact O-CG 3.31Å; R463-R467 WeakPolarHBondContact O-CG 3.47Å; R463-R467 PolarHBondContact O-N 3.37Å; L464-R467 PolarHBondContact O-N 3.35Å; V465-R467 PolarHBondContact O-N 3.41Å; R467-I470 PolarHBondContact O-N 2.87Å; R467-Y471 WeakPolarHBondContact O-CB 3.49Å; R467-Y471 PolarHBondContact O-N 3.16Å
468	T	90.1	Very high	89.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-47.2	173	-61.7	0	0	0	0	111.1	L420 L464 V465 Y466 I470 Y471 I472 L568 L580	L420-T468 VanDerWaalsContact CD1-OG1 3.29Å; L420-T468 WeakPolarHBondContact CD1-OG1 3.42Å; L464-T468 VanDerWaalsContact O-CB 3.26Å; L464-T468 WeakPolarHBondContact O-CB 3.27Å; L464-T468 PolarHBondContact O-N 3.34Å; L464-T468 PolarHBondContact O-OG1 3.4Å; V465-T468 WeakPolarHBondContact O-CB 3.39Å; V465-T468 PolarHBondContact O-N 3.08Å; Y466-T468 VanDerWaalsContact C-N 3.31Å; Y466-T468 PolarHBondContact O-N 3.17Å; T468-I470 VanDerWaalsContact C-N 3.34Å; T468-I470 PolarHBondContact O-N 3.16Å; T468-Y471 CarbonylContact O-C 3.57Å; T468-Y471 WeakPolarHBondContact O-CB 2.85Å; T468-Y471 PolarHBondContact O-N 3.31Å; T468-Y471 VanDerWaalsContact O-N 3.13Å; T468-I472 HydrophobicContact CG2-CD1 3.87Å; T468-I472 HydrophobicContact CG2-CG1 4.38Å; T468-I472 WeakPolarHBondContact O-CG1 3.45Å; T468-I472 PolarHBondContact O-N 3.43Å; T468-L568 HydrophobicContact CG2-CD1 3.58Å; T468-L568 HydrophobicContact CG2-CD2 4.24Å; T468-L568 VanDerWaalsContact OG1-CD2 3.28Å; T468-L568 WeakPolarHBondContact OG1-CD2 3.4Å; T468-L580 HydrophobicContact CG2-CD1 4.25Å; T468-L580 HydrophobicContact CG2-CD2 4.14Å
469	H	89.4	Confident	88.9	Confident	67 Å²	67	49.2 Å²	49.2	31%	0.31	25%	0.247	S	C	.	.	H	α-helix	trans	-61.2	-43.5	178.8	-174.6	72.8	0	0	0	111.6	V465 Y466 Y471 I472 Q473 E583	V465-H469 PolarHBondContact O-N 2.86Å; Y466-H469 PolarHBondContact O-N 3.19Å; H469-Y471 VanDerWaalsContact C-N 3.33Å; H469-Y471 PolarHBondContact O-N 3.42Å; H469-I472 PolarHBondContact O-N 3.25Å; H469-Q473 PolarHBondContact CE1-NE2 3.03Å; H469-Q473 PolarHBondContact NE2-NE2 3.04Å; H469-Q473 WeakPolarHBondContact O-CG 3.24Å; H469-Q473 PolarHBondContact O-N 3.29Å; H469-E583 IonicContact CE1-OE1 3.8Å; H469-E583 PolarHBondContact CE1-OE1 2.92Å; H469-E583 IonicContact CE1-OE2 3.18Å; H469-E583 PolarHBondContact CE1-OE2 2.84Å; H469-E583 VanDerWaalsContact ND1-CD 3.32Å; H469-E583 IonicContact ND1-OE1 2.99Å; H469-E583 PolarHBondContact ND1-OE1 3.22Å; H469-E583 IonicContact ND1-OE2 2.66Å; H469-E583 PolarHBondContact ND1-OE2 3.06Å
470	I	88.3	Confident	88.2	Confident	38 Å²	38	56.1 Å²	56.1	20%	0.195	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-42.1	173.5	-67.6	173.6	0	0	0	111.5	Y466 R467 T468 Q473 T474	Y466-I470 HydrophobicContact CD1-CD1 3.97Å; Y466-I470 HydrophobicContact CE1-CD1 3.33Å; Y466-I470 HydrophobicContact CE1-CG1 4.49Å; Y466-I470 HydrophobicContact CE2-CD1 4.05Å; Y466-I470 PolarHBondContact O-N 2.99Å; Y466-I470 VanDerWaalsContact O-N 3.13Å; R467-I470 PolarHBondContact O-N 2.87Å; T468-I470 VanDerWaalsContact C-N 3.34Å; T468-I470 PolarHBondContact O-N 3.16Å; I470-Q473 PolarHBondContact O-N 3.2Å; I470-T474 VanDerWaalsContact O-CB 3.28Å; I470-T474 WeakPolarHBondContact O-CB 3.35Å; I470-T474 PolarHBondContact O-N 3.29Å; I470-T474 PolarHBondContact O-OG1 3.46Å
471	Y	90.1	Very high	87.5	Confident	48 Å²	48	58.1 Å²	58.1	19%	0.188	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-43.7	177.5	179.3	-98.9	0	0	0	111.1	R467 T468 H469 Q473 T474 D475 I476 R560 C564	R467-Y471 WeakPolarHBondContact O-CB 3.49Å; R467-Y471 PolarHBondContact O-N 3.16Å; T468-Y471 CarbonylContact O-C 3.57Å; T468-Y471 WeakPolarHBondContact O-CB 2.85Å; T468-Y471 PolarHBondContact O-N 3.31Å; T468-Y471 VanDerWaalsContact O-N 3.13Å; H469-Y471 VanDerWaalsContact C-N 3.33Å; H469-Y471 PolarHBondContact O-N 3.42Å; Y471-Q473 PolarHBondContact O-N 2.94Å; Y471-T474 PolarHBondContact O-N 3.16Å; Y471-D475 HydrophobicContact CD2-CB 3.81Å; Y471-D475 WeakPolarHBondContact CD2-OD2 3.46Å; Y471-D475 HydrophobicContact CE2-CB 3.68Å; Y471-D475 VanDerWaalsContact CE2-OD2 3.23Å; Y471-D475 WeakPolarHBondContact CE2-OD2 3.15Å; Y471-D475 HydrophobicContact CG-CB 4.33Å; Y471-D475 WeakPolarHBondContact O-CA 3.34Å; Y471-D475 VanDerWaalsContact O-CB 3.29Å; Y471-D475 WeakPolarHBondContact O-CB 3.38Å; Y471-D475 PolarHBondContact O-N 3.28Å; Y471-I476 HydrophobicContact CE1-CD1 4.49Å; Y471-R560 HydrophobicContact CE1-CB 4.35Å; Y471-R560 VanDerWaalsContact OH-CB 3.22Å; Y471-R560 WeakPolarHBondContact OH-CB 3.37Å; Y471-R560 VanDerWaalsContact OH-CG 3.3Å; Y471-R560 WeakPolarHBondContact OH-CG 3.13Å; Y471-C564 HydrophobicContact CD1-CB 4.43Å; Y471-C564 HydrophobicContact CE1-CB 4.03Å
472	I	88.9	Confident	86.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.299	C	S	.	.	I	π-helix	trans	-60.3	-48.2	175.8	-65.2	163	0	0	0	110.5	T468 H469 I476 T477 E583 A584 A587	T468-I472 HydrophobicContact CG2-CD1 3.87Å; T468-I472 HydrophobicContact CG2-CG1 4.38Å; T468-I472 WeakPolarHBondContact O-CG1 3.45Å; T468-I472 PolarHBondContact O-N 3.43Å; H469-I472 PolarHBondContact O-N 3.25Å; I472-I476 HydrophobicContact CB-CD1 4.38Å; I472-I476 HydrophobicContact CG1-CD1 4.1Å; I472-I476 HydrophobicContact CG2-CD1 4.4Å; I472-I476 VanDerWaalsContact O-CB 3.32Å; I472-I476 WeakPolarHBondContact O-CB 3.3Å; I472-I476 PolarHBondContact O-N 3.12Å; I472-T477 PolarHBondContact O-N 3Å; I472-T477 PolarHBondContact O-OG1 3.31Å; I472-E583 HydrophobicContact CD1-CB 4.45Å; I472-E583 HydrophobicContact CG2-CG 4.21Å; I472-A584 HydrophobicContact CD1-CB 3.77Å; I472-A584 HydrophobicContact CG1-CB 3.99Å; I472-A587 HydrophobicContact CG2-CB 3.72Å
473	Q	88.4	Confident	85.6	Confident	98 Å²	98	57.6 Å²	57.6	46%	0.458	30%	0.303	S	S	.	.	I	π-helix	trans	-64.8	-43.2	-179.7	-70.9	-174.5	-5.1	0	0	113	H469 I470 Y471 G478	H469-Q473 PolarHBondContact CE1-NE2 3.03Å; H469-Q473 PolarHBondContact NE2-NE2 3.04Å; H469-Q473 WeakPolarHBondContact O-CG 3.24Å; H469-Q473 PolarHBondContact O-N 3.29Å; I470-Q473 PolarHBondContact O-N 3.2Å; Y471-Q473 PolarHBondContact O-N 2.94Å; Q473-G478 PolarHBondContact O-N 3.13Å
474	T	88.3	Confident	84.3	Confident	83 Å²	83	56.8 Å²	56.8	51%	0.509	31%	0.311	S	S	.	.	I	π-helix	trans	-84.6	-46.6	-172.3	-47.8	0	0	0	0	112	I470 Y471 G478	I470-T474 VanDerWaalsContact O-CB 3.28Å; I470-T474 WeakPolarHBondContact O-CB 3.35Å; I470-T474 PolarHBondContact O-N 3.29Å; I470-T474 PolarHBondContact O-OG1 3.46Å; Y471-T474 PolarHBondContact O-N 3.16Å; T474-G478 CarbonylContact O-C 3.6Å
475	D	85.4	Confident	83.4	Confident	54 Å²	54	58.4 Å²	58.4	29%	0.289	32%	0.319	S	S	.	.	I	π-helix	trans	-98.3	-14	-169.2	-82.3	-48.3	0	0	0	114.8	Y471 R560	Y471-D475 HydrophobicContact CD2-CB 3.81Å; Y471-D475 WeakPolarHBondContact CD2-OD2 3.46Å; Y471-D475 HydrophobicContact CE2-CB 3.68Å; Y471-D475 VanDerWaalsContact CE2-OD2 3.23Å; Y471-D475 WeakPolarHBondContact CE2-OD2 3.15Å; Y471-D475 HydrophobicContact CG-CB 4.33Å; Y471-D475 WeakPolarHBondContact O-CA 3.34Å; Y471-D475 VanDerWaalsContact O-CB 3.29Å; Y471-D475 WeakPolarHBondContact O-CB 3.38Å; Y471-D475 PolarHBondContact O-N 3.28Å; D475-R560 WeakPolarHBondContact O-CD 3.26Å; D475-R560 PolarHBondContact O-NH1 2.63Å; D475-R560 IonicContact OD1-CZ 2.62Å; D475-R560 IonicContact OD1-NH1 2.67Å; D475-R560 PolarHBondContact OD1-NH1 2.87Å; D475-R560 IonicContact OD1-NH2 3.71Å
476	I	87.3	Confident	82.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.315	C	S	.	.	I	π-helix	trans	-112.4	-62.3	176.8	-54.2	173.2	0	0	0	110.3	Y471 I472 Y479 T561 A587 C588	Y471-I476 HydrophobicContact CE1-CD1 4.49Å; I472-I476 HydrophobicContact CB-CD1 4.38Å; I472-I476 HydrophobicContact CG1-CD1 4.1Å; I472-I476 HydrophobicContact CG2-CD1 4.4Å; I472-I476 VanDerWaalsContact O-CB 3.32Å; I472-I476 WeakPolarHBondContact O-CB 3.3Å; I472-I476 PolarHBondContact O-N 3.12Å; I476-Y479 WeakPolarHBondContact O-CB 3.47Å; I476-T561 WeakPolarHBondContact CD1-OG1 3.32Å; I476-A587 HydrophobicContact CB-CB 4.31Å; I476-A587 HydrophobicContact CG2-CB 3.7Å; I476-C588 HydrophobicContact CG2-CB 4.29Å
477	T	85.6	Confident	81.3	Confident	75 Å²	75	53 Å²	53	46%	0.46	30%	0.303	S	S	.	.	I	π-helix	trans	-70.7	-45.6	-177.6	-50.7	0	0	0	0	111.8	I472 Y479 A587	I472-T477 PolarHBondContact O-N 3Å; I472-T477 PolarHBondContact O-OG1 3.31Å; T477-Y479 PolarHBondContact O-N 3.21Å; T477-A587 VanDerWaalsContact OG1-CB 3.28Å; T477-A587 WeakPolarHBondContact OG1-CB 3.2Å
478	G	82.1	Confident	80.4	Confident	46 Å²	46	50.9 Å²	50.9	47%	0.474	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	1.4	179.3	0	0	0	0	0	114.9	Q473 T474 K480	Q473-G478 PolarHBondContact O-N 3.13Å; T474-G478 CarbonylContact O-C 3.6Å; G478-K480 PolarHBondContact O-N 3.46Å
479	Y	83.9	Confident	79.3	Confident	42 Å²	42	51.2 Å²	51.2	17%	0.165	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-66.7	120.9	-175.9	-178.6	-103.4	0	0	0	111.7	I476 T477 P481 D485 Y555 P556 T557	I476-Y479 WeakPolarHBondContact O-CB 3.47Å; T477-Y479 PolarHBondContact O-N 3.21Å; Y479-P481 HydrophobicContact CE1-CB 4.47Å; Y479-D485 PolarHBondContact OH-OD2 3.2Å; Y479-Y555 HydrophobicContact CE1-CE2 4.49Å; Y479-Y555 AromaticContact CE1-CZ 3.99Å; Y479-P556 HydrophobicContact CE1-CB 4.38Å; Y479-P556 HydrophobicContact CE2-CB 4.43Å; Y479-T557 HydrophobicContact CD1-CG2 3.54Å; Y479-T557 HydrophobicContact CE1-CG2 4.29Å; Y479-T557 HydrophobicContact CG-CG2 3.73Å
480	K	76.3	Confident	78.4	Confident	181 Å²	181	52.2 Å²	52.2	79%	0.787	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-93.5	119	173.5	-67.3	-177	-177.3	177.3	0	109.4	G478 A482	G478-K480 PolarHBondContact O-N 3.46Å; K480-A482 PolarHBondContact O-N 3.26Å
481	P	76.9	Confident	77.5	Confident	44 Å²	44	54.7 Å²	54.7	29%	0.286	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-64.9	129.7	-178.3	24.5	-32	0	0	0	111	Y479 L486	Y479-P481 HydrophobicContact CE1-CB 4.47Å; P481-L486 HydrophobicContact CB-CD1 4.31Å; P481-L486 HydrophobicContact CB-CD2 3.96Å; P481-L486 HydrophobicContact CB-CG 3.98Å; P481-L486 HydrophobicContact CG-CD1 4.32Å; P481-L486 HydrophobicContact CG-CD2 4.16Å; P481-L486 HydrophobicContact CG-CG 4.4Å
482	A	76.4	Confident	76.6	Confident	43 Å²	43	52.9 Å²	52.9	36%	0.355	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-71.2	154.5	172.2	0	0	0	0	0	110.3	K480 G484 D485 L486	K480-A482 PolarHBondContact O-N 3.26Å; A482-G484 PolarHBondContact O-N 3.21Å; A482-G484 VanDerWaalsContact O-N 3.15Å; A482-D485 WeakPolarHBondContact CB-OD2 3.27Å; A482-D485 PolarHBondContact O-N 3.39Å; A482-L486 PolarHBondContact O-N 3.42Å
483	P	65.4	Low	75.7	Confident	113 Å²	113	55.5 Å²	55.5	73%	0.734	32%	0.323	S	S	*	.	H	α-helix	trans	-58.9	-29.8	178.3	22.4	-32.9	0	0	0	112.5	A487	P483-A487 PolarHBondContact O-N 3.15Å; P483-A487 VanDerWaalsContact O-N 3.16Å
484	G	64.8	Low	74.8	Confident	34 Å²	34	56.6 Å²	56.6	35%	0.351	33%	0.329	S	S	.	.	H	α-helix	trans	-67.9	-30.7	173.1	0	0	0	0	0	113.9	A482 K491	A482-G484 PolarHBondContact O-N 3.21Å; A482-G484 VanDerWaalsContact O-N 3.15Å; G484-K491 WeakPolarHBondContact O-CE 3.18Å; G484-K491 PolarHBondContact O-NZ 2.84Å
485	D	70.8	Confident	73.9	Confident	34 Å²	34	55.4 Å²	55.4	18%	0.182	32%	0.319	C	S	.	.	H	α-helix	trans	-79.6	-28.3	179.3	-59.5	-39.4	0	0	0	111.9	Y479 A482 K491 Y555	Y479-D485 PolarHBondContact OH-OD2 3.2Å; A482-D485 WeakPolarHBondContact CB-OD2 3.27Å; A482-D485 PolarHBondContact O-N 3.39Å; D485-K491 IonicContact OD1-NZ 2.73Å; D485-Y555 HydrophobicContact CB-CE2 4.24Å
486	L	70.6	Confident	73.2	Confident	28 Å²	28	55.5 Å²	55.5	15%	0.147	32%	0.318	C	S	.	.	H	α-helix	trans	-76.1	-23.8	171.9	-64	170.2	0	0	0	112.9	P481 A482 Y488 I599	P481-L486 HydrophobicContact CB-CD1 4.31Å; P481-L486 HydrophobicContact CB-CD2 3.96Å; P481-L486 HydrophobicContact CB-CG 3.98Å; P481-L486 HydrophobicContact CG-CD1 4.32Å; P481-L486 HydrophobicContact CG-CD2 4.16Å; P481-L486 HydrophobicContact CG-CG 4.4Å; A482-L486 PolarHBondContact O-N 3.42Å; L486-Y488 PolarHBondContact O-N 3.03Å; L486-I599 HydrophobicContact CD2-CG1 4.12Å
487	A	68.4	Low	72.5	Confident	31 Å²	31	61.3 Å²	61.3	26%	0.256	35%	0.345	S	S	.	.			trans	-77.3	31.2	173.9	0	0	0	0	0	113.1	P483 D490 K491	P483-A487 PolarHBondContact O-N 3.15Å; P483-A487 VanDerWaalsContact O-N 3.16Å; A487-D490 PolarHBondContact O-N 2.83Å; A487-K491 WeakPolarHBondContact O-CG 3.36Å; A487-K491 PolarHBondContact O-N 3.07Å
488	Y	70.3	Confident	71.9	Confident	10 Å²	10	61.6 Å²	61.6	4%	0.039	34%	0.342	C	S	.	.	H	α-helix	trans	-55.1	-41.5	178.3	-157.1	-97.4	0	0	0	114.3	L486 D490 K491 L492 M553 F611 K614 H615 Y771	L486-Y488 PolarHBondContact O-N 3.03Å; Y488-D490 VanDerWaalsContact C-N 3.35Å; Y488-D490 PolarHBondContact O-N 2.64Å; Y488-K491 PolarHBondContact O-N 3.38Å; Y488-L492 HydrophobicContact CD1-CD1 3.66Å; Y488-L492 HydrophobicContact CD1-CG 4.06Å; Y488-L492 HydrophobicContact CE1-CD1 3.56Å; Y488-L492 HydrophobicContact CE1-CD2 4.14Å; Y488-L492 HydrophobicContact CE1-CG 3.93Å; Y488-L492 WeakPolarHBondContact O-CG 3.36Å; Y488-L492 PolarHBondContact O-N 2.93Å; Y488-L492 VanDerWaalsContact O-N 3.13Å; Y488-M553 WeakPolarHBondContact CE2-O 3.37Å; Y488-M553 PolarHBondContact OH-O 3.4Å; Y488-F611 AromaticContact CD1-CD2 3.6Å; Y488-F611 HydrophobicContact CD1-CD2 3.6Å; Y488-F611 HydrophobicContact CD1-CE2 4.15Å; Y488-F611 HydrophobicContact CD2-CD2 4.19Å; Y488-F611 AromaticContact CD2-CE2 3.89Å; Y488-F611 HydrophobicContact CD2-CE2 3.89Å; Y488-F611 AromaticContact CE1-CD2 3.96Å; Y488-F611 HydrophobicContact CE1-CD2 3.96Å; Y488-F611 HydrophobicContact CE1-CE2 4.42Å; Y488-F611 HydrophobicContact CE2-CE2 4.22Å; Y488-F611 AromaticContact CG-CD2 3.72Å; Y488-F611 HydrophobicContact CG-CD2 3.72Å; Y488-F611 AromaticContact CG-CE2 3.86Å; Y488-F611 HydrophobicContact CG-CE2 3.86Å; Y488-K614 HydrophobicContact CE1-CD 4.24Å; Y488-K614 PolarHBondContact OH-NZ 3.13Å; Y488-K614 VanDerWaalsContact OH-NZ 3.1Å; Y488-H615 AromaticContact CE1-CE1 3.84Å; Y488-H615 AromaticContact CE2-CE1 3.79Å; Y488-H615 AromaticContact CE2-NE2 3.94Å; Y488-H615 AromaticContact CZ-CE1 3.44Å; Y488-H615 VanDerWaalsContact CZ-CE1 3.44Å; Y488-H615 AromaticContact CZ-NE2 3.85Å; Y488-H615 PolarHBondContact OH-CE1 2.87Å; Y488-Y771 AromaticContact CD1-CE1 3.82Å; Y488-Y771 HydrophobicContact CD1-CE1 3.82Å; Y488-Y771 HydrophobicContact CE1-CD1 4.43Å; Y488-Y771 HydrophobicContact CE1-CE1 4.11Å
489	P	68.3	Low	71.3	Confident	6 Å²	6	60.5 Å²	60.5	4%	0.039	33%	0.329	C	S	.	.	H	α-helix	trans	-66.9	-34.4	-179.3	-10.8	23	0	0	0	112.5	V493 I599 K603 D607 Y771	P489-V493 WeakPolarHBondContact O-CG2 3.49Å; P489-V493 PolarHBondContact O-N 3.19Å; P489-I599 HydrophobicContact CG-CG2 4.37Å; P489-K603 HydrophobicContact CB-CD 4.03Å; P489-K603 HydrophobicContact CG-CD 3.77Å; P489-K603 HydrophobicContact CG-CG 4.35Å; P489-D607 HydrophobicContact CG-CB 4.07Å; P489-Y771 VanDerWaalsContact CB-OH 3.26Å; P489-Y771 WeakPolarHBondContact CB-OH 3.44Å; P489-Y771 WeakPolarHBondContact CG-OH 3.46Å
490	D	69.1	Low	70.7	Confident	89 Å²	89	62.9 Å²	62.9	48%	0.476	34%	0.342	S	S	.	.	H	α-helix	trans	-70.5	-39.5	176.1	-65.7	-45.3	0	0	0	111.8	A487 Y488 L492 V493 M494 K603	A487-D490 PolarHBondContact O-N 2.83Å; Y488-D490 VanDerWaalsContact C-N 3.35Å; Y488-D490 PolarHBondContact O-N 2.64Å; D490-L492 VanDerWaalsContact C-N 3.31Å; D490-L492 PolarHBondContact O-N 2.84Å; D490-V493 PolarHBondContact O-N 3.42Å; D490-M494 WeakPolarHBondContact O-CB 3.41Å; D490-M494 PolarHBondContact O-N 3.08Å; D490-K603 IonicContact OD1-NZ 2.87Å; D490-K603 PolarHBondContact OD1-NZ 2.95Å; D490-K603 WeakPolarHBondContact OD2-CE 3.5Å; D490-K603 IonicContact OD2-NZ 3.54Å; D490-K603 PolarHBondContact OD2-NZ 2.85Å
491	K	70.1	Confident	70.6	Confident	90 Å²	90	57 Å²	57	39%	0.391	32%	0.324	S	S	.	.	H	α-helix	trans	-58.6	-43.4	175.9	-73.5	174.9	167.9	177.5	0	111.6	G484 D485 A487 Y488 M495	G484-K491 WeakPolarHBondContact O-CE 3.18Å; G484-K491 PolarHBondContact O-NZ 2.84Å; D485-K491 IonicContact OD1-NZ 2.73Å; A487-K491 WeakPolarHBondContact O-CG 3.36Å; A487-K491 PolarHBondContact O-N 3.07Å; Y488-K491 PolarHBondContact O-N 3.38Å; K491-M495 WeakPolarHBondContact O-CB 3.38Å; K491-M495 WeakPolarHBondContact O-CG 3.4Å; K491-M495 PolarHBondContact O-N 3.43Å
492	L	70.6	Confident	70.5	Confident	9 Å²	9	59.1 Å²	59.1	5%	0.047	33%	0.332	C	S	.	.	H	α-helix	trans	-67.1	-42.5	178.5	-69.9	174.1	0	0	0	112.7	Y488 D490 M495 E496 M553 L770 Y771	Y488-L492 HydrophobicContact CD1-CD1 3.66Å; Y488-L492 HydrophobicContact CD1-CG 4.06Å; Y488-L492 HydrophobicContact CE1-CD1 3.56Å; Y488-L492 HydrophobicContact CE1-CD2 4.14Å; Y488-L492 HydrophobicContact CE1-CG 3.93Å; Y488-L492 WeakPolarHBondContact O-CG 3.36Å; Y488-L492 PolarHBondContact O-N 2.93Å; Y488-L492 VanDerWaalsContact O-N 3.13Å; D490-L492 VanDerWaalsContact C-N 3.31Å; D490-L492 PolarHBondContact O-N 2.84Å; L492-M495 PolarHBondContact O-N 2.88Å; L492-E496 PolarHBondContact O-N 3.08Å; L492-M553 HydrophobicContact CD2-CE 3.45Å; L492-M553 VanDerWaalsContact CD2-CE 3.45Å; L492-M553 HydrophobicContact CG-CE 4.4Å; L492-L770 HydrophobicContact CB-CD2 3.46Å; L492-L770 VanDerWaalsContact CB-CD2 3.46Å; L492-L770 HydrophobicContact CB-CG 4.06Å; L492-L770 HydrophobicContact CD1-CD2 3.54Å; L492-L770 HydrophobicContact CG-CD2 4.15Å; L492-Y771 HydrophobicContact CD1-CD1 3.75Å; L492-Y771 HydrophobicContact CD1-CD2 4.07Å; L492-Y771 HydrophobicContact CD1-CE1 3.62Å; L492-Y771 HydrophobicContact CD1-CE2 3.96Å; L492-Y771 HydrophobicContact CD1-CG 3.98Å
493	V	71.1	Confident	70.2	Confident	56 Å²	56	63.7 Å²	63.7	34%	0.339	34%	0.344	S	S	.	.	H	α-helix	trans	-63.8	-44.1	176.7	173.1	0	0	0	0	111	P489 D490 M495 E496 Q497 L770	P489-V493 WeakPolarHBondContact O-CG2 3.49Å; P489-V493 PolarHBondContact O-N 3.19Å; D490-V493 PolarHBondContact O-N 3.42Å; V493-M495 VanDerWaalsContact C-N 3.29Å; V493-M495 PolarHBondContact O-N 3.22Å; V493-E496 PolarHBondContact O-N 3.06Å; V493-Q497 WeakPolarHBondContact O-CG 3.44Å; V493-Q497 PolarHBondContact O-N 3.02Å; V493-L770 HydrophobicContact CB-CD1 4.5Å; V493-L770 HydrophobicContact CG2-CD1 3.6Å
494	M	69.7	Low	70.3	Confident	120 Å²	120	62.6 Å²	62.6	59%	0.591	33%	0.332	S	S	*	.	H	α-helix	trans	-60.6	-40.5	176.8	-171	178.6	-170.9	0	0	111.2	D490 Q497 I498	D490-M494 WeakPolarHBondContact O-CB 3.41Å; D490-M494 PolarHBondContact O-N 3.08Å; M494-Q497 WeakPolarHBondContact O-CB 3.4Å; M494-Q497 PolarHBondContact O-N 2.9Å; M494-I498 HydrophobicContact CG-CD1 4.12Å; M494-I498 WeakPolarHBondContact O-CD1 3.41Å; M494-I498 WeakPolarHBondContact O-CG1 3.21Å; M494-I498 PolarHBondContact O-N 2.93Å
495	M	69.1	Low	70.2	Confident	58 Å²	58	67.2 Å²	67.2	29%	0.286	34%	0.344	S	S	.	.	H	α-helix	trans	-71.7	-34.4	176.6	-75.7	-172.2	64.4	0	0	113.7	K491 L492 V493 Q497 I498 A499 M553	K491-M495 WeakPolarHBondContact O-CB 3.38Å; K491-M495 WeakPolarHBondContact O-CG 3.4Å; K491-M495 PolarHBondContact O-N 3.43Å; L492-M495 PolarHBondContact O-N 2.88Å; V493-M495 VanDerWaalsContact C-N 3.29Å; V493-M495 PolarHBondContact O-N 3.22Å; M495-Q497 VanDerWaalsContact C-N 3.31Å; M495-I498 PolarHBondContact O-N 3.13Å; M495-A499 VanDerWaalsContact O-CB 3.27Å; M495-A499 WeakPolarHBondContact O-CB 3.31Å; M495-A499 PolarHBondContact O-N 3.15Å; M495-M553 HydrophobicContact CE-CE 4.32Å; M495-M553 HydrophobicContact CE-CG 4.3Å; M495-M553 HydrophobicContact CE-SD 3.33Å; M495-M553 WeakPolarHBondContact CE-SD 3.48Å; M495-M553 HydrophobicContact SD-CE 3.44Å; M495-M553 WeakPolarHBondContact SD-CE 3.46Å; M495-M553 HydrophobicContact SD-CG 3.98Å; M495-M553 HydrophobicContact SD-SD 3.18Å
496	E	70.6	Confident	69.5	Low	57 Å²	57	73.1 Å²	73.1	27%	0.266	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-42.4	171.4	-167	-171.1	-173.2	0	0	110.5	L492 V493 A499 Q500	L492-E496 PolarHBondContact O-N 3.08Å; V493-E496 PolarHBondContact O-N 3.06Å; E496-A499 PolarHBondContact O-N 3.09Å; E496-Q500 WeakPolarHBondContact O-CB 3.48Å; E496-Q500 VanDerWaalsContact O-CG 3.22Å; E496-Q500 WeakPolarHBondContact O-CG 3.36Å; E496-Q500 PolarHBondContact O-N 2.87Å; E496-Q500 PolarHBondContact OE1-NE2 2.96Å; E496-Q500 VanDerWaalsContact OE1-NE2 3.17Å
497	Q	73	Confident	68.8	Low	121 Å²	121	80.2 Å²	80.2	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-63.9	-42.5	175.4	-70.5	171.8	-5.4	0	0	112	V493 M494 M495 Q500 S501	V493-Q497 WeakPolarHBondContact O-CG 3.44Å; V493-Q497 PolarHBondContact O-N 3.02Å; M494-Q497 WeakPolarHBondContact O-CB 3.4Å; M494-Q497 PolarHBondContact O-N 2.9Å; M495-Q497 VanDerWaalsContact C-N 3.31Å; Q497-Q500 PolarHBondContact O-N 3.18Å; Q497-S501 WeakPolarHBondContact O-CB 3.49Å; Q497-S501 PolarHBondContact O-N 2.74Å; Q497-S501 PolarHBondContact O-OG 3.01Å
498	I	73.2	Confident	67.9	Low	81 Å²	81	87.1 Å²	87.1	42%	0.415	43%	0.425	S	S	.	.	H	α-helix	trans	-62.8	-47.9	174.6	-67.4	162	0	0	0	110	M494 M495 Q500 S501 L502	M494-I498 HydrophobicContact CG-CD1 4.12Å; M494-I498 WeakPolarHBondContact O-CD1 3.41Å; M494-I498 WeakPolarHBondContact O-CG1 3.21Å; M494-I498 PolarHBondContact O-N 2.93Å; M495-I498 PolarHBondContact O-N 3.13Å; I498-Q500 VanDerWaalsContact C-N 3.33Å; I498-Q500 PolarHBondContact O-N 3.16Å; I498-S501 WeakPolarHBondContact CA-OG 3.34Å; I498-S501 PolarHBondContact O-N 3.13Å; I498-S501 PolarHBondContact O-OG 2.97Å; I498-L502 HydrophobicContact CG2-CD1 3.88Å; I498-L502 HydrophobicContact CG2-CG 4.37Å; I498-L502 WeakPolarHBondContact O-CG 3.33Å; I498-L502 PolarHBondContact O-N 3.24Å
499	A	69.5	Low	66.4	Low	24 Å²	24	91.8 Å²	91.8	20%	0.198	45%	0.454	C	S	.	.	H	α-helix	trans	-64.4	-35.7	179.3	0	0	0	0	0	112.8	M495 E496 K503 P547	M495-A499 VanDerWaalsContact O-CB 3.27Å; M495-A499 WeakPolarHBondContact O-CB 3.31Å; M495-A499 PolarHBondContact O-N 3.15Å; E496-A499 PolarHBondContact O-N 3.09Å; A499-K503 WeakPolarHBondContact O-CB 3.35Å; A499-K503 VanDerWaalsContact O-CG 3.32Å; A499-K503 WeakPolarHBondContact O-CG 3.4Å; A499-K503 PolarHBondContact O-N 2.89Å; A499-P547 HydrophobicContact CB-CG 4.42Å
500	Q	71.7	Confident	65.1	Low	91 Å²	91	97 Å²	97	43%	0.425	49%	0.488	S	S	.	.	H	α-helix	trans	-67.7	-44.2	172.9	-75.1	173.5	6.8	0	0	110.9	E496 Q497 I498 L502 K503 D504	E496-Q500 WeakPolarHBondContact O-CB 3.48Å; E496-Q500 VanDerWaalsContact O-CG 3.22Å; E496-Q500 WeakPolarHBondContact O-CG 3.36Å; E496-Q500 PolarHBondContact O-N 2.87Å; E496-Q500 PolarHBondContact OE1-NE2 2.96Å; E496-Q500 VanDerWaalsContact OE1-NE2 3.17Å; Q497-Q500 PolarHBondContact O-N 3.18Å; I498-Q500 VanDerWaalsContact C-N 3.33Å; I498-Q500 PolarHBondContact O-N 3.16Å; Q500-L502 PolarHBondContact O-N 3.28Å; Q500-K503 PolarHBondContact O-N 3.38Å; Q500-D504 WeakPolarHBondContact O-CB 3.28Å; Q500-D504 VanDerWaalsContact O-CG 3.27Å; Q500-D504 PolarHBondContact O-N 3.45Å
501	S	73.8	Confident	63.8	Low	58 Å²	58	98.4 Å²	98.4	41%	0.406	50%	0.504	S	S	.	.	H	α-helix	trans	-61.7	-41.1	175.6	69.5	0	0	0	0	112.5	Q497 I498 D504 E505	Q497-S501 WeakPolarHBondContact O-CB 3.49Å; Q497-S501 PolarHBondContact O-N 2.74Å; Q497-S501 PolarHBondContact O-OG 3.01Å; I498-S501 WeakPolarHBondContact CA-OG 3.34Å; I498-S501 PolarHBondContact O-N 3.13Å; I498-S501 PolarHBondContact O-OG 2.97Å; S501-D504 CarbonylContact O-C 3.6Å; S501-D504 PolarHBondContact O-N 3.25Å; S501-E505 WeakPolarHBondContact O-CB 3.37Å; S501-E505 WeakPolarHBondContact O-CG 3.45Å; S501-E505 PolarHBondContact O-N 3.18Å
502	L	74.8	Confident	62	Low	88 Å²	88	103.1 Å²	103.1	46%	0.461	53%	0.528	S	S	.	.	H	α-helix	trans	-66.9	-39.5	175.8	-71.4	169.3	0	0	0	112.2	I498 Q500 D504 E505 Q506	I498-L502 HydrophobicContact CG2-CD1 3.88Å; I498-L502 HydrophobicContact CG2-CG 4.37Å; I498-L502 WeakPolarHBondContact O-CG 3.33Å; I498-L502 PolarHBondContact O-N 3.24Å; Q500-L502 PolarHBondContact O-N 3.28Å; L502-D504 VanDerWaalsContact C-N 3.32Å; L502-E505 PolarHBondContact O-N 3.31Å; L502-Q506 WeakPolarHBondContact O-CB 3.33Å; L502-Q506 WeakPolarHBondContact O-CG 3.45Å; L502-Q506 PolarHBondContact O-N 3.03Å
503	K	69.5	Low	60.2	Low	139 Å²	139	107.1 Å²	107.1	60%	0.604	56%	0.563	S	S	*	*	H	α-helix	trans	-67.2	-34.3	173.9	-78.9	177.1	179.4	177.3	0	112.1	A499 Q500 K507	A499-K503 WeakPolarHBondContact O-CB 3.35Å; A499-K503 VanDerWaalsContact O-CG 3.32Å; A499-K503 WeakPolarHBondContact O-CG 3.4Å; A499-K503 PolarHBondContact O-N 2.89Å; Q500-K503 PolarHBondContact O-N 3.38Å; K503-K507 WeakPolarHBondContact O-CB 3.47Å; K503-K507 WeakPolarHBondContact O-CG 3.34Å; K503-K507 PolarHBondContact O-N 3.11Å; K503-K507 VanDerWaalsContact O-N 3.07Å
504	D	68.3	Low	58.8	Low	90 Å²	90	109.8 Å²	109.8	48%	0.481	58%	0.584	S	S	.	*	H	α-helix	trans	-76.6	-32.6	177.2	-73.7	-17.2	0	0	0	112	Q500 S501 L502 K507 K508	Q500-D504 WeakPolarHBondContact O-CB 3.28Å; Q500-D504 VanDerWaalsContact O-CG 3.27Å; Q500-D504 PolarHBondContact O-N 3.45Å; S501-D504 CarbonylContact O-C 3.6Å; S501-D504 PolarHBondContact O-N 3.25Å; L502-D504 VanDerWaalsContact C-N 3.32Å; D504-K507 PolarHBondContact O-N 3.36Å; D504-K508 WeakPolarHBondContact O-CB 3.39Å; D504-K508 WeakPolarHBondContact O-CG 3.36Å; D504-K508 PolarHBondContact O-N 3.4Å
505	E	62.2	Low	56.9	Low	131 Å²	131	113 Å²	113	61%	0.612	60%	0.595	S	S	*	*	H	α-helix	trans	-68	-43.1	169	-76.9	-167.9	149.9	0	0	111.5	S501 L502 K507 K508	S501-E505 WeakPolarHBondContact O-CB 3.37Å; S501-E505 WeakPolarHBondContact O-CG 3.45Å; S501-E505 PolarHBondContact O-N 3.18Å; L502-E505 PolarHBondContact O-N 3.31Å; E505-K507 PolarHBondContact O-N 3.26Å; E505-K508 PolarHBondContact O-N 2.81Å
506	Q	55.8	Low	55.2	Low	159 Å²	159	114.9 Å²	114.9	74%	0.743	61%	0.614	S	S	*	*	H	α-helix	trans	-63.8	-27.3	173.6	-79.2	178	-11.5	0	0	113.3	L502	L502-Q506 WeakPolarHBondContact O-CB 3.33Å; L502-Q506 WeakPolarHBondContact O-CG 3.45Å; L502-Q506 PolarHBondContact O-N 3.03Å
507	K	55.2	Low	53.2	Low	176 Å²	176	120 Å²	120	77%	0.765	64%	0.643	S	S	*	*	H	α-helix	trans	-81.6	-15	173.4	-82.5	179.1	177	177	0	114	K503 D504 E505	K503-K507 WeakPolarHBondContact O-CB 3.47Å; K503-K507 WeakPolarHBondContact O-CG 3.34Å; K503-K507 PolarHBondContact O-N 3.11Å; K503-K507 VanDerWaalsContact O-N 3.07Å; D504-K507 PolarHBondContact O-N 3.36Å; E505-K507 PolarHBondContact O-N 3.26Å
508	K	50.3	Low	51.1	Low	177 Å²	177	120 Å²	120	77%	0.77	65%	0.651	S	S	*	*	H	α-helix	trans	-100	-1.2	-174.7	-85.2	-176.9	178.1	177.9	0	115.2	D504 E505 P510	D504-K508 WeakPolarHBondContact O-CB 3.39Å; D504-K508 WeakPolarHBondContact O-CG 3.36Å; D504-K508 PolarHBondContact O-N 3.4Å; E505-K508 PolarHBondContact O-N 2.81Å; K508-P510 WeakPolarHBondContact O-CD 3.43Å
509	V	38.2	Very low	48.9	Very low	108 Å²	108	125 Å²	125	66%	0.655	67%	0.672	S	S	*	*			trans	-100.7	108.8	174.9	-175.8	0	0	0	0	110
510	P	41.7	Very low	46.9	Very low	114 Å²	114	131.4 Å²	131.4	74%	0.74	70%	0.702	S	S	*	*			trans	-70.7	137.5	158.9	2.4	15.1	0	0	0	108.1	K508 E512	K508-P510 WeakPolarHBondContact O-CD 3.43Å; P510-E512 PolarHBondContact O-N 3.37Å; P510-E512 VanDerWaalsContact O-N 3.14Å
511	S	41.6	Very low	44.9	Very low	119 Å²	119	135.7 Å²	135.7	83%	0.832	72%	0.722	S	S	*	*	S	Bend	trans	-44.1	112.9	177.9	-53.6	0	0	0	0	113.3
512	E	31.8	Very low	42.8	Very low	189 Å²	189	142.3 Å²	142.3	88%	0.883	75%	0.747	S	S	*	*			trans	-171.6	140.9	144.6	-109.2	175.1	-166.8	0	0	111.7	P510	P510-E512 PolarHBondContact O-N 3.37Å; P510-E512 VanDerWaalsContact O-N 3.14Å
513	A	32.7	Very low	40.5	Very low	94 Å²	94	141.6 Å²	141.6	78%	0.777	76%	0.761	S	S	*	*			trans	64.9	106.1	173.2	0	0	0	0	0	116.2
514	S	41.5	Very low	38.5	Very low	112 Å²	112	144.1 Å²	144.1	78%	0.783	78%	0.775	S	S	*	*				40.8	85.9	61.8	-156.3	0	0	0	0	113.5
515	F	30.4	Very low	36.7	Very low	187 Å²	187	146 Å²	146	82%	0.82	80%	0.795	S	S	*	*				-173.1	132.8	123.9	-123.4	-106.8	0	0	0	113.2
516	S	34.2	Very low	35	Very low	98 Å²	98	147 Å²	147	69%	0.685	80%	0.804	S	S	*	*			trans	44.3	111.7	149.4	61.5	0	0	0	0	120.4
517	D	27.4	Very low	33.6	Very low	165 Å²	165	144.6 Å²	144.6	88%	0.882	81%	0.805	S	S	*	*			trans	-114.9	132.2	155.4	-158	8.4	0	0	0	110.5
518	V	30.2	Very low	32.4	Very low	121 Å²	121	143.8 Å²	143.8	73%	0.733	81%	0.808	S	S	*	*			trans	-86.6	113.7	-178.1	170.6	0	0	0	0	107	L520	V518-L520 PolarHBondContact O-N 3.37Å
519	H	25.2	Very low	31.4	Very low	184 Å²	184	141.4 Å²	141.4	85%	0.852	81%	0.809	S	S	*	*			trans	-78.6	114	177.5	-145.2	58	0	0	0	109.7
520	L	29.2	Very low	31	Very low	159 Å²	159	146.8 Å²	146.8	83%	0.832	82%	0.823	S	S	*	*			trans	-95.6	132.5	162.9	-82.7	164.4	0	0	0	108.6	V518	V518-L520 PolarHBondContact O-N 3.37Å
521	E	29.5	Very low	30.3	Very low	182 Å²	182	147.5 Å²	147.5	85%	0.85	83%	0.831	S	S	*	*			trans	-67.4	141.3	-175	-59	-166	147.8	0	0	113.9
522	E	28.2	Very low	29.5	Very low	196 Å²	196	144.9 Å²	144.9	92%	0.916	82%	0.823	S	S	*	*			trans	-146.6	107	143.8	-99.2	-175.7	178.8	0	0	110.2
523	G	27.7	Very low	29.2	Very low	74 Å²	74	141.8 Å²	141.8	76%	0.763	82%	0.822	S	S	*	*				66.9	77.8	122	0	0	0	0	0	121.1
524	E	27.5	Very low	29.1	Very low	192 Å²	192	144 Å²	144	90%	0.897	83%	0.826	S	S	*	*			trans	42.1	124.8	139.8	-60	-170.4	159.7	0	0	122.9
525	S	29.3	Very low	28.4	Very low	128 Å²	128	147.5 Å²	147.5	90%	0.895	83%	0.83	S	S	*	*				-165.4	134	112.4	27.9	0	0	0	0	113.4
526	N	27.2	Very low	28.2	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	82%	0.824	S	S	*	*			trans	-54.5	139.2	-168.5	-84.1	-36.5	0	0	0	117.9
527	S	26.6	Very low	28	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	83%	0.831	S	S	*	*			trans	-132.1	114.2	138.4	68.9	0	0	0	0	109.9
528	L	29.1	Very low	28	Very low	158 Å²	158	145.9 Å²	145.9	83%	0.827	83%	0.829	S	S	*	*			trans	-74.4	126.2	168.8	-75.7	101.7	0	0	0	108.9
529	T	30.6	Very low	28.1	Very low	128 Å²	128	146.1 Å²	146.1	79%	0.785	83%	0.834	S	S	*	*			trans	-119.5	125	164.3	42.9	0	0	0	0	109.3
530	K	29.4	Very low	28.2	Very low	220 Å²	220	148.1 Å²	148.1	96%	0.957	83%	0.833	S	S	*	*			trans	-68.9	139.1	167	-95.5	177.2	174.6	174.1	0	109.3
531	S	26.6	Very low	28.3	Very low	130 Å²	130	146.2 Å²	146.2	91%	0.909	83%	0.831	S	S	*	*			trans	-62.3	144.5	177.6	170.1	0	0	0	0	114.3
532	G	24.3	Very low	28.3	Very low	63 Å²	63	146.4 Å²	146.4	65%	0.649	83%	0.832	S	S	*	*			trans	121.3	88.1	139.6	0	0	0	0	0	117.4
533	S	26.7	Very low	28.3	Very low	125 Å²	125	143 Å²	143	87%	0.874	82%	0.824	S	S	*	*				173.5	132.6	124.9	38.9	0	0	0	0	111.6
534	T	30.5	Very low	28.4	Very low	140 Å²	140	146 Å²	146	86%	0.859	83%	0.828	S	S	*	*			trans	-78	125.1	-179.4	-28.8	0	0	0	0	109.9
535	E	26.8	Very low	28.9	Very low	186 Å²	186	143.4 Å²	143.4	87%	0.869	82%	0.819	S	S	*	*			trans	-168.4	117.4	148.2	-110	168.8	-161.8	0	0	114.1
536	S	27.1	Very low	29.4	Very low	99 Å²	99	139.5 Å²	139.5	69%	0.692	79%	0.792	S	S	*	*			trans	36.6	111.5	146.9	62.5	0	0	0	0	123
537	L	29.8	Very low	29.9	Very low	159 Å²	159	135.6 Å²	135.6	83%	0.832	78%	0.775	S	S	*	*				38.3	106	120.6	-68.3	158.9	0	0	0	119.3
538	N	27.6	Very low	30.6	Very low	157 Å²	157	131.2 Å²	131.2	84%	0.84	75%	0.745	S	S	*	*			trans	-164.1	116.1	135.6	-95.5	-31.7	0	0	0	110.2	R540	N538-R540 PolarHBondContact O-N 2.9Å
539	P	32.2	Very low	31.7	Very low	127 Å²	127	127.7 Å²	127.7	83%	0.825	73%	0.727	S	S	*	*			trans	-78.9	106.3	172.9	30.5	-28.5	0	0	0	109.3
540	R	27.5	Very low	32.8	Very low	225 Å²	225	127.6 Å²	127.6	85%	0.849	72%	0.721	S	S	*	*			trans	-66.6	148	162.2	-87.6	178.5	173.2	166.9	-1.7	109.3	N538 Q542	N538-R540 PolarHBondContact O-N 2.9Å; R540-Q542 PolarHBondContact O-N 2.83Å; R540-Q542 VanDerWaalsContact O-N 3.08Å
541	P	31.1	Very low	34.1	Very low	120 Å²	120	122.3 Å²	122.3	78%	0.779	70%	0.699	S	S	*	*			trans	-63.4	116.5	-176	26.1	-31.8	0	0	0	109.3	T543	P541-T543 PolarHBondContact O-N 2.93Å
542	Q	28.1	Very low	35.6	Very low	186 Å²	186	119.2 Å²	119.2	87%	0.869	69%	0.688	S	S	*	*			trans	-60.5	107.4	171.2	-71.5	177.5	-28	0	0	108	R540 T544	R540-Q542 PolarHBondContact O-N 2.83Å; R540-Q542 VanDerWaalsContact O-N 3.08Å; Q542-T544 PolarHBondContact O-N 3.17Å; Q542-T544 VanDerWaalsContact O-N 3.14Å
543	T	28.9	Very low	37.6	Very low	123 Å²	123	117.4 Å²	117.4	76%	0.755	66%	0.663	S	S	*	*			trans	-54.8	117.2	156.2	37.4	0	0	0	0	106.6	P541 I545	P541-T543 PolarHBondContact O-N 2.93Å; T543-I545 PolarHBondContact O-N 2.76Å
544	T	29.9	Very low	40.2	Very low	138 Å²	138	112.7 Å²	112.7	85%	0.847	63%	0.626	S	S	*	*			trans	-59	96.8	179.2	52	0	0	0	0	109.2	Q542 S546	Q542-T544 PolarHBondContact O-N 3.17Å; Q542-T544 VanDerWaalsContact O-N 3.14Å; T544-S546 PolarHBondContact O-N 3.31Å
545	I	37.8	Very low	42.7	Very low	137 Å²	137	106.3 Å²	106.3	70%	0.703	59%	0.586	S	S	*	*			trans	-66.6	117.7	173.9	-57.5	170.9	0	0	0	106.3	T543 D549	T543-I545 PolarHBondContact O-N 2.76Å; I545-D549 HydrophobicContact CG2-CB 3.83Å
546	S	39.5	Very low	45.5	Very low	47 Å²	47	99 Å²	99	33%	0.329	56%	0.555	S	S	.	*			trans	-71.9	144.3	177	-179.8	0	0	0	0	109	T544 A548 D549	T544-S546 PolarHBondContact O-N 3.31Å; S546-A548 PolarHBondContact O-N 3.28Å; S546-D549 PolarHBondContact O-N 2.81Å
547	P	37.6	Very low	48.4	Very low	71 Å²	71	94.2 Å²	94.2	46%	0.461	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-59.5	-6.9	176.4	22	-31.8	0	0	0	114.2	A499 D549	A499-P547 HydrophobicContact CB-CG 4.42Å; P547-D549 VanDerWaalsContact C-N 3.31Å
548	A	42.6	Very low	51.1	Low	16 Å²	16	86.7 Å²	86.7	13%	0.132	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-75.4	-11.9	171.7	0	0	0	0	0	115.2	S546 L550 M553	S546-A548 PolarHBondContact O-N 3.28Å; A548-L550 VanDerWaalsContact C-N 3.31Å; A548-M553 WeakPolarHBondContact CA-SD 3.46Å; A548-M553 HydrophobicContact CB-SD 3.88Å
549	D	50.5	Low	53.9	Low	84 Å²	84	85.3 Å²	85.3	45%	0.449	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-87.4	4.4	176.6	-73.4	-32.3	0	0	0	113.3	I545 S546 P547 H551	I545-D549 HydrophobicContact CG2-CB 3.83Å; S546-D549 PolarHBondContact O-N 2.81Å; P547-D549 VanDerWaalsContact C-N 3.31Å; D549-H551 PolarHBondContact O-N 2.86Å
550	L	54.5	Low	56.5	Low	126 Å²	126	82.7 Å²	82.7	66%	0.66	44%	0.439	S	S	*	.	S	Bend	trans	-65.7	128.2	169.2	-116.4	74.8	0	0	0	109.4	A548 G552 M553	A548-L550 VanDerWaalsContact C-N 3.31Å; L550-G552 PolarHBondContact O-N 3.39Å; L550-M553 PolarHBondContact O-N 3.18Å
551	H	56.1	Low	59.4	Low	109 Å²	109	72 Å²	72	51%	0.505	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-47.7	-14.4	174.9	-71.6	-85.3	0	0	0	115.1	D549 M553 W554	D549-H551 PolarHBondContact O-N 2.86Å; H551-M553 VanDerWaalsContact C-N 3.34Å; H551-W554 AromaticContact CE1-CH2 3.21Å; H551-W554 WeakPolarHBondContact CE1-CH2 3.3Å; H551-W554 AromaticContact CE1-CZ2 3.81Å; H551-W554 AromaticContact CE1-CZ3 3.64Å; H551-W554 AromaticContact ND1-CE3 3.69Å; H551-W554 AromaticContact ND1-CH2 3.1Å; H551-W554 WeakPolarHBondContact ND1-CH2 3.49Å; H551-W554 AromaticContact ND1-CZ2 3.58Å; H551-W554 AromaticContact ND1-CZ3 3.14Å; H551-W554 WeakPolarHBondContact ND1-CZ3 3.44Å
552	G	58.3	Low	62	Low	65 Å²	65	67 Å²	67	67%	0.67	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-72	-16.5	173.2	0	0	0	0	0	115.5	L550	L550-G552 PolarHBondContact O-N 3.39Å
553	M	67.3	Low	64.7	Low	25 Å²	25	61.1 Å²	61.1	12%	0.123	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-98.8	-2.4	180	-70.6	-162	75.8	0	0	114.8	Y488 L492 M495 A548 L550 H551	Y488-M553 WeakPolarHBondContact CE2-O 3.37Å; Y488-M553 PolarHBondContact OH-O 3.4Å; L492-M553 HydrophobicContact CD2-CE 3.45Å; L492-M553 VanDerWaalsContact CD2-CE 3.45Å; L492-M553 HydrophobicContact CG-CE 4.4Å; M495-M553 HydrophobicContact CE-CE 4.32Å; M495-M553 HydrophobicContact CE-CG 4.3Å; M495-M553 HydrophobicContact CE-SD 3.33Å; M495-M553 WeakPolarHBondContact CE-SD 3.48Å; M495-M553 HydrophobicContact SD-CE 3.44Å; M495-M553 WeakPolarHBondContact SD-CE 3.46Å; M495-M553 HydrophobicContact SD-CG 3.98Å; M495-M553 HydrophobicContact SD-SD 3.18Å; A548-M553 WeakPolarHBondContact CA-SD 3.46Å; A548-M553 HydrophobicContact CB-SD 3.88Å; L550-M553 PolarHBondContact O-N 3.18Å; H551-M553 VanDerWaalsContact C-N 3.34Å
554	W	80.1	Confident	67.5	Low	27 Å²	27	55.3 Å²	55.3	10%	0.102	31%	0.306	C	S	.	.	S	Bend	trans	-73.5	141.3	177.7	-63.9	-2.3	0	0	0	109.8	H551 R559 L562 I618 Q622	H551-W554 AromaticContact CE1-CH2 3.21Å; H551-W554 WeakPolarHBondContact CE1-CH2 3.3Å; H551-W554 AromaticContact CE1-CZ2 3.81Å; H551-W554 AromaticContact CE1-CZ3 3.64Å; H551-W554 AromaticContact ND1-CE3 3.69Å; H551-W554 AromaticContact ND1-CH2 3.1Å; H551-W554 WeakPolarHBondContact ND1-CH2 3.49Å; H551-W554 AromaticContact ND1-CZ2 3.58Å; H551-W554 AromaticContact ND1-CZ3 3.14Å; H551-W554 WeakPolarHBondContact ND1-CZ3 3.44Å; W554-R559 HydrophobicContact CE3-CB 4.46Å; W554-L562 HydrophobicContact CE3-CD1 4.09Å; W554-L562 HydrophobicContact CH2-CD1 4.21Å; W554-L562 HydrophobicContact CZ3-CD1 3.56Å; W554-I618 HydrophobicContact CD2-CG2 4.33Å; W554-I618 HydrophobicContact CZ2-CG2 4.19Å; W554-Q622 HydrophobicContact CH2-CG 3.9Å; W554-Q622 HydrophobicContact CZ2-CG 4.39Å
555	Y	83.5	Confident	70.1	Confident	6 Å²	6	48.8 Å²	48.8	2%	0.024	27%	0.266	C	S	.	.			trans	-55.5	133.8	171.3	-172.7	-112.9	0	0	0	110.1	Y479 D485 T557 V558 R559 L592 A595 F611 H615	Y479-Y555 HydrophobicContact CE1-CE2 4.49Å; Y479-Y555 AromaticContact CE1-CZ 3.99Å; D485-Y555 HydrophobicContact CB-CE2 4.24Å; Y555-T557 VanDerWaalsContact C-N 3.25Å; Y555-T557 HydrophobicContact CD1-CG2 4.41Å; Y555-T557 WeakPolarHBondContact CD1-OG1 3.33Å; Y555-T557 HydrophobicContact CE1-CG2 3.89Å; Y555-T557 WeakPolarHBondContact CE1-OG1 3.45Å; Y555-T557 PolarHBondContact O-N 3.27Å; Y555-T557 VanDerWaalsContact O-N 3.09Å; Y555-V558 WeakPolarHBondContact O-CB 3.22Å; Y555-V558 PolarHBondContact O-N 2.87Å; Y555-R559 PolarHBondContact O-N 3.17Å; Y555-L592 HydrophobicContact CD1-CD2 3.74Å; Y555-L592 HydrophobicContact CE1-CD2 4.43Å; Y555-L592 HydrophobicContact CG-CD2 4.28Å; Y555-A595 HydrophobicContact CE1-CB 4.22Å; Y555-A595 HydrophobicContact CE2-CB 4.19Å; Y555-F611 HydrophobicContact CD2-CE2 4.37Å; Y555-F611 AromaticContact CD2-CZ 3.8Å; Y555-F611 HydrophobicContact CD2-CZ 3.8Å; Y555-F611 HydrophobicContact CE2-CZ 4.41Å; Y555-F611 AromaticContact CG-CZ 3.91Å; Y555-F611 HydrophobicContact CG-CZ 3.91Å; Y555-H615 PolarHBondContact N-NE2 3.04Å
556	P	85.4	Confident	72.3	Confident	31 Å²	31	44.8 Å²	44.8	20%	0.201	25%	0.25	C	S	.	.	H	α-helix	trans	-53.2	-37.3	-169.3	-33	38.4	0	0	0	114.7	Y479 R559 R560	Y479-P556 HydrophobicContact CE1-CB 4.38Å; Y479-P556 HydrophobicContact CE2-CB 4.43Å; P556-R559 PolarHBondContact O-N 2.83Å; P556-R560 WeakPolarHBondContact O-CB 3.37Å; P556-R560 WeakPolarHBondContact O-CG 3.36Å; P556-R560 PolarHBondContact O-N 3.24Å
557	T	87.6	Confident	74.4	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-68	-36.5	179.1	61.8	0	0	0	0	112.7	Y479 Y555 R559 R560 T561 S591	Y479-T557 HydrophobicContact CD1-CG2 3.54Å; Y479-T557 HydrophobicContact CE1-CG2 4.29Å; Y479-T557 HydrophobicContact CG-CG2 3.73Å; Y555-T557 VanDerWaalsContact C-N 3.25Å; Y555-T557 HydrophobicContact CD1-CG2 4.41Å; Y555-T557 WeakPolarHBondContact CD1-OG1 3.33Å; Y555-T557 HydrophobicContact CE1-CG2 3.89Å; Y555-T557 WeakPolarHBondContact CE1-OG1 3.45Å; Y555-T557 PolarHBondContact O-N 3.27Å; Y555-T557 VanDerWaalsContact O-N 3.09Å; T557-R559 PolarHBondContact O-N 3.27Å; T557-R560 PolarHBondContact O-N 3.17Å; T557-T561 WeakPolarHBondContact O-CB 3.39Å; T557-T561 PolarHBondContact O-N 3.01Å; T557-T561 PolarHBondContact O-OG1 3.17Å; T557-S591 VanDerWaalsContact CG2-OG 3.26Å; T557-S591 WeakPolarHBondContact CG2-OG 3.16Å; T557-S591 PolarHBondContact OG1-OG 3.18Å
558	V	87.2	Confident	76.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-45.9	174.8	178	0	0	0	0	110.6	Y555 T561 L562 L592 H615	Y555-V558 WeakPolarHBondContact O-CB 3.22Å; Y555-V558 PolarHBondContact O-N 2.87Å; V558-T561 PolarHBondContact O-N 3.05Å; V558-L562 HydrophobicContact CG1-CD1 3.91Å; V558-L562 HydrophobicContact CG1-CG 4.48Å; V558-L562 VanDerWaalsContact O-CG 3.31Å; V558-L562 WeakPolarHBondContact O-CG 3.1Å; V558-L562 PolarHBondContact O-N 3.44Å; V558-L592 HydrophobicContact CG2-CD1 3.94Å; V558-L592 HydrophobicContact CG2-CD2 3.85Å; V558-L592 HydrophobicContact CG2-CG 4.2Å; V558-H615 HydrophobicContact CG2-CB 4.44Å
559	R	85.4	Confident	78.6	Confident	128 Å²	128	45.7 Å²	45.7	48%	0.483	24%	0.236	S	C	.	.	H	α-helix	trans	-61.8	-47	177.2	-177.7	176.2	175.8	171.2	-2.6	111.4	W554 Y555 P556 T557 T561 L562 V563	W554-R559 HydrophobicContact CE3-CB 4.46Å; Y555-R559 PolarHBondContact O-N 3.17Å; P556-R559 PolarHBondContact O-N 2.83Å; T557-R559 PolarHBondContact O-N 3.27Å; R559-T561 PolarHBondContact O-N 2.96Å; R559-L562 PolarHBondContact O-N 3Å; R559-V563 HydrophobicContact CG-CG2 4.42Å; R559-V563 WeakPolarHBondContact O-CG2 3.48Å; R559-V563 PolarHBondContact O-N 3.4Å
560	R	87.4	Confident	80	Confident	73 Å²	73	50.8 Å²	50.8	28%	0.275	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-44	178.7	-74.3	172.7	-179.4	-152.2	-9	112	Y471 D475 P556 T557 C564	Y471-R560 HydrophobicContact CE1-CB 4.35Å; Y471-R560 VanDerWaalsContact OH-CB 3.22Å; Y471-R560 WeakPolarHBondContact OH-CB 3.37Å; Y471-R560 VanDerWaalsContact OH-CG 3.3Å; Y471-R560 WeakPolarHBondContact OH-CG 3.13Å; D475-R560 WeakPolarHBondContact O-CD 3.26Å; D475-R560 PolarHBondContact O-NH1 2.63Å; D475-R560 IonicContact OD1-CZ 2.62Å; D475-R560 IonicContact OD1-NH1 2.67Å; D475-R560 PolarHBondContact OD1-NH1 2.87Å; D475-R560 IonicContact OD1-NH2 3.71Å; P556-R560 WeakPolarHBondContact O-CB 3.37Å; P556-R560 WeakPolarHBondContact O-CG 3.36Å; P556-R560 PolarHBondContact O-N 3.24Å; T557-R560 PolarHBondContact O-N 3.17Å; R560-C564 WeakPolarHBondContact O-CB 3.34Å; R560-C564 PolarHBondContact O-N 3.29Å
561	T	88.2	Confident	81.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-48.8	176.4	-59.9	0	0	0	0	111.5	I476 T557 V558 R559 C564 L565 A584 L585 C588	I476-T561 WeakPolarHBondContact CD1-OG1 3.32Å; T557-T561 WeakPolarHBondContact O-CB 3.39Å; T557-T561 PolarHBondContact O-N 3.01Å; T557-T561 PolarHBondContact O-OG1 3.17Å; V558-T561 PolarHBondContact O-N 3.05Å; R559-T561 PolarHBondContact O-N 2.96Å; T561-C564 WeakPolarHBondContact O-CB 3.41Å; T561-C564 PolarHBondContact O-N 3.49Å; T561-L565 HydrophobicContact CG2-CD1 4.04Å; T561-L565 HydrophobicContact CG2-CG 4.38Å; T561-L565 VanDerWaalsContact O-CG 3.3Å; T561-L565 WeakPolarHBondContact O-CG 3.32Å; T561-L565 PolarHBondContact O-N 3.45Å; T561-A584 HydrophobicContact CG2-CB 4.09Å; T561-L585 HydrophobicContact CG2-CD2 4.28Å; T561-C588 HydrophobicContact CG2-CB 4.2Å; T561-C588 WeakPolarHBondContact OG1-CB 3.46Å
562	L	85.9	Confident	82.7	Confident	16 Å²	16	40.6 Å²	40.6	8%	0.084	20%	0.199	C	C	.	.	H	α-helix	trans	-66.8	-40.9	-177.1	-69.1	173.4	0	0	0	112.9	W554 V558 R559 C564 L565 S566 L619 Q622 I623	W554-L562 HydrophobicContact CE3-CD1 4.09Å; W554-L562 HydrophobicContact CH2-CD1 4.21Å; W554-L562 HydrophobicContact CZ3-CD1 3.56Å; V558-L562 HydrophobicContact CG1-CD1 3.91Å; V558-L562 HydrophobicContact CG1-CG 4.48Å; V558-L562 VanDerWaalsContact O-CG 3.31Å; V558-L562 WeakPolarHBondContact O-CG 3.1Å; V558-L562 PolarHBondContact O-N 3.44Å; R559-L562 PolarHBondContact O-N 3Å; L562-C564 VanDerWaalsContact C-N 3.34Å; L562-L565 PolarHBondContact O-N 3.23Å; L562-S566 WeakPolarHBondContact O-CB 3.37Å; L562-S566 PolarHBondContact O-N 3.21Å; L562-L619 HydrophobicContact CD2-CD1 4.16Å; L562-Q622 HydrophobicContact CD1-CB 3.57Å; L562-Q622 HydrophobicContact CD1-CG 3.77Å; L562-Q622 HydrophobicContact CD2-CB 3.64Å; L562-Q622 HydrophobicContact CG-CB 4.27Å; L562-I623 HydrophobicContact CD2-CG2 4.38Å
563	V	85.1	Confident	83.9	Confident	62 Å²	62	42.3 Å²	42.3	38%	0.376	19%	0.193	S	C	.	.	H	α-helix	trans	-61.5	-46.3	174.2	172.2	0	0	0	0	110.1	R559 L565 S566 K567	R559-V563 HydrophobicContact CG-CG2 4.42Å; R559-V563 WeakPolarHBondContact O-CG2 3.48Å; R559-V563 PolarHBondContact O-N 3.4Å; V563-L565 PolarHBondContact O-N 2.88Å; V563-S566 PolarHBondContact O-N 2.83Å; V563-S566 PolarHBondContact O-OG 3.45Å; V563-K567 WeakPolarHBondContact O-CG 3.48Å; V563-K567 PolarHBondContact O-N 2.79Å; V563-K567 VanDerWaalsContact O-N 3.15Å
564	C	86.6	Confident	84.5	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.007	22%	0.218	C	C	.	.	H	α-helix	trans	-55.9	-53.2	175.8	-174.4	0	0	0	0	111.4	L420 Y471 R560 T561 L562 S566 K567 L568	L420-C564 HydrophobicContact CD2-CB 4.46Å; Y471-C564 HydrophobicContact CD1-CB 4.43Å; Y471-C564 HydrophobicContact CE1-CB 4.03Å; R560-C564 WeakPolarHBondContact O-CB 3.34Å; R560-C564 PolarHBondContact O-N 3.29Å; T561-C564 WeakPolarHBondContact O-CB 3.41Å; T561-C564 PolarHBondContact O-N 3.49Å; L562-C564 VanDerWaalsContact C-N 3.34Å; C564-S566 VanDerWaalsContact C-N 3.33Å; C564-S566 PolarHBondContact O-N 3.35Å; C564-K567 PolarHBondContact O-N 3.18Å; C564-K567 VanDerWaalsContact O-N 3.17Å; C564-L568 VanDerWaalsContact O-CG 3.24Å; C564-L568 WeakPolarHBondContact O-CG 3.42Å; C564-L568 PolarHBondContact O-N 3.26Å; C564-L568 VanDerWaalsContact SG-CD1 3.59Å
565	L	86.5	Confident	84.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.8	-43	178.4	-68.4	176.5	0	0	0	112.6	T561 L562 V563 K567 L568 Y569 F577 S581 A584 L585	T561-L565 HydrophobicContact CG2-CD1 4.04Å; T561-L565 HydrophobicContact CG2-CG 4.38Å; T561-L565 VanDerWaalsContact O-CG 3.3Å; T561-L565 WeakPolarHBondContact O-CG 3.32Å; T561-L565 PolarHBondContact O-N 3.45Å; L562-L565 PolarHBondContact O-N 3.23Å; V563-L565 PolarHBondContact O-N 2.88Å; L565-K567 VanDerWaalsContact C-N 3.28Å; L565-K567 PolarHBondContact O-N 2.94Å; L565-L568 PolarHBondContact O-N 3.38Å; L565-Y569 WeakPolarHBondContact O-CB 3.43Å; L565-Y569 PolarHBondContact O-N 2.87Å; L565-F577 HydrophobicContact CD2-CE2 4.31Å; L565-F577 HydrophobicContact CD2-CZ 4.44Å; L565-S581 VanDerWaalsContact CD2-CB 3.49Å; L565-A584 HydrophobicContact CD2-CB 4.48Å; L565-L585 HydrophobicContact CD1-CD2 4.15Å; L565-L585 HydrophobicContact CD1-CG 4.34Å
566	S	84.1	Confident	84.6	Confident	53 Å²	53	54.1 Å²	54.1	37%	0.371	26%	0.259	S	S	.	.	H	α-helix	trans	-62.4	-35.2	-179.9	74.8	0	0	0	0	113.1	L562 V563 C564	L562-S566 WeakPolarHBondContact O-CB 3.37Å; L562-S566 PolarHBondContact O-N 3.21Å; V563-S566 PolarHBondContact O-N 2.83Å; V563-S566 PolarHBondContact O-OG 3.45Å; C564-S566 VanDerWaalsContact C-N 3.33Å; C564-S566 PolarHBondContact O-N 3.35Å
567	K	83.1	Confident	84.6	Confident	73 Å²	73	52.7 Å²	52.7	32%	0.317	25%	0.25	S	C	.	.	H	α-helix	trans	-77.5	-40.1	179.3	-68.7	-68.8	-169.9	165.6	0	111.5	V563 C564 L565 Y569 C571	V563-K567 WeakPolarHBondContact O-CG 3.48Å; V563-K567 PolarHBondContact O-N 2.79Å; V563-K567 VanDerWaalsContact O-N 3.15Å; C564-K567 PolarHBondContact O-N 3.18Å; C564-K567 VanDerWaalsContact O-N 3.17Å; L565-K567 VanDerWaalsContact C-N 3.28Å; L565-K567 PolarHBondContact O-N 2.94Å; K567-Y569 VanDerWaalsContact C-N 3.34Å; K567-Y569 PolarHBondContact O-N 3.49Å; K567-C571 PolarHBondContact O-SG 3.38Å
568	L	85.8	Confident	84.4	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-68.9	-33.2	180	-61.9	169	0	0	0	112.6	L464 T468 C564 L565 R570 C571 I572 F577	L464-L568 HydrophobicContact CD1-CD2 4.23Å; L464-L568 HydrophobicContact CD2-CD2 4.06Å; L464-L568 HydrophobicContact CG-CD2 3.93Å; T468-L568 HydrophobicContact CG2-CD1 3.58Å; T468-L568 HydrophobicContact CG2-CD2 4.24Å; T468-L568 VanDerWaalsContact OG1-CD2 3.28Å; T468-L568 WeakPolarHBondContact OG1-CD2 3.4Å; C564-L568 VanDerWaalsContact O-CG 3.24Å; C564-L568 WeakPolarHBondContact O-CG 3.42Å; C564-L568 PolarHBondContact O-N 3.26Å; C564-L568 VanDerWaalsContact SG-CD1 3.59Å; L565-L568 PolarHBondContact O-N 3.38Å; L568-R570 VanDerWaalsContact C-N 3.26Å; L568-R570 PolarHBondContact O-N 3.4Å; L568-R570 VanDerWaalsContact O-N 3.16Å; L568-C571 PolarHBondContact O-N 2.97Å; L568-C571 VanDerWaalsContact O-N 3.09Å; L568-I572 HydrophobicContact CB-CD1 4.17Å; L568-I572 HydrophobicContact CD2-CD1 3.41Å; L568-I572 VanDerWaalsContact CD2-CD1 3.41Å; L568-I572 HydrophobicContact CD2-CG1 4.46Å; L568-I572 HydrophobicContact CG-CD1 4.31Å; L568-I572 PolarHBondContact O-N 2.95Å; L568-F577 HydrophobicContact CB-CD2 3.85Å; L568-F577 HydrophobicContact CB-CE2 4.02Å
569	Y	82.7	Confident	84.2	Confident	80 Å²	80	56 Å²	56	31%	0.314	27%	0.274	S	S	.	.	H	α-helix	trans	-54	-37.4	-174.5	-179.1	-104.9	0	0	0	114.1	L565 K567 F577 F626 E629	L565-Y569 WeakPolarHBondContact O-CB 3.43Å; L565-Y569 PolarHBondContact O-N 2.87Å; K567-Y569 VanDerWaalsContact C-N 3.34Å; K567-Y569 PolarHBondContact O-N 3.49Å; Y569-F577 HydrophobicContact CD2-CD1 4.49Å; Y569-F577 AromaticContact CD2-CE1 3.93Å; Y569-F577 HydrophobicContact CD2-CE1 3.93Å; Y569-F577 HydrophobicContact CD2-CE2 4.42Å; Y569-F577 AromaticContact CD2-CZ 3.89Å; Y569-F577 HydrophobicContact CD2-CZ 3.89Å; Y569-F626 HydrophobicContact CD1-CD1 4.43Å; Y569-F626 HydrophobicContact CD1-CE1 4.37Å; Y569-F626 AromaticContact CD2-CD1 3.68Å; Y569-F626 HydrophobicContact CD2-CD1 3.68Å; Y569-F626 HydrophobicContact CD2-CE1 4.23Å; Y569-F626 HydrophobicContact CE2-CD1 4.09Å; Y569-F626 AromaticContact CG-CD1 3.88Å; Y569-F626 HydrophobicContact CG-CD1 3.88Å; Y569-F626 AromaticContact CG-CE1 3.95Å; Y569-F626 HydrophobicContact CG-CE1 3.95Å; Y569-E629 WeakPolarHBondContact CE2-OE2 3.38Å
570	R	79.6	Confident	84.3	Confident	191 Å²	191	50.5 Å²	50.5	72%	0.721	25%	0.254	S	S	*	.	H	α-helix	trans	-88.5	-21.3	-178.4	-64.7	-175.9	178.9	171.5	-0.1	113.6	K431 L568	K431-R570 PolarHBondContact NZ-O 2.83Å; L568-R570 VanDerWaalsContact C-N 3.26Å; L568-R570 PolarHBondContact O-N 3.4Å; L568-R570 VanDerWaalsContact O-N 3.16Å
571	C	83.4	Confident	84.2	Confident	7 Å²	7	47 Å²	47	5%	0.047	24%	0.241	C	C	.	.	H	α-helix	trans	-101.4	-19.8	-164.6	-60.1	0	0	0	0	113.6	S424 C427 Q461 L464 K567 L568	S424-C571 PolarHBondContact O-SG 3.45Å; C427-C571 HydrophobicContact CB-CB 3.64Å; Q461-C571 PolarHBondContact NE2-O 3.34Å; L464-C571 HydrophobicContact CD2-CB 3.8Å; K567-C571 PolarHBondContact O-SG 3.38Å; L568-C571 PolarHBondContact O-N 2.97Å; L568-C571 VanDerWaalsContact O-N 3.09Å
572	I	83.9	Confident	84.1	Confident	13 Å²	13	49.1 Å²	49.1	7%	0.067	25%	0.251	C	S	.	.	S	Bend	trans	-123.7	151.3	-169.3	-59	-178.2	0	0	0	110.6	L464 V465 L568 V576 L580	L464-I572 HydrophobicContact CD2-CD1 3.84Å; L464-I572 HydrophobicContact CD2-CG1 3.86Å; L464-I572 HydrophobicContact CG-CD1 4.18Å; V465-I572 HydrophobicContact CG2-CD1 3.96Å; L568-I572 HydrophobicContact CB-CD1 4.17Å; L568-I572 HydrophobicContact CD2-CD1 3.41Å; L568-I572 VanDerWaalsContact CD2-CD1 3.41Å; L568-I572 HydrophobicContact CD2-CG1 4.46Å; L568-I572 HydrophobicContact CG-CD1 4.31Å; L568-I572 PolarHBondContact O-N 2.95Å; I572-V576 HydrophobicContact CG2-CB 3.56Å; I572-V576 HydrophobicContact CG2-CG1 3.69Å; I572-L580 HydrophobicContact CD1-CD1 4.02Å
573	D	82.6	Confident	84.1	Confident	101 Å²	101	51.2 Å²	51.2	54%	0.54	26%	0.26	S	S	.	.			trans	-63.8	149.1	173.1	-69.5	-30.1	0	0	0	113.1	A575 V576 F577	D573-A575 VanDerWaalsContact C-N 3.28Å; D573-A575 PolarHBondContact O-N 2.81Å; D573-A575 VanDerWaalsContact O-N 3.13Å; D573-V576 PolarHBondContact O-N 3.22Å; D573-V576 VanDerWaalsContact O-N 3.1Å; D573-F577 WeakPolarHBondContact O-CB 3.22Å; D573-F577 PolarHBondContact O-N 3.2Å
574	R	81.1	Confident	84.3	Confident	171 Å²	171	48.3 Å²	48.3	65%	0.645	24%	0.242	S	C	*	.	H	α-helix	trans	-51.4	-42.7	-174.8	-69.1	-178.9	167.3	160.8	3	113.8	Q578 E629	R574-Q578 VanDerWaalsContact O-CB 3.3Å; R574-Q578 WeakPolarHBondContact O-CB 3.45Å; R574-Q578 WeakPolarHBondContact O-CG 3.45Å; R574-Q578 PolarHBondContact O-N 3.42Å; R574-E629 IonicContact CZ-OE1 2.91Å; R574-E629 IonicContact NE-OE1 3.74Å; R574-E629 PolarHBondContact NE-OE1 3.33Å; R574-E629 IonicContact NH2-OE1 2.72Å; R574-E629 PolarHBondContact NH2-OE1 3Å
575	A	81.3	Confident	84.5	Confident	74 Å²	74	48.4 Å²	48.4	61%	0.612	24%	0.243	S	C	*	.	H	α-helix	trans	-68	-39.4	-177	0	0	0	0	0	112.7	D573 Q578 G579	D573-A575 VanDerWaalsContact C-N 3.28Å; D573-A575 PolarHBondContact O-N 2.81Å; D573-A575 VanDerWaalsContact O-N 3.13Å; A575-Q578 WeakPolarHBondContact O-CB 3.49Å; A575-G579 PolarHBondContact O-N 3.1Å
576	V	83.7	Confident	84.6	Confident	62 Å²	62	50.3 Å²	50.3	38%	0.376	26%	0.256	S	S	.	.	H	α-helix	trans	-77.1	-39.6	179.6	-179.3	0	0	0	0	110.4	V465 I572 D573 Q578 G579 L580	V465-V576 HydrophobicContact CG1-CG1 4.29Å; V465-V576 HydrophobicContact CG2-CG1 3.61Å; I572-V576 HydrophobicContact CG2-CB 3.56Å; I572-V576 HydrophobicContact CG2-CG1 3.69Å; D573-V576 PolarHBondContact O-N 3.22Å; D573-V576 VanDerWaalsContact O-N 3.1Å; V576-Q578 VanDerWaalsContact C-N 3.3Å; V576-Q578 PolarHBondContact O-N 2.97Å; V576-G579 PolarHBondContact O-N 3.43Å; V576-L580 HydrophobicContact CG1-CD1 4.06Å; V576-L580 HydrophobicContact CG1-CG 4.46Å; V576-L580 WeakPolarHBondContact O-CG 3.31Å; V576-L580 PolarHBondContact O-N 2.89Å
577	F	85.9	Confident	84.8	Confident	1 Å²	1	48 Å²	48	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-57.7	-44.8	173.4	176.1	-103.1	0	0	0	111.7	L565 L568 Y569 D573 L580 S581 E629 F630	L565-F577 HydrophobicContact CD2-CE2 4.31Å; L565-F577 HydrophobicContact CD2-CZ 4.44Å; L568-F577 HydrophobicContact CB-CD2 3.85Å; L568-F577 HydrophobicContact CB-CE2 4.02Å; Y569-F577 HydrophobicContact CD2-CD1 4.49Å; Y569-F577 AromaticContact CD2-CE1 3.93Å; Y569-F577 HydrophobicContact CD2-CE1 3.93Å; Y569-F577 HydrophobicContact CD2-CE2 4.42Å; Y569-F577 AromaticContact CD2-CZ 3.89Å; Y569-F577 HydrophobicContact CD2-CZ 3.89Å; D573-F577 WeakPolarHBondContact O-CB 3.22Å; D573-F577 PolarHBondContact O-N 3.2Å; F577-L580 PolarHBondContact O-N 3.42Å; F577-S581 WeakPolarHBondContact O-CB 3.07Å; F577-S581 PolarHBondContact O-N 3.32Å; F577-S581 PolarHBondContact O-OG 3.46Å; F577-E629 HydrophobicContact CD1-CB 4.42Å; F577-F630 HydrophobicContact CE1-CD1 4.09Å; F577-F630 AromaticContact CE1-CE1 3.53Å; F577-F630 HydrophobicContact CE1-CE1 3.53Å; F577-F630 HydrophobicContact CE1-CZ 4.31Å; F577-F630 AromaticContact CZ-CE1 3.79Å; F577-F630 HydrophobicContact CZ-CE1 3.79Å; F577-F630 HydrophobicContact CZ-CZ 4.34Å
578	Q	83	Confident	85.2	Confident	35 Å²	35	44.5 Å²	44.5	16%	0.164	23%	0.225	C	C	.	.	H	α-helix	trans	-51.6	-58.6	174.4	-85.8	173.8	11.5	0	0	111.5	R574 A575 V576 L580 S581 Q582 E629 T631 I632	R574-Q578 VanDerWaalsContact O-CB 3.3Å; R574-Q578 WeakPolarHBondContact O-CB 3.45Å; R574-Q578 WeakPolarHBondContact O-CG 3.45Å; R574-Q578 PolarHBondContact O-N 3.42Å; A575-Q578 WeakPolarHBondContact O-CB 3.49Å; V576-Q578 VanDerWaalsContact C-N 3.3Å; V576-Q578 PolarHBondContact O-N 2.97Å; Q578-L580 PolarHBondContact O-N 3.47Å; Q578-S581 PolarHBondContact O-N 3.34Å; Q578-S581 PolarHBondContact O-OG 2.56Å; Q578-Q582 PolarHBondContact O-N 3.14Å; Q578-Q582 VanDerWaalsContact O-N 3.13Å; Q578-E629 WeakPolarHBondContact CG-O 3.49Å; Q578-T631 PolarHBondContact NE2-O 2.87Å; Q578-T631 PolarHBondContact OE1-O 2.63Å; Q578-I632 HydrophobicContact CB-CD1 4.22Å; Q578-I632 HydrophobicContact CB-CG1 3.6Å; Q578-I632 HydrophobicContact CG-CG1 4.28Å; Q578-I632 WeakPolarHBondContact O-CD1 3.25Å
579	G	83.5	Confident	85.3	Confident	33 Å²	33	44.6 Å²	44.6	34%	0.34	23%	0.226	S	C	.	.	H	α-helix	trans	-58.5	-46.9	-179.1	0	0	0	0	0	113.6	A575 V576 S581 Q582 E583	A575-G579 PolarHBondContact O-N 3.1Å; V576-G579 PolarHBondContact O-N 3.43Å; G579-S581 VanDerWaalsContact C-N 3.31Å; G579-S581 PolarHBondContact O-N 3.01Å; G579-Q582 PolarHBondContact O-N 2.99Å; G579-E583 PolarHBondContact O-N 3.07Å
580	L	86.3	Confident	85.7	Confident	13 Å²	13	46.7 Å²	46.7	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-37	178	-72.2	173.8	0	0	0	112.5	V465 T468 I572 V576 F577 Q578 E583 A584	V465-L580 HydrophobicContact CB-CD1 4.4Å; V465-L580 HydrophobicContact CG1-CD1 4.19Å; V465-L580 HydrophobicContact CG1-CD2 4.33Å; V465-L580 HydrophobicContact CG2-CD1 4.06Å; T468-L580 HydrophobicContact CG2-CD1 4.25Å; T468-L580 HydrophobicContact CG2-CD2 4.14Å; I572-L580 HydrophobicContact CD1-CD1 4.02Å; V576-L580 HydrophobicContact CG1-CD1 4.06Å; V576-L580 HydrophobicContact CG1-CG 4.46Å; V576-L580 WeakPolarHBondContact O-CG 3.31Å; V576-L580 PolarHBondContact O-N 2.89Å; F577-L580 PolarHBondContact O-N 3.42Å; Q578-L580 PolarHBondContact O-N 3.47Å; L580-E583 PolarHBondContact O-N 2.95Å; L580-A584 WeakPolarHBondContact O-CB 3.31Å; L580-A584 PolarHBondContact O-N 3.35Å
581	S	86.1	Confident	86.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-68.1	-37.8	180	71.7	0	0	0	0	112.7	L565 F577 Q578 G579 A584 L585 F630	L565-S581 VanDerWaalsContact CD2-CB 3.49Å; F577-S581 WeakPolarHBondContact O-CB 3.07Å; F577-S581 PolarHBondContact O-N 3.32Å; F577-S581 PolarHBondContact O-OG 3.46Å; Q578-S581 PolarHBondContact O-N 3.34Å; Q578-S581 PolarHBondContact O-OG 2.56Å; G579-S581 VanDerWaalsContact C-N 3.31Å; G579-S581 PolarHBondContact O-N 3.01Å; S581-A584 PolarHBondContact O-N 3.34Å; S581-L585 VanDerWaalsContact O-CB 3.27Å; S581-L585 WeakPolarHBondContact O-CB 3.13Å; S581-L585 WeakPolarHBondContact O-CG 3.24Å; S581-L585 PolarHBondContact O-N 2.97Å; S581-F630 WeakPolarHBondContact OG-CD1 3.46Å; S581-F630 WeakPolarHBondContact OG-CE1 3.18Å
582	Q	85.3	Confident	86.5	Confident	45 Å²	45	38 Å²	38	21%	0.21	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-45.6	173.5	-179.2	-168.8	1.6	0	0	111	Q578 G579 L585 S586 I632 E634 L683	Q578-Q582 PolarHBondContact O-N 3.14Å; Q578-Q582 VanDerWaalsContact O-N 3.13Å; G579-Q582 PolarHBondContact O-N 2.99Å; Q582-L585 PolarHBondContact O-N 3.16Å; Q582-S586 VanDerWaalsContact O-CB 3.31Å; Q582-S586 WeakPolarHBondContact O-CB 3.26Å; Q582-S586 PolarHBondContact O-N 3.44Å; Q582-S586 PolarHBondContact O-OG 2.74Å; Q582-I632 HydrophobicContact CB-CD1 3.71Å; Q582-I632 HydrophobicContact CG-CD1 4.29Å; Q582-E634 PolarHBondContact NE2-OE1 2.95Å; Q582-L683 VanDerWaalsContact NE2-CD2 3.32Å
583	E	87.6	Confident	86.8	Confident	60 Å²	60	40.4 Å²	40.4	28%	0.28	22%	0.219	S	C	.	.	H	α-helix	trans	-62.2	-47.1	177.7	-165.9	-177.5	-177.2	0	0	111.1	H469 I472 G579 L580 L585 S586 A587	H469-E583 IonicContact CE1-OE1 3.8Å; H469-E583 PolarHBondContact CE1-OE1 2.92Å; H469-E583 IonicContact CE1-OE2 3.18Å; H469-E583 PolarHBondContact CE1-OE2 2.84Å; H469-E583 VanDerWaalsContact ND1-CD 3.32Å; H469-E583 IonicContact ND1-OE1 2.99Å; H469-E583 PolarHBondContact ND1-OE1 3.22Å; H469-E583 IonicContact ND1-OE2 2.66Å; H469-E583 PolarHBondContact ND1-OE2 3.06Å; I472-E583 HydrophobicContact CD1-CB 4.45Å; I472-E583 HydrophobicContact CG2-CG 4.21Å; G579-E583 PolarHBondContact O-N 3.07Å; L580-E583 PolarHBondContact O-N 2.95Å; E583-L585 PolarHBondContact O-N 3.05Å; E583-S586 PolarHBondContact O-N 3.27Å; E583-S586 PolarHBondContact O-OG 3.46Å; E583-A587 VanDerWaalsContact O-CB 3.25Å; E583-A587 WeakPolarHBondContact O-CB 3.27Å; E583-A587 PolarHBondContact O-N 3.48Å
584	A	89.2	Confident	87	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-40.1	179.4	0	0	0	0	0	112.9	I472 T561 L565 L580 S581 C588	I472-A584 HydrophobicContact CD1-CB 3.77Å; I472-A584 HydrophobicContact CG1-CB 3.99Å; T561-A584 HydrophobicContact CG2-CB 4.09Å; L565-A584 HydrophobicContact CD2-CB 4.48Å; L580-A584 WeakPolarHBondContact O-CB 3.31Å; L580-A584 PolarHBondContact O-N 3.35Å; S581-A584 PolarHBondContact O-N 3.34Å; A584-C588 WeakPolarHBondContact O-CB 3.41Å; A584-C588 PolarHBondContact O-N 2.89Å
585	L	89	Confident	87.3	Confident	3 Å²	3	29 Å²	29	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-71	-44.8	178.6	-73	170.3	0	0	0	111.6	T561 L565 S581 Q582 E583 C588 I589 L619 I623	T561-L585 HydrophobicContact CG2-CD2 4.28Å; L565-L585 HydrophobicContact CD1-CD2 4.15Å; L565-L585 HydrophobicContact CD1-CG 4.34Å; S581-L585 VanDerWaalsContact O-CB 3.27Å; S581-L585 WeakPolarHBondContact O-CB 3.13Å; S581-L585 WeakPolarHBondContact O-CG 3.24Å; S581-L585 PolarHBondContact O-N 2.97Å; Q582-L585 PolarHBondContact O-N 3.16Å; E583-L585 PolarHBondContact O-N 3.05Å; L585-C588 WeakPolarHBondContact O-CB 3.43Å; L585-C588 PolarHBondContact O-N 3.45Å; L585-I589 VanDerWaalsContact O-CG1 3.31Å; L585-I589 WeakPolarHBondContact O-CG1 3.42Å; L585-I589 PolarHBondContact O-N 3.16Å; L585-L619 HydrophobicContact CD2-CD1 3.76Å; L585-L619 HydrophobicContact CD2-CD2 4.1Å; L585-L619 HydrophobicContact CD2-CG 4.12Å; L585-I623 HydrophobicContact CD2-CG2 3.96Å
586	S	88.8	Confident	87.6	Confident	40 Å²	40	26 Å²	26	28%	0.28	15%	0.154	S	C	.	.	H	α-helix	trans	-62.7	-43.4	176.9	60.9	0	0	0	0	111.8	Q582 E583 C588 I589 Q590	Q582-S586 VanDerWaalsContact O-CB 3.31Å; Q582-S586 WeakPolarHBondContact O-CB 3.26Å; Q582-S586 PolarHBondContact O-N 3.44Å; Q582-S586 PolarHBondContact O-OG 2.74Å; E583-S586 PolarHBondContact O-N 3.27Å; E583-S586 PolarHBondContact O-OG 3.46Å; S586-C588 VanDerWaalsContact C-N 3.32Å; S586-C588 PolarHBondContact O-N 3.19Å; S586-I589 PolarHBondContact O-N 2.74Å; S586-Q590 WeakPolarHBondContact O-CG 3.46Å; S586-Q590 PolarHBondContact O-N 3.22Å
587	A	89	Confident	87.8	Confident	4 Å²	4	28.7 Å²	28.7	3%	0.033	16%	0.162	C	C	.	.	H	α-helix	trans	-59	-42	172.2	0	0	0	0	0	112.2	I472 I476 T477 E583 Q590 S591	I472-A587 HydrophobicContact CG2-CB 3.72Å; I476-A587 HydrophobicContact CB-CB 4.31Å; I476-A587 HydrophobicContact CG2-CB 3.7Å; T477-A587 VanDerWaalsContact OG1-CB 3.28Å; T477-A587 WeakPolarHBondContact OG1-CB 3.2Å; E583-A587 VanDerWaalsContact O-CB 3.25Å; E583-A587 WeakPolarHBondContact O-CB 3.27Å; E583-A587 PolarHBondContact O-N 3.48Å; A587-Q590 PolarHBondContact O-N 3.31Å; A587-S591 WeakPolarHBondContact O-CB 3.22Å; A587-S591 PolarHBondContact O-N 3.22Å
588	C	90.6	Very high	87.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.3	-45.1	176.2	-173.3	0	0	0	0	111.9	I476 T561 A584 L585 S586 S591 L592	I476-C588 HydrophobicContact CG2-CB 4.29Å; T561-C588 HydrophobicContact CG2-CB 4.2Å; T561-C588 WeakPolarHBondContact OG1-CB 3.46Å; A584-C588 WeakPolarHBondContact O-CB 3.41Å; A584-C588 PolarHBondContact O-N 2.89Å; L585-C588 WeakPolarHBondContact O-CB 3.43Å; L585-C588 PolarHBondContact O-N 3.45Å; S586-C588 VanDerWaalsContact C-N 3.32Å; S586-C588 PolarHBondContact O-N 3.19Å; C588-S591 PolarHBondContact O-N 2.81Å; C588-L592 WeakPolarHBondContact O-CG 3.26Å; C588-L592 PolarHBondContact O-N 2.96Å
589	I	89.7	Confident	87.9	Confident	4 Å²	4	28.9 Å²	28.9	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-44.5	178	-66.6	165.6	0	0	0	110.3	L585 S586 S591 L592 L593 L616 L619 V689 H692	L585-I589 VanDerWaalsContact O-CG1 3.31Å; L585-I589 WeakPolarHBondContact O-CG1 3.42Å; L585-I589 PolarHBondContact O-N 3.16Å; S586-I589 PolarHBondContact O-N 2.74Å; I589-S591 VanDerWaalsContact C-N 3.33Å; I589-S591 PolarHBondContact O-N 3.31Å; I589-L592 PolarHBondContact O-N 3.43Å; I589-L593 HydrophobicContact CG2-CD1 4.09Å; I589-L593 HydrophobicContact CG2-CG 4.4Å; I589-L593 WeakPolarHBondContact O-CG 3.35Å; I589-L593 PolarHBondContact O-N 2.66Å; I589-L616 HydrophobicContact CG1-CD2 4.25Å; I589-L619 HydrophobicContact CG1-CD2 4.32Å; I589-V689 HydrophobicContact CD1-CG2 3.93Å; I589-H692 HydrophobicContact CG2-CB 4.37Å
590	Q	89.9	Confident	88	Confident	124 Å²	124	29.1 Å²	29.1	58%	0.579	16%	0.164	S	C	*	.	H	α-helix	trans	-60.1	-43.5	176.4	-73.3	-178.5	-4.2	0	0	112	S586 A587 L592 L593 G594	S586-Q590 WeakPolarHBondContact O-CG 3.46Å; S586-Q590 PolarHBondContact O-N 3.22Å; A587-Q590 PolarHBondContact O-N 3.31Å; Q590-L592 VanDerWaalsContact C-N 3.34Å; Q590-L592 PolarHBondContact O-N 2.9Å; Q590-L593 PolarHBondContact O-N 3.23Å; Q590-G594 PolarHBondContact O-N 3.04Å
591	S	90.6	Very high	87.9	Confident	16 Å²	16	36.3 Å²	36.3	11%	0.112	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-41.3	175.2	-172.5	0	0	0	0	112.1	T557 A587 C588 I589 G594 A595	T557-S591 VanDerWaalsContact CG2-OG 3.26Å; T557-S591 WeakPolarHBondContact CG2-OG 3.16Å; T557-S591 PolarHBondContact OG1-OG 3.18Å; A587-S591 WeakPolarHBondContact O-CB 3.22Å; A587-S591 PolarHBondContact O-N 3.22Å; C588-S591 PolarHBondContact O-N 2.81Å; I589-S591 VanDerWaalsContact C-N 3.33Å; I589-S591 PolarHBondContact O-N 3.31Å; S591-G594 PolarHBondContact O-N 3.01Å; S591-A595 WeakPolarHBondContact O-CB 3.4Å; S591-A595 PolarHBondContact O-N 2.9Å
592	L	90	Very high	87.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.1	-39	176.6	-73.7	174.1	0	0	0	112.9	Y555 V558 C588 I589 Q590 A595 S596 F611 L612 H615 L616	Y555-L592 HydrophobicContact CD1-CD2 3.74Å; Y555-L592 HydrophobicContact CE1-CD2 4.43Å; Y555-L592 HydrophobicContact CG-CD2 4.28Å; V558-L592 HydrophobicContact CG2-CD1 3.94Å; V558-L592 HydrophobicContact CG2-CD2 3.85Å; V558-L592 HydrophobicContact CG2-CG 4.2Å; C588-L592 WeakPolarHBondContact O-CG 3.26Å; C588-L592 PolarHBondContact O-N 2.96Å; I589-L592 PolarHBondContact O-N 3.43Å; Q590-L592 VanDerWaalsContact C-N 3.34Å; Q590-L592 PolarHBondContact O-N 2.9Å; L592-A595 PolarHBondContact O-N 3.26Å; L592-S596 WeakPolarHBondContact O-CB 3.18Å; L592-S596 PolarHBondContact O-N 3.45Å; L592-F611 HydrophobicContact CD2-CE1 4.12Å; L592-F611 HydrophobicContact CD2-CZ 4.33Å; L592-L612 HydrophobicContact CB-CD1 3.98Å; L592-H615 HydrophobicContact CD1-CB 4.04Å; L592-H615 HydrophobicContact CD2-CB 3.69Å; L592-L616 HydrophobicContact CD1-CD2 4.22Å
593	L	89.8	Confident	87.3	Confident	62 Å²	62	43.5 Å²	43.5	33%	0.325	23%	0.23	S	C	.	.	H	α-helix	trans	-63.1	-47.5	174.6	-71	170.8	0	0	0	110.9	I589 Q590 A595 S596 E597 L612	I589-L593 HydrophobicContact CG2-CD1 4.09Å; I589-L593 HydrophobicContact CG2-CG 4.4Å; I589-L593 WeakPolarHBondContact O-CG 3.35Å; I589-L593 PolarHBondContact O-N 2.66Å; Q590-L593 PolarHBondContact O-N 3.23Å; L593-A595 VanDerWaalsContact C-N 3.32Å; L593-A595 PolarHBondContact O-N 2.82Å; L593-S596 WeakPolarHBondContact O-CB 3.33Å; L593-S596 PolarHBondContact O-N 3.47Å; L593-E597 PolarHBondContact O-N 3.12Å; L593-L612 HydrophobicContact CD2-CD1 4.12Å; L593-L612 HydrophobicContact CD2-CD2 3.71Å
594	G	87.4	Confident	87	Confident	33 Å²	33	43.6 Å²	43.6	34%	0.34	24%	0.235	S	C	.	.	H	α-helix	trans	-61.9	-37.7	176	0	0	0	0	0	113.3	Q590 S591 S598	Q590-G594 PolarHBondContact O-N 3.04Å; S591-G594 PolarHBondContact O-N 3.01Å; G594-S598 WeakPolarHBondContact O-CB 3.38Å; G594-S598 PolarHBondContact O-N 2.96Å; G594-S598 VanDerWaalsContact O-N 3.1Å; G594-S598 PolarHBondContact O-OG 3.45Å
595	A	86.8	Confident	86.8	Confident	1 Å²	1	49 Å²	49	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-44.1	174	0	0	0	0	0	111.8	Y555 S591 L592 L593 E597 S598 I599 F611	Y555-A595 HydrophobicContact CE1-CB 4.22Å; Y555-A595 HydrophobicContact CE2-CB 4.19Å; S591-A595 WeakPolarHBondContact O-CB 3.4Å; S591-A595 PolarHBondContact O-N 2.9Å; L592-A595 PolarHBondContact O-N 3.26Å; L593-A595 VanDerWaalsContact C-N 3.32Å; L593-A595 PolarHBondContact O-N 2.82Å; A595-E597 PolarHBondContact O-N 3.24Å; A595-S598 PolarHBondContact O-N 2.98Å; A595-I599 VanDerWaalsContact O-CG1 3.29Å; A595-I599 WeakPolarHBondContact O-CG1 3.36Å; A595-I599 PolarHBondContact O-N 2.91Å; A595-F611 HydrophobicContact CB-CE1 3.87Å; A595-F611 HydrophobicContact CB-CZ 4.29Å
596	S	87.8	Confident	86.5	Confident	11 Å²	11	50.4 Å²	50.4	8%	0.077	27%	0.268	C	S	.	.	H	α-helix	trans	-59.6	-44	176.5	174.7	0	0	0	0	112.6	L592 L593 S598 I599 S600 G608	L592-S596 WeakPolarHBondContact O-CB 3.18Å; L592-S596 PolarHBondContact O-N 3.45Å; L593-S596 WeakPolarHBondContact O-CB 3.33Å; L593-S596 PolarHBondContact O-N 3.47Å; S596-S598 VanDerWaalsContact C-N 3.34Å; S596-S598 PolarHBondContact O-N 2.95Å; S596-I599 PolarHBondContact O-N 2.68Å; S596-S600 WeakPolarHBondContact O-CB 3.21Å; S596-S600 PolarHBondContact O-N 3.27Å; S596-S600 PolarHBondContact O-OG 3.27Å; S596-G608 VanDerWaalsContact OG-C 3.3Å; S596-G608 PolarHBondContact OG-O 3.24Å
597	E	87.3	Confident	86.3	Confident	118 Å²	118	49.5 Å²	49.5	55%	0.551	26%	0.26	S	S	*	.	H	α-helix	trans	-63.3	-40.5	175.1	-73.2	-175.8	-171.7	0	0	112	L593 A595 S600 K601	L593-E597 PolarHBondContact O-N 3.12Å; A595-E597 PolarHBondContact O-N 3.24Å; E597-S600 PolarHBondContact O-N 3.02Å; E597-K601 WeakPolarHBondContact O-CG 3.3Å; E597-K601 PolarHBondContact O-N 3.45Å
598	S	85.3	Confident	86.1	Confident	38 Å²	38	49.3 Å²	49.3	27%	0.266	26%	0.258	S	S	.	.	H	α-helix	trans	-66.9	-39.7	178.8	-59.4	0	0	0	0	112	G594 A595 S596 K601 N602	G594-S598 WeakPolarHBondContact O-CB 3.38Å; G594-S598 PolarHBondContact O-N 2.96Å; G594-S598 VanDerWaalsContact O-N 3.1Å; G594-S598 PolarHBondContact O-OG 3.45Å; A595-S598 PolarHBondContact O-N 2.98Å; S596-S598 VanDerWaalsContact C-N 3.34Å; S596-S598 PolarHBondContact O-N 2.95Å; S598-K601 PolarHBondContact O-N 3.16Å; S598-N602 PolarHBondContact O-N 3.3Å; S598-N602 PolarHBondContact O-ND2 3.21Å
599	I	85.1	Confident	85.9	Confident	2 Å²	2	50 Å²	50	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-41.4	174.2	-67	166.1	0	0	0	110.5	L486 P489 A595 S596 K601 N602 K603 D607 F611	L486-I599 HydrophobicContact CD2-CG1 4.12Å; P489-I599 HydrophobicContact CG-CG2 4.37Å; A595-I599 VanDerWaalsContact O-CG1 3.29Å; A595-I599 WeakPolarHBondContact O-CG1 3.36Å; A595-I599 PolarHBondContact O-N 2.91Å; S596-I599 PolarHBondContact O-N 2.68Å; I599-K601 VanDerWaalsContact C-N 3.26Å; I599-K601 PolarHBondContact O-N 3Å; I599-N602 PolarHBondContact O-N 2.91Å; I599-K603 PolarHBondContact O-N 3.27Å; I599-D607 HydrophobicContact CG2-CB 4.23Å; I599-F611 HydrophobicContact CD1-CB 4.17Å; I599-F611 HydrophobicContact CD1-CD1 3.72Å; I599-F611 HydrophobicContact CD1-CD2 3.71Å; I599-F611 HydrophobicContact CD1-CE1 3.99Å; I599-F611 HydrophobicContact CD1-CE2 3.95Å; I599-F611 HydrophobicContact CD1-CG 3.58Å; I599-F611 HydrophobicContact CD1-CZ 4.1Å
600	S	85.4	Confident	85.8	Confident	37 Å²	37	49.9 Å²	49.9	26%	0.259	26%	0.261	S	S	.	.	H	α-helix	trans	-60.6	-35.7	177.7	-60.3	0	0	0	0	112.4	S596 E597	S596-S600 WeakPolarHBondContact O-CB 3.21Å; S596-S600 PolarHBondContact O-N 3.27Å; S596-S600 PolarHBondContact O-OG 3.27Å; E597-S600 PolarHBondContact O-N 3.02Å
601	K	84.4	Confident	85.7	Confident	164 Å²	164	44 Å²	44	71%	0.713	23%	0.233	S	C	*	.	H	α-helix	trans	-72	-36.4	175.4	-72.3	171.1	-175	169.2	0	113.2	E597 S598 I599	E597-K601 WeakPolarHBondContact O-CG 3.3Å; E597-K601 PolarHBondContact O-N 3.45Å; S598-K601 PolarHBondContact O-N 3.16Å; I599-K601 VanDerWaalsContact C-N 3.26Å; I599-K601 PolarHBondContact O-N 3Å
602	N	80.6	Confident	85.6	Confident	115 Å²	115	43.8 Å²	43.8	62%	0.615	23%	0.231	S	C	*	.	H	α-helix	trans	-84.7	-32.9	-173.5	-72.6	-15.6	0	0	0	113.9	S598 I599	S598-N602 PolarHBondContact O-N 3.3Å; S598-N602 PolarHBondContact O-ND2 3.21Å; I599-N602 PolarHBondContact O-N 2.91Å
603	K	78.9	Confident	85.6	Confident	81 Å²	81	43.9 Å²	43.9	35%	0.352	23%	0.231	S	C	.	.	S	Bend	trans	-125	-87.4	-174.7	-71.1	-133.3	-168.5	-178.8	0	113.5	P489 D490 I599	P489-K603 HydrophobicContact CB-CD 4.03Å; P489-K603 HydrophobicContact CG-CD 3.77Å; P489-K603 HydrophobicContact CG-CG 4.35Å; D490-K603 IonicContact OD1-NZ 2.87Å; D490-K603 PolarHBondContact OD1-NZ 2.95Å; D490-K603 WeakPolarHBondContact OD2-CE 3.5Å; D490-K603 IonicContact OD2-NZ 3.54Å; D490-K603 PolarHBondContact OD2-NZ 2.85Å; I599-K603 PolarHBondContact O-N 3.27Å
604	T	82.1	Confident	85.4	Confident	62 Å²	62	41.6 Å²	41.6	38%	0.38	22%	0.219	S	C	.	.			trans	-144.6	149.4	-178	77.6	0	0	0	0	109.4	I606 D607 G608	T604-I606 PolarHBondContact O-N 2.84Å; T604-D607 PolarHBondContact O-N 3.03Å; T604-D607 WeakPolarHBondContact OG1-CB 3.39Å; T604-D607 PolarHBondContact OG1-N 2.82Å; T604-D607 VanDerWaalsContact OG1-N 3.16Å; T604-D607 PolarHBondContact OG1-OD2 3.09Å; T604-G608 PolarHBondContact O-N 3.14Å
605	Q	84.3	Confident	85.4	Confident	114 Å²	114	40 Å²	40	53%	0.533	20%	0.202	S	C	.	.	H	α-helix	trans	-64.4	-29.5	176.8	-170.9	164.4	3.1	0	0	112.4	Q609 Q703	Q605-Q609 WeakPolarHBondContact O-CG 3.23Å; Q605-Q609 PolarHBondContact O-N 2.71Å; Q605-Q703 VanDerWaalsContact NE2-CD 3.32Å
606	I	83.6	Confident	85.5	Confident	32 Å²	32	40 Å²	40	16%	0.164	20%	0.202	C	C	.	.	H	α-helix	trans	-65.2	-47.1	176.7	-57.8	-176.6	0	0	0	110.2	T604 G608 Q609 L610 F700	T604-I606 PolarHBondContact O-N 2.84Å; I606-G608 VanDerWaalsContact C-N 3.33Å; I606-G608 PolarHBondContact O-N 3.34Å; I606-Q609 PolarHBondContact O-N 3.42Å; I606-L610 HydrophobicContact CG2-CD1 3.71Å; I606-L610 HydrophobicContact CG2-CG 4.23Å; I606-L610 WeakPolarHBondContact O-CB 3.5Å; I606-L610 WeakPolarHBondContact O-CG 3.36Å; I606-L610 PolarHBondContact O-N 3.24Å; I606-F700 HydrophobicContact CG2-CE2 4.27Å
607	D	82.8	Confident	85.5	Confident	22 Å²	22	42.1 Å²	42.1	12%	0.118	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-36.9	-178.8	-66.8	-38.3	0	0	0	112.4	P489 I599 T604 F611 Y771	P489-D607 HydrophobicContact CG-CB 4.07Å; I599-D607 HydrophobicContact CG2-CB 4.23Å; T604-D607 PolarHBondContact O-N 3.03Å; T604-D607 WeakPolarHBondContact OG1-CB 3.39Å; T604-D607 PolarHBondContact OG1-N 2.82Å; T604-D607 VanDerWaalsContact OG1-N 3.16Å; T604-D607 PolarHBondContact OG1-OD2 3.09Å; D607-F611 WeakPolarHBondContact O-CB 3.42Å; D607-F611 PolarHBondContact O-N 3.05Å; D607-Y771 HydrophobicContact CB-CE2 4.5Å; D607-Y771 WeakPolarHBondContact CB-OH 3.22Å; D607-Y771 WeakPolarHBondContact OD1-CE2 3.31Å
608	G	85.5	Confident	85.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-45.5	175.3	0	0	0	0	0	112.7	S596 T604 I606 F611 L612	S596-G608 VanDerWaalsContact OG-C 3.3Å; S596-G608 PolarHBondContact OG-O 3.24Å; T604-G608 PolarHBondContact O-N 3.14Å; I606-G608 VanDerWaalsContact C-N 3.33Å; I606-G608 PolarHBondContact O-N 3.34Å; G608-F611 WeakPolarHBondContact O-CB 3.04Å; G608-F611 PolarHBondContact O-N 3.43Å; G608-L612 PolarHBondContact O-N 3.31Å
609	Q	86.8	Confident	85.4	Confident	15 Å²	15	36 Å²	36	7%	0.07	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-43.6	177.6	-70.8	-173	-39.2	0	0	112.8	Q605 I606 F611 L612 I613 F700 Q703	Q605-Q609 WeakPolarHBondContact O-CG 3.23Å; Q605-Q609 PolarHBondContact O-N 2.71Å; I606-Q609 PolarHBondContact O-N 3.42Å; Q609-F611 VanDerWaalsContact C-N 3.33Å; Q609-L612 PolarHBondContact O-N 2.93Å; Q609-I613 WeakPolarHBondContact O-CG1 3.29Å; Q609-I613 PolarHBondContact O-N 2.95Å; Q609-F700 HydrophobicContact CB-CD2 4Å; Q609-Q703 VanDerWaalsContact OE1-OE1 3.1Å
610	L	86.8	Confident	85.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-35.6	176.9	-68.7	177.6	0	0	0	111.9	I606 I613 K614 F700 M768 Y771	I606-L610 HydrophobicContact CG2-CD1 3.71Å; I606-L610 HydrophobicContact CG2-CG 4.23Å; I606-L610 WeakPolarHBondContact O-CB 3.5Å; I606-L610 WeakPolarHBondContact O-CG 3.36Å; I606-L610 PolarHBondContact O-N 3.24Å; L610-I613 PolarHBondContact O-N 3.49Å; L610-K614 VanDerWaalsContact O-CB 3.31Å; L610-K614 WeakPolarHBondContact O-CB 3.3Å; L610-K614 PolarHBondContact O-N 3.48Å; L610-F700 HydrophobicContact CD2-CD2 4.29Å; L610-F700 HydrophobicContact CD2-CE2 3.72Å; L610-F700 HydrophobicContact CD2-CZ 3.96Å; L610-F700 HydrophobicContact CG-CE2 3.98Å; L610-M768 HydrophobicContact CD1-CG 4.24Å; L610-M768 HydrophobicContact CD2-CG 4.01Å; L610-Y771 HydrophobicContact CB-CD1 3.89Å; L610-Y771 HydrophobicContact CB-CD2 4.04Å; L610-Y771 HydrophobicContact CB-CE1 4.43Å; L610-Y771 HydrophobicContact CB-CG 3.67Å; L610-Y771 HydrophobicContact CD1-CD2 4.07Å; L610-Y771 HydrophobicContact CD1-CG 4.37Å
611	F	88.1	Confident	85.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.9	-47.6	170.4	171.1	-91.5	0	0	0	111.5	Y488 Y555 L592 A595 I599 D607 G608 Q609 K614 H615 Y771	Y488-F611 AromaticContact CD1-CD2 3.6Å; Y488-F611 HydrophobicContact CD1-CD2 3.6Å; Y488-F611 HydrophobicContact CD1-CE2 4.15Å; Y488-F611 HydrophobicContact CD2-CD2 4.19Å; Y488-F611 AromaticContact CD2-CE2 3.89Å; Y488-F611 HydrophobicContact CD2-CE2 3.89Å; Y488-F611 AromaticContact CE1-CD2 3.96Å; Y488-F611 HydrophobicContact CE1-CD2 3.96Å; Y488-F611 HydrophobicContact CE1-CE2 4.42Å; Y488-F611 HydrophobicContact CE2-CE2 4.22Å; Y488-F611 AromaticContact CG-CD2 3.72Å; Y488-F611 HydrophobicContact CG-CD2 3.72Å; Y488-F611 AromaticContact CG-CE2 3.86Å; Y488-F611 HydrophobicContact CG-CE2 3.86Å; Y555-F611 HydrophobicContact CD2-CE2 4.37Å; Y555-F611 AromaticContact CD2-CZ 3.8Å; Y555-F611 HydrophobicContact CD2-CZ 3.8Å; Y555-F611 HydrophobicContact CE2-CZ 4.41Å; Y555-F611 AromaticContact CG-CZ 3.91Å; Y555-F611 HydrophobicContact CG-CZ 3.91Å; L592-F611 HydrophobicContact CD2-CE1 4.12Å; L592-F611 HydrophobicContact CD2-CZ 4.33Å; A595-F611 HydrophobicContact CB-CE1 3.87Å; A595-F611 HydrophobicContact CB-CZ 4.29Å; I599-F611 HydrophobicContact CD1-CB 4.17Å; I599-F611 HydrophobicContact CD1-CD1 3.72Å; I599-F611 HydrophobicContact CD1-CD2 3.71Å; I599-F611 HydrophobicContact CD1-CE1 3.99Å; I599-F611 HydrophobicContact CD1-CE2 3.95Å; I599-F611 HydrophobicContact CD1-CG 3.58Å; I599-F611 HydrophobicContact CD1-CZ 4.1Å; D607-F611 WeakPolarHBondContact O-CB 3.42Å; D607-F611 PolarHBondContact O-N 3.05Å; G608-F611 WeakPolarHBondContact O-CB 3.04Å; G608-F611 PolarHBondContact O-N 3.43Å; Q609-F611 VanDerWaalsContact C-N 3.33Å; F611-K614 PolarHBondContact O-N 2.84Å; F611-H615 AromaticContact CD2-CE1 3.35Å; F611-H615 WeakPolarHBondContact CD2-CE1 3.47Å; F611-H615 AromaticContact CD2-ND1 3.51Å; F611-H615 AromaticContact CE2-CE1 3.07Å; F611-H615 WeakPolarHBondContact CE2-CE1 3.31Å; F611-H615 AromaticContact CE2-ND1 3.42Å; F611-H615 WeakPolarHBondContact CE2-ND1 3.35Å; F611-H615 AromaticContact CE2-NE2 3.84Å; F611-H615 AromaticContact CG-ND1 3.89Å; F611-H615 AromaticContact CZ-CE1 3.7Å; F611-H615 AromaticContact CZ-ND1 3.71Å; F611-H615 PolarHBondContact O-N 2.89Å; F611-H615 VanDerWaalsContact O-N 3.1Å; F611-H615 PolarHBondContact O-ND1 3.19Å; F611-Y771 HydrophobicContact CB-CE1 3.98Å
612	L	89.4	Confident	85.2	Confident	12 Å²	12	40.1 Å²	40.1	6%	0.063	19%	0.194	C	C	.	.	H	α-helix	trans	-63.3	-47.8	179.4	-177.6	62.9	0	0	0	111.6	L592 L593 G608 Q609 K614 H615 L616 A696	L592-L612 HydrophobicContact CB-CD1 3.98Å; L593-L612 HydrophobicContact CD2-CD1 4.12Å; L593-L612 HydrophobicContact CD2-CD2 3.71Å; G608-L612 PolarHBondContact O-N 3.31Å; Q609-L612 PolarHBondContact O-N 2.93Å; L612-K614 VanDerWaalsContact C-N 3.34Å; L612-K614 PolarHBondContact O-N 3.41Å; L612-H615 PolarHBondContact O-N 3.2Å; L612-L616 HydrophobicContact CD1-CD1 3.89Å; L612-L616 HydrophobicContact CD1-CG 4.09Å; L612-L616 HydrophobicContact CG-CD1 3.86Å; L612-L616 HydrophobicContact CG-CG 4.41Å; L612-L616 WeakPolarHBondContact O-CB 3.34Å; L612-L616 VanDerWaalsContact O-CG 3.31Å; L612-L616 WeakPolarHBondContact O-CG 3.49Å; L612-L616 PolarHBondContact O-N 3.11Å; L612-A696 HydrophobicContact CD2-CB 3.83Å; L612-A696 HydrophobicContact CG-CB 4.25Å
613	I	89	Confident	85.2	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-45.7	178.5	-67.7	167.4	0	0	0	110.4	Q609 L610 H615 L616 L617 L693 A696 F700 L772 L781	Q609-I613 WeakPolarHBondContact O-CG1 3.29Å; Q609-I613 PolarHBondContact O-N 2.95Å; L610-I613 PolarHBondContact O-N 3.49Å; I613-H615 PolarHBondContact O-N 3.05Å; I613-L616 PolarHBondContact O-N 3.04Å; I613-L617 HydrophobicContact CG2-CD1 3.9Å; I613-L617 HydrophobicContact CG2-CG 4.42Å; I613-L617 WeakPolarHBondContact O-CB 3.4Å; I613-L617 VanDerWaalsContact O-CG 3.27Å; I613-L617 WeakPolarHBondContact O-CG 3.5Å; I613-L617 PolarHBondContact O-N 2.83Å; I613-L693 HydrophobicContact CG2-CD1 4.26Å; I613-A696 HydrophobicContact CG1-CB 4.11Å; I613-F700 HydrophobicContact CD1-CB 3.98Å; I613-F700 HydrophobicContact CD1-CG 4.2Å; I613-L772 HydrophobicContact CG2-CD2 4.18Å; I613-L781 HydrophobicContact CD1-CD1 4.27Å; I613-L781 HydrophobicContact CD1-CD2 4.43Å
614	K	86.9	Confident	85	Confident	14 Å²	14	32.1 Å²	32.1	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-58.2	-50.4	178.5	-173.9	-173.8	-173.4	-177.8	0	111.9	Y488 L610 F611 L612 L617 I618 Y771	Y488-K614 HydrophobicContact CE1-CD 4.24Å; Y488-K614 PolarHBondContact OH-NZ 3.13Å; Y488-K614 VanDerWaalsContact OH-NZ 3.1Å; L610-K614 VanDerWaalsContact O-CB 3.31Å; L610-K614 WeakPolarHBondContact O-CB 3.3Å; L610-K614 PolarHBondContact O-N 3.48Å; F611-K614 PolarHBondContact O-N 2.84Å; L612-K614 VanDerWaalsContact C-N 3.34Å; L612-K614 PolarHBondContact O-N 3.41Å; K614-L617 PolarHBondContact O-N 3.24Å; K614-I618 HydrophobicContact CG-CD1 4.14Å; K614-I618 WeakPolarHBondContact O-CG1 3.43Å; K614-I618 PolarHBondContact O-N 2.98Å; K614-Y771 HydrophobicContact CD-CD1 4.48Å; K614-Y771 VanDerWaalsContact CD-O 3.25Å; K614-Y771 WeakPolarHBondContact CD-O 3.43Å; K614-Y771 WeakPolarHBondContact CE-O 3.42Å
615	H	87.5	Confident	84.5	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-73.3	-31	-175.9	-70.8	84.6	0	0	0	113.1	Y488 Y555 V558 L592 F611 L612 I613 I618 L619	Y488-H615 AromaticContact CE1-CE1 3.84Å; Y488-H615 AromaticContact CE2-CE1 3.79Å; Y488-H615 AromaticContact CE2-NE2 3.94Å; Y488-H615 AromaticContact CZ-CE1 3.44Å; Y488-H615 VanDerWaalsContact CZ-CE1 3.44Å; Y488-H615 AromaticContact CZ-NE2 3.85Å; Y488-H615 PolarHBondContact OH-CE1 2.87Å; Y555-H615 PolarHBondContact N-NE2 3.04Å; V558-H615 HydrophobicContact CG2-CB 4.44Å; L592-H615 HydrophobicContact CD1-CB 4.04Å; L592-H615 HydrophobicContact CD2-CB 3.69Å; F611-H615 AromaticContact CD2-CE1 3.35Å; F611-H615 WeakPolarHBondContact CD2-CE1 3.47Å; F611-H615 AromaticContact CD2-ND1 3.51Å; F611-H615 AromaticContact CE2-CE1 3.07Å; F611-H615 WeakPolarHBondContact CE2-CE1 3.31Å; F611-H615 AromaticContact CE2-ND1 3.42Å; F611-H615 WeakPolarHBondContact CE2-ND1 3.35Å; F611-H615 AromaticContact CE2-NE2 3.84Å; F611-H615 AromaticContact CG-ND1 3.89Å; F611-H615 AromaticContact CZ-CE1 3.7Å; F611-H615 AromaticContact CZ-ND1 3.71Å; F611-H615 PolarHBondContact O-N 2.89Å; F611-H615 VanDerWaalsContact O-N 3.1Å; F611-H615 PolarHBondContact O-ND1 3.19Å; L612-H615 PolarHBondContact O-N 3.2Å; I613-H615 PolarHBondContact O-N 3.05Å; H615-I618 PolarHBondContact O-N 3.13Å; H615-L619 WeakPolarHBondContact O-CB 3.44Å; H615-L619 PolarHBondContact O-N 3.38Å
616	L	88.6	Confident	83.8	Confident	1 Å²	1	30 Å²	30	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-69.5	-35.5	171.6	-70.6	176.6	0	0	0	112.2	I589 L592 L612 I613 L619 R620 H692 L693 A696	I589-L616 HydrophobicContact CG1-CD2 4.25Å; L592-L616 HydrophobicContact CD1-CD2 4.22Å; L612-L616 HydrophobicContact CD1-CD1 3.89Å; L612-L616 HydrophobicContact CD1-CG 4.09Å; L612-L616 HydrophobicContact CG-CD1 3.86Å; L612-L616 HydrophobicContact CG-CG 4.41Å; L612-L616 WeakPolarHBondContact O-CB 3.34Å; L612-L616 VanDerWaalsContact O-CG 3.31Å; L612-L616 WeakPolarHBondContact O-CG 3.49Å; L612-L616 PolarHBondContact O-N 3.11Å; I613-L616 PolarHBondContact O-N 3.04Å; L616-L619 PolarHBondContact O-N 3.14Å; L616-R620 VanDerWaalsContact O-CB 3.27Å; L616-R620 WeakPolarHBondContact O-CB 3.4Å; L616-R620 PolarHBondContact O-N 3.31Å; L616-H692 HydrophobicContact CD1-CB 4.31Å; L616-L693 HydrophobicContact CB-CB 4.28Å; L616-L693 HydrophobicContact CB-CD1 3.92Å; L616-L693 HydrophobicContact CD1-CB 4.37Å; L616-A696 HydrophobicContact CD1-CB 4.4Å
617	L	86.3	Confident	82.5	Confident	56 Å²	56	32.5 Å²	32.5	29%	0.293	16%	0.164	S	C	.	.	H	α-helix	trans	-64.8	-44.5	172.2	-75	170.4	0	0	0	111.8	I613 K614 R620 E621 L693 L772	I613-L617 HydrophobicContact CG2-CD1 3.9Å; I613-L617 HydrophobicContact CG2-CG 4.42Å; I613-L617 WeakPolarHBondContact O-CB 3.4Å; I613-L617 VanDerWaalsContact O-CG 3.27Å; I613-L617 WeakPolarHBondContact O-CG 3.5Å; I613-L617 PolarHBondContact O-N 2.83Å; K614-L617 PolarHBondContact O-N 3.24Å; L617-R620 PolarHBondContact O-N 3.03Å; L617-E621 PolarHBondContact O-N 3.47Å; L617-L693 HydrophobicContact CD2-CD1 4.17Å; L617-L693 HydrophobicContact CD2-CD2 3.69Å; L617-L693 HydrophobicContact CG-CD1 4.01Å; L617-L693 HydrophobicContact CG-CD2 4.36Å; L617-L772 HydrophobicContact CD1-CD2 4.04Å
618	I	84.7	Confident	80.9	Confident	26 Å²	26	37 Å²	37	13%	0.133	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-48.9	174.7	-67.2	165.5	0	0	0	109.8	W554 K614 H615 R620 E621 Q622	W554-I618 HydrophobicContact CD2-CG2 4.33Å; W554-I618 HydrophobicContact CZ2-CG2 4.19Å; K614-I618 HydrophobicContact CG-CD1 4.14Å; K614-I618 WeakPolarHBondContact O-CG1 3.43Å; K614-I618 PolarHBondContact O-N 2.98Å; H615-I618 PolarHBondContact O-N 3.13Å; I618-R620 VanDerWaalsContact C-N 3.31Å; I618-R620 PolarHBondContact O-N 3.29Å; I618-E621 PolarHBondContact O-N 3.02Å; I618-Q622 HydrophobicContact CG2-CG 4.13Å; I618-Q622 WeakPolarHBondContact O-CB 3.5Å; I618-Q622 VanDerWaalsContact O-CG 3.23Å; I618-Q622 WeakPolarHBondContact O-CG 3.47Å; I618-Q622 PolarHBondContact O-N 3.34Å
619	L	85.8	Confident	79.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.9	-45.5	179	-172.6	63.4	0	0	0	111.1	L562 L585 I589 H615 L616 E621 Q622 I623 V689	L562-L619 HydrophobicContact CD2-CD1 4.16Å; L585-L619 HydrophobicContact CD2-CD1 3.76Å; L585-L619 HydrophobicContact CD2-CD2 4.1Å; L585-L619 HydrophobicContact CD2-CG 4.12Å; I589-L619 HydrophobicContact CG1-CD2 4.32Å; H615-L619 WeakPolarHBondContact O-CB 3.44Å; H615-L619 PolarHBondContact O-N 3.38Å; L616-L619 PolarHBondContact O-N 3.14Å; L619-E621 PolarHBondContact O-N 3.45Å; L619-Q622 PolarHBondContact O-N 2.91Å; L619-I623 HydrophobicContact CD1-CG2 4.33Å; L619-I623 WeakPolarHBondContact O-CG1 3.45Å; L619-I623 VanDerWaalsContact O-CG2 3.32Å; L619-I623 WeakPolarHBondContact O-CG2 3.41Å; L619-I623 PolarHBondContact O-N 3.46Å; L619-V689 HydrophobicContact CD2-CG1 4.47Å; L619-V689 HydrophobicContact CD2-CG2 4.06Å
620	R	85.4	Confident	78.1	Confident	93 Å²	93	36.9 Å²	36.9	35%	0.351	19%	0.192	S	C	.	.	H	α-helix	trans	-60	-42	177.7	-177.9	-174.6	-176.1	-100.3	0.6	113.3	L616 L617 I618 I623 V689 D690	L616-R620 VanDerWaalsContact O-CB 3.27Å; L616-R620 WeakPolarHBondContact O-CB 3.4Å; L616-R620 PolarHBondContact O-N 3.31Å; L617-R620 PolarHBondContact O-N 3.03Å; I618-R620 VanDerWaalsContact C-N 3.31Å; I618-R620 PolarHBondContact O-N 3.29Å; R620-I623 VanDerWaalsContact O-CG1 3.27Å; R620-I623 WeakPolarHBondContact O-CG1 3.17Å; R620-V689 HydrophobicContact CB-CG1 4.14Å; R620-D690 WeakPolarHBondContact CD-OD1 3.44Å; R620-D690 IonicContact CZ-OD1 2.78Å; R620-D690 IonicContact NE-OD1 3.33Å; R620-D690 PolarHBondContact NE-OD1 3.46Å
621	E	84.3	Confident	76.5	Confident	123 Å²	123	39.9 Å²	39.9	58%	0.575	21%	0.21	S	C	*	.	H	α-helix	trans	-70.2	-43.5	179.4	-169.8	63.6	-161.5	0	0	111.1	L617 I618 L619 I623 A624	L617-E621 PolarHBondContact O-N 3.47Å; I618-E621 PolarHBondContact O-N 3.02Å; L619-E621 PolarHBondContact O-N 3.45Å; E621-I623 VanDerWaalsContact C-N 3.32Å; E621-I623 PolarHBondContact O-N 3.34Å; E621-A624 WeakPolarHBondContact O-CB 3.46Å; E621-A624 PolarHBondContact O-N 2.99Å; E621-A624 VanDerWaalsContact O-N 3.09Å
622	Q	82.1	Confident	74.8	Confident	74 Å²	74	41 Å²	41	35%	0.346	22%	0.216	S	C	.	.	H	α-helix	trans	-73.4	-22.5	-176.8	-62.9	-61.5	-41.6	0	0	113.3	W554 L562 I618 L619 A624 P625 F626	W554-Q622 HydrophobicContact CH2-CG 3.9Å; W554-Q622 HydrophobicContact CZ2-CG 4.39Å; L562-Q622 HydrophobicContact CD1-CB 3.57Å; L562-Q622 HydrophobicContact CD1-CG 3.77Å; L562-Q622 HydrophobicContact CD2-CB 3.64Å; L562-Q622 HydrophobicContact CG-CB 4.27Å; I618-Q622 HydrophobicContact CG2-CG 4.13Å; I618-Q622 WeakPolarHBondContact O-CB 3.5Å; I618-Q622 VanDerWaalsContact O-CG 3.23Å; I618-Q622 WeakPolarHBondContact O-CG 3.47Å; I618-Q622 PolarHBondContact O-N 3.34Å; L619-Q622 PolarHBondContact O-N 2.91Å; Q622-A624 VanDerWaalsContact C-N 3.28Å; Q622-P625 WeakPolarHBondContact O-CD 3.34Å; Q622-F626 WeakPolarHBondContact O-CE2 3.43Å
623	I	80.4	Confident	73.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.8	171.2	67.7	177.5	0	0	0	113	L562 L585 L619 R620 E621 F626 F630 K686 V689	L562-I623 HydrophobicContact CD2-CG2 4.38Å; L585-I623 HydrophobicContact CD2-CG2 3.96Å; L619-I623 HydrophobicContact CD1-CG2 4.33Å; L619-I623 WeakPolarHBondContact O-CG1 3.45Å; L619-I623 VanDerWaalsContact O-CG2 3.32Å; L619-I623 WeakPolarHBondContact O-CG2 3.41Å; L619-I623 PolarHBondContact O-N 3.46Å; R620-I623 VanDerWaalsContact O-CG1 3.27Å; R620-I623 WeakPolarHBondContact O-CG1 3.17Å; E621-I623 VanDerWaalsContact C-N 3.32Å; E621-I623 PolarHBondContact O-N 3.34Å; I623-F626 PolarHBondContact O-N 3.23Å; I623-F630 HydrophobicContact CB-CE2 4.03Å; I623-K686 HydrophobicContact CD1-CB 4.25Å; I623-K686 HydrophobicContact CD1-CG 4.28Å; I623-V689 HydrophobicContact CD1-CB 4.46Å; I623-V689 HydrophobicContact CD1-CG2 4.19Å
624	A	75.4	Confident	71.5	Confident	28 Å²	28	51 Å²	51	23%	0.231	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-63.1	-39.3	-175.8	0	0	0	0	0	115.4	E621 Q622 F626 H627	E621-A624 WeakPolarHBondContact O-CB 3.46Å; E621-A624 PolarHBondContact O-N 2.99Å; E621-A624 VanDerWaalsContact O-N 3.09Å; Q622-A624 VanDerWaalsContact C-N 3.28Å; A624-F626 PolarHBondContact O-N 3.38Å; A624-F626 VanDerWaalsContact O-N 3.12Å; A624-H627 WeakPolarHBondContact CA-CE1 3.4Å; A624-H627 VanDerWaalsContact CA-NE2 3.35Å; A624-H627 WeakPolarHBondContact CA-NE2 3.36Å; A624-H627 WeakPolarHBondContact CB-NE2 3.49Å; A624-H627 WeakPolarHBondContact O-CB 3.29Å; A624-H627 PolarHBondContact O-CD2 3.13Å; A624-H627 PolarHBondContact O-N 2.9Å; A624-H627 PolarHBondContact O-ND1 3.07Å; A624-H627 PolarHBondContact O-NE2 3.33Å
625	P	71.6	Confident	70	Confident	103 Å²	103	56.5 Å²	56.5	67%	0.669	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-62.1	-19.8	177	-25.4	36.4	0	0	0	114.8	Q622	Q622-P625 WeakPolarHBondContact O-CD 3.34Å
626	F	68.6	Low	68.8	Low	30 Å²	30	58.6 Å²	58.6	13%	0.132	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-97.8	13.2	-174.5	-53.3	-75.8	0	0	0	113.5	Y569 Q622 I623 A624 T628 E629 F630	Y569-F626 HydrophobicContact CD1-CD1 4.43Å; Y569-F626 HydrophobicContact CD1-CE1 4.37Å; Y569-F626 AromaticContact CD2-CD1 3.68Å; Y569-F626 HydrophobicContact CD2-CD1 3.68Å; Y569-F626 HydrophobicContact CD2-CE1 4.23Å; Y569-F626 HydrophobicContact CE2-CD1 4.09Å; Y569-F626 AromaticContact CG-CD1 3.88Å; Y569-F626 HydrophobicContact CG-CD1 3.88Å; Y569-F626 AromaticContact CG-CE1 3.95Å; Y569-F626 HydrophobicContact CG-CE1 3.95Å; Q622-F626 WeakPolarHBondContact O-CE2 3.43Å; I623-F626 PolarHBondContact O-N 3.23Å; A624-F626 PolarHBondContact O-N 3.38Å; A624-F626 VanDerWaalsContact O-N 3.12Å; F626-T628 VanDerWaalsContact C-N 3.34Å; F626-T628 PolarHBondContact O-N 2.87Å; F626-T628 VanDerWaalsContact O-N 3.08Å; F626-E629 PolarHBondContact O-N 3.47Å; F626-F630 HydrophobicContact CB-CD2 4.17Å; F626-F630 HydrophobicContact CB-CE1 4.25Å; F626-F630 HydrophobicContact CB-CE2 3.24Å; F626-F630 HydrophobicContact CB-CZ 3.27Å; F626-F630 HydrophobicContact CD2-CE2 4.4Å; F626-F630 HydrophobicContact CD2-CZ 4.13Å; F626-F630 HydrophobicContact CG-CE2 4.22Å; F626-F630 AromaticContact CG-CZ 3.91Å; F626-F630 HydrophobicContact CG-CZ 3.91Å
627	H	55.9	Low	67.6	Low	83 Å²	83	62.8 Å²	62.8	38%	0.384	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-54.5	-29.3	-165.1	-85.6	-26.6	0	0	0	118.3	A624 E629 K686	A624-H627 WeakPolarHBondContact CA-CE1 3.4Å; A624-H627 VanDerWaalsContact CA-NE2 3.35Å; A624-H627 WeakPolarHBondContact CA-NE2 3.36Å; A624-H627 WeakPolarHBondContact CB-NE2 3.49Å; A624-H627 WeakPolarHBondContact O-CB 3.29Å; A624-H627 PolarHBondContact O-CD2 3.13Å; A624-H627 PolarHBondContact O-N 2.9Å; A624-H627 PolarHBondContact O-ND1 3.07Å; A624-H627 PolarHBondContact O-NE2 3.33Å; H627-E629 VanDerWaalsContact C-N 3.26Å; H627-E629 PolarHBondContact O-N 3.3Å; H627-K686 VanDerWaalsContact CE1-CD 3.47Å; H627-K686 WeakPolarHBondContact CE1-CD 3.29Å; H627-K686 VanDerWaalsContact CE1-CE 3.4Å; H627-K686 WeakPolarHBondContact CE1-CE 3.17Å; H627-K686 PolarHBondContact CE1-NZ 2.71Å; H627-K686 PolarHBondContact NE2-NZ 2.95Å; H627-K686 VanDerWaalsContact NE2-NZ 3.13Å
628	T	50.9	Low	66.8	Low	116 Å²	116	61.2 Å²	61.2	71%	0.712	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-78.5	-8.8	-176.1	40.4	0	0	0	0	113.8	F626	F626-T628 VanDerWaalsContact C-N 3.34Å; F626-T628 PolarHBondContact O-N 2.87Å; F626-T628 VanDerWaalsContact O-N 3.08Å
629	E	54	Low	66.4	Low	14 Å²	14	64.7 Å²	64.7	7%	0.065	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-129.1	21.4	-163.5	-58.6	-172.7	174.3	0	0	113.8	Y569 R574 F577 Q578 F626 H627	Y569-E629 WeakPolarHBondContact CE2-OE2 3.38Å; R574-E629 IonicContact CZ-OE1 2.91Å; R574-E629 IonicContact NE-OE1 3.74Å; R574-E629 PolarHBondContact NE-OE1 3.33Å; R574-E629 IonicContact NH2-OE1 2.72Å; R574-E629 PolarHBondContact NH2-OE1 3Å; F577-E629 HydrophobicContact CD1-CB 4.42Å; Q578-E629 WeakPolarHBondContact CG-O 3.49Å; F626-E629 PolarHBondContact O-N 3.47Å; H627-E629 VanDerWaalsContact C-N 3.26Å; H627-E629 PolarHBondContact O-N 3.3Å
630	F	57.8	Low	66	Low	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.363	C	S	.	.			trans	-112.1	8.2	177	-65.5	-48.6	0	0	0	115.4	F577 S581 I623 F626	F577-F630 HydrophobicContact CE1-CD1 4.09Å; F577-F630 AromaticContact CE1-CE1 3.53Å; F577-F630 HydrophobicContact CE1-CE1 3.53Å; F577-F630 HydrophobicContact CE1-CZ 4.31Å; F577-F630 AromaticContact CZ-CE1 3.79Å; F577-F630 HydrophobicContact CZ-CE1 3.79Å; F577-F630 HydrophobicContact CZ-CZ 4.34Å; S581-F630 WeakPolarHBondContact OG-CD1 3.46Å; S581-F630 WeakPolarHBondContact OG-CE1 3.18Å; I623-F630 HydrophobicContact CB-CE2 4.03Å; F626-F630 HydrophobicContact CB-CD2 4.17Å; F626-F630 HydrophobicContact CB-CE1 4.25Å; F626-F630 HydrophobicContact CB-CE2 3.24Å; F626-F630 HydrophobicContact CB-CZ 3.27Å; F626-F630 HydrophobicContact CD2-CE2 4.4Å; F626-F630 HydrophobicContact CD2-CZ 4.13Å; F626-F630 HydrophobicContact CG-CE2 4.22Å; F626-F630 AromaticContact CG-CZ 3.91Å; F626-F630 HydrophobicContact CG-CZ 3.91Å
631	T	53	Low	65.4	Low	63 Å²	63	71.4 Å²	71.4	39%	0.387	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	105	178.6	52.7	0	0	0	0	110.4	Q578 D684	Q578-T631 PolarHBondContact NE2-O 2.87Å; Q578-T631 PolarHBondContact OE1-O 2.63Å; T631-D684 HydrophobicContact CG2-CB 4.35Å
632	I	54	Low	65.1	Low	22 Å²	22	67 Å²	67	11%	0.113	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	138.2	175.6	-64.5	157.8	0	0	0	109.5	Q578 Q582 E634 L683	Q578-I632 HydrophobicContact CB-CD1 4.22Å; Q578-I632 HydrophobicContact CB-CG1 3.6Å; Q578-I632 HydrophobicContact CG-CG1 4.28Å; Q578-I632 WeakPolarHBondContact O-CD1 3.25Å; Q582-I632 HydrophobicContact CB-CD1 3.71Å; Q582-I632 HydrophobicContact CG-CD1 4.29Å; I632-E634 HydrophobicContact CG2-CG 3.97Å; I632-E634 PolarHBondContact O-N 2.85Å; I632-L683 PolarHBondContact N-O 3.3Å; I632-L683 VanDerWaalsContact N-O 3.13Å; I632-L683 PolarHBondContact O-N 3.46Å
633	K	53.9	Low	65	Low	141 Å²	141	70.1 Å²	70.1	61%	0.613	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	94	168.3	-66	-176.6	179	-174.4	0	108.8	Y682	K633-Y682 HydrophobicContact CD-CE1 4.29Å; K633-Y682 HydrophobicContact CG-CD1 4.26Å; K633-Y682 HydrophobicContact CG-CE1 3.8Å
634	E	54.1	Low	64.7	Low	84 Å²	84	73.7 Å²	73.7	39%	0.393	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	119.7	166.5	-74.5	-175.3	-176.3	0	0	109.1	Q582 I632 S636 H681	Q582-E634 PolarHBondContact NE2-OE1 2.95Å; I632-E634 HydrophobicContact CG2-CG 3.97Å; I632-E634 PolarHBondContact O-N 2.85Å; E634-S636 PolarHBondContact O-N 2.95Å; E634-H681 PolarHBondContact N-O 2.89Å; E634-H681 PolarHBondContact O-N 2.85Å
635	I	56.4	Low	64.6	Low	129 Å²	129	72.6 Å²	72.6	66%	0.662	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	95.1	173	-57	178	0	0	0	106.6	I678	I635-I678 HydrophobicContact CG2-CG2 3.35Å
636	S	60.7	Low	64.8	Low	45 Å²	45	69.5 Å²	69.5	32%	0.315	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	144.6	174.6	79.3	0	0	0	0	110.7	E634 R679 H681	E634-S636 PolarHBondContact O-N 2.95Å; S636-R679 PolarHBondContact N-O 2.89Å; S636-R679 PolarHBondContact O-N 3.31Å; S636-R679 VanDerWaalsContact O-N 3.09Å; S636-H681 PolarHBondContact OG-CD2 3.33Å
637	L	63.8	Low	65.1	Low	89 Å²	89	74.1 Å²	74.1	47%	0.466	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	100.5	-175.6	-159.5	56.1	0	0	0	106.6	L639 P676 I678	L637-L639 HydrophobicContact CD2-CD2 3.41Å; L637-L639 VanDerWaalsContact CD2-CD2 3.41Å; L637-L639 HydrophobicContact CD2-CG 3.8Å; L637-L639 PolarHBondContact O-N 3.48Å; L637-P676 HydrophobicContact CD1-CB 3.71Å; L637-P676 HydrophobicContact CD1-CG 4.01Å; L637-P676 HydrophobicContact CD2-CB 3.17Å; L637-P676 HydrophobicContact CD2-CG 3.9Å; L637-P676 HydrophobicContact CG-CB 4.01Å; L637-I678 HydrophobicContact CD1-CG1 4.34Å
638	D	69.1	Low	65.7	Low	22 Å²	22	74.8 Å²	74.8	12%	0.118	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	94	-175.8	-169.3	-2.7	0	0	0	110.2	K640 E677 R679	D638-K640 PolarHBondContact O-N 3.22Å; D638-K640 VanDerWaalsContact OD1-CB 3.25Å; D638-K640 WeakPolarHBondContact OD1-CB 3.27Å; D638-K640 WeakPolarHBondContact OD1-CD 3.36Å; D638-K640 WeakPolarHBondContact OD1-CG 3.36Å; D638-K640 PolarHBondContact OD1-N 3.37Å; D638-K640 VanDerWaalsContact OD1-N 3.11Å; D638-E677 PolarHBondContact N-O 2.88Å; D638-R679 HydrophobicContact CB-CB 4.44Å; D638-R679 HydrophobicContact CB-CG 4.22Å; D638-R679 WeakPolarHBondContact OD2-CD 3.26Å; D638-R679 IonicContact OD2-CZ 3.05Å; D638-R679 IonicContact OD2-NE 2.69Å; D638-R679 IonicContact OD2-NH1 3.04Å; D638-R679 PolarHBondContact OD2-NH1 3.11Å
639	L	77	Confident	66.7	Low	100 Å²	100	71.1 Å²	71.1	52%	0.524	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	2	179.1	-68.2	173.1	0	0	0	113.5	L637 K641 T642 R643 P676	L637-L639 HydrophobicContact CD2-CD2 3.41Å; L637-L639 VanDerWaalsContact CD2-CD2 3.41Å; L637-L639 HydrophobicContact CD2-CG 3.8Å; L637-L639 PolarHBondContact O-N 3.48Å; L639-K641 VanDerWaalsContact C-N 3.33Å; L639-K641 PolarHBondContact O-N 3.49Å; L639-T642 PolarHBondContact O-N 3.09Å; L639-R643 WeakPolarHBondContact O-CB 3.41Å; L639-R643 PolarHBondContact O-N 2.9Å; L639-P676 HydrophobicContact CD2-CB 4.37Å
640	K	77.1	Confident	67.4	Low	130 Å²	130	77 Å²	77	57%	0.565	38%	0.38	S	S	*	.	H	α-helix	trans	-60.2	-43	-179.1	-72.9	172.8	-174.2	172.9	0	112	D638 R643 D644	D638-K640 PolarHBondContact O-N 3.22Å; D638-K640 VanDerWaalsContact OD1-CB 3.25Å; D638-K640 WeakPolarHBondContact OD1-CB 3.27Å; D638-K640 WeakPolarHBondContact OD1-CD 3.36Å; D638-K640 WeakPolarHBondContact OD1-CG 3.36Å; D638-K640 PolarHBondContact OD1-N 3.37Å; D638-K640 VanDerWaalsContact OD1-N 3.11Å; K640-R643 PolarHBondContact O-N 3.3Å; K640-D644 VanDerWaalsContact O-CB 3.31Å; K640-D644 WeakPolarHBondContact O-CB 3.44Å; K640-D644 PolarHBondContact O-N 2.85Å
641	K	73.4	Confident	68	Low	103 Å²	103	81.5 Å²	81.5	45%	0.448	40%	0.403	S	S	.	.	H	α-helix	trans	-66	-44.3	176.7	-71.8	-175.1	170.9	-178.9	0	112.2	L639 R643 D644 A645 E677	L639-K641 VanDerWaalsContact C-N 3.33Å; L639-K641 PolarHBondContact O-N 3.49Å; K641-R643 VanDerWaalsContact C-N 3.32Å; K641-R643 PolarHBondContact O-N 3.11Å; K641-D644 PolarHBondContact O-N 3.43Å; K641-A645 WeakPolarHBondContact O-CB 3.47Å; K641-A645 PolarHBondContact O-N 3.18Å; K641-E677 WeakPolarHBondContact CE-OE2 3.07Å; K641-E677 IonicContact NZ-OE2 2.72Å; K641-E677 PolarHBondContact NZ-OE2 3.13Å
642	T	78.7	Confident	68.3	Low	30 Å²	30	83.2 Å²	83.2	18%	0.184	42%	0.416	C	S	.	.	H	α-helix	trans	-61.2	-41.7	174.6	-46.8	0	0	0	0	111.7	L639 A646 F670 G674	L639-T642 PolarHBondContact O-N 3.09Å; T642-A646 WeakPolarHBondContact O-CB 3.4Å; T642-A646 PolarHBondContact O-N 2.84Å; T642-F670 HydrophobicContact CG2-CE2 4.32Å; T642-F670 HydrophobicContact CG2-CZ 4.47Å; T642-G674 WeakPolarHBondContact CG2-O 3.44Å; T642-G674 PolarHBondContact OG1-O 2.91Å
643	R	78.2	Confident	68.6	Low	140 Å²	140	90 Å²	90	53%	0.528	45%	0.449	S	S	.	.	H	α-helix	trans	-65.4	-47.4	176.8	-171.7	-162.3	68.9	152	3.1	110.8	L639 K640 K641 A646 F647	L639-R643 WeakPolarHBondContact O-CB 3.41Å; L639-R643 PolarHBondContact O-N 2.9Å; K640-R643 PolarHBondContact O-N 3.3Å; K641-R643 VanDerWaalsContact C-N 3.32Å; K641-R643 PolarHBondContact O-N 3.11Å; R643-A646 PolarHBondContact O-N 2.88Å; R643-F647 HydrophobicContact CG-CD2 3.81Å; R643-F647 HydrophobicContact CG-CE2 3.75Å; R643-F647 VanDerWaalsContact O-CD2 3.24Å; R643-F647 WeakPolarHBondContact O-CD2 3.48Å; R643-F647 PolarHBondContact O-N 2.95Å
644	D	76	Confident	68.7	Low	75 Å²	75	85.2 Å²	85.2	40%	0.401	43%	0.432	S	S	.	.	H	α-helix	trans	-68.7	-37.7	-179.1	-64.4	-12.1	0	0	0	111.1	K640 K641 F647 K648	K640-D644 VanDerWaalsContact O-CB 3.31Å; K640-D644 WeakPolarHBondContact O-CB 3.44Å; K640-D644 PolarHBondContact O-N 2.85Å; K641-D644 PolarHBondContact O-N 3.43Å; D644-F647 PolarHBondContact O-N 3.32Å; D644-K648 WeakPolarHBondContact O-CG 3.39Å; D644-K648 PolarHBondContact O-N 2.92Å
645	A	72.6	Confident	68.9	Low	6 Å²	6	85.1 Å²	85.1	5%	0.05	44%	0.437	C	S	.	.	H	α-helix	trans	-66.7	-37.1	171.7	0	0	0	0	0	112.4	K641 K648 I649 F670	K641-A645 WeakPolarHBondContact O-CB 3.47Å; K641-A645 PolarHBondContact O-N 3.18Å; A645-K648 WeakPolarHBondContact O-CB 3.47Å; A645-K648 PolarHBondContact O-N 3.44Å; A645-I649 PolarHBondContact O-N 2.89Å; A645-F670 HydrophobicContact CB-CD2 3.72Å; A645-F670 HydrophobicContact CB-CE2 4.4Å
646	A	74.7	Confident	69	Low	37 Å²	37	83.2 Å²	83.2	31%	0.306	43%	0.433	S	S	.	.	H	α-helix	trans	-68.1	-40.3	172.4	0	0	0	0	0	112.1	T642 R643 K648 I649 L650 F670	T642-A646 WeakPolarHBondContact O-CB 3.4Å; T642-A646 PolarHBondContact O-N 2.84Å; R643-A646 PolarHBondContact O-N 2.88Å; A646-K648 VanDerWaalsContact C-N 3.34Å; A646-I649 WeakPolarHBondContact O-CB 3.35Å; A646-I649 PolarHBondContact O-N 2.89Å; A646-I649 VanDerWaalsContact O-N 3.14Å; A646-L650 PolarHBondContact O-N 3.3Å; A646-F670 HydrophobicContact CB-CE2 4.02Å
647	F	75.1	Confident	68.9	Low	128 Å²	128	87.7 Å²	87.7	56%	0.561	44%	0.443	S	S	*	.	H	α-helix	trans	-65.7	-35.4	173.6	-90.7	-73	0	0	0	112.1	R643 D644 I649 L650 N651	R643-F647 HydrophobicContact CG-CD2 3.81Å; R643-F647 HydrophobicContact CG-CE2 3.75Å; R643-F647 VanDerWaalsContact O-CD2 3.24Å; R643-F647 WeakPolarHBondContact O-CD2 3.48Å; R643-F647 PolarHBondContact O-N 2.95Å; D644-F647 PolarHBondContact O-N 3.32Å; F647-I649 VanDerWaalsContact C-N 3.25Å; F647-I649 PolarHBondContact O-N 2.92Å; F647-L650 PolarHBondContact O-N 3.45Å; F647-N651 PolarHBondContact O-N 3.31Å
648	K	70.1	Confident	68.6	Low	97 Å²	97	86.2 Å²	86.2	42%	0.422	43%	0.433	S	S	.	.	H	α-helix	trans	-61.5	-32	171	-77.1	177.3	-179.5	-177.8	0	112.3	D644 A645 A646 T654 E669 E673	D644-K648 WeakPolarHBondContact O-CG 3.39Å; D644-K648 PolarHBondContact O-N 2.92Å; A645-K648 WeakPolarHBondContact O-CB 3.47Å; A645-K648 PolarHBondContact O-N 3.44Å; A646-K648 VanDerWaalsContact C-N 3.34Å; K648-T654 WeakPolarHBondContact O-CB 3.5Å; K648-T654 PolarHBondContact O-OG1 3.49Å; K648-E669 IonicContact NZ-OE1 3.49Å; K648-E669 PolarHBondContact NZ-OE1 3.41Å; K648-E673 IonicContact NZ-OE2 3.07Å; K648-E673 PolarHBondContact NZ-OE2 3.32Å
649	I	71.3	Confident	68.2	Low	39 Å²	39	93.6 Å²	93.6	20%	0.2	46%	0.464	C	S	.	.	H	α-helix	trans	-73.7	-39.5	172.3	-73.6	169.1	0	0	0	111.6	A645 A646 F647 N651 F658 F670	A645-I649 PolarHBondContact O-N 2.89Å; A646-I649 WeakPolarHBondContact O-CB 3.35Å; A646-I649 PolarHBondContact O-N 2.89Å; A646-I649 VanDerWaalsContact O-N 3.14Å; F647-I649 VanDerWaalsContact C-N 3.25Å; F647-I649 PolarHBondContact O-N 2.92Å; I649-N651 VanDerWaalsContact C-N 3.32Å; I649-N651 PolarHBondContact O-N 2.81Å; I649-F658 HydrophobicContact CG2-CD2 4.32Å; I649-F658 HydrophobicContact CG2-CE2 3.67Å; I649-F670 HydrophobicContact CD1-CB 3.43Å; I649-F670 VanDerWaalsContact CD1-CB 3.43Å; I649-F670 HydrophobicContact CD1-CD1 4.13Å; I649-F670 HydrophobicContact CD1-CD2 3.69Å; I649-F670 HydrophobicContact CD1-CE2 4.5Å; I649-F670 HydrophobicContact CD1-CG 3.47Å; I649-F670 VanDerWaalsContact CD1-CG 3.47Å; I649-F670 HydrophobicContact CG1-CB 4.43Å
650	L	68.7	Low	67.5	Low	138 Å²	138	96 Å²	96	72%	0.723	47%	0.466	S	S	*	.	H	α-helix	trans	-78.8	-12.8	-174.7	-127.4	110.7	0	0	0	114.1	A646 F647	A646-L650 PolarHBondContact O-N 3.3Å; F647-L650 PolarHBondContact O-N 3.45Å
651	N	71.2	Confident	66.5	Low	93 Å²	93	98.7 Å²	98.7	50%	0.497	49%	0.486	S	S	.	.	S	Bend	trans	-73.3	124.8	-178.9	-142.6	-5.9	0	0	0	110.3	F647 I649 M653 T654	F647-N651 PolarHBondContact O-N 3.31Å; I649-N651 VanDerWaalsContact C-N 3.32Å; I649-N651 PolarHBondContact O-N 2.81Å; N651-M653 PolarHBondContact O-N 3.38Å; N651-T654 PolarHBondContact O-N 3.25Å; N651-T654 VanDerWaalsContact O-N 3.1Å; N651-T654 PolarHBondContact O-OG1 2.97Å
652	P	59	Low	65.9	Low	100 Å²	100	98.9 Å²	98.9	65%	0.649	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-14.8	-171.9	19.8	-32.2	0	0	0	115.2
653	M	59	Low	65.1	Low	163 Å²	163	102.1 Å²	102.1	80%	0.803	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-19.4	178	-69.8	-83.8	116.1	0	0	114	N651	N651-M653 PolarHBondContact O-N 3.38Å
654	T	57.2	Low	64.2	Low	41 Å²	41	101 Å²	101	25%	0.252	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-12.3	-173.9	48.3	0	0	0	0	113.8	K648 N651 R657	K648-T654 WeakPolarHBondContact O-CB 3.5Å; K648-T654 PolarHBondContact O-OG1 3.49Å; N651-T654 PolarHBondContact O-N 3.25Å; N651-T654 VanDerWaalsContact O-N 3.1Å; N651-T654 PolarHBondContact O-OG1 2.97Å; T654-R657 WeakPolarHBondContact O-CB 3.47Å; T654-R657 PolarHBondContact O-N 3.14Å
655	V	57.9	Low	63.8	Low	82 Å²	82	98.3 Å²	98.3	50%	0.497	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-49.1	-40.1	174.1	-172.6	0	0	0	0	114.2	R657 F658	V655-R657 PolarHBondContact O-N 3.22Å; V655-F658 VanDerWaalsContact O-CB 3.29Å; V655-F658 WeakPolarHBondContact O-CB 3.25Å; V655-F658 PolarHBondContact O-N 3.34Å; V655-F658 VanDerWaalsContact O-N 3.14Å
656	P	59.2	Low	63.4	Low	90 Å²	90	98.7 Å²	98.7	58%	0.584	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-69.1	-2.4	177.6	24.7	-32.6	0	0	0	114.9	R660	P656-R660 PolarHBondContact O-NE 2.85Å
657	R	58.4	Low	63	Low	139 Å²	139	99.7 Å²	99.7	53%	0.525	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-101	-1.9	174.2	-63.5	-176.6	179.6	176.4	-0.3	113.8	T654 V655 F659 R660 N665	T654-R657 WeakPolarHBondContact O-CB 3.47Å; T654-R657 PolarHBondContact O-N 3.14Å; V655-R657 PolarHBondContact O-N 3.22Å; R657-F659 VanDerWaalsContact C-N 3.32Å; R657-F659 PolarHBondContact O-N 2.87Å; R657-R660 PolarHBondContact O-N 3.36Å; R657-N665 PolarHBondContact O-OD1 3.31Å
658	F	57.8	Low	62.8	Low	58 Å²	58	97.5 Å²	97.5	25%	0.254	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-30	-172.9	-157.6	-98.5	0	0	0	114.2	I649 V655 N665 L667	I649-F658 HydrophobicContact CG2-CD2 4.32Å; I649-F658 HydrophobicContact CG2-CE2 3.67Å; V655-F658 VanDerWaalsContact O-CB 3.29Å; V655-F658 WeakPolarHBondContact O-CB 3.25Å; V655-F658 PolarHBondContact O-N 3.34Å; V655-F658 VanDerWaalsContact O-N 3.14Å; F658-N665 PolarHBondContact O-OD1 3.06Å; F658-N665 VanDerWaalsContact O-OD1 3.13Å; F658-L667 HydrophobicContact CD1-CD1 3.77Å; F658-L667 HydrophobicContact CD1-CG 4.47Å; F658-L667 HydrophobicContact CD2-CD1 4.43Å; F658-L667 HydrophobicContact CD2-CG 4.28Å; F658-L667 HydrophobicContact CE1-CD1 3.45Å; F658-L667 VanDerWaalsContact CE1-CD1 3.45Å; F658-L667 HydrophobicContact CE1-CG 4.07Å; F658-L667 HydrophobicContact CE2-CD1 4.13Å; F658-L667 HydrophobicContact CE2-CD2 4.31Å; F658-L667 HydrophobicContact CE2-CG 3.83Å; F658-L667 HydrophobicContact CG-CD1 4.27Å; F658-L667 HydrophobicContact CZ-CD1 3.65Å; F658-L667 HydrophobicContact CZ-CD2 3.99Å; F658-L667 HydrophobicContact CZ-CG 3.73Å
659	F	60.5	Low	62.8	Low	176 Å²	176	96.5 Å²	96.5	77%	0.772	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	14.2	-176.9	-62.5	-72.5	0	0	0	114.1	R657 L661	R657-F659 VanDerWaalsContact C-N 3.32Å; R657-F659 PolarHBondContact O-N 2.87Å; F659-L661 PolarHBondContact O-N 3.46Å
660	R	60.8	Low	62.8	Low	152 Å²	152	97.6 Å²	97.6	57%	0.574	50%	0.502	S	S	*	.			trans	-81.5	118.4	177.7	-68.9	-173.3	-176.5	-171.2	-3	109.8	P656 R657 N662 N665	P656-R660 PolarHBondContact O-NE 2.85Å; R657-R660 PolarHBondContact O-N 3.36Å; R660-N662 PolarHBondContact O-N 3.08Å; R660-N665 WeakPolarHBondContact O-CB 3.4Å; R660-N665 PolarHBondContact O-ND2 3.47Å
661	L	56.7	Low	62.9	Low	186 Å²	186	97 Å²	97	97%	0.974	50%	0.499	S	S	*	.			trans	-71.8	29.5	176.6	-77.3	154.4	0	0	0	114.1	F659	F659-L661 PolarHBondContact O-N 3.46Å
662	N	61.4	Low	62.9	Low	106 Å²	106	98.6 Å²	98.6	57%	0.567	51%	0.507	S	S	*	.	S	Bend	trans	-108	159.8	176.8	-165.3	-12.1	0	0	0	109.4	R660 N664 N665	R660-N662 PolarHBondContact O-N 3.08Å; N662-N664 PolarHBondContact O-N 3.43Å; N662-N665 PolarHBondContact O-N 3.09Å
663	S	60.7	Low	63.3	Low	99 Å²	99	98.6 Å²	98.6	69%	0.692	50%	0.498	S	S	*	.	S	Bend	trans	-48.4	-13.8	177.4	52.8	0	0	0	0	116.2
664	N	59.6	Low	63.5	Low	117 Å²	117	91.2 Å²	91.2	63%	0.626	46%	0.464	S	S	*	.			trans	-103.9	44.1	176.2	-63.9	-20.3	0	0	0	112.5	N662	N662-N664 PolarHBondContact O-N 3.43Å
665	N	67.3	Low	64.2	Low	17 Å²	17	93.3 Å²	93.3	9%	0.091	48%	0.477	C	S	.	.			trans	-90.6	123.8	176.1	-169.7	-10.3	0	0	0	110.4	R657 F658 R660 N662 L667 I668 E669	R657-N665 PolarHBondContact O-OD1 3.31Å; F658-N665 PolarHBondContact O-OD1 3.06Å; F658-N665 VanDerWaalsContact O-OD1 3.13Å; R660-N665 WeakPolarHBondContact O-CB 3.4Å; R660-N665 PolarHBondContact O-ND2 3.47Å; N662-N665 PolarHBondContact O-N 3.09Å; N665-L667 PolarHBondContact O-N 2.63Å; N665-L667 PolarHBondContact OD1-N 3.45Å; N665-L667 VanDerWaalsContact OD1-N 3.12Å; N665-I668 HydrophobicContact CB-CB 4.18Å; N665-I668 HydrophobicContact CB-CD1 3.96Å; N665-I668 HydrophobicContact CB-CG1 3.99Å; N665-I668 PolarHBondContact O-N 2.83Å; N665-E669 PolarHBondContact O-N 3.25Å
666	A	64.3	Low	64.7	Low	14 Å²	14	92.3 Å²	92.3	12%	0.116	47%	0.472	C	S	.	.	H	α-helix	trans	-60.6	-26.3	178.9	0	0	0	0	0	113.3	F670	A666-F670 WeakPolarHBondContact O-CB 3.35Å; A666-F670 PolarHBondContact O-N 3.02Å
667	L	67.8	Low	65.2	Low	59 Å²	59	91.1 Å²	91.1	31%	0.309	46%	0.459	S	S	.	.	H	α-helix	trans	-72.4	-38.9	173.6	-96.7	167.3	0	0	0	112.7	F658 N665 F670 L671	F658-L667 HydrophobicContact CD1-CD1 3.77Å; F658-L667 HydrophobicContact CD1-CG 4.47Å; F658-L667 HydrophobicContact CD2-CD1 4.43Å; F658-L667 HydrophobicContact CD2-CG 4.28Å; F658-L667 HydrophobicContact CE1-CD1 3.45Å; F658-L667 VanDerWaalsContact CE1-CD1 3.45Å; F658-L667 HydrophobicContact CE1-CG 4.07Å; F658-L667 HydrophobicContact CE2-CD1 4.13Å; F658-L667 HydrophobicContact CE2-CD2 4.31Å; F658-L667 HydrophobicContact CE2-CG 3.83Å; F658-L667 HydrophobicContact CG-CD1 4.27Å; F658-L667 HydrophobicContact CZ-CD1 3.65Å; F658-L667 HydrophobicContact CZ-CD2 3.99Å; F658-L667 HydrophobicContact CZ-CG 3.73Å; N665-L667 PolarHBondContact O-N 2.63Å; N665-L667 PolarHBondContact OD1-N 3.45Å; N665-L667 VanDerWaalsContact OD1-N 3.12Å; L667-F670 PolarHBondContact O-N 3.27Å; L667-L671 PolarHBondContact O-N 3.32Å
668	I	70.9	Confident	65.5	Low	81 Å²	81	89.9 Å²	89.9	42%	0.415	46%	0.461	S	S	.	.	H	α-helix	trans	-73	-40.2	176.9	-62.4	176.7	0	0	0	109.2	N665 F670 L671 L672	N665-I668 HydrophobicContact CB-CB 4.18Å; N665-I668 HydrophobicContact CB-CD1 3.96Å; N665-I668 HydrophobicContact CB-CG1 3.99Å; N665-I668 PolarHBondContact O-N 2.83Å; I668-F670 VanDerWaalsContact C-N 3.32Å; I668-F670 PolarHBondContact O-N 3.02Å; I668-L671 PolarHBondContact O-N 2.95Å; I668-L672 HydrophobicContact CG2-CD1 3.53Å; I668-L672 WeakPolarHBondContact O-CB 3.4Å; I668-L672 WeakPolarHBondContact O-CD1 3.46Å; I668-L672 PolarHBondContact O-N 3.5Å
669	E	68.3	Low	65.5	Low	76 Å²	76	92 Å²	92	36%	0.355	47%	0.468	S	S	.	.	H	α-helix	trans	-60.5	-39.1	172.1	-166.7	-178.9	155	0	0	111.3	K648 N665 E673	K648-E669 IonicContact NZ-OE1 3.49Å; K648-E669 PolarHBondContact NZ-OE1 3.41Å; N665-E669 PolarHBondContact O-N 3.25Å; E669-E673 HydrophobicContact CG-CG 4.08Å; E669-E673 WeakPolarHBondContact O-CA 3.45Å; E669-E673 WeakPolarHBondContact O-CB 3.39Å; E669-E673 WeakPolarHBondContact O-CG 3.29Å; E669-E673 PolarHBondContact O-N 2.67Å
670	F	72.6	Confident	65.2	Low	63 Å²	63	88.9 Å²	88.9	28%	0.276	46%	0.456	S	S	.	.	H	α-helix	trans	-69.7	-37.8	173.3	177	-97.1	0	0	0	113.7	T642 A645 A646 I649 A666 L667 I668 L672 G674	T642-F670 HydrophobicContact CG2-CE2 4.32Å; T642-F670 HydrophobicContact CG2-CZ 4.47Å; A645-F670 HydrophobicContact CB-CD2 3.72Å; A645-F670 HydrophobicContact CB-CE2 4.4Å; A646-F670 HydrophobicContact CB-CE2 4.02Å; I649-F670 HydrophobicContact CD1-CB 3.43Å; I649-F670 VanDerWaalsContact CD1-CB 3.43Å; I649-F670 HydrophobicContact CD1-CD1 4.13Å; I649-F670 HydrophobicContact CD1-CD2 3.69Å; I649-F670 HydrophobicContact CD1-CE2 4.5Å; I649-F670 HydrophobicContact CD1-CG 3.47Å; I649-F670 VanDerWaalsContact CD1-CG 3.47Å; I649-F670 HydrophobicContact CG1-CB 4.43Å; A666-F670 WeakPolarHBondContact O-CB 3.35Å; A666-F670 PolarHBondContact O-N 3.02Å; L667-F670 PolarHBondContact O-N 3.27Å; I668-F670 VanDerWaalsContact C-N 3.32Å; I668-F670 PolarHBondContact O-N 3.02Å; F670-L672 VanDerWaalsContact C-N 3.34Å; F670-G674 WeakPolarHBondContact O-CA 3.27Å; F670-G674 PolarHBondContact O-N 3.31Å
671	L	71.2	Confident	64.9	Low	125 Å²	125	86 Å²	86	65%	0.654	45%	0.449	S	S	*	.	H	α-helix	trans	-69.3	-31.5	175.8	-84.5	161.6	0	0	0	112.6	L667 I668	L667-L671 PolarHBondContact O-N 3.32Å; I668-L671 PolarHBondContact O-N 2.95Å
672	L	71.3	Confident	64.9	Low	127 Å²	127	82.9 Å²	82.9	67%	0.665	43%	0.425	S	S	*	.	H	α-helix	trans	-85.7	-49.5	176.1	-90.9	114.7	0	0	0	113.1	I668 F670 T675	I668-L672 HydrophobicContact CG2-CD1 3.53Å; I668-L672 WeakPolarHBondContact O-CB 3.4Å; I668-L672 WeakPolarHBondContact O-CD1 3.46Å; I668-L672 PolarHBondContact O-N 3.5Å; F670-L672 VanDerWaalsContact C-N 3.34Å; L672-T675 PolarHBondContact O-OG1 3.47Å
673	E	66.9	Low	64.8	Low	99 Å²	99	81.1 Å²	81.1	46%	0.463	42%	0.415	S	S	.	.	H	α-helix	trans	-91.4	-17.8	-175.6	-57.2	-170.9	163.1	0	0	114.1	K648 E669 T675	K648-E673 IonicContact NZ-OE2 3.07Å; K648-E673 PolarHBondContact NZ-OE2 3.32Å; E669-E673 HydrophobicContact CG-CG 4.08Å; E669-E673 WeakPolarHBondContact O-CA 3.45Å; E669-E673 WeakPolarHBondContact O-CB 3.39Å; E669-E673 WeakPolarHBondContact O-CG 3.29Å; E669-E673 PolarHBondContact O-N 2.67Å; E673-T675 VanDerWaalsContact C-N 3.3Å
674	G	63.2	Low	65.2	Low	8 Å²	8	77.9 Å²	77.9	8%	0.082	39%	0.39	C	S	.	.			trans	-86.1	0.8	178.7	0	0	0	0	0	113.9	T642 F670	T642-G674 WeakPolarHBondContact CG2-O 3.44Å; T642-G674 PolarHBondContact OG1-O 2.91Å; F670-G674 WeakPolarHBondContact O-CA 3.27Å; F670-G674 PolarHBondContact O-N 3.31Å
675	T	72.3	Confident	65.8	Low	86 Å²	86	72.7 Å²	72.7	53%	0.528	36%	0.362	S	S	.	.	S	Bend	trans	-60.1	124.7	170.2	49.7	0	0	0	0	109	L672 E673 E677	L672-T675 PolarHBondContact O-OG1 3.47Å; E673-T675 VanDerWaalsContact C-N 3.3Å; T675-E677 PolarHBondContact O-N 3.01Å
676	P	67.3	Low	66.2	Low	60 Å²	60	74.3 Å²	74.3	39%	0.39	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-64.3	124.2	-178.7	23.4	-31	0	0	0	109.9	L637 L639 I678	L637-P676 HydrophobicContact CD1-CB 3.71Å; L637-P676 HydrophobicContact CD1-CG 4.01Å; L637-P676 HydrophobicContact CD2-CB 3.17Å; L637-P676 HydrophobicContact CD2-CG 3.9Å; L637-P676 HydrophobicContact CG-CB 4.01Å; L639-P676 HydrophobicContact CD2-CB 4.37Å; P676-I678 PolarHBondContact O-N 3.36Å
677	E	69.6	Low	67	Low	65 Å²	65	80 Å²	80	30%	0.304	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	120.7	177	-168.6	-179.9	138.7	0	0	108.3	D638 K641 T675 R679	D638-E677 PolarHBondContact N-O 2.88Å; K641-E677 WeakPolarHBondContact CE-OE2 3.07Å; K641-E677 IonicContact NZ-OE2 2.72Å; K641-E677 PolarHBondContact NZ-OE2 3.13Å; T675-E677 PolarHBondContact O-N 3.01Å; E677-R679 HydrophobicContact CG-CG 4.14Å; E677-R679 PolarHBondContact O-N 3.14Å; E677-R679 VanDerWaalsContact O-N 3.15Å; E677-R679 IonicContact OE1-CZ 3.77Å; E677-R679 IonicContact OE1-NE 2.85Å; E677-R679 PolarHBondContact OE1-NE 3.27Å; E677-R679 IonicContact OE1-NH2 3.38Å
678	I	66	Low	67.7	Low	114 Å²	114	79.3 Å²	79.3	59%	0.585	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	107	171.9	-59.3	176	0	0	0	106.4	I635 L637 P676	I635-I678 HydrophobicContact CG2-CG2 3.35Å; L637-I678 HydrophobicContact CD1-CG1 4.34Å; P676-I678 PolarHBondContact O-N 3.36Å
679	R	56.7	Low	68.4	Low	101 Å²	101	75.5 Å²	75.5	38%	0.381	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	115.6	175.6	-77.3	-170.9	168.4	176.6	-12.6	109.7	S636 D638 E677 H681	S636-R679 PolarHBondContact N-O 2.89Å; S636-R679 PolarHBondContact O-N 3.31Å; S636-R679 VanDerWaalsContact O-N 3.09Å; D638-R679 HydrophobicContact CB-CB 4.44Å; D638-R679 HydrophobicContact CB-CG 4.22Å; D638-R679 WeakPolarHBondContact OD2-CD 3.26Å; D638-R679 IonicContact OD2-CZ 3.05Å; D638-R679 IonicContact OD2-NE 2.69Å; D638-R679 IonicContact OD2-NH1 3.04Å; D638-R679 PolarHBondContact OD2-NH1 3.11Å; E677-R679 HydrophobicContact CG-CG 4.14Å; E677-R679 PolarHBondContact O-N 3.14Å; E677-R679 VanDerWaalsContact O-N 3.15Å; E677-R679 IonicContact OE1-CZ 3.77Å; E677-R679 IonicContact OE1-NE 2.85Å; E677-R679 PolarHBondContact OE1-NE 3.27Å; E677-R679 IonicContact OE1-NH2 3.38Å; R679-H681 PolarHBondContact O-N 3.48Å
680	E	53.6	Low	69.2	Low	112 Å²	112	74.1 Å²	74.1	52%	0.523	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	105.7	170.2	-61.8	-177	-178.7	0	0	108.7	Y682	E680-Y682 HydrophobicContact CB-CE2 4.08Å; E680-Y682 PolarHBondContact OE2-OH 3.12Å
681	H	55.8	Low	70	Confident	92 Å²	92	79.9 Å²	79.9	43%	0.426	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.8	169.4	-78.3	-86.2	0	0	0	108.5	E634 S636 R679 L683	E634-H681 PolarHBondContact N-O 2.89Å; E634-H681 PolarHBondContact O-N 2.85Å; S636-H681 PolarHBondContact OG-CD2 3.33Å; R679-H681 PolarHBondContact O-N 3.48Å; H681-L683 VanDerWaalsContact C-N 3.34Å; H681-L683 PolarHBondContact O-N 3.27Å; H681-L683 VanDerWaalsContact O-N 3.1Å
682	Y	56.6	Low	70.8	Confident	120 Å²	120	77 Å²	77	47%	0.471	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	90.1	166.4	-66.9	-93.1	0	0	0	107.6	K633 E680 D684	K633-Y682 HydrophobicContact CD-CE1 4.29Å; K633-Y682 HydrophobicContact CG-CD1 4.26Å; K633-Y682 HydrophobicContact CG-CE1 3.8Å; E680-Y682 HydrophobicContact CB-CE2 4.08Å; E680-Y682 PolarHBondContact OE2-OH 3.12Å; Y682-D684 PolarHBondContact O-N 3.35Å
683	L	59.4	Low	71.7	Confident	68 Å²	68	71.8 Å²	71.8	36%	0.356	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	115.4	174.3	-146.5	85.3	0	0	0	107.8	Q582 I632 H681	Q582-L683 VanDerWaalsContact NE2-CD2 3.32Å; I632-L683 PolarHBondContact N-O 3.3Å; I632-L683 VanDerWaalsContact N-O 3.13Å; I632-L683 PolarHBondContact O-N 3.46Å; H681-L683 VanDerWaalsContact C-N 3.34Å; H681-L683 PolarHBondContact O-N 3.27Å; H681-L683 VanDerWaalsContact O-N 3.1Å
684	D	68.9	Low	72.8	Confident	32 Å²	32	73.2 Å²	73.2	17%	0.171	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	116.8	177.8	176	-1	0	0	0	107.5	T631 Y682 K686 K687 D688	T631-D684 HydrophobicContact CG2-CB 4.35Å; Y682-D684 PolarHBondContact O-N 3.35Å; D684-K686 PolarHBondContact O-N 3.46Å; D684-K686 VanDerWaalsContact O-N 3.13Å; D684-K686 WeakPolarHBondContact OD1-CB 3.18Å; D684-K686 PolarHBondContact OD1-N 3.43Å; D684-K687 HydrophobicContact CB-CB 4.1Å; D684-K687 HydrophobicContact CB-CD 3.92Å; D684-K687 HydrophobicContact CB-CG 3.84Å; D684-K687 WeakPolarHBondContact O-CA 3.47Å; D684-K687 WeakPolarHBondContact O-CB 3.43Å; D684-K687 PolarHBondContact O-N 2.87Å; D684-D688 PolarHBondContact O-N 2.91Å; D684-D688 VanDerWaalsContact O-N 3.16Å
685	S	72.9	Confident	74.1	Confident	7 Å²	7	75 Å²	75	5%	0.049	36%	0.355	C	S	.	.	H	α-helix	trans	-57.9	-27.4	179.9	-48.5	0	0	0	0	112.2	D688 V689	S685-D688 PolarHBondContact O-N 3.47Å; S685-V689 WeakPolarHBondContact O-CG2 3.48Å; S685-V689 PolarHBondContact O-N 2.94Å; S685-V689 VanDerWaalsContact O-N 3.11Å
686	K	75.3	Confident	74.9	Confident	51 Å²	51	71.1 Å²	71.1	22%	0.222	33%	0.332	C	S	.	.	H	α-helix	trans	-67	-43.1	172.3	-175.8	-171.5	-178.6	172.7	0	111.8	I623 H627 D684 D688 V689 D690	I623-K686 HydrophobicContact CD1-CB 4.25Å; I623-K686 HydrophobicContact CD1-CG 4.28Å; H627-K686 VanDerWaalsContact CE1-CD 3.47Å; H627-K686 WeakPolarHBondContact CE1-CD 3.29Å; H627-K686 VanDerWaalsContact CE1-CE 3.4Å; H627-K686 WeakPolarHBondContact CE1-CE 3.17Å; H627-K686 PolarHBondContact CE1-NZ 2.71Å; H627-K686 PolarHBondContact NE2-NZ 2.95Å; H627-K686 VanDerWaalsContact NE2-NZ 3.13Å; D684-K686 PolarHBondContact O-N 3.46Å; D684-K686 VanDerWaalsContact O-N 3.13Å; D684-K686 WeakPolarHBondContact OD1-CB 3.18Å; D684-K686 PolarHBondContact OD1-N 3.43Å; K686-D688 PolarHBondContact O-N 3.3Å; K686-V689 PolarHBondContact O-N 3.22Å; K686-D690 WeakPolarHBondContact O-CB 3.31Å; K686-D690 PolarHBondContact O-N 3.16Å
687	K	80.4	Confident	75.9	Confident	133 Å²	133	69.5 Å²	69.5	58%	0.578	32%	0.321	S	S	*	.	H	α-helix	trans	-62.1	-32.7	176.7	-71.8	-178.8	-169.9	170.1	0	111.2	D684 R691	D684-K687 HydrophobicContact CB-CB 4.1Å; D684-K687 HydrophobicContact CB-CD 3.92Å; D684-K687 HydrophobicContact CB-CG 3.84Å; D684-K687 WeakPolarHBondContact O-CA 3.47Å; D684-K687 WeakPolarHBondContact O-CB 3.43Å; D684-K687 PolarHBondContact O-N 2.87Å; K687-R691 WeakPolarHBondContact O-CB 3.48Å; K687-R691 PolarHBondContact O-N 2.87Å
688	D	81.9	Confident	76.9	Confident	46 Å²	46	71.3 Å²	71.3	25%	0.246	33%	0.33	C	S	.	.	H	α-helix	trans	-69.7	-45.7	176.5	-160.4	34	0	0	0	111.8	D684 S685 K686 D690 R691 H692	D684-D688 PolarHBondContact O-N 2.91Å; D684-D688 VanDerWaalsContact O-N 3.16Å; S685-D688 PolarHBondContact O-N 3.47Å; K686-D688 PolarHBondContact O-N 3.3Å; D688-D690 VanDerWaalsContact C-N 3.35Å; D688-D690 PolarHBondContact O-N 3.23Å; D688-R691 WeakPolarHBondContact O-CB 3.47Å; D688-R691 PolarHBondContact O-N 3.46Å; D688-H692 PolarHBondContact O-CD2 3.47Å; D688-H692 PolarHBondContact O-N 2.91Å; D688-H692 IonicContact OD1-CD2 3.79Å; D688-H692 IonicContact OD1-NE2 2.84Å
689	V	85.6	Confident	78	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.2	-46.4	171	175.9	0	0	0	0	111.1	I589 L619 R620 I623 S685 K686 R691 H692 L693	I589-V689 HydrophobicContact CD1-CG2 3.93Å; L619-V689 HydrophobicContact CD2-CG1 4.47Å; L619-V689 HydrophobicContact CD2-CG2 4.06Å; R620-V689 HydrophobicContact CB-CG1 4.14Å; I623-V689 HydrophobicContact CD1-CB 4.46Å; I623-V689 HydrophobicContact CD1-CG2 4.19Å; S685-V689 WeakPolarHBondContact O-CG2 3.48Å; S685-V689 PolarHBondContact O-N 2.94Å; S685-V689 VanDerWaalsContact O-N 3.11Å; K686-V689 PolarHBondContact O-N 3.22Å; V689-R691 VanDerWaalsContact C-N 3.33Å; V689-R691 PolarHBondContact O-N 3.29Å; V689-H692 PolarHBondContact O-N 3.38Å; V689-L693 VanDerWaalsContact O-CB 3.29Å; V689-L693 WeakPolarHBondContact O-CB 3.42Å; V689-L693 PolarHBondContact O-N 3.39Å
690	D	86.3	Confident	79.6	Confident	48 Å²	48	65.4 Å²	65.4	26%	0.257	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-37.7	178.2	-79.7	-24.3	0	0	0	111.8	R620 K686 D688 K694	R620-D690 WeakPolarHBondContact CD-OD1 3.44Å; R620-D690 IonicContact CZ-OD1 2.78Å; R620-D690 IonicContact NE-OD1 3.33Å; R620-D690 PolarHBondContact NE-OD1 3.46Å; K686-D690 WeakPolarHBondContact O-CB 3.31Å; K686-D690 PolarHBondContact O-N 3.16Å; D688-D690 VanDerWaalsContact C-N 3.35Å; D688-D690 PolarHBondContact O-N 3.23Å; D690-K694 VanDerWaalsContact O-CB 3.27Å; D690-K694 WeakPolarHBondContact O-CB 3.42Å; D690-K694 PolarHBondContact O-N 2.85Å
691	R	89.1	Confident	81.2	Confident	184 Å²	184	61.4 Å²	61.4	69%	0.694	29%	0.286	S	S	*	.	H	α-helix	trans	-65.1	-47.2	175.8	-179.6	-175.1	179.2	-172.4	-1	111.1	K687 D688 V689 K694 S695	K687-R691 WeakPolarHBondContact O-CB 3.48Å; K687-R691 PolarHBondContact O-N 2.87Å; D688-R691 WeakPolarHBondContact O-CB 3.47Å; D688-R691 PolarHBondContact O-N 3.46Å; V689-R691 VanDerWaalsContact C-N 3.33Å; V689-R691 PolarHBondContact O-N 3.29Å; R691-K694 PolarHBondContact O-N 3.33Å; R691-S695 WeakPolarHBondContact O-CB 3.24Å; R691-S695 PolarHBondContact O-N 2.92Å
692	H	88.2	Confident	82.8	Confident	63 Å²	63	63.9 Å²	63.9	29%	0.292	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-39.9	176.6	-83.5	-71	0	0	0	112	I589 L616 D688 V689 S695 A696	I589-H692 HydrophobicContact CG2-CB 4.37Å; L616-H692 HydrophobicContact CD1-CB 4.31Å; D688-H692 PolarHBondContact O-CD2 3.47Å; D688-H692 PolarHBondContact O-N 2.91Å; D688-H692 IonicContact OD1-CD2 3.79Å; D688-H692 IonicContact OD1-NE2 2.84Å; V689-H692 PolarHBondContact O-N 3.38Å; H692-S695 PolarHBondContact O-N 3.28Å; H692-A696 WeakPolarHBondContact O-CB 3.13Å; H692-A696 PolarHBondContact O-N 2.95Å
693	L	89.4	Confident	84.2	Confident	18 Å²	18	61 Å²	61	9%	0.094	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-47.1	174.9	176.2	62.7	0	0	0	111.3	I613 L616 L617 V689 S695 A696 C697	I613-L693 HydrophobicContact CG2-CD1 4.26Å; L616-L693 HydrophobicContact CB-CB 4.28Å; L616-L693 HydrophobicContact CB-CD1 3.92Å; L616-L693 HydrophobicContact CD1-CB 4.37Å; L617-L693 HydrophobicContact CD2-CD1 4.17Å; L617-L693 HydrophobicContact CD2-CD2 3.69Å; L617-L693 HydrophobicContact CG-CD1 4.01Å; L617-L693 HydrophobicContact CG-CD2 4.36Å; V689-L693 VanDerWaalsContact O-CB 3.29Å; V689-L693 WeakPolarHBondContact O-CB 3.42Å; V689-L693 PolarHBondContact O-N 3.39Å; L693-S695 PolarHBondContact O-N 3.38Å; L693-A696 PolarHBondContact O-N 3.09Å; L693-C697 PolarHBondContact O-N 2.78Å; L693-C697 PolarHBondContact O-SG 3.43Å
694	K	89.9	Confident	85.5	Confident	129 Å²	129	58.1 Å²	58.1	56%	0.561	27%	0.273	S	S	*	.	H	α-helix	trans	-61.2	-45.1	177.3	-176.6	174.8	173.5	-179.8	0	111.2	D690 R691 A696 C697 E698	D690-K694 VanDerWaalsContact O-CB 3.27Å; D690-K694 WeakPolarHBondContact O-CB 3.42Å; D690-K694 PolarHBondContact O-N 2.85Å; R691-K694 PolarHBondContact O-N 3.33Å; K694-A696 PolarHBondContact O-N 2.91Å; K694-C697 PolarHBondContact O-N 2.88Å; K694-E698 WeakPolarHBondContact CE-OE1 3.38Å; K694-E698 HydrophobicContact CG-CG 4.43Å; K694-E698 IonicContact NZ-OE1 2.79Å; K694-E698 WeakPolarHBondContact O-CB 3.35Å; K694-E698 WeakPolarHBondContact O-CG 3.28Å; K694-E698 PolarHBondContact O-N 3.23Å
695	S	90.6	Very high	86.3	Confident	46 Å²	46	57 Å²	57	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-61.9	-42.6	176.8	-172.2	0	0	0	0	112.1	R691 H692 L693 C697 E698 Q699	R691-S695 WeakPolarHBondContact O-CB 3.24Å; R691-S695 PolarHBondContact O-N 2.92Å; H692-S695 PolarHBondContact O-N 3.28Å; L693-S695 PolarHBondContact O-N 3.38Å; S695-C697 PolarHBondContact O-N 2.87Å; S695-E698 PolarHBondContact O-N 3.15Å; S695-Q699 WeakPolarHBondContact O-CB 3.38Å; S695-Q699 VanDerWaalsContact O-CG 3.25Å; S695-Q699 WeakPolarHBondContact O-CG 3.41Å; S695-Q699 PolarHBondContact O-N 3.34Å; S695-Q699 PolarHBondContact OG-NE2 3.44Å
696	A	89.7	Confident	86.9	Confident	5 Å²	5	62.3 Å²	62.3	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-40.7	175.7	0	0	0	0	0	112.2	L612 I613 L616 H692 L693 K694 F700	L612-A696 HydrophobicContact CD2-CB 3.83Å; L612-A696 HydrophobicContact CG-CB 4.25Å; I613-A696 HydrophobicContact CG1-CB 4.11Å; L616-A696 HydrophobicContact CD1-CB 4.4Å; H692-A696 WeakPolarHBondContact O-CB 3.13Å; H692-A696 PolarHBondContact O-N 2.95Å; L693-A696 PolarHBondContact O-N 3.09Å; K694-A696 PolarHBondContact O-N 2.91Å; A696-F700 WeakPolarHBondContact O-CB 3.27Å; A696-F700 PolarHBondContact O-N 3.45Å
697	C	89.3	Confident	87.4	Confident	26 Å²	26	63.7 Å²	63.7	18%	0.176	30%	0.299	C	S	.	.	H	α-helix	trans	-65.9	-44.3	175.3	-65.4	0	0	0	0	111.9	L693 K694 S695 F700 I701 L781	L693-C697 PolarHBondContact O-N 2.78Å; L693-C697 PolarHBondContact O-SG 3.43Å; K694-C697 PolarHBondContact O-N 2.88Å; S695-C697 PolarHBondContact O-N 2.87Å; C697-F700 PolarHBondContact O-N 2.7Å; C697-I701 WeakPolarHBondContact O-CB 3.11Å; C697-I701 WeakPolarHBondContact O-CD1 3.25Å; C697-I701 WeakPolarHBondContact O-CG1 3.19Å; C697-I701 PolarHBondContact O-N 3.38Å; C697-L781 HydrophobicContact CB-CD1 3.87Å; C697-L781 VanDerWaalsContact SG-CD1 3.59Å
698	E	90.4	Very high	87.5	Confident	102 Å²	102	57.6 Å²	57.6	48%	0.477	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-45.4	177.2	-75.1	172.1	171.6	0	0	111.4	K694 S695 F700 I701 E702	K694-E698 WeakPolarHBondContact CE-OE1 3.38Å; K694-E698 HydrophobicContact CG-CG 4.43Å; K694-E698 IonicContact NZ-OE1 2.79Å; K694-E698 WeakPolarHBondContact O-CB 3.35Å; K694-E698 WeakPolarHBondContact O-CG 3.28Å; K694-E698 PolarHBondContact O-N 3.23Å; S695-E698 PolarHBondContact O-N 3.15Å; E698-F700 VanDerWaalsContact C-N 3.33Å; E698-F700 PolarHBondContact O-N 3.39Å; E698-I701 PolarHBondContact O-N 2.91Å; E698-E702 WeakPolarHBondContact O-CB 3.44Å; E698-E702 PolarHBondContact O-N 3.37Å
699	Q	88.3	Confident	87.5	Confident	91 Å²	91	55.5 Å²	55.5	43%	0.425	26%	0.261	S	S	.	.	H	α-helix	trans	-62.3	-38.9	175.5	-72.6	175.9	19.8	0	0	112.3	S695 Q703	S695-Q699 WeakPolarHBondContact O-CB 3.38Å; S695-Q699 VanDerWaalsContact O-CG 3.25Å; S695-Q699 WeakPolarHBondContact O-CG 3.41Å; S695-Q699 PolarHBondContact O-N 3.34Å; S695-Q699 PolarHBondContact OG-NE2 3.44Å; Q699-Q703 WeakPolarHBondContact O-CB 3.36Å; Q699-Q703 VanDerWaalsContact O-CG 3.24Å; Q699-Q703 WeakPolarHBondContact O-CG 3.46Å; Q699-Q703 PolarHBondContact O-N 2.92Å
700	F	89.8	Confident	87.4	Confident	1 Å²	1	59 Å²	59	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-47.9	173.8	176.9	-92.5	0	0	0	111	I606 Q609 L610 I613 A696 C697 E698 E702 Q703 Q704 T764 M768 L781	I606-F700 HydrophobicContact CG2-CE2 4.27Å; Q609-F700 HydrophobicContact CB-CD2 4Å; L610-F700 HydrophobicContact CD2-CD2 4.29Å; L610-F700 HydrophobicContact CD2-CE2 3.72Å; L610-F700 HydrophobicContact CD2-CZ 3.96Å; L610-F700 HydrophobicContact CG-CE2 3.98Å; I613-F700 HydrophobicContact CD1-CB 3.98Å; I613-F700 HydrophobicContact CD1-CG 4.2Å; A696-F700 WeakPolarHBondContact O-CB 3.27Å; A696-F700 PolarHBondContact O-N 3.45Å; C697-F700 PolarHBondContact O-N 2.7Å; E698-F700 VanDerWaalsContact C-N 3.33Å; E698-F700 PolarHBondContact O-N 3.39Å; F700-E702 PolarHBondContact O-N 2.93Å; F700-Q703 PolarHBondContact O-N 2.91Å; F700-Q704 HydrophobicContact CD1-CG 4.08Å; F700-Q704 HydrophobicContact CD2-CG 4.21Å; F700-Q704 HydrophobicContact CE1-CG 3.66Å; F700-Q704 HydrophobicContact CE2-CG 3.82Å; F700-Q704 HydrophobicContact CG-CG 4.35Å; F700-Q704 HydrophobicContact CZ-CG 3.53Å; F700-Q704 WeakPolarHBondContact O-CB 3.23Å; F700-Q704 WeakPolarHBondContact O-CG 3.47Å; F700-Q704 PolarHBondContact O-N 3.31Å; F700-T764 HydrophobicContact CZ-CG2 4.31Å; F700-M768 HydrophobicContact CE1-CE 4.47Å; F700-M768 HydrophobicContact CE1-SD 4.01Å; F700-M768 HydrophobicContact CZ-CG 4.06Å; F700-M768 HydrophobicContact CZ-SD 3.86Å; F700-L781 HydrophobicContact CD1-CD2 3.46Å; F700-L781 VanDerWaalsContact CD1-CD2 3.46Å; F700-L781 HydrophobicContact CD1-CG 4.12Å; F700-L781 HydrophobicContact CE1-CD2 3.36Å; F700-L781 HydrophobicContact CE1-CG 4.29Å; F700-L781 HydrophobicContact CG-CD2 4.34Å; F700-L781 HydrophobicContact CZ-CD2 4.17Å
701	I	88.3	Confident	87	Confident	27 Å²	27	60.7 Å²	60.7	14%	0.138	29%	0.287	C	S	.	.	H	α-helix	trans	-60	-46	179.4	-69.4	160.5	0	0	0	110.7	C697 E698 T705 P784 V785	C697-I701 WeakPolarHBondContact O-CB 3.11Å; C697-I701 WeakPolarHBondContact O-CD1 3.25Å; C697-I701 WeakPolarHBondContact O-CG1 3.19Å; C697-I701 PolarHBondContact O-N 3.38Å; E698-I701 PolarHBondContact O-N 2.91Å; I701-T705 VanDerWaalsContact O-CB 3.26Å; I701-T705 WeakPolarHBondContact O-CB 3.28Å; I701-T705 PolarHBondContact O-N 3.45Å; I701-T705 PolarHBondContact O-OG1 3.42Å; I701-P784 HydrophobicContact CD1-CB 3.89Å; I701-P784 HydrophobicContact CD1-CG 3.98Å; I701-P784 HydrophobicContact CG1-CB 4.33Å; I701-P784 HydrophobicContact CG2-CB 3.99Å; I701-V785 HydrophobicContact CB-CG2 4.17Å; I701-V785 HydrophobicContact CG1-CG2 4.03Å; I701-V785 HydrophobicContact CG2-CG2 3.97Å
702	E	87.9	Confident	86.5	Confident	144 Å²	144	52 Å²	52	67%	0.673	25%	0.254	S	S	*	.	H	α-helix	trans	-62.8	-46.9	178.9	-172.3	178	-174.8	0	0	111.2	E698 F700 T705 K706	E698-E702 WeakPolarHBondContact O-CB 3.44Å; E698-E702 PolarHBondContact O-N 3.37Å; F700-E702 PolarHBondContact O-N 2.93Å; E702-T705 PolarHBondContact O-N 2.89Å; E702-K706 WeakPolarHBondContact O-CB 3.46Å; E702-K706 PolarHBondContact O-N 2.83Å
703	Q	86.3	Confident	86.2	Confident	61 Å²	61	52.5 Å²	52.5	29%	0.285	26%	0.256	S	S	.	.	H	α-helix	trans	-66	-41.9	179.3	-74.6	179.5	16.6	0	0	113	Q605 Q609 Q699 F700 K706 L707	Q605-Q703 VanDerWaalsContact NE2-CD 3.32Å; Q609-Q703 VanDerWaalsContact OE1-OE1 3.1Å; Q699-Q703 WeakPolarHBondContact O-CB 3.36Å; Q699-Q703 VanDerWaalsContact O-CG 3.24Å; Q699-Q703 WeakPolarHBondContact O-CG 3.46Å; Q699-Q703 PolarHBondContact O-N 2.92Å; F700-Q703 PolarHBondContact O-N 2.91Å; Q703-K706 PolarHBondContact O-N 3.16Å; Q703-L707 WeakPolarHBondContact O-CB 3.5Å; Q703-L707 PolarHBondContact O-N 3.13Å
704	Q	87.1	Confident	85.8	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.028	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-42.7	175.5	-66	-47.1	-60.7	0	0	111.2	F700 K706 L707 F708 T764 V785	F700-Q704 HydrophobicContact CD1-CG 4.08Å; F700-Q704 HydrophobicContact CD2-CG 4.21Å; F700-Q704 HydrophobicContact CE1-CG 3.66Å; F700-Q704 HydrophobicContact CE2-CG 3.82Å; F700-Q704 HydrophobicContact CG-CG 4.35Å; F700-Q704 HydrophobicContact CZ-CG 3.53Å; F700-Q704 WeakPolarHBondContact O-CB 3.23Å; F700-Q704 WeakPolarHBondContact O-CG 3.47Å; F700-Q704 PolarHBondContact O-N 3.31Å; Q704-K706 VanDerWaalsContact C-N 3.33Å; Q704-K706 PolarHBondContact O-N 2.82Å; Q704-L707 PolarHBondContact O-N 2.82Å; Q704-F708 HydrophobicContact CB-CE2 4.26Å; Q704-F708 WeakPolarHBondContact O-CD2 3.42Å; Q704-F708 PolarHBondContact O-N 3.36Å; Q704-F708 VanDerWaalsContact O-N 3.12Å; Q704-T764 HydrophobicContact CG-CG2 4.34Å; Q704-T764 PolarHBondContact OE1-OG1 3.28Å; Q704-V785 HydrophobicContact CB-CG1 4.15Å; Q704-V785 HydrophobicContact CB-CG2 4.29Å
705	T	85.8	Confident	85.4	Confident	10 Å²	10	50.9 Å²	50.9	6%	0.061	25%	0.25	C	S	.	.	H	α-helix	trans	-58.6	-47.2	176.2	-57.1	0	0	0	0	110.4	I701 E702 F708 V709 N788	I701-T705 VanDerWaalsContact O-CB 3.26Å; I701-T705 WeakPolarHBondContact O-CB 3.28Å; I701-T705 PolarHBondContact O-N 3.45Å; I701-T705 PolarHBondContact O-OG1 3.42Å; E702-T705 PolarHBondContact O-N 2.89Å; T705-F708 PolarHBondContact O-N 3.26Å; T705-V709 WeakPolarHBondContact O-CB 3.34Å; T705-V709 WeakPolarHBondContact O-CG2 3.35Å; T705-V709 PolarHBondContact O-N 2.96Å; T705-N788 HydrophobicContact CG2-CB 3.62Å; T705-N788 PolarHBondContact OG1-ND2 3.12Å
706	K	86	Confident	84.8	Confident	118 Å²	118	50.2 Å²	50.2	51%	0.513	24%	0.242	S	C	.	.	H	α-helix	trans	-59.4	-49.7	175.5	-167.4	173.5	-176.5	175.7	0	111	E702 Q703 Q704 F708 V709 D710	E702-K706 WeakPolarHBondContact O-CB 3.46Å; E702-K706 PolarHBondContact O-N 2.83Å; Q703-K706 PolarHBondContact O-N 3.16Å; Q704-K706 VanDerWaalsContact C-N 3.33Å; Q704-K706 PolarHBondContact O-N 2.82Å; K706-F708 PolarHBondContact O-N 2.83Å; K706-F708 VanDerWaalsContact O-N 3.08Å; K706-V709 PolarHBondContact O-N 2.92Å; K706-V709 VanDerWaalsContact O-N 3.09Å; K706-D710 WeakPolarHBondContact CE-OD1 3.46Å; K706-D710 HydrophobicContact CG-CB 4.09Å; K706-D710 WeakPolarHBondContact CG-OD1 3.22Å; K706-D710 WeakPolarHBondContact O-CA 3.42Å; K706-D710 WeakPolarHBondContact O-CB 3.31Å; K706-D710 PolarHBondContact O-N 3.45Å
707	L	85.4	Confident	84.3	Confident	79 Å²	79	54 Å²	54	41%	0.414	27%	0.265	S	S	.	.	H	α-helix	trans	-53.6	-36.4	179	-177.3	66.2	0	0	0	113.5	Q703 Q704	Q703-L707 WeakPolarHBondContact O-CB 3.5Å; Q703-L707 PolarHBondContact O-N 3.13Å; Q704-L707 PolarHBondContact O-N 2.82Å
708	F	82	Confident	83.8	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-83.6	-28.5	-180	-66.9	-57.9	0	0	0	114.2	Q704 T705 K706 L757 K760 L761 V785 I789	Q704-F708 HydrophobicContact CB-CE2 4.26Å; Q704-F708 WeakPolarHBondContact O-CD2 3.42Å; Q704-F708 PolarHBondContact O-N 3.36Å; Q704-F708 VanDerWaalsContact O-N 3.12Å; T705-F708 PolarHBondContact O-N 3.26Å; K706-F708 PolarHBondContact O-N 2.83Å; K706-F708 VanDerWaalsContact O-N 3.08Å; F708-L757 HydrophobicContact CB-CD1 4.27Å; F708-L757 HydrophobicContact CD1-CD1 3.66Å; F708-L757 HydrophobicContact CE1-CD1 4.14Å; F708-L757 HydrophobicContact CG-CD1 3.97Å; F708-K760 HydrophobicContact CE1-CB 3.81Å; F708-L761 HydrophobicContact CE1-CB 4.21Å; F708-L761 HydrophobicContact CZ-CB 4.39Å; F708-L761 HydrophobicContact CZ-CD1 4.28Å; F708-V785 HydrophobicContact CD2-CG1 4.24Å; F708-V785 HydrophobicContact CE2-CG1 4.3Å; F708-I789 HydrophobicContact CB-CD1 4Å; F708-I789 HydrophobicContact CB-CG1 4.22Å; F708-I789 HydrophobicContact CD2-CD1 3.68Å; F708-I789 HydrophobicContact CE2-CD1 4.46Å; F708-I789 HydrophobicContact CG-CD1 4.01Å
709	V	82.8	Confident	83.2	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-127.8	-3.3	-163.7	-160.1	0	0	0	0	114	T705 K706 Q711 L712 E713 I789 V792	T705-V709 WeakPolarHBondContact O-CB 3.34Å; T705-V709 WeakPolarHBondContact O-CG2 3.35Å; T705-V709 PolarHBondContact O-N 2.96Å; K706-V709 PolarHBondContact O-N 2.92Å; K706-V709 VanDerWaalsContact O-N 3.09Å; V709-Q711 VanDerWaalsContact C-N 3.27Å; V709-Q711 PolarHBondContact O-N 2.87Å; V709-Q711 VanDerWaalsContact O-N 3.08Å; V709-L712 HydrophobicContact CG1-CB 3.91Å; V709-L712 HydrophobicContact CG1-CD1 4.24Å; V709-L712 CarbonylContact O-C 3.6Å; V709-L712 WeakPolarHBondContact O-CA 3.3Å; V709-L712 WeakPolarHBondContact O-CB 3.33Å; V709-L712 PolarHBondContact O-N 2.81Å; V709-E713 HydrophobicContact CG1-CG 4.07Å; V709-E713 PolarHBondContact O-N 3.02Å; V709-I789 HydrophobicContact CG2-CB 4.29Å; V709-I789 HydrophobicContact CG2-CG1 3.77Å; V709-I789 HydrophobicContact CG2-CG2 4.32Å; V709-V792 HydrophobicContact CG1-CB 3.58Å; V709-V792 HydrophobicContact CG1-CG1 3.25Å; V709-V792 HydrophobicContact CG1-CG2 3.99Å
710	D	83.1	Confident	82.6	Confident	73 Å²	73	51 Å²	51	39%	0.39	25%	0.253	S	S	.	.	H	α-helix	trans	-47.2	-46.8	-175.4	-162	44.7	0	0	0	113.1	K706 L712 E713 E714	K706-D710 WeakPolarHBondContact CE-OD1 3.46Å; K706-D710 HydrophobicContact CG-CB 4.09Å; K706-D710 WeakPolarHBondContact CG-OD1 3.22Å; K706-D710 WeakPolarHBondContact O-CA 3.42Å; K706-D710 WeakPolarHBondContact O-CB 3.31Å; K706-D710 PolarHBondContact O-N 3.45Å; D710-L712 VanDerWaalsContact C-N 3.34Å; D710-L712 PolarHBondContact O-N 3.35Å; D710-E713 PolarHBondContact O-N 2.9Å; D710-E714 WeakPolarHBondContact O-CB 3.24Å; D710-E714 PolarHBondContact O-N 3.03Å
711	Q	78.6	Confident	82.1	Confident	85 Å²	85	52.9 Å²	52.9	40%	0.397	27%	0.269	S	S	.	.	H	α-helix	trans	-66.1	-34.8	-179.1	-65.7	-173.9	-14.9	0	0	113.1	V709 F715 L749 T752	V709-Q711 VanDerWaalsContact C-N 3.27Å; V709-Q711 PolarHBondContact O-N 2.87Å; V709-Q711 VanDerWaalsContact O-N 3.08Å; Q711-F715 PolarHBondContact O-N 3.23Å; Q711-L749 HydrophobicContact CB-CD1 3.86Å; Q711-T752 VanDerWaalsContact OE1-CG2 3.28Å
712	L	78.4	Confident	81.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-76.3	-43	175.7	-70.2	170.2	0	0	0	110.3	V709 D710 E714 F715 M716 L749 A753 V792 F793 F796	V709-L712 HydrophobicContact CG1-CB 3.91Å; V709-L712 HydrophobicContact CG1-CD1 4.24Å; V709-L712 CarbonylContact O-C 3.6Å; V709-L712 WeakPolarHBondContact O-CA 3.3Å; V709-L712 WeakPolarHBondContact O-CB 3.33Å; V709-L712 PolarHBondContact O-N 2.81Å; D710-L712 VanDerWaalsContact C-N 3.34Å; D710-L712 PolarHBondContact O-N 3.35Å; L712-E714 PolarHBondContact O-N 3.33Å; L712-F715 PolarHBondContact O-N 3.34Å; L712-M716 WeakPolarHBondContact O-CB 2.9Å; L712-M716 WeakPolarHBondContact O-CG 3.37Å; L712-M716 PolarHBondContact O-N 2.89Å; L712-L749 HydrophobicContact CD2-CD2 4.12Å; L712-L749 HydrophobicContact CD2-CG 4.21Å; L712-A753 HydrophobicContact CD1-CB 3.57Å; L712-A753 HydrophobicContact CD2-CB 4.38Å; L712-A753 HydrophobicContact CG-CB 3.8Å; L712-V792 HydrophobicContact CB-CG1 4.44Å; L712-F793 HydrophobicContact CD1-CD1 4.17Å; L712-F793 HydrophobicContact CD1-CD2 4.37Å; L712-F793 HydrophobicContact CD1-CE1 3.58Å; L712-F793 HydrophobicContact CD1-CE2 3.8Å; L712-F793 HydrophobicContact CD1-CZ 3.37Å; L712-F796 HydrophobicContact CD2-CD1 4.36Å; L712-F796 HydrophobicContact CD2-CD2 4.16Å; L712-F796 HydrophobicContact CD2-CE1 4.21Å; L712-F796 HydrophobicContact CD2-CE2 4.02Å; L712-F796 HydrophobicContact CD2-CG 4.33Å; L712-F796 HydrophobicContact CD2-CZ 4.04Å
713	E	81.3	Confident	80.6	Confident	75 Å²	75	49.8 Å²	49.8	35%	0.35	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-43.7	176.7	-76.5	-174.1	170.4	0	0	112	V709 D710 F715 M716 T717 V792	V709-E713 HydrophobicContact CG1-CG 4.07Å; V709-E713 PolarHBondContact O-N 3.02Å; D710-E713 PolarHBondContact O-N 2.9Å; E713-F715 VanDerWaalsContact C-N 3.31Å; E713-F715 PolarHBondContact O-N 3.49Å; E713-M716 WeakPolarHBondContact O-CB 3.38Å; E713-M716 PolarHBondContact O-N 3.44Å; E713-M716 VanDerWaalsContact O-N 3.12Å; E713-T717 PolarHBondContact O-N 3.2Å; E713-T717 PolarHBondContact O-OG1 2.75Å; E713-V792 HydrophobicContact CG-CG1 4.07Å; E713-V792 HydrophobicContact CG-CG2 4.29Å
714	E	81.4	Confident	79.9	Confident	97 Å²	97	50.4 Å²	50.4	45%	0.453	26%	0.262	S	S	.	.	H	α-helix	trans	-59.3	-43.8	177.1	-164.6	-168.5	162.3	0	0	111.2	D710 L712 T717 K718	D710-E714 WeakPolarHBondContact O-CB 3.24Å; D710-E714 PolarHBondContact O-N 3.03Å; L712-E714 PolarHBondContact O-N 3.33Å; E714-T717 VanDerWaalsContact CA-OG1 3.29Å; E714-T717 WeakPolarHBondContact CA-OG1 3.32Å; E714-T717 PolarHBondContact O-N 2.67Å; E714-T717 PolarHBondContact O-OG1 3.4Å; E714-K718 WeakPolarHBondContact O-CG 3.25Å; E714-K718 PolarHBondContact O-N 2.77Å; E714-K718 VanDerWaalsContact OE1-CE 3.27Å; E714-K718 WeakPolarHBondContact OE1-CE 3.19Å; E714-K718 IonicContact OE1-NZ 3.72Å; E714-K718 PolarHBondContact OE1-NZ 3.49Å
715	F	80.4	Confident	79	Confident	16 Å²	16	55.9 Å²	55.9	7%	0.07	29%	0.289	C	S	.	.	H	α-helix	trans	-62.2	-45.8	173.9	177.8	-95.2	0	0	0	111.8	Q711 L712 E713 T717 K718 V719 W740 A741 V746 L749 F796	Q711-F715 PolarHBondContact O-N 3.23Å; L712-F715 PolarHBondContact O-N 3.34Å; E713-F715 VanDerWaalsContact C-N 3.31Å; E713-F715 PolarHBondContact O-N 3.49Å; F715-T717 VanDerWaalsContact C-N 3.34Å; F715-T717 PolarHBondContact O-N 3.42Å; F715-K718 PolarHBondContact O-N 3.24Å; F715-V719 HydrophobicContact CD1-CG2 4.18Å; F715-V719 HydrophobicContact CE1-CG2 3.78Å; F715-V719 HydrophobicContact CE2-CG2 4.29Å; F715-V719 HydrophobicContact CZ-CG2 3.84Å; F715-V719 WeakPolarHBondContact O-CG2 3.33Å; F715-V719 PolarHBondContact O-N 2.94Å; F715-W740 AromaticContact CD2-CE3 3.95Å; F715-W740 HydrophobicContact CD2-CE3 3.95Å; F715-W740 AromaticContact CD2-CZ3 3.87Å; F715-W740 HydrophobicContact CD2-CZ3 3.87Å; F715-W740 AromaticContact CE2-CE3 3.77Å; F715-W740 HydrophobicContact CE2-CE3 3.77Å; F715-W740 AromaticContact CE2-CZ3 3.65Å; F715-W740 HydrophobicContact CE2-CZ3 3.65Å; F715-W740 HydrophobicContact CZ-CZ3 4.45Å; F715-A741 HydrophobicContact CE2-CB 4.19Å; F715-V746 HydrophobicContact CE2-CG2 3.97Å; F715-V746 HydrophobicContact CZ-CG1 4.43Å; F715-V746 HydrophobicContact CZ-CG2 3.84Å; F715-L749 HydrophobicContact CB-CD2 3.51Å; F715-L749 HydrophobicContact CD1-CD2 4.19Å; F715-L749 HydrophobicContact CD2-CD2 3.9Å; F715-L749 HydrophobicContact CG-CD2 3.6Å; F715-F796 HydrophobicContact CD1-CD2 4.21Å; F715-F796 AromaticContact CD1-CE2 3.76Å; F715-F796 HydrophobicContact CD1-CE2 3.76Å; F715-F796 HydrophobicContact CE1-CD2 4.32Å; F715-F796 AromaticContact CE1-CE2 3.7Å; F715-F796 HydrophobicContact CE1-CE2 3.7Å
716	M	77.6	Confident	77.9	Confident	31 Å²	31	57.5 Å²	57.5	15%	0.153	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-42	176.9	-66.7	-69.7	-64.3	0	0	111.7	L712 E713 V719 S720 K795 F796 L799	L712-M716 WeakPolarHBondContact O-CB 2.9Å; L712-M716 WeakPolarHBondContact O-CG 3.37Å; L712-M716 PolarHBondContact O-N 2.89Å; E713-M716 WeakPolarHBondContact O-CB 3.38Å; E713-M716 PolarHBondContact O-N 3.44Å; E713-M716 VanDerWaalsContact O-N 3.12Å; M716-V719 PolarHBondContact O-N 3.36Å; M716-S720 WeakPolarHBondContact O-CB 3.46Å; M716-S720 PolarHBondContact O-N 2.8Å; M716-S720 PolarHBondContact O-OG 3.19Å; M716-K795 HydrophobicContact CE-CB 3.66Å; M716-F796 HydrophobicContact SD-CB 4.03Å; M716-F796 HydrophobicContact SD-CD2 3.87Å; M716-F796 HydrophobicContact SD-CG 4.46Å; M716-L799 HydrophobicContact CE-CD1 3.23Å; M716-L799 HydrophobicContact CE-CG 3.78Å; M716-L799 HydrophobicContact SD-CD1 3.34Å; M716-L799 WeakPolarHBondContact SD-CD1 3.24Å; M716-L799 HydrophobicContact SD-CG 4.2Å
717	T	80.9	Confident	76.8	Confident	85 Å²	85	56.3 Å²	56.3	52%	0.521	31%	0.31	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175	26.8	0	0	0	0	112.5	E713 E714 F715 V719 S720 A721	E713-T717 PolarHBondContact O-N 3.2Å; E713-T717 PolarHBondContact O-OG1 2.75Å; E714-T717 VanDerWaalsContact CA-OG1 3.29Å; E714-T717 WeakPolarHBondContact CA-OG1 3.32Å; E714-T717 PolarHBondContact O-N 2.67Å; E714-T717 PolarHBondContact O-OG1 3.4Å; F715-T717 VanDerWaalsContact C-N 3.34Å; F715-T717 PolarHBondContact O-N 3.42Å; T717-V719 VanDerWaalsContact C-N 3.34Å; T717-V719 PolarHBondContact O-N 2.93Å; T717-S720 WeakPolarHBondContact CA-OG 3.28Å; T717-S720 PolarHBondContact O-N 3.35Å; T717-S720 PolarHBondContact O-OG 3.4Å; T717-A721 VanDerWaalsContact O-CB 3.28Å; T717-A721 WeakPolarHBondContact O-CB 3.49Å; T717-A721 PolarHBondContact O-N 2.78Å
718	K	78.8	Confident	75.7	Confident	95 Å²	95	60.6 Å²	60.6	41%	0.413	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-42.2	176.1	-72.6	171.5	-175.7	166.2	0	111.2	E714 F715 L722 W740	E714-K718 WeakPolarHBondContact O-CG 3.25Å; E714-K718 PolarHBondContact O-N 2.77Å; E714-K718 VanDerWaalsContact OE1-CE 3.27Å; E714-K718 WeakPolarHBondContact OE1-CE 3.19Å; E714-K718 IonicContact OE1-NZ 3.72Å; E714-K718 PolarHBondContact OE1-NZ 3.49Å; F715-K718 PolarHBondContact O-N 3.24Å; K718-L722 WeakPolarHBondContact O-CG 3.48Å; K718-L722 PolarHBondContact O-N 2.76Å; K718-L722 VanDerWaalsContact O-N 3.12Å; K718-W740 HydrophobicContact CB-CH2 3.73Å; K718-W740 HydrophobicContact CB-CZ2 4.28Å; K718-W740 HydrophobicContact CB-CZ3 3.97Å
719	V	76.9	Confident	74.4	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.012	36%	0.363	C	S	.	.	H	α-helix	trans	-67	-43.3	175.7	176.9	0	0	0	0	111.3	F715 M716 T717 A721 L722 K723 L735 W740 L799	F715-V719 HydrophobicContact CD1-CG2 4.18Å; F715-V719 HydrophobicContact CE1-CG2 3.78Å; F715-V719 HydrophobicContact CE2-CG2 4.29Å; F715-V719 HydrophobicContact CZ-CG2 3.84Å; F715-V719 WeakPolarHBondContact O-CG2 3.33Å; F715-V719 PolarHBondContact O-N 2.94Å; M716-V719 PolarHBondContact O-N 3.36Å; T717-V719 VanDerWaalsContact C-N 3.34Å; T717-V719 PolarHBondContact O-N 2.93Å; V719-A721 PolarHBondContact O-N 2.84Å; V719-L722 PolarHBondContact O-N 3.28Å; V719-K723 WeakPolarHBondContact O-CG 3.21Å; V719-K723 PolarHBondContact O-N 3.38Å; V719-L735 HydrophobicContact CG1-CD1 3.8Å; V719-L735 HydrophobicContact CG1-CD2 4.49Å; V719-W740 HydrophobicContact CG2-CH2 4.08Å; V719-W740 HydrophobicContact CG2-CZ3 3.93Å; V719-L799 HydrophobicContact CB-CD1 4.29Å; V719-L799 HydrophobicContact CG1-CD1 3.88Å
720	S	76.2	Confident	73.1	Confident	59 Å²	59	65.4 Å²	65.4	41%	0.413	38%	0.379	S	S	.	.	H	α-helix	trans	-66.1	-37.5	177.3	64.4	0	0	0	0	112.8	M716 T717 L722 K723 T724	M716-S720 WeakPolarHBondContact O-CB 3.46Å; M716-S720 PolarHBondContact O-N 2.8Å; M716-S720 PolarHBondContact O-OG 3.19Å; T717-S720 WeakPolarHBondContact CA-OG 3.28Å; T717-S720 PolarHBondContact O-N 3.35Å; T717-S720 PolarHBondContact O-OG 3.4Å; S720-L722 VanDerWaalsContact C-N 3.33Å; S720-L722 PolarHBondContact O-N 2.96Å; S720-K723 PolarHBondContact O-N 3.48Å; S720-T724 WeakPolarHBondContact O-CG2 3.29Å; S720-T724 PolarHBondContact O-N 3.43Å; S720-T724 PolarHBondContact O-OG1 3.24Å
721	A	78	Confident	71.6	Confident	41 Å²	41	65.7 Å²	65.7	34%	0.339	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-43.4	176	0	0	0	0	0	110.6	T717 V719 T724 M725	T717-A721 VanDerWaalsContact O-CB 3.28Å; T717-A721 WeakPolarHBondContact O-CB 3.49Å; T717-A721 PolarHBondContact O-N 2.78Å; V719-A721 PolarHBondContact O-N 2.84Å; A721-T724 WeakPolarHBondContact CA-OG1 3.27Å; A721-T724 PolarHBondContact O-N 3.24Å; A721-T724 PolarHBondContact O-OG1 3.32Å; A721-M725 VanDerWaalsContact O-CG 3.3Å; A721-M725 WeakPolarHBondContact O-CG 3.32Å; A721-M725 PolarHBondContact O-N 3.37Å
722	L	73.8	Confident	70.5	Confident	39 Å²	39	71.9 Å²	71.9	20%	0.204	41%	0.411	C	S	.	.	H	α-helix	trans	-62.5	-42.1	172.4	-73	-174.6	0	0	0	112.6	K718 V719 S720 T724 M725 A726 L735 Q738 W740	K718-L722 WeakPolarHBondContact O-CG 3.48Å; K718-L722 PolarHBondContact O-N 2.76Å; K718-L722 VanDerWaalsContact O-N 3.12Å; V719-L722 PolarHBondContact O-N 3.28Å; S720-L722 VanDerWaalsContact C-N 3.33Å; S720-L722 PolarHBondContact O-N 2.96Å; L722-T724 VanDerWaalsContact C-N 3.35Å; L722-T724 PolarHBondContact O-N 2.98Å; L722-M725 PolarHBondContact O-N 2.88Å; L722-A726 WeakPolarHBondContact O-CB 3.29Å; L722-A726 PolarHBondContact O-N 2.89Å; L722-L735 HydrophobicContact CD1-CD2 3.98Å; L722-Q738 HydrophobicContact CD1-CG 4.41Å; L722-W740 HydrophobicContact CD1-CH2 3.71Å; L722-W740 HydrophobicContact CD1-CZ2 3.43Å; L722-W740 VanDerWaalsContact CD1-CZ2 3.43Å; L722-W740 HydrophobicContact CG-CZ2 4.29Å
723	K	71.2	Confident	69.4	Low	67 Å²	67	77.6 Å²	77.6	29%	0.291	43%	0.433	S	S	.	.	H	α-helix	trans	-61.2	-42	174.6	-73	-169.9	178	-154	0	111.7	V719 S720 A726 S727 E802 E803	V719-K723 WeakPolarHBondContact O-CG 3.21Å; V719-K723 PolarHBondContact O-N 3.38Å; S720-K723 PolarHBondContact O-N 3.48Å; K723-A726 PolarHBondContact O-N 3.3Å; K723-S727 PolarHBondContact O-N 2.86Å; K723-S727 PolarHBondContact O-OG 3.49Å; K723-E802 IonicContact NZ-OE2 2.63Å; K723-E802 PolarHBondContact NZ-OE2 3.3Å; K723-E803 WeakPolarHBondContact CE-OE1 3.36Å; K723-E803 IonicContact NZ-OE1 2.96Å; K723-E803 PolarHBondContact NZ-OE1 3.42Å
724	T	71.7	Confident	68.4	Low	74 Å²	74	77.5 Å²	77.5	45%	0.454	44%	0.438	S	S	.	.	H	α-helix	trans	-66.4	-40.8	176.9	50.9	0	0	0	0	112.3	S720 A721 L722 A726 S727 Q728	S720-T724 WeakPolarHBondContact O-CG2 3.29Å; S720-T724 PolarHBondContact O-N 3.43Å; S720-T724 PolarHBondContact O-OG1 3.24Å; A721-T724 WeakPolarHBondContact CA-OG1 3.27Å; A721-T724 PolarHBondContact O-N 3.24Å; A721-T724 PolarHBondContact O-OG1 3.32Å; L722-T724 VanDerWaalsContact C-N 3.35Å; L722-T724 PolarHBondContact O-N 2.98Å; T724-A726 VanDerWaalsContact C-N 3.32Å; T724-A726 PolarHBondContact O-N 2.86Å; T724-S727 WeakPolarHBondContact CA-OG 3.34Å; T724-S727 PolarHBondContact O-N 2.99Å; T724-S727 PolarHBondContact O-OG 3.41Å; T724-Q728 WeakPolarHBondContact O-CG 3.42Å; T724-Q728 PolarHBondContact O-N 3.44Å
725	M	68.1	Low	67.3	Low	120 Å²	120	73.5 Å²	73.5	59%	0.591	42%	0.42	S	S	*	.	H	α-helix	trans	-65.6	-35	174.8	-70.9	-178.1	-179.6	0	0	112.2	A721 L722 G730	A721-M725 VanDerWaalsContact O-CG 3.3Å; A721-M725 WeakPolarHBondContact O-CG 3.32Å; A721-M725 PolarHBondContact O-N 3.37Å; L722-M725 PolarHBondContact O-N 2.88Å; M725-G730 PolarHBondContact O-N 2.9Å
726	A	64.1	Low	66.3	Low	44 Å²	44	74.8 Å²	74.8	36%	0.364	43%	0.431	S	S	.	.	H	α-helix	trans	-68.1	-39.6	173.8	0	0	0	0	0	112.2	L722 K723 T724 Q728 G729	L722-A726 WeakPolarHBondContact O-CB 3.29Å; L722-A726 PolarHBondContact O-N 2.89Å; K723-A726 PolarHBondContact O-N 3.3Å; T724-A726 VanDerWaalsContact C-N 3.32Å; T724-A726 PolarHBondContact O-N 2.86Å; A726-Q728 VanDerWaalsContact C-N 3.28Å; A726-Q728 PolarHBondContact O-N 2.93Å; A726-G729 PolarHBondContact O-N 3.39Å
727	S	61.9	Low	65.6	Low	94 Å²	94	80.6 Å²	80.6	66%	0.657	46%	0.458	S	S	*	.	H	α-helix	trans	-68.8	-23	177.8	67.9	0	0	0	0	114.2	K723 T724 G729	K723-S727 PolarHBondContact O-N 2.86Å; K723-S727 PolarHBondContact O-OG 3.49Å; T724-S727 WeakPolarHBondContact CA-OG 3.34Å; T724-S727 PolarHBondContact O-N 2.99Å; T724-S727 PolarHBondContact O-OG 3.41Å; S727-G729 VanDerWaalsContact C-N 3.33Å
728	Q	63.6	Low	64.8	Low	169 Å²	169	79 Å²	79	79%	0.79	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	14.5	178.8	-69	178.8	-0.5	0	0	113.7	T724 A726	T724-Q728 WeakPolarHBondContact O-CG 3.42Å; T724-Q728 PolarHBondContact O-N 3.44Å; A726-Q728 VanDerWaalsContact C-N 3.28Å; A726-Q728 PolarHBondContact O-N 2.93Å
729	G	53	Low	64.1	Low	73 Å²	73	78.3 Å²	78.3	75%	0.753	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.5	17.8	173.8	0	0	0	0	0	115.8	A726 S727	A726-G729 PolarHBondContact O-N 3.39Å; S727-G729 VanDerWaalsContact C-N 3.33Å
730	G	56.9	Low	63.7	Low	34 Å²	34	82 Å²	82	35%	0.351	46%	0.463	S	S	.	.			trans	-75.6	172.6	171.4	0	0	0	0	0	114.3	M725	M725-G730 PolarHBondContact O-N 2.9Å
731	P	51.8	Low	63.2	Low	79 Å²	79	79.2 Å²	79.2	51%	0.513	44%	0.443	S	S	.	.			trans	-55.3	149.9	177.6	-21.4	30.1	0	0	0	113.3	Y733	P731-Y733 HydrophobicContact CB-CD1 4.47Å; P731-Y733 HydrophobicContact CB-CE1 3.89Å; P731-Y733 HydrophobicContact CB-CE2 3.92Å; P731-Y733 WeakPolarHBondContact CD-OH 3.39Å; P731-Y733 HydrophobicContact CG-CE1 4.18Å; P731-Y733 HydrophobicContact CG-CE2 4.11Å; P731-Y733 WeakPolarHBondContact CG-OH 3.38Å; P731-Y733 WeakPolarHBondContact O-CD2 3.17Å; P731-Y733 WeakPolarHBondContact O-CE2 3.43Å; P731-Y733 PolarHBondContact O-N 3.33Å
732	K	53.8	Low	63	Low	216 Å²	216	81.5 Å²	81.5	94%	0.939	45%	0.447	S	S	*	.			trans	-69.6	111.9	168.7	-74.2	-177.8	177	179.8	0	108.9
733	Y	56.1	Low	62.8	Low	119 Å²	119	80.6 Å²	80.6	47%	0.467	44%	0.444	S	S	.	.			trans	-103.1	145.6	179.9	-60.8	-74.4	0	0	0	111.4	P731	P731-Y733 HydrophobicContact CB-CD1 4.47Å; P731-Y733 HydrophobicContact CB-CE1 3.89Å; P731-Y733 HydrophobicContact CB-CE2 3.92Å; P731-Y733 WeakPolarHBondContact CD-OH 3.39Å; P731-Y733 HydrophobicContact CG-CE1 4.18Å; P731-Y733 HydrophobicContact CG-CE2 4.11Å; P731-Y733 WeakPolarHBondContact CG-OH 3.38Å; P731-Y733 WeakPolarHBondContact O-CD2 3.17Å; P731-Y733 WeakPolarHBondContact O-CE2 3.43Å; P731-Y733 PolarHBondContact O-N 3.33Å
734	T	59.3	Low	62.8	Low	73 Å²	73	80 Å²	80	45%	0.448	45%	0.452	S	S	.	.			trans	-102.1	120.5	166.5	-48.1	0	0	0	0	107.8	S736 Q737	T734-S736 VanDerWaalsContact CG2-OG 3.28Å; T734-S736 WeakPolarHBondContact CG2-OG 3.47Å; T734-S736 PolarHBondContact O-N 2.92Å; T734-S736 VanDerWaalsContact O-N 3.16Å; T734-Q737 PolarHBondContact O-N 2.92Å; T734-Q737 VanDerWaalsContact O-N 3.1Å
735	L	60.1	Low	62.9	Low	13 Å²	13	81.4 Å²	81.4	7%	0.068	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-58.3	-30.1	-174.7	-74.8	-178.6	0	0	0	113.2	V719 L722 Q737 Q738 A741 E803	V719-L735 HydrophobicContact CG1-CD1 3.8Å; V719-L735 HydrophobicContact CG1-CD2 4.49Å; L722-L735 HydrophobicContact CD1-CD2 3.98Å; L735-Q737 PolarHBondContact O-N 3Å; L735-Q738 PolarHBondContact O-N 3.49Å; L735-A741 VanDerWaalsContact O-CB 3.3Å; L735-A741 WeakPolarHBondContact O-CB 3.43Å; L735-E803 HydrophobicContact CD1-CB 3.63Å; L735-E803 HydrophobicContact CD1-CG 3.47Å; L735-E803 VanDerWaalsContact CD1-CG 3.47Å; L735-E803 WeakPolarHBondContact CD1-OE2 3.46Å
736	S	57.8	Low	63.3	Low	44 Å²	44	75.7 Å²	75.7	31%	0.308	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-65.3	-18.2	178	59.4	0	0	0	0	115.1	T734	T734-S736 VanDerWaalsContact CG2-OG 3.28Å; T734-S736 WeakPolarHBondContact CG2-OG 3.47Å; T734-S736 PolarHBondContact O-N 2.92Å; T734-S736 VanDerWaalsContact O-N 3.16Å
737	Q	63	Low	63.9	Low	153 Å²	153	74.9 Å²	74.9	72%	0.715	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-84.6	-13.4	178.4	-66.9	-177.7	-3.7	0	0	113.5	T734 L735	T734-Q737 PolarHBondContact O-N 2.92Å; T734-Q737 VanDerWaalsContact O-N 3.1Å; L735-Q737 PolarHBondContact O-N 3Å
738	Q	65	Low	64.7	Low	52 Å²	52	75.2 Å²	75.2	24%	0.243	41%	0.409	C	S	.	.	S	Bend	trans	-77	134.8	178.4	-67.9	-66.5	-31.8	0	0	110.3	L722 L735 W740 A741 Q742	L722-Q738 HydrophobicContact CD1-CG 4.41Å; L735-Q738 PolarHBondContact O-N 3.49Å; Q738-W740 HydrophobicContact CB-CD2 4.45Å; Q738-W740 HydrophobicContact CB-CZ2 4.45Å; Q738-W740 HydrophobicContact CG-CZ2 4.48Å; Q738-W740 PolarHBondContact O-N 2.72Å; Q738-A741 HydrophobicContact CB-CB 4.16Å; Q738-A741 PolarHBondContact O-N 2.98Å; Q738-Q742 PolarHBondContact O-N 3.4Å
739	P	63.1	Low	65.5	Low	80 Å²	80	68.8 Å²	68.8	52%	0.519	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.2	-173.4	23.4	-32.2	0	0	0	114.3	K745	P739-K745 VanDerWaalsContact O-CD 3.23Å; P739-K745 WeakPolarHBondContact O-CD 3.41Å; P739-K745 WeakPolarHBondContact O-CE 3.24Å; P739-K745 PolarHBondContact O-NZ 3Å
740	W	68.8	Low	66.7	Low	79 Å²	79	65.4 Å²	65.4	30%	0.299	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-7.5	177.6	54.2	-93.5	0	0	0	113.5	F715 K718 V719 L722 Q738	F715-W740 AromaticContact CD2-CE3 3.95Å; F715-W740 HydrophobicContact CD2-CE3 3.95Å; F715-W740 AromaticContact CD2-CZ3 3.87Å; F715-W740 HydrophobicContact CD2-CZ3 3.87Å; F715-W740 AromaticContact CE2-CE3 3.77Å; F715-W740 HydrophobicContact CE2-CE3 3.77Å; F715-W740 AromaticContact CE2-CZ3 3.65Å; F715-W740 HydrophobicContact CE2-CZ3 3.65Å; F715-W740 HydrophobicContact CZ-CZ3 4.45Å; K718-W740 HydrophobicContact CB-CH2 3.73Å; K718-W740 HydrophobicContact CB-CZ2 4.28Å; K718-W740 HydrophobicContact CB-CZ3 3.97Å; V719-W740 HydrophobicContact CG2-CH2 4.08Å; V719-W740 HydrophobicContact CG2-CZ3 3.93Å; L722-W740 HydrophobicContact CD1-CH2 3.71Å; L722-W740 HydrophobicContact CD1-CZ2 3.43Å; L722-W740 VanDerWaalsContact CD1-CZ2 3.43Å; L722-W740 HydrophobicContact CG-CZ2 4.29Å; Q738-W740 HydrophobicContact CB-CD2 4.45Å; Q738-W740 HydrophobicContact CB-CZ2 4.45Å; Q738-W740 HydrophobicContact CG-CZ2 4.48Å; Q738-W740 PolarHBondContact O-N 2.72Å
741	A	66.4	Low	67.9	Low	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.349	C	S	.	.	S	Bend	trans	-117.5	20.6	-179.9	0	0	0	0	0	113	F715 L735 Q738	F715-A741 HydrophobicContact CE2-CB 4.19Å; L735-A741 VanDerWaalsContact O-CB 3.3Å; L735-A741 WeakPolarHBondContact O-CB 3.43Å; Q738-A741 HydrophobicContact CB-CB 4.16Å; Q738-A741 PolarHBondContact O-N 2.98Å
742	Q	74.6	Confident	69.3	Low	90 Å²	90	65.5 Å²	65.5	42%	0.421	34%	0.343	S	S	.	.			trans	-62.8	141	169.2	-71	-178.4	-19.3	0	0	110.4	Q738 A744 K745 V746	Q738-Q742 PolarHBondContact O-N 3.4Å; Q742-A744 PolarHBondContact O-N 3.29Å; Q742-A744 VanDerWaalsContact O-N 3.09Å; Q742-K745 PolarHBondContact O-N 3.39Å; Q742-V746 WeakPolarHBondContact O-CG2 3.29Å; Q742-V746 PolarHBondContact O-N 3.28Å
743	P	68.1	Low	70.6	Confident	20 Å²	20	55.3 Å²	55.3	13%	0.13	30%	0.299	C	S	.	.	H	α-helix	trans	-50.7	-39	-177.4	-29.4	34.7	0	0	0	114.2	V746 S747 F804 D808 I811 I812	P743-V746 PolarHBondContact O-N 3.37Å; P743-S747 WeakPolarHBondContact O-CB 3.43Å; P743-S747 PolarHBondContact O-N 3.06Å; P743-F804 HydrophobicContact CG-CE1 4.49Å; P743-D808 HydrophobicContact CB-CB 4.47Å; P743-D808 HydrophobicContact CG-CB 4.08Å; P743-I811 HydrophobicContact CB-CB 4.43Å; P743-I811 HydrophobicContact CB-CG2 4.03Å; P743-I812 HydrophobicContact CB-CD1 4.4Å; P743-I812 HydrophobicContact CB-CG1 4.02Å; P743-I812 WeakPolarHBondContact O-CG1 3.45Å
744	A	71.8	Confident	71.8	Confident	55 Å²	55	52.8 Å²	52.8	46%	0.455	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-42	176.4	0	0	0	0	0	113.1	Q742 S747 D748	Q742-A744 PolarHBondContact O-N 3.29Å; Q742-A744 VanDerWaalsContact O-N 3.09Å; A744-S747 WeakPolarHBondContact O-CB 3.34Å; A744-S747 PolarHBondContact O-N 2.89Å; A744-D748 PolarHBondContact O-N 3.47Å
745	K	74.1	Confident	72.9	Confident	102 Å²	102	56.4 Å²	56.4	44%	0.443	30%	0.299	S	S	.	.	H	α-helix	trans	-74	-31.1	179.4	-66.3	-174.2	-178	-177.8	0	112.6	P739 Q742 D748 L749	P739-K745 VanDerWaalsContact O-CD 3.23Å; P739-K745 WeakPolarHBondContact O-CD 3.41Å; P739-K745 WeakPolarHBondContact O-CE 3.24Å; P739-K745 PolarHBondContact O-NZ 3Å; Q742-K745 PolarHBondContact O-N 3.39Å; K745-D748 PolarHBondContact O-N 2.9Å; K745-L749 WeakPolarHBondContact O-CB 3.17Å; K745-L749 PolarHBondContact O-N 3.5Å
746	V	75.5	Confident	73.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-71.1	-35.4	173.2	-178.7	0	0	0	0	110.4	F715 Q742 P743 L749 A750 F796 L800 F804 I812	F715-V746 HydrophobicContact CE2-CG2 3.97Å; F715-V746 HydrophobicContact CZ-CG1 4.43Å; F715-V746 HydrophobicContact CZ-CG2 3.84Å; Q742-V746 WeakPolarHBondContact O-CG2 3.29Å; Q742-V746 PolarHBondContact O-N 3.28Å; P743-V746 PolarHBondContact O-N 3.37Å; V746-L749 PolarHBondContact O-N 2.9Å; V746-A750 WeakPolarHBondContact O-CB 3.36Å; V746-A750 PolarHBondContact O-N 3.22Å; V746-F796 HydrophobicContact CG1-CE2 4.25Å; V746-F796 HydrophobicContact CG1-CZ 3.75Å; V746-L800 HydrophobicContact CG1-CD2 3.93Å; V746-F804 HydrophobicContact CG2-CZ 4.36Å; V746-I812 HydrophobicContact CB-CD1 4.39Å; V746-I812 HydrophobicContact CB-CG1 4.29Å; V746-I812 HydrophobicContact CG1-CD1 4.17Å; V746-I812 HydrophobicContact CG1-CG1 4.33Å; V746-I812 HydrophobicContact CG1-CG2 3.96Å
747	S	77.4	Confident	75.1	Confident	27 Å²	27	55.7 Å²	55.7	19%	0.189	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-48.9	169.1	-164.8	0	0	0	0	111.6	P743 A744 L749 A750 A751 I812	P743-S747 WeakPolarHBondContact O-CB 3.43Å; P743-S747 PolarHBondContact O-N 3.06Å; A744-S747 WeakPolarHBondContact O-CB 3.34Å; A744-S747 PolarHBondContact O-N 2.89Å; S747-L749 VanDerWaalsContact C-N 3.28Å; S747-L749 PolarHBondContact O-N 3.49Å; S747-A750 PolarHBondContact O-N 3.39Å; S747-A751 VanDerWaalsContact O-CB 3.29Å; S747-A751 WeakPolarHBondContact O-CB 3.18Å; S747-A751 PolarHBondContact O-N 2.82Å; S747-I812 WeakPolarHBondContact CA-O 3.5Å; S747-I812 VanDerWaalsContact CB-O 3.31Å; S747-I812 WeakPolarHBondContact CB-O 3.39Å; S747-I812 PolarHBondContact OG-O 2.95Å
748	D	79.2	Confident	76	Confident	102 Å²	102	55 Å²	55	55%	0.545	29%	0.287	S	S	.	.	H	α-helix	trans	-60	-39	177.3	-71.5	-26.5	0	0	0	111.7	A744 K745 T752	A744-D748 PolarHBondContact O-N 3.47Å; K745-D748 PolarHBondContact O-N 2.9Å; D748-T752 VanDerWaalsContact O-CB 3.24Å; D748-T752 WeakPolarHBondContact O-CB 3.33Å; D748-T752 PolarHBondContact O-N 2.91Å; D748-T752 PolarHBondContact O-OG1 3.38Å
749	L	80	Confident	76.9	Confident	34 Å²	34	56.3 Å²	56.3	18%	0.178	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-48.5	175.7	-170.3	74.1	0	0	0	111.8	Q711 L712 F715 K745 V746 S747 T752 A753	Q711-L749 HydrophobicContact CB-CD1 3.86Å; L712-L749 HydrophobicContact CD2-CD2 4.12Å; L712-L749 HydrophobicContact CD2-CG 4.21Å; F715-L749 HydrophobicContact CB-CD2 3.51Å; F715-L749 HydrophobicContact CD1-CD2 4.19Å; F715-L749 HydrophobicContact CD2-CD2 3.9Å; F715-L749 HydrophobicContact CG-CD2 3.6Å; K745-L749 WeakPolarHBondContact O-CB 3.17Å; K745-L749 PolarHBondContact O-N 3.5Å; V746-L749 PolarHBondContact O-N 2.9Å; S747-L749 VanDerWaalsContact C-N 3.28Å; S747-L749 PolarHBondContact O-N 3.49Å; L749-T752 PolarHBondContact O-N 2.67Å; L749-A753 WeakPolarHBondContact O-CB 3.38Å; L749-A753 PolarHBondContact O-N 3.19Å
750	A	78.6	Confident	77.8	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-64.8	-40.8	178.3	0	0	0	0	0	111.9	V746 S747 A753 Y754 F796	V746-A750 WeakPolarHBondContact O-CB 3.36Å; V746-A750 PolarHBondContact O-N 3.22Å; S747-A750 PolarHBondContact O-N 3.39Å; A750-A753 PolarHBondContact O-N 2.75Å; A750-Y754 WeakPolarHBondContact O-CB 3.46Å; A750-Y754 PolarHBondContact O-N 3.33Å; A750-F796 HydrophobicContact CB-CE1 4.21Å
751	A	80.9	Confident	78.4	Confident	54 Å²	54	54.2 Å²	54.2	45%	0.446	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-39.1	175.9	0	0	0	0	0	111.9	S747 Y754 K755	S747-A751 VanDerWaalsContact O-CB 3.29Å; S747-A751 WeakPolarHBondContact O-CB 3.18Å; S747-A751 PolarHBondContact O-N 2.82Å; A751-Y754 PolarHBondContact O-N 3.49Å; A751-K755 VanDerWaalsContact O-CB 3.24Å; A751-K755 WeakPolarHBondContact O-CB 3.47Å; A751-K755 PolarHBondContact O-N 3.44Å
752	T	82.5	Confident	79.2	Confident	61 Å²	61	57.9 Å²	57.9	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-68	-43.8	176.9	-55.4	0	0	0	0	111.1	Q711 D748 L749 Y754 K755 T756	Q711-T752 VanDerWaalsContact OE1-CG2 3.28Å; D748-T752 VanDerWaalsContact O-CB 3.24Å; D748-T752 WeakPolarHBondContact O-CB 3.33Å; D748-T752 PolarHBondContact O-N 2.91Å; D748-T752 PolarHBondContact O-OG1 3.38Å; L749-T752 PolarHBondContact O-N 2.67Å; T752-Y754 PolarHBondContact O-N 3Å; T752-K755 PolarHBondContact O-N 3.07Å; T752-T756 WeakPolarHBondContact O-CB 3.31Å; T752-T756 PolarHBondContact O-N 2.97Å; T752-T756 PolarHBondContact O-OG1 2.96Å
753	A	80.1	Confident	79.5	Confident	3 Å²	3	58 Å²	58	3%	0.025	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-44.2	174.1	0	0	0	0	0	112	L712 L749 A750 K755 T756 L757 F793	L712-A753 HydrophobicContact CD1-CB 3.57Å; L712-A753 HydrophobicContact CD2-CB 4.38Å; L712-A753 HydrophobicContact CG-CB 3.8Å; L749-A753 WeakPolarHBondContact O-CB 3.38Å; L749-A753 PolarHBondContact O-N 3.19Å; A750-A753 PolarHBondContact O-N 2.75Å; A753-K755 PolarHBondContact O-N 2.74Å; A753-T756 PolarHBondContact O-N 2.72Å; A753-L757 WeakPolarHBondContact O-CB 3.37Å; A753-L757 PolarHBondContact O-N 3.01Å; A753-F793 HydrophobicContact CB-CZ 4.29Å
754	Y	81.2	Confident	80.2	Confident	65 Å²	65	57.1 Å²	57.1	26%	0.255	31%	0.309	S	S	.	.	H	α-helix	trans	-65.6	-38.2	176.9	-171.4	-102.5	0	0	0	112.8	A750 A751 T752 L757 K758 P815 L820 L823	A750-Y754 WeakPolarHBondContact O-CB 3.46Å; A750-Y754 PolarHBondContact O-N 3.33Å; A751-Y754 PolarHBondContact O-N 3.49Å; T752-Y754 PolarHBondContact O-N 3Å; Y754-L757 PolarHBondContact O-N 2.98Å; Y754-K758 WeakPolarHBondContact O-CB 3.33Å; Y754-K758 PolarHBondContact O-N 3.26Å; Y754-P815 HydrophobicContact CD2-CB 3.87Å; Y754-P815 HydrophobicContact CD2-CG 3.67Å; Y754-P815 HydrophobicContact CE2-CB 3.95Å; Y754-P815 HydrophobicContact CE2-CG 4.27Å; Y754-P815 HydrophobicContact CG-CB 4.49Å; Y754-P815 HydrophobicContact CG-CG 4.11Å; Y754-L820 HydrophobicContact CD2-CD2 4.03Å; Y754-L820 HydrophobicContact CE2-CD2 4.24Å; Y754-L823 HydrophobicContact CE2-CD1 3.94Å; Y754-L823 WeakPolarHBondContact OH-CD1 3.31Å
755	K	82.6	Confident	80.6	Confident	150 Å²	150	55.5 Å²	55.5	65%	0.652	29%	0.293	S	S	*	.	H	α-helix	trans	-67.1	-40.1	174.9	-173.2	178.2	179.4	-179.2	0	111.9	A751 T752 A753 K758 T759	A751-K755 VanDerWaalsContact O-CB 3.24Å; A751-K755 WeakPolarHBondContact O-CB 3.47Å; A751-K755 PolarHBondContact O-N 3.44Å; T752-K755 PolarHBondContact O-N 3.07Å; A753-K755 PolarHBondContact O-N 2.74Å; K755-K758 PolarHBondContact O-N 3.44Å; K755-T759 WeakPolarHBondContact O-CB 3.36Å; K755-T759 WeakPolarHBondContact O-CG2 3.31Å; K755-T759 PolarHBondContact O-N 2.87Å; K755-T759 PolarHBondContact O-OG1 2.86Å
756	T	82.1	Confident	81	Confident	39 Å²	39	58.2 Å²	58.2	24%	0.239	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-44.8	173.9	-60.7	0	0	0	0	110.6	T752 A753 K758 T759 K760	T752-T756 WeakPolarHBondContact O-CB 3.31Å; T752-T756 PolarHBondContact O-N 2.97Å; T752-T756 PolarHBondContact O-OG1 2.96Å; A753-T756 PolarHBondContact O-N 2.72Å; T756-K758 PolarHBondContact O-N 3.37Å; T756-T759 PolarHBondContact O-N 3.28Å; T756-T759 PolarHBondContact O-OG1 2.88Å; T756-K760 HydrophobicContact CG2-CG 4.17Å; T756-K760 WeakPolarHBondContact O-CB 3.44Å; T756-K760 PolarHBondContact O-N 3.4Å
757	L	82.2	Confident	81.2	Confident	2 Å²	2	59 Å²	59	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-48.8	174.5	-169.2	68.2	0	0	0	111.3	F708 A753 Y754 T759 L761 I789 L820 L823 L824	F708-L757 HydrophobicContact CB-CD1 4.27Å; F708-L757 HydrophobicContact CD1-CD1 3.66Å; F708-L757 HydrophobicContact CE1-CD1 4.14Å; F708-L757 HydrophobicContact CG-CD1 3.97Å; A753-L757 WeakPolarHBondContact O-CB 3.37Å; A753-L757 PolarHBondContact O-N 3.01Å; Y754-L757 PolarHBondContact O-N 2.98Å; L757-T759 VanDerWaalsContact C-N 3.32Å; L757-T759 PolarHBondContact O-N 2.89Å; L757-L761 WeakPolarHBondContact O-CB 3.37Å; L757-L761 PolarHBondContact O-N 2.91Å; L757-L761 VanDerWaalsContact O-N 3.08Å; L757-I789 HydrophobicContact CD1-CD1 4.16Å; L757-L820 HydrophobicContact CD2-CD2 3.92Å; L757-L823 HydrophobicContact CD2-CD2 3.79Å; L757-L823 HydrophobicContact CG-CD2 3.77Å; L757-L824 HydrophobicContact CD1-CD2 4.19Å; L757-L824 HydrophobicContact CD2-CD2 4.46Å
758	K	81.5	Confident	81.4	Confident	139 Å²	139	57.7 Å²	57.7	60%	0.604	30%	0.297	S	S	*	.	H	α-helix	trans	-63.6	-32.3	-179.2	-170.5	175.2	-179.6	178.6	0	114	Y754 K755 T756 P762 L823	Y754-K758 WeakPolarHBondContact O-CB 3.33Å; Y754-K758 PolarHBondContact O-N 3.26Å; K755-K758 PolarHBondContact O-N 3.44Å; T756-K758 PolarHBondContact O-N 3.37Å; K758-P762 WeakPolarHBondContact O-CD 3.31Å; K758-L823 HydrophobicContact CB-CD1 4.5Å
759	T	83.7	Confident	81.4	Confident	80 Å²	80	55.4 Å²	55.4	49%	0.491	29%	0.288	S	S	.	.	H	α-helix	trans	-91.2	-38.1	-175.3	51.8	0	0	0	0	113.2	K755 T756 L757	K755-T759 WeakPolarHBondContact O-CB 3.36Å; K755-T759 WeakPolarHBondContact O-CG2 3.31Å; K755-T759 PolarHBondContact O-N 2.87Å; K755-T759 PolarHBondContact O-OG1 2.86Å; T756-T759 PolarHBondContact O-N 3.28Å; T756-T759 PolarHBondContact O-OG1 2.88Å; L757-T759 VanDerWaalsContact C-N 3.32Å; L757-T759 PolarHBondContact O-N 2.89Å
760	K	82.1	Confident	81.4	Confident	107 Å²	107	55 Å²	55	47%	0.465	29%	0.287	S	S	.	.	H	α-helix	trans	-90	-30	-175.9	-64	-66.6	-174.6	175.8	0	113.2	F708 T756 V763 T764	F708-K760 HydrophobicContact CE1-CB 3.81Å; T756-K760 HydrophobicContact CG2-CG 4.17Å; T756-K760 WeakPolarHBondContact O-CB 3.44Å; T756-K760 PolarHBondContact O-N 3.4Å; K760-V763 PolarHBondContact O-N 3.46Å; K760-T764 PolarHBondContact O-N 2.84Å; K760-T764 PolarHBondContact O-OG1 2.97Å
761	L	82.4	Confident	81.3	Confident	7 Å²	7	55 Å²	55	4%	0.037	29%	0.286	C	S	.	.	H	α-helix	trans	-58.1	-47.3	-178.6	178.4	67.7	0	0	0	113.5	F708 L757 V763 T764 L765 F782 L823 L824	F708-L761 HydrophobicContact CE1-CB 4.21Å; F708-L761 HydrophobicContact CZ-CB 4.39Å; F708-L761 HydrophobicContact CZ-CD1 4.28Å; L757-L761 WeakPolarHBondContact O-CB 3.37Å; L757-L761 PolarHBondContact O-N 2.91Å; L757-L761 VanDerWaalsContact O-N 3.08Å; L761-V763 VanDerWaalsContact C-N 3.26Å; L761-V763 PolarHBondContact O-N 3.37Å; L761-T764 PolarHBondContact O-N 3Å; L761-L765 HydrophobicContact CD1-CD1 4.08Å; L761-L765 HydrophobicContact CD1-CG 4.21Å; L761-L765 HydrophobicContact CG-CD1 4.02Å; L761-L765 WeakPolarHBondContact O-CG 3.35Å; L761-L765 PolarHBondContact O-N 3.13Å; L761-F782 HydrophobicContact CD1-CE1 4.49Å; L761-F782 HydrophobicContact CD1-CE2 3.68Å; L761-F782 HydrophobicContact CD1-CZ 3.41Å; L761-F782 VanDerWaalsContact CD1-CZ 3.41Å; L761-L823 HydrophobicContact CD2-CD2 3.62Å; L761-L824 HydrophobicContact CD2-CD2 4.27Å
762	P	82	Confident	81.2	Confident	77 Å²	77	53 Å²	53	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-65.4	-30.7	179.3	-20.9	34.2	0	0	0	113	K758 R766	K758-P762 WeakPolarHBondContact O-CD 3.31Å; P762-R766 VanDerWaalsContact O-CB 3.28Å; P762-R766 WeakPolarHBondContact O-CB 3.35Å; P762-R766 PolarHBondContact O-N 3.14Å
763	V	82.3	Confident	80.4	Confident	92 Å²	92	53.3 Å²	53.3	56%	0.558	27%	0.272	S	S	*	.	H	α-helix	trans	-70.4	-45.7	178.2	-178.5	0	0	0	0	110.2	K760 L761 R766 S767	K760-V763 PolarHBondContact O-N 3.46Å; L761-V763 VanDerWaalsContact C-N 3.26Å; L761-V763 PolarHBondContact O-N 3.37Å; V763-R766 PolarHBondContact O-N 2.99Å; V763-S767 PolarHBondContact O-N 2.97Å; V763-S767 PolarHBondContact O-OG 3.29Å
764	T	81.4	Confident	80.2	Confident	3 Å²	3	57 Å²	57	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-62	-47	176.5	-55.3	0	0	0	0	111.2	F700 Q704 K760 L761 R766 S767 M768	F700-T764 HydrophobicContact CZ-CG2 4.31Å; Q704-T764 HydrophobicContact CG-CG2 4.34Å; Q704-T764 PolarHBondContact OE1-OG1 3.28Å; K760-T764 PolarHBondContact O-N 2.84Å; K760-T764 PolarHBondContact O-OG1 2.97Å; L761-T764 PolarHBondContact O-N 3Å; T764-R766 VanDerWaalsContact C-N 3.35Å; T764-R766 PolarHBondContact O-N 2.97Å; T764-S767 WeakPolarHBondContact CA-OG 3.43Å; T764-S767 PolarHBondContact O-N 3.35Å; T764-S767 PolarHBondContact O-OG 3.47Å; T764-M768 HydrophobicContact CG2-SD 4.19Å; T764-M768 WeakPolarHBondContact O-CG 3.48Å; T764-M768 PolarHBondContact O-N 3.3Å
765	L	80.7	Confident	79.9	Confident	21 Å²	21	60.7 Å²	60.7	11%	0.11	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-41.7	177.1	-70.1	172.9	0	0	0	111.9	L761 S767 M768 S769 F782	L761-L765 HydrophobicContact CD1-CD1 4.08Å; L761-L765 HydrophobicContact CD1-CG 4.21Å; L761-L765 HydrophobicContact CG-CD1 4.02Å; L761-L765 WeakPolarHBondContact O-CG 3.35Å; L761-L765 PolarHBondContact O-N 3.13Å; L765-S767 PolarHBondContact O-N 2.99Å; L765-M768 PolarHBondContact O-N 3.45Å; L765-S769 PolarHBondContact O-N 3.49Å; L765-S769 PolarHBondContact O-OG 3.38Å; L765-F782 HydrophobicContact CD2-CD1 4.38Å; L765-F782 HydrophobicContact CD2-CD2 4.03Å; L765-F782 HydrophobicContact CD2-CE1 4.5Å; L765-F782 HydrophobicContact CD2-CE2 4.17Å; L765-F782 HydrophobicContact CD2-CG 4.17Å; L765-F782 HydrophobicContact CD2-CZ 4.43Å
766	R	81.7	Confident	79.6	Confident	158 Å²	158	58.9 Å²	58.9	60%	0.596	31%	0.306	S	S	*	.	H	α-helix	trans	-60.4	-46.8	174.7	-173.3	175.2	-176.8	163.2	2.5	111.7	P762 V763 T764 M768 S769 L770	P762-R766 VanDerWaalsContact O-CB 3.28Å; P762-R766 WeakPolarHBondContact O-CB 3.35Å; P762-R766 PolarHBondContact O-N 3.14Å; V763-R766 PolarHBondContact O-N 2.99Å; T764-R766 VanDerWaalsContact C-N 3.35Å; T764-R766 PolarHBondContact O-N 2.97Å; R766-M768 VanDerWaalsContact C-N 3.34Å; R766-M768 PolarHBondContact O-N 3.37Å; R766-S769 PolarHBondContact O-N 2.93Å; R766-S769 PolarHBondContact O-OG 3.42Å; R766-L770 WeakPolarHBondContact O-CB 3.4Å; R766-L770 PolarHBondContact O-N 3.48Å
767	S	79.9	Confident	79.6	Confident	17 Å²	17	59.1 Å²	59.1	12%	0.119	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-40.6	175	55.4	0	0	0	0	112.3	V763 T764 L765 S769 L770 Y771	V763-S767 PolarHBondContact O-N 2.97Å; V763-S767 PolarHBondContact O-OG 3.29Å; T764-S767 WeakPolarHBondContact CA-OG 3.43Å; T764-S767 PolarHBondContact O-N 3.35Å; T764-S767 PolarHBondContact O-OG 3.47Å; L765-S767 PolarHBondContact O-N 2.99Å; S767-S769 PolarHBondContact O-N 2.94Å; S767-L770 PolarHBondContact O-N 3.25Å; S767-Y771 VanDerWaalsContact O-CD2 3.32Å; S767-Y771 WeakPolarHBondContact O-CD2 3.43Å; S767-Y771 PolarHBondContact O-N 3.38Å; S767-Y771 VanDerWaalsContact O-N 3.11Å
768	M	81.4	Confident	79.5	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-45.9	176.8	-73.4	178.5	63.9	0	0	111.4	L610 F700 T764 L765 R766 L770 Y771 L772 E778 L781 F782	L610-M768 HydrophobicContact CD1-CG 4.24Å; L610-M768 HydrophobicContact CD2-CG 4.01Å; F700-M768 HydrophobicContact CE1-CE 4.47Å; F700-M768 HydrophobicContact CE1-SD 4.01Å; F700-M768 HydrophobicContact CZ-CG 4.06Å; F700-M768 HydrophobicContact CZ-SD 3.86Å; T764-M768 HydrophobicContact CG2-SD 4.19Å; T764-M768 WeakPolarHBondContact O-CG 3.48Å; T764-M768 PolarHBondContact O-N 3.3Å; L765-M768 PolarHBondContact O-N 3.45Å; R766-M768 VanDerWaalsContact C-N 3.34Å; R766-M768 PolarHBondContact O-N 3.37Å; M768-L770 VanDerWaalsContact C-N 3.27Å; M768-L770 PolarHBondContact O-N 2.9Å; M768-Y771 PolarHBondContact O-N 2.89Å; M768-L772 WeakPolarHBondContact O-CA 3.3Å; M768-L772 VanDerWaalsContact O-CB 3.27Å; M768-L772 WeakPolarHBondContact O-CB 3.28Å; M768-L772 PolarHBondContact O-N 3.2Å; M768-E778 HydrophobicContact CB-CG 4.09Å; M768-E778 HydrophobicContact CE-CG 3.87Å; M768-L781 HydrophobicContact CE-CB 4.01Å; M768-L781 HydrophobicContact CE-CD2 3.54Å; M768-L781 HydrophobicContact CE-CG 4.32Å; M768-L781 HydrophobicContact SD-CD2 4.48Å; M768-F782 HydrophobicContact CE-CB 4.03Å; M768-F782 HydrophobicContact SD-CD2 4.36Å
769	S	80.7	Confident	79.5	Confident	53 Å²	53	58.5 Å²	58.5	37%	0.371	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-30	177.8	70.2	0	0	0	0	113.8	L765 R766 S767	L765-S769 PolarHBondContact O-N 3.49Å; L765-S769 PolarHBondContact O-OG 3.38Å; R766-S769 PolarHBondContact O-N 2.93Å; R766-S769 PolarHBondContact O-OG 3.42Å; S767-S769 PolarHBondContact O-N 2.94Å
770	L	78.9	Confident	79.6	Confident	27 Å²	27	60.2 Å²	60.2	14%	0.141	31%	0.31	C	S	.	.	H	α-helix	trans	-77.6	-33.3	-179.3	179.6	147.5	0	0	0	112	L492 V493 R766 S767 M768	L492-L770 HydrophobicContact CB-CD2 3.46Å; L492-L770 VanDerWaalsContact CB-CD2 3.46Å; L492-L770 HydrophobicContact CB-CG 4.06Å; L492-L770 HydrophobicContact CD1-CD2 3.54Å; L492-L770 HydrophobicContact CG-CD2 4.15Å; V493-L770 HydrophobicContact CB-CD1 4.5Å; V493-L770 HydrophobicContact CG2-CD1 3.6Å; R766-L770 WeakPolarHBondContact O-CB 3.4Å; R766-L770 PolarHBondContact O-N 3.48Å; S767-L770 PolarHBondContact O-N 3.25Å; M768-L770 VanDerWaalsContact C-N 3.27Å; M768-L770 PolarHBondContact O-N 2.9Å
771	Y	77.4	Confident	79.7	Confident	1 Å²	1	55.8 Å²	55.8	0%	0.004	29%	0.292	C	S	.	.	H	α-helix	trans	-89.7	-42	177.4	-82.2	-97.5	0	0	0	113.2	Y488 P489 L492 D607 L610 F611 K614 S767 M768	Y488-Y771 AromaticContact CD1-CE1 3.82Å; Y488-Y771 HydrophobicContact CD1-CE1 3.82Å; Y488-Y771 HydrophobicContact CE1-CD1 4.43Å; Y488-Y771 HydrophobicContact CE1-CE1 4.11Å; P489-Y771 VanDerWaalsContact CB-OH 3.26Å; P489-Y771 WeakPolarHBondContact CB-OH 3.44Å; P489-Y771 WeakPolarHBondContact CG-OH 3.46Å; L492-Y771 HydrophobicContact CD1-CD1 3.75Å; L492-Y771 HydrophobicContact CD1-CD2 4.07Å; L492-Y771 HydrophobicContact CD1-CE1 3.62Å; L492-Y771 HydrophobicContact CD1-CE2 3.96Å; L492-Y771 HydrophobicContact CD1-CG 3.98Å; D607-Y771 HydrophobicContact CB-CE2 4.5Å; D607-Y771 WeakPolarHBondContact CB-OH 3.22Å; D607-Y771 WeakPolarHBondContact OD1-CE2 3.31Å; L610-Y771 HydrophobicContact CB-CD1 3.89Å; L610-Y771 HydrophobicContact CB-CD2 4.04Å; L610-Y771 HydrophobicContact CB-CE1 4.43Å; L610-Y771 HydrophobicContact CB-CG 3.67Å; L610-Y771 HydrophobicContact CD1-CD2 4.07Å; L610-Y771 HydrophobicContact CD1-CG 4.37Å; F611-Y771 HydrophobicContact CB-CE1 3.98Å; K614-Y771 HydrophobicContact CD-CD1 4.48Å; K614-Y771 VanDerWaalsContact CD-O 3.25Å; K614-Y771 WeakPolarHBondContact CD-O 3.43Å; K614-Y771 WeakPolarHBondContact CE-O 3.42Å; S767-Y771 VanDerWaalsContact O-CD2 3.32Å; S767-Y771 WeakPolarHBondContact O-CD2 3.43Å; S767-Y771 PolarHBondContact O-N 3.38Å; S767-Y771 VanDerWaalsContact O-N 3.11Å; M768-Y771 PolarHBondContact O-N 2.89Å
772	L	78.4	Confident	79.8	Confident	10 Å²	10	56 Å²	56	5%	0.052	29%	0.293	C	S	.	.			trans	-99.7	104.3	-178.5	-56.4	174.1	0	0	0	108.7	I613 L617 M768 N774 L781	I613-L772 HydrophobicContact CG2-CD2 4.18Å; L617-L772 HydrophobicContact CD1-CD2 4.04Å; M768-L772 WeakPolarHBondContact O-CA 3.3Å; M768-L772 VanDerWaalsContact O-CB 3.27Å; M768-L772 WeakPolarHBondContact O-CB 3.28Å; M768-L772 PolarHBondContact O-N 3.2Å; L772-N774 PolarHBondContact O-N 3.22Å; L772-L781 HydrophobicContact CD1-CD2 4.34Å
773	C	65.4	Low	80	Confident	68 Å²	68	57.5 Å²	57.5	46%	0.459	29%	0.291	S	S	.	.			trans	-69.7	-15.7	-179.1	-64.1	0	0	0	0	113.4
774	N	76.6	Confident	80.2	Confident	81 Å²	81	55.3 Å²	55.3	43%	0.433	28%	0.279	S	S	.	.			trans	-102.4	116.9	-177.7	-174.1	-9.5	0	0	0	111.9	L772 D776 T777 E778	L772-N774 PolarHBondContact O-N 3.22Å; N774-D776 PolarHBondContact O-N 3.26Å; N774-D776 WeakPolarHBondContact OD1-CB 3.4Å; N774-D776 PolarHBondContact OD1-N 3.46Å; N774-T777 HydrophobicContact CB-CG2 4.17Å; N774-T777 PolarHBondContact O-N 3.03Å; N774-T777 VanDerWaalsContact O-N 3.14Å; N774-T777 PolarHBondContact O-OG1 2.97Å; N774-E778 PolarHBondContact O-N 2.95Å; N774-E778 VanDerWaalsContact O-N 3.11Å
775	K	74	Confident	80.4	Confident	142 Å²	142	55.2 Å²	55.2	62%	0.617	28%	0.278	S	S	*	.	H	α-helix	trans	-57.9	-31.7	177.1	-69.7	-166.8	170.2	-165.1	0	113.3	E778 F779	K775-E778 PolarHBondContact O-N 3.26Å; K775-F779 WeakPolarHBondContact O-CB 3.34Å; K775-F779 PolarHBondContact O-N 3.28Å
776	D	77.3	Confident	80.5	Confident	112 Å²	112	57.1 Å²	57.1	60%	0.599	28%	0.284	S	S	*	.	H	α-helix	trans	-69.6	-41.3	178.4	-64.9	-32.7	0	0	0	111.1	N774 F779 I780	N774-D776 PolarHBondContact O-N 3.26Å; N774-D776 WeakPolarHBondContact OD1-CB 3.4Å; N774-D776 PolarHBondContact OD1-N 3.46Å; D776-F779 PolarHBondContact O-N 3.41Å; D776-I780 WeakPolarHBondContact O-CB 3.29Å; D776-I780 WeakPolarHBondContact O-CD1 3.39Å; D776-I780 WeakPolarHBondContact O-CG1 3.32Å; D776-I780 PolarHBondContact O-N 3.35Å
777	T	80.7	Confident	80.8	Confident	45 Å²	45	52.7 Å²	52.7	28%	0.276	27%	0.272	S	S	.	.	H	α-helix	trans	-67.5	-37.4	176.6	58.5	0	0	0	0	112.1	N774 I780 L781	N774-T777 HydrophobicContact CB-CG2 4.17Å; N774-T777 PolarHBondContact O-N 3.03Å; N774-T777 VanDerWaalsContact O-N 3.14Å; N774-T777 PolarHBondContact O-OG1 2.97Å; T777-I780 PolarHBondContact O-N 3.24Å; T777-L781 WeakPolarHBondContact O-CB 3.4Å; T777-L781 PolarHBondContact O-N 3.39Å
778	E	81.9	Confident	81.1	Confident	28 Å²	28	54.5 Å²	54.5	13%	0.131	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-48.8	172.6	-173.3	-172.1	167.7	0	0	110.7	M768 N774 K775 I780 L781 F782	M768-E778 HydrophobicContact CB-CG 4.09Å; M768-E778 HydrophobicContact CE-CG 3.87Å; N774-E778 PolarHBondContact O-N 2.95Å; N774-E778 VanDerWaalsContact O-N 3.11Å; K775-E778 PolarHBondContact O-N 3.26Å; E778-I780 PolarHBondContact O-N 3.38Å; E778-L781 PolarHBondContact O-N 3.05Å; E778-F782 VanDerWaalsContact O-CB 3.29Å; E778-F782 WeakPolarHBondContact O-CB 3.4Å; E778-F782 PolarHBondContact O-N 3.47Å
779	F	81.6	Confident	81.2	Confident	100 Å²	100	54.5 Å²	54.5	44%	0.439	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-43.3	178.9	-178.4	-98.9	0	0	0	112.4	K775 D776 L781 F782 K783	K775-F779 WeakPolarHBondContact O-CB 3.34Å; K775-F779 PolarHBondContact O-N 3.28Å; D776-F779 PolarHBondContact O-N 3.41Å; F779-L781 VanDerWaalsContact C-N 3.35Å; F779-L781 PolarHBondContact O-N 2.99Å; F779-F782 PolarHBondContact O-N 3.04Å; F779-K783 HydrophobicContact CE1-CD 4.24Å; F779-K783 VanDerWaalsContact O-CB 3.23Å; F779-K783 WeakPolarHBondContact O-CB 3.27Å; F779-K783 PolarHBondContact O-N 2.93Å
780	I	83.9	Confident	81.4	Confident	115 Å²	115	53.6 Å²	53.6	59%	0.59	27%	0.27	S	S	*	.	H	α-helix	trans	-62.1	-42.7	178	-69.7	164.2	0	0	0	111	D776 T777 E778 P784	D776-I780 WeakPolarHBondContact O-CB 3.29Å; D776-I780 WeakPolarHBondContact O-CD1 3.39Å; D776-I780 WeakPolarHBondContact O-CG1 3.32Å; D776-I780 PolarHBondContact O-N 3.35Å; T777-I780 PolarHBondContact O-N 3.24Å; E778-I780 PolarHBondContact O-N 3.38Å; I780-P784 WeakPolarHBondContact O-CD 3.35Å
781	L	84.1	Confident	81.7	Confident	15 Å²	15	57 Å²	57	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-71.6	-37.5	179.6	-162.3	94.8	0	0	0	112.2	I613 C697 F700 M768 L772 T777 E778 F779 P784	I613-L781 HydrophobicContact CD1-CD1 4.27Å; I613-L781 HydrophobicContact CD1-CD2 4.43Å; C697-L781 HydrophobicContact CB-CD1 3.87Å; C697-L781 VanDerWaalsContact SG-CD1 3.59Å; F700-L781 HydrophobicContact CD1-CD2 3.46Å; F700-L781 VanDerWaalsContact CD1-CD2 3.46Å; F700-L781 HydrophobicContact CD1-CG 4.12Å; F700-L781 HydrophobicContact CE1-CD2 3.36Å; F700-L781 HydrophobicContact CE1-CG 4.29Å; F700-L781 HydrophobicContact CG-CD2 4.34Å; F700-L781 HydrophobicContact CZ-CD2 4.17Å; M768-L781 HydrophobicContact CE-CB 4.01Å; M768-L781 HydrophobicContact CE-CD2 3.54Å; M768-L781 HydrophobicContact CE-CG 4.32Å; M768-L781 HydrophobicContact SD-CD2 4.48Å; L772-L781 HydrophobicContact CD1-CD2 4.34Å; T777-L781 WeakPolarHBondContact O-CB 3.4Å; T777-L781 PolarHBondContact O-N 3.39Å; E778-L781 PolarHBondContact O-N 3.05Å; F779-L781 VanDerWaalsContact C-N 3.35Å; F779-L781 PolarHBondContact O-N 2.99Å; L781-P784 WeakPolarHBondContact O-CD 3.43Å
782	F	84.9	Confident	82	Confident	12 Å²	12	57.6 Å²	57.6	5%	0.053	29%	0.289	C	S	.	.	H	α-helix	trans	-79.9	-27	-177.3	-171.5	-106.6	0	0	0	113.5	L761 L765 M768 E778 F779 V785 R786 L824	L761-F782 HydrophobicContact CD1-CE1 4.49Å; L761-F782 HydrophobicContact CD1-CE2 3.68Å; L761-F782 HydrophobicContact CD1-CZ 3.41Å; L761-F782 VanDerWaalsContact CD1-CZ 3.41Å; L765-F782 HydrophobicContact CD2-CD1 4.38Å; L765-F782 HydrophobicContact CD2-CD2 4.03Å; L765-F782 HydrophobicContact CD2-CE1 4.5Å; L765-F782 HydrophobicContact CD2-CE2 4.17Å; L765-F782 HydrophobicContact CD2-CG 4.17Å; L765-F782 HydrophobicContact CD2-CZ 4.43Å; M768-F782 HydrophobicContact CE-CB 4.03Å; M768-F782 HydrophobicContact SD-CD2 4.36Å; E778-F782 VanDerWaalsContact O-CB 3.29Å; E778-F782 WeakPolarHBondContact O-CB 3.4Å; E778-F782 PolarHBondContact O-N 3.47Å; F779-F782 PolarHBondContact O-N 3.04Å; F782-V785 HydrophobicContact CD2-CB 4.35Å; F782-V785 HydrophobicContact CE2-CB 4.44Å; F782-V785 HydrophobicContact CE2-CG1 4.28Å; F782-V785 WeakPolarHBondContact O-CB 3.41Å; F782-V785 PolarHBondContact O-N 3.47Å; F782-V785 VanDerWaalsContact O-N 3.13Å; F782-R786 HydrophobicContact CD1-CB 4.44Å; F782-R786 HydrophobicContact CE1-CB 4.12Å; F782-R786 PolarHBondContact O-N 2.94Å; F782-L824 HydrophobicContact CZ-CD2 4.36Å
783	K	86.6	Confident	82.1	Confident	108 Å²	108	57.3 Å²	57.3	47%	0.47	29%	0.287	S	S	.	.	H	α-helix	trans	-56.3	-45.9	-179.1	175.8	-179.6	-177.5	-178.1	0	113.8	F779 R786 N787	F779-K783 HydrophobicContact CE1-CD 4.24Å; F779-K783 VanDerWaalsContact O-CB 3.23Å; F779-K783 WeakPolarHBondContact O-CB 3.27Å; F779-K783 PolarHBondContact O-N 2.93Å; K783-R786 PolarHBondContact O-N 3.34Å; K783-N787 VanDerWaalsContact O-CG 3.29Å; K783-N787 PolarHBondContact O-N 2.87Å
784	P	86.9	Confident	83.1	Confident	45 Å²	45	58.8 Å²	58.8	29%	0.292	29%	0.288	S	S	.	.	H	α-helix	trans	-58.9	-43.4	172.5	-26.6	34.5	0	0	0	113.6	I701 I780 L781 R786 N787 N788	I701-P784 HydrophobicContact CD1-CB 3.89Å; I701-P784 HydrophobicContact CD1-CG 3.98Å; I701-P784 HydrophobicContact CG1-CB 4.33Å; I701-P784 HydrophobicContact CG2-CB 3.99Å; I780-P784 WeakPolarHBondContact O-CD 3.35Å; L781-P784 WeakPolarHBondContact O-CD 3.43Å; P784-R786 VanDerWaalsContact C-N 3.35Å; P784-R786 PolarHBondContact O-N 2.93Å; P784-N787 PolarHBondContact O-N 3.3Å; P784-N788 WeakPolarHBondContact O-CB 3.44Å; P784-N788 VanDerWaalsContact O-CG 3.24Å; P784-N788 PolarHBondContact O-N 2.92Å
785	V	85.1	Confident	83.3	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-60.1	-47.5	177.5	-178.9	0	0	0	0	110.1	I701 Q704 F708 F782 N787 N788 I789	I701-V785 HydrophobicContact CB-CG2 4.17Å; I701-V785 HydrophobicContact CG1-CG2 4.03Å; I701-V785 HydrophobicContact CG2-CG2 3.97Å; Q704-V785 HydrophobicContact CB-CG1 4.15Å; Q704-V785 HydrophobicContact CB-CG2 4.29Å; F708-V785 HydrophobicContact CD2-CG1 4.24Å; F708-V785 HydrophobicContact CE2-CG1 4.3Å; F782-V785 HydrophobicContact CD2-CB 4.35Å; F782-V785 HydrophobicContact CE2-CB 4.44Å; F782-V785 HydrophobicContact CE2-CG1 4.28Å; F782-V785 WeakPolarHBondContact O-CB 3.41Å; F782-V785 PolarHBondContact O-N 3.47Å; F782-V785 VanDerWaalsContact O-N 3.13Å; V785-N787 PolarHBondContact O-N 3.47Å; V785-N788 PolarHBondContact O-N 3.15Å; V785-I789 HydrophobicContact CG1-CD1 3.85Å; V785-I789 VanDerWaalsContact O-CG1 3.25Å; V785-I789 WeakPolarHBondContact O-CG1 3.42Å; V785-I789 PolarHBondContact O-N 3.48Å
786	R	84.3	Confident	83.7	Confident	62 Å²	62	54.1 Å²	54.1	23%	0.234	26%	0.263	C	S	.	.	H	α-helix	trans	-56.6	-47.6	174.9	174.4	175	179.3	179.5	2.8	112	F782 K783 P784 Q790 L824	F782-R786 HydrophobicContact CD1-CB 4.44Å; F782-R786 HydrophobicContact CE1-CB 4.12Å; F782-R786 PolarHBondContact O-N 2.94Å; K783-R786 PolarHBondContact O-N 3.34Å; P784-R786 VanDerWaalsContact C-N 3.35Å; P784-R786 PolarHBondContact O-N 2.93Å; R786-Q790 WeakPolarHBondContact O-CB 3.34Å; R786-Q790 VanDerWaalsContact O-CG 3.29Å; R786-Q790 WeakPolarHBondContact O-CG 3.49Å; R786-Q790 PolarHBondContact O-N 3.37Å; R786-L824 HydrophobicContact CG-CB 4.05Å; R786-L824 HydrophobicContact CG-CD1 4.24Å
787	N	86.7	Confident	83.8	Confident	65 Å²	65	50.7 Å²	50.7	35%	0.348	24%	0.244	S	C	.	.	H	α-helix	trans	-64.7	-41.7	-179.4	-72.9	-9.6	0	0	0	111.9	K783 P784 V785 Q790 Q791	K783-N787 VanDerWaalsContact O-CG 3.29Å; K783-N787 PolarHBondContact O-N 2.87Å; P784-N787 PolarHBondContact O-N 3.3Å; V785-N787 PolarHBondContact O-N 3.47Å; N787-Q790 PolarHBondContact O-N 3.28Å; N787-Q791 VanDerWaalsContact O-CG 3.31Å; N787-Q791 WeakPolarHBondContact O-CG 3.26Å; N787-Q791 PolarHBondContact O-N 3.06Å
788	N	86.1	Confident	83.8	Confident	55 Å²	55	50.8 Å²	50.8	29%	0.294	25%	0.249	S	C	.	.	H	α-helix	trans	-63.6	-46.7	178.2	-69.9	-13.1	0	0	0	111.4	T705 P784 V785 Q790 Q791 V792	T705-N788 HydrophobicContact CG2-CB 3.62Å; T705-N788 PolarHBondContact OG1-ND2 3.12Å; P784-N788 WeakPolarHBondContact O-CB 3.44Å; P784-N788 VanDerWaalsContact O-CG 3.24Å; P784-N788 PolarHBondContact O-N 2.92Å; V785-N788 PolarHBondContact O-N 3.15Å; N788-Q790 VanDerWaalsContact C-N 3.33Å; N788-Q790 PolarHBondContact O-N 2.69Å; N788-Q791 PolarHBondContact O-N 3.47Å; N788-V792 WeakPolarHBondContact O-CG2 3.43Å; N788-V792 PolarHBondContact O-N 2.96Å
789	I	84.5	Confident	83.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57	-49.3	175.3	-64.9	164.9	0	0	0	109.9	F708 V709 L757 V785 Q791 V792 F793 L824	F708-I789 HydrophobicContact CB-CD1 4Å; F708-I789 HydrophobicContact CB-CG1 4.22Å; F708-I789 HydrophobicContact CD2-CD1 3.68Å; F708-I789 HydrophobicContact CE2-CD1 4.46Å; F708-I789 HydrophobicContact CG-CD1 4.01Å; V709-I789 HydrophobicContact CG2-CB 4.29Å; V709-I789 HydrophobicContact CG2-CG1 3.77Å; V709-I789 HydrophobicContact CG2-CG2 4.32Å; L757-I789 HydrophobicContact CD1-CD1 4.16Å; V785-I789 HydrophobicContact CG1-CD1 3.85Å; V785-I789 VanDerWaalsContact O-CG1 3.25Å; V785-I789 WeakPolarHBondContact O-CG1 3.42Å; V785-I789 PolarHBondContact O-N 3.48Å; I789-Q791 VanDerWaalsContact C-N 3.33Å; I789-Q791 PolarHBondContact O-N 2.98Å; I789-V792 PolarHBondContact O-N 2.96Å; I789-F793 HydrophobicContact CG2-CD2 3.74Å; I789-F793 HydrophobicContact CG2-CE2 3.83Å; I789-F793 WeakPolarHBondContact O-CD2 3.34Å; I789-F793 PolarHBondContact O-N 3.43Å; I789-L824 HydrophobicContact CD1-CD2 4.2Å; I789-L824 HydrophobicContact CG2-CD1 4.12Å
790	Q	84.4	Confident	83.4	Confident	34 Å²	34	46.4 Å²	46.4	16%	0.159	23%	0.231	C	C	.	.	H	α-helix	trans	-57.9	-43.3	177.9	-77.8	-175.7	-6.4	0	0	112.6	R786 N787 N788 F793 Q794 M817 L824	R786-Q790 WeakPolarHBondContact O-CB 3.34Å; R786-Q790 VanDerWaalsContact O-CG 3.29Å; R786-Q790 WeakPolarHBondContact O-CG 3.49Å; R786-Q790 PolarHBondContact O-N 3.37Å; N787-Q790 PolarHBondContact O-N 3.28Å; N788-Q790 VanDerWaalsContact C-N 3.33Å; N788-Q790 PolarHBondContact O-N 2.69Å; Q790-F793 PolarHBondContact O-N 2.99Å; Q790-Q794 WeakPolarHBondContact O-CB 3.31Å; Q790-Q794 WeakPolarHBondContact O-CG 3.37Å; Q790-Q794 PolarHBondContact O-N 3.28Å; Q790-M817 HydrophobicContact CB-CE 3.59Å; Q790-M817 HydrophobicContact CG-CE 3.67Å; Q790-L824 HydrophobicContact CG-CD1 3.88Å
791	Q	85.5	Confident	83	Confident	97 Å²	97	48.6 Å²	48.6	45%	0.453	24%	0.236	S	C	.	.	H	α-helix	trans	-64.7	-40.8	178.3	-75.5	178.6	18.4	0	0	112.7	N787 N788 I789 Q794 K795	N787-Q791 VanDerWaalsContact O-CG 3.31Å; N787-Q791 WeakPolarHBondContact O-CG 3.26Å; N787-Q791 PolarHBondContact O-N 3.06Å; N788-Q791 PolarHBondContact O-N 3.47Å; I789-Q791 VanDerWaalsContact C-N 3.33Å; I789-Q791 PolarHBondContact O-N 2.98Å; Q791-Q794 PolarHBondContact O-N 3.48Å; Q791-K795 WeakPolarHBondContact O-CG 3.46Å; Q791-K795 PolarHBondContact O-N 3.25Å
792	V	82.8	Confident	82.6	Confident	15 Å²	15	54.2 Å²	54.2	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-69	-42.4	179	-179.3	0	0	0	0	110.9	V709 L712 E713 N788 I789 Q794 K795 F796	V709-V792 HydrophobicContact CG1-CB 3.58Å; V709-V792 HydrophobicContact CG1-CG1 3.25Å; V709-V792 HydrophobicContact CG1-CG2 3.99Å; L712-V792 HydrophobicContact CB-CG1 4.44Å; E713-V792 HydrophobicContact CG-CG1 4.07Å; E713-V792 HydrophobicContact CG-CG2 4.29Å; N788-V792 WeakPolarHBondContact O-CG2 3.43Å; N788-V792 PolarHBondContact O-N 2.96Å; I789-V792 PolarHBondContact O-N 2.96Å; V792-Q794 VanDerWaalsContact C-N 3.31Å; V792-Q794 PolarHBondContact O-N 3.16Å; V792-K795 PolarHBondContact O-N 3.19Å; V792-F796 WeakPolarHBondContact O-CB 3.41Å; V792-F796 PolarHBondContact O-N 2.7Å
793	F	81.9	Confident	81.8	Confident	3 Å²	3	57 Å²	57	1%	0.013	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-36.3	173.2	-85.4	-82.6	0	0	0	112.3	L712 A753 I789 Q790 F796 H797 L820	L712-F793 HydrophobicContact CD1-CD1 4.17Å; L712-F793 HydrophobicContact CD1-CD2 4.37Å; L712-F793 HydrophobicContact CD1-CE1 3.58Å; L712-F793 HydrophobicContact CD1-CE2 3.8Å; L712-F793 HydrophobicContact CD1-CZ 3.37Å; A753-F793 HydrophobicContact CB-CZ 4.29Å; I789-F793 HydrophobicContact CG2-CD2 3.74Å; I789-F793 HydrophobicContact CG2-CE2 3.83Å; I789-F793 WeakPolarHBondContact O-CD2 3.34Å; I789-F793 PolarHBondContact O-N 3.43Å; Q790-F793 PolarHBondContact O-N 2.99Å; F793-F796 PolarHBondContact O-N 2.96Å; F793-H797 WeakPolarHBondContact O-CB 3.41Å; F793-H797 PolarHBondContact O-CD2 3.2Å; F793-H797 PolarHBondContact O-N 2.88Å; F793-L820 HydrophobicContact CB-CD1 3.84Å; F793-L820 HydrophobicContact CD1-CD1 3.52Å; F793-L820 HydrophobicContact CD1-CD2 4.37Å; F793-L820 HydrophobicContact CD2-CD1 4.25Å; F793-L820 HydrophobicContact CD2-CD2 4.31Å; F793-L820 HydrophobicContact CE1-CD1 4.09Å; F793-L820 HydrophobicContact CE1-CD2 4.19Å; F793-L820 HydrophobicContact CE2-CD2 4.15Å; F793-L820 HydrophobicContact CG-CD1 3.61Å; F793-L820 HydrophobicContact CG-CD2 4.42Å; F793-L820 HydrophobicContact CZ-CD2 4.08Å
794	Q	84.6	Confident	81	Confident	100 Å²	100	52.7 Å²	52.7	47%	0.467	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-45.4	173.2	-78.5	171.7	-5.7	0	0	112.3	Q790 Q791 V792 F796 H797 A798 M817	Q790-Q794 WeakPolarHBondContact O-CB 3.31Å; Q790-Q794 WeakPolarHBondContact O-CG 3.37Å; Q790-Q794 PolarHBondContact O-N 3.28Å; Q791-Q794 PolarHBondContact O-N 3.48Å; V792-Q794 VanDerWaalsContact C-N 3.31Å; V792-Q794 PolarHBondContact O-N 3.16Å; Q794-F796 VanDerWaalsContact C-N 3.32Å; Q794-F796 PolarHBondContact O-N 3.37Å; Q794-H797 PolarHBondContact O-N 3.26Å; Q794-A798 PolarHBondContact O-N 3.05Å; Q794-M817 HydrophobicContact CG-CE 3.72Å; Q794-M817 HydrophobicContact CG-SD 3.8Å; Q794-M817 VanDerWaalsContact NE2-CE 3.34Å
795	K	82.2	Confident	80.3	Confident	124 Å²	124	52.7 Å²	52.7	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-63.3	-39.6	175.8	-71.1	173.6	-178.2	174.6	0	111.4	M716 Q791 V792 A798 L799	M716-K795 HydrophobicContact CE-CB 3.66Å; Q791-K795 WeakPolarHBondContact O-CG 3.46Å; Q791-K795 PolarHBondContact O-N 3.25Å; V792-K795 PolarHBondContact O-N 3.19Å; K795-A798 PolarHBondContact O-N 3.24Å; K795-L799 PolarHBondContact O-N 3Å
796	F	81.3	Confident	79.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-46.8	175	-177.6	-109.9	0	0	0	111.5	L712 F715 M716 V746 A750 V792 F793 Q794 A798 L799 L800	L712-F796 HydrophobicContact CD2-CD1 4.36Å; L712-F796 HydrophobicContact CD2-CD2 4.16Å; L712-F796 HydrophobicContact CD2-CE1 4.21Å; L712-F796 HydrophobicContact CD2-CE2 4.02Å; L712-F796 HydrophobicContact CD2-CG 4.33Å; L712-F796 HydrophobicContact CD2-CZ 4.04Å; F715-F796 HydrophobicContact CD1-CD2 4.21Å; F715-F796 AromaticContact CD1-CE2 3.76Å; F715-F796 HydrophobicContact CD1-CE2 3.76Å; F715-F796 HydrophobicContact CE1-CD2 4.32Å; F715-F796 AromaticContact CE1-CE2 3.7Å; F715-F796 HydrophobicContact CE1-CE2 3.7Å; M716-F796 HydrophobicContact SD-CB 4.03Å; M716-F796 HydrophobicContact SD-CD2 3.87Å; M716-F796 HydrophobicContact SD-CG 4.46Å; V746-F796 HydrophobicContact CG1-CE2 4.25Å; V746-F796 HydrophobicContact CG1-CZ 3.75Å; A750-F796 HydrophobicContact CB-CE1 4.21Å; V792-F796 WeakPolarHBondContact O-CB 3.41Å; V792-F796 PolarHBondContact O-N 2.7Å; F793-F796 PolarHBondContact O-N 2.96Å; Q794-F796 VanDerWaalsContact C-N 3.32Å; Q794-F796 PolarHBondContact O-N 3.37Å; F796-A798 VanDerWaalsContact C-N 3.31Å; F796-A798 PolarHBondContact O-N 2.89Å; F796-L799 PolarHBondContact O-N 3.4Å; F796-L800 HydrophobicContact CD1-CD1 3.9Å; F796-L800 HydrophobicContact CD1-CG 4.41Å; F796-L800 HydrophobicContact CE1-CD1 3.52Å; F796-L800 HydrophobicContact CE1-CG 4.18Å; F796-L800 HydrophobicContact CZ-CD1 3.96Å; F796-L800 HydrophobicContact CZ-CD2 4.24Å; F796-L800 HydrophobicContact CZ-CG 4.25Å; F796-L800 WeakPolarHBondContact O-CG 3.38Å; F796-L800 PolarHBondContact O-N 3.09Å
797	H	79.6	Confident	78.5	Confident	40 Å²	40	61.8 Å²	61.8	19%	0.185	31%	0.312	C	S	.	.	H	α-helix	trans	-59.8	-38	173.7	-86.5	-67.7	0	0	0	112.8	F793 Q794 L800 K801 C814 P815	F793-H797 WeakPolarHBondContact O-CB 3.41Å; F793-H797 PolarHBondContact O-CD2 3.2Å; F793-H797 PolarHBondContact O-N 2.88Å; Q794-H797 PolarHBondContact O-N 3.26Å; H797-L800 PolarHBondContact O-N 3.2Å; H797-K801 WeakPolarHBondContact O-CG 3.39Å; H797-K801 PolarHBondContact O-N 3.49Å; H797-C814 PolarHBondContact CE1-SG 2.93Å; H797-P815 PolarHBondContact CE1-O 3.47Å; H797-P815 PolarHBondContact NE2-O 3.15Å
798	A	82	Confident	77.6	Confident	47 Å²	47	60.6 Å²	60.6	39%	0.388	31%	0.306	S	S	.	.	H	α-helix	trans	-65.1	-45.7	174.7	0	0	0	0	0	111.7	Q794 K795 F796 L800 K801 E802	Q794-A798 PolarHBondContact O-N 3.05Å; K795-A798 PolarHBondContact O-N 3.24Å; F796-A798 VanDerWaalsContact C-N 3.31Å; F796-A798 PolarHBondContact O-N 2.89Å; A798-L800 VanDerWaalsContact C-N 3.33Å; A798-L800 PolarHBondContact O-N 2.94Å; A798-K801 PolarHBondContact O-N 2.94Å; A798-E802 WeakPolarHBondContact O-CG 3.45Å; A798-E802 PolarHBondContact O-N 3.25Å; A798-E802 VanDerWaalsContact O-N 3.11Å
799	L	77.7	Confident	76.7	Confident	30 Å²	30	61 Å²	61	16%	0.157	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-38.3	175.5	-75.7	-168.3	0	0	0	112.9	M716 V719 K795 F796 K801 E802 E803	M716-L799 HydrophobicContact CE-CD1 3.23Å; M716-L799 HydrophobicContact CE-CG 3.78Å; M716-L799 HydrophobicContact SD-CD1 3.34Å; M716-L799 WeakPolarHBondContact SD-CD1 3.24Å; M716-L799 HydrophobicContact SD-CG 4.2Å; V719-L799 HydrophobicContact CB-CD1 4.29Å; V719-L799 HydrophobicContact CG1-CD1 3.88Å; K795-L799 PolarHBondContact O-N 3Å; F796-L799 PolarHBondContact O-N 3.4Å; L799-K801 VanDerWaalsContact C-N 3.29Å; L799-K801 PolarHBondContact O-N 3.33Å; L799-E802 PolarHBondContact O-N 3.45Å; L799-E803 WeakPolarHBondContact O-CB 3.35Å; L799-E803 WeakPolarHBondContact O-CG 3.47Å; L799-E803 PolarHBondContact O-N 3.47Å
800	L	75.7	Confident	75.8	Confident	6 Å²	6	68.8 Å²	68.8	3%	0.031	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-37.8	176.3	-71.9	-179.1	0	0	0	112.1	V746 F796 H797 A798 F804 I812 C814	V746-L800 HydrophobicContact CG1-CD2 3.93Å; F796-L800 HydrophobicContact CD1-CD1 3.9Å; F796-L800 HydrophobicContact CD1-CG 4.41Å; F796-L800 HydrophobicContact CE1-CD1 3.52Å; F796-L800 HydrophobicContact CE1-CG 4.18Å; F796-L800 HydrophobicContact CZ-CD1 3.96Å; F796-L800 HydrophobicContact CZ-CD2 4.24Å; F796-L800 HydrophobicContact CZ-CG 4.25Å; F796-L800 WeakPolarHBondContact O-CG 3.38Å; F796-L800 PolarHBondContact O-N 3.09Å; H797-L800 PolarHBondContact O-N 3.2Å; A798-L800 VanDerWaalsContact C-N 3.33Å; A798-L800 PolarHBondContact O-N 2.94Å; L800-F804 HydrophobicContact CD2-CD2 3.78Å; L800-F804 HydrophobicContact CD2-CE2 3.82Å; L800-F804 WeakPolarHBondContact O-CB 3.3Å; L800-F804 PolarHBondContact O-N 3.18Å; L800-I812 HydrophobicContact CD1-CG2 4.1Å; L800-I812 HydrophobicContact CD2-CD1 3.85Å; L800-I812 HydrophobicContact CD2-CG2 4.45Å; L800-C814 HydrophobicContact CD1-CB 4.08Å
801	K	75.8	Confident	74.9	Confident	162 Å²	162	71.9 Å²	71.9	70%	0.704	36%	0.36	S	S	*	.	H	α-helix	trans	-72.9	-30.2	177.8	-72.2	177.1	-178.7	-177.1	0	113.7	H797 A798 L799	H797-K801 WeakPolarHBondContact O-CG 3.39Å; H797-K801 PolarHBondContact O-N 3.49Å; A798-K801 PolarHBondContact O-N 2.94Å; L799-K801 VanDerWaalsContact C-N 3.29Å; L799-K801 PolarHBondContact O-N 3.33Å
802	E	75.4	Confident	74	Confident	133 Å²	133	67.3 Å²	67.3	62%	0.621	34%	0.339	S	S	*	.	H	α-helix	trans	-78.3	-32.5	-179.5	-74.9	179.3	178.2	0	0	112.9	K723 A798 L799	K723-E802 IonicContact NZ-OE2 2.63Å; K723-E802 PolarHBondContact NZ-OE2 3.3Å; A798-E802 WeakPolarHBondContact O-CG 3.45Å; A798-E802 PolarHBondContact O-N 3.25Å; A798-E802 VanDerWaalsContact O-N 3.11Å; L799-E802 PolarHBondContact O-N 3.45Å
803	E	68.8	Low	73.5	Confident	69 Å²	69	70.1 Å²	70.1	32%	0.322	36%	0.364	S	S	.	.	H	α-helix	trans	-118.2	-13.2	-162.2	-59.5	-74.9	159.8	0	0	115.2	K723 L735 L799	K723-E803 WeakPolarHBondContact CE-OE1 3.36Å; K723-E803 IonicContact NZ-OE1 2.96Å; K723-E803 PolarHBondContact NZ-OE1 3.42Å; L735-E803 HydrophobicContact CD1-CB 3.63Å; L735-E803 HydrophobicContact CD1-CG 3.47Å; L735-E803 VanDerWaalsContact CD1-CG 3.47Å; L735-E803 WeakPolarHBondContact CD1-OE2 3.46Å; L799-E803 WeakPolarHBondContact O-CB 3.35Å; L799-E803 WeakPolarHBondContact O-CG 3.47Å; L799-E803 PolarHBondContact O-N 3.47Å
804	F	70.8	Confident	72.8	Confident	18 Å²	18	71.2 Å²	71.2	8%	0.079	37%	0.372	C	S	.	.	S	Bend	trans	-117.7	147.6	-177.1	-67.6	-91	0	0	0	111.7	P743 V746 L800 D808 I809 I812	P743-F804 HydrophobicContact CG-CE1 4.49Å; V746-F804 HydrophobicContact CG2-CZ 4.36Å; L800-F804 HydrophobicContact CD2-CD2 3.78Å; L800-F804 HydrophobicContact CD2-CE2 3.82Å; L800-F804 WeakPolarHBondContact O-CB 3.3Å; L800-F804 PolarHBondContact O-N 3.18Å; F804-D808 HydrophobicContact CB-CB 4.01Å; F804-D808 HydrophobicContact CD1-CB 4.08Å; F804-I809 HydrophobicContact CB-CG1 4.03Å; F804-I812 HydrophobicContact CD1-CD1 3.93Å; F804-I812 HydrophobicContact CD2-CD1 4.44Å; F804-I812 HydrophobicContact CE1-CD1 4.21Å; F804-I812 HydrophobicContact CG-CD1 4.04Å
805	S	72.4	Confident	72	Confident	46 Å²	46	67.2 Å²	67.2	32%	0.322	35%	0.354	S	S	.	.			trans	-68.6	157.9	176.1	78.7	0	0	0	0	110.8	E807 D808 I809	S805-E807 PolarHBondContact O-N 3.17Å; S805-E807 VanDerWaalsContact O-N 3.16Å; S805-D808 WeakPolarHBondContact CB-OD2 3.13Å; S805-D808 PolarHBondContact N-OD2 3.35Å; S805-D808 PolarHBondContact O-N 3.42Å; S805-D808 PolarHBondContact OG-N 3.26Å; S805-D808 PolarHBondContact OG-OD2 3.03Å; S805-I809 WeakPolarHBondContact O-CG1 2.89Å; S805-I809 PolarHBondContact O-N 3.14Å
806	P	67.3	Low	71.5	Confident	108 Å²	108	63.5 Å²	63.5	70%	0.701	34%	0.344	S	S	*	.	H	α-helix	trans	-58.1	-28.4	177.3	22.9	-33.8	0	0	0	113.2	Q810	P806-Q810 PolarHBondContact O-N 3.19Å
807	E	63.7	Low	70.9	Confident	146 Å²	146	66.2 Å²	66.2	68%	0.682	36%	0.357	S	S	*	.	H	α-helix	trans	-73	-41.3	175.4	-62.8	179.3	-175.1	0	0	111.4	S805 I809 Q810 I811	S805-E807 PolarHBondContact O-N 3.17Å; S805-E807 VanDerWaalsContact O-N 3.16Å; E807-I809 PolarHBondContact O-N 3.44Å; E807-Q810 WeakPolarHBondContact O-CB 3.32Å; E807-Q810 PolarHBondContact O-N 3.28Å; E807-I811 WeakPolarHBondContact O-CG1 3.06Å; E807-I811 PolarHBondContact O-N 3.4Å
808	D	66.4	Low	70.4	Confident	40 Å²	40	71.7 Å²	71.7	21%	0.214	38%	0.383	C	S	.	.	H	α-helix	trans	-66.3	-36.8	176	-64.6	-47.6	0	0	0	112.1	P743 F804 S805 Q810 I811 I812	P743-D808 HydrophobicContact CB-CB 4.47Å; P743-D808 HydrophobicContact CG-CB 4.08Å; F804-D808 HydrophobicContact CB-CB 4.01Å; F804-D808 HydrophobicContact CD1-CB 4.08Å; S805-D808 WeakPolarHBondContact CB-OD2 3.13Å; S805-D808 PolarHBondContact N-OD2 3.35Å; S805-D808 PolarHBondContact O-N 3.42Å; S805-D808 PolarHBondContact OG-N 3.26Å; S805-D808 PolarHBondContact OG-OD2 3.03Å; D808-Q810 VanDerWaalsContact C-N 3.25Å; D808-Q810 PolarHBondContact O-N 3.22Å; D808-I811 PolarHBondContact O-N 3.19Å; D808-I812 WeakPolarHBondContact O-CD1 3.49Å; D808-I812 WeakPolarHBondContact O-CG1 3.48Å; D808-I812 PolarHBondContact O-N 3.17Å
809	I	67.5	Low	70	Confident	64 Å²	64	74.5 Å²	74.5	33%	0.328	39%	0.388	S	S	.	.	H	α-helix	trans	-62.6	-36.1	175.5	-67.5	167.8	0	0	0	110.8	F804 S805 E807 I812 A813	F804-I809 HydrophobicContact CB-CG1 4.03Å; S805-I809 WeakPolarHBondContact O-CG1 2.89Å; S805-I809 PolarHBondContact O-N 3.14Å; E807-I809 PolarHBondContact O-N 3.44Å; I809-I812 PolarHBondContact O-N 3.32Å; I809-A813 PolarHBondContact O-N 3.41Å
810	Q	66.6	Low	69.9	Low	163 Å²	163	73.2 Å²	73.2	76%	0.762	38%	0.381	S	S	*	.	H	α-helix	trans	-71	-33.7	177.6	-157.6	167.8	9.6	0	0	112	P806 E807 D808	P806-Q810 PolarHBondContact O-N 3.19Å; E807-Q810 WeakPolarHBondContact O-CB 3.32Å; E807-Q810 PolarHBondContact O-N 3.28Å; D808-Q810 VanDerWaalsContact C-N 3.25Å; D808-Q810 PolarHBondContact O-N 3.22Å
811	I	66.1	Low	69.7	Low	99 Å²	99	74.9 Å²	74.9	51%	0.508	39%	0.393	S	S	.	.	H	α-helix	trans	-70.4	-36.6	173.3	-64.4	166.1	0	0	0	111.4	P743 E807 D808 A813	P743-I811 HydrophobicContact CB-CB 4.43Å; P743-I811 HydrophobicContact CB-CG2 4.03Å; E807-I811 WeakPolarHBondContact O-CG1 3.06Å; E807-I811 PolarHBondContact O-N 3.4Å; D808-I811 PolarHBondContact O-N 3.19Å; I811-A813 VanDerWaalsContact C-N 3.29Å; I811-A813 PolarHBondContact O-N 3.39Å
812	I	66.3	Low	69.7	Low	1 Å²	1	73.1 Å²	73.1	1%	0.005	39%	0.391	C	S	.	.	H	α-helix	trans	-67.3	-30.3	-179.8	-68.7	163.6	0	0	0	111.7	P743 V746 S747 L800 F804 D808 I809 C814	P743-I812 HydrophobicContact CB-CD1 4.4Å; P743-I812 HydrophobicContact CB-CG1 4.02Å; P743-I812 WeakPolarHBondContact O-CG1 3.45Å; V746-I812 HydrophobicContact CB-CD1 4.39Å; V746-I812 HydrophobicContact CB-CG1 4.29Å; V746-I812 HydrophobicContact CG1-CD1 4.17Å; V746-I812 HydrophobicContact CG1-CG1 4.33Å; V746-I812 HydrophobicContact CG1-CG2 3.96Å; S747-I812 WeakPolarHBondContact CA-O 3.5Å; S747-I812 VanDerWaalsContact CB-O 3.31Å; S747-I812 WeakPolarHBondContact CB-O 3.39Å; S747-I812 PolarHBondContact OG-O 2.95Å; L800-I812 HydrophobicContact CD1-CG2 4.1Å; L800-I812 HydrophobicContact CD2-CD1 3.85Å; L800-I812 HydrophobicContact CD2-CG2 4.45Å; F804-I812 HydrophobicContact CD1-CD1 3.93Å; F804-I812 HydrophobicContact CD2-CD1 4.44Å; F804-I812 HydrophobicContact CE1-CD1 4.21Å; F804-I812 HydrophobicContact CG-CD1 4.04Å; D808-I812 WeakPolarHBondContact O-CD1 3.49Å; D808-I812 WeakPolarHBondContact O-CG1 3.48Å; D808-I812 PolarHBondContact O-N 3.17Å; I809-I812 PolarHBondContact O-N 3.32Å; I812-C814 VanDerWaalsContact C-N 3.26Å; I812-C814 HydrophobicContact CG2-CB 4.31Å; I812-C814 PolarHBondContact O-N 3.49Å
813	A	70.7	Confident	69.5	Low	74 Å²	74	68 Å²	68	61%	0.612	37%	0.368	S	S	*	.			trans	49.6	42.3	173.9	0	0	0	0	0	114	I809 I811	I809-A813 PolarHBondContact O-N 3.41Å; I811-A813 VanDerWaalsContact C-N 3.29Å; I811-A813 PolarHBondContact O-N 3.39Å
814	C	67.3	Low	69.6	Low	26 Å²	26	64.9 Å²	64.9	18%	0.176	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-65.5	135.1	-179.4	-170.1	0	0	0	0	111	H797 L800 I812 S816	H797-C814 PolarHBondContact CE1-SG 2.93Å; L800-C814 HydrophobicContact CD1-CB 4.08Å; I812-C814 VanDerWaalsContact C-N 3.26Å; I812-C814 HydrophobicContact CG2-CB 4.31Å; I812-C814 PolarHBondContact O-N 3.49Å; C814-S816 PolarHBondContact O-N 3.33Å
815	P	69.1	Low	69.4	Low	16 Å²	16	66.6 Å²	66.6	10%	0.104	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-58.3	137.8	178.1	21.5	-32.3	0	0	0	111.7	Y754 H797 L820	Y754-P815 HydrophobicContact CD2-CB 3.87Å; Y754-P815 HydrophobicContact CD2-CG 3.67Å; Y754-P815 HydrophobicContact CE2-CB 3.95Å; Y754-P815 HydrophobicContact CE2-CG 4.27Å; Y754-P815 HydrophobicContact CG-CB 4.49Å; Y754-P815 HydrophobicContact CG-CG 4.11Å; H797-P815 PolarHBondContact CE1-O 3.47Å; H797-P815 PolarHBondContact NE2-O 3.15Å; P815-L820 HydrophobicContact CB-CG 4.46Å
816	S	72.3	Confident	68.7	Low	46 Å²	46	69.2 Å²	69.2	32%	0.322	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-64.3	152	180	63.2	0	0	0	0	111.5	C814 E818 Q819 L820	C814-S816 PolarHBondContact O-N 3.33Å; S816-E818 PolarHBondContact O-N 3.06Å; S816-Q819 VanDerWaalsContact N-OE1 3.09Å; S816-Q819 PolarHBondContact O-N 3.17Å; S816-Q819 VanDerWaalsContact O-N 3.12Å; S816-Q819 WeakPolarHBondContact OG-CB 3.22Å; S816-Q819 WeakPolarHBondContact OG-CG 2.96Å; S816-Q819 PolarHBondContact OG-N 2.76Å; S816-Q819 PolarHBondContact OG-OE1 3.49Å; S816-L820 PolarHBondContact O-N 3.41Å
817	M	68.6	Low	67.6	Low	57 Å²	57	66.7 Å²	66.7	28%	0.281	37%	0.366	S	S	.	.	H	α-helix	trans	-57.9	-32	177.2	-167.9	66.4	-169.1	0	0	112.1	Q790 Q794 S821	Q790-M817 HydrophobicContact CB-CE 3.59Å; Q790-M817 HydrophobicContact CG-CE 3.67Å; Q794-M817 HydrophobicContact CG-CE 3.72Å; Q794-M817 HydrophobicContact CG-SD 3.8Å; Q794-M817 VanDerWaalsContact NE2-CE 3.34Å; M817-S821 WeakPolarHBondContact O-CB 3.24Å; M817-S821 PolarHBondContact O-N 3.33Å
818	E	68.9	Low	66.3	Low	155 Å²	155	72 Å²	72	72%	0.724	39%	0.387	S	S	*	.	H	α-helix	trans	-67.8	-45.7	176.2	-66.4	-179.5	-179.8	0	0	111.8	S816 L820 S821 L822	S816-E818 PolarHBondContact O-N 3.06Å; E818-L820 VanDerWaalsContact C-N 3.32Å; E818-L820 PolarHBondContact O-N 3.13Å; E818-S821 WeakPolarHBondContact CA-OG 3.49Å; E818-S821 PolarHBondContact O-N 2.95Å; E818-S821 VanDerWaalsContact O-N 3.16Å; E818-S821 PolarHBondContact O-OG 3.42Å; E818-L822 WeakPolarHBondContact O-CB 3.48Å; E818-L822 PolarHBondContact O-N 3.4Å
819	Q	73.1	Confident	66.3	Low	106 Å²	106	73.6 Å²	73.6	50%	0.495	40%	0.396	S	S	.	.	H	α-helix	trans	-62.3	-38	175.7	-74.4	165.1	-22.6	0	0	112.3	S816 L823	S816-Q819 VanDerWaalsContact N-OE1 3.09Å; S816-Q819 PolarHBondContact O-N 3.17Å; S816-Q819 VanDerWaalsContact O-N 3.12Å; S816-Q819 WeakPolarHBondContact OG-CB 3.22Å; S816-Q819 WeakPolarHBondContact OG-CG 2.96Å; S816-Q819 PolarHBondContact OG-N 2.76Å; S816-Q819 PolarHBondContact OG-OE1 3.49Å; Q819-L823 WeakPolarHBondContact O-CB 3.39Å; Q819-L823 PolarHBondContact O-N 3.01Å; Q819-L823 VanDerWaalsContact O-N 3.07Å
820	L	74.3	Confident	66.2	Low	2 Å²	2	74.1 Å²	74.1	1%	0.01	40%	0.399	C	S	.	.	H	α-helix	trans	-66.7	-42.7	173	-75.1	162.8	0	0	0	111.5	Y754 L757 F793 P815 S816 E818 L822 L823 L824	Y754-L820 HydrophobicContact CD2-CD2 4.03Å; Y754-L820 HydrophobicContact CE2-CD2 4.24Å; L757-L820 HydrophobicContact CD2-CD2 3.92Å; F793-L820 HydrophobicContact CB-CD1 3.84Å; F793-L820 HydrophobicContact CD1-CD1 3.52Å; F793-L820 HydrophobicContact CD1-CD2 4.37Å; F793-L820 HydrophobicContact CD2-CD1 4.25Å; F793-L820 HydrophobicContact CD2-CD2 4.31Å; F793-L820 HydrophobicContact CE1-CD1 4.09Å; F793-L820 HydrophobicContact CE1-CD2 4.19Å; F793-L820 HydrophobicContact CE2-CD2 4.15Å; F793-L820 HydrophobicContact CG-CD1 3.61Å; F793-L820 HydrophobicContact CG-CD2 4.42Å; F793-L820 HydrophobicContact CZ-CD2 4.08Å; P815-L820 HydrophobicContact CB-CG 4.46Å; S816-L820 PolarHBondContact O-N 3.41Å; E818-L820 VanDerWaalsContact C-N 3.32Å; E818-L820 PolarHBondContact O-N 3.13Å; L820-L822 VanDerWaalsContact C-N 3.29Å; L820-L822 PolarHBondContact O-N 3.49Å; L820-L823 PolarHBondContact O-N 3.46Å; L820-L824 WeakPolarHBondContact O-CB 3.49Å; L820-L824 WeakPolarHBondContact O-CD1 3.44Å; L820-L824 VanDerWaalsContact O-CG 3.24Å; L820-L824 WeakPolarHBondContact O-CG 3.45Å; L820-L824 PolarHBondContact O-N 3.04Å
821	S	72.4	Confident	66.2	Low	41 Å²	41	69.1 Å²	69.1	29%	0.287	38%	0.379	S	S	.	.	H	α-helix	trans	-64.1	-35.4	178	79.3	0	0	0	0	112.6	M817 E818 S825	M817-S821 WeakPolarHBondContact O-CB 3.24Å; M817-S821 PolarHBondContact O-N 3.33Å; E818-S821 WeakPolarHBondContact CA-OG 3.49Å; E818-S821 PolarHBondContact O-N 2.95Å; E818-S821 VanDerWaalsContact O-N 3.16Å; E818-S821 PolarHBondContact O-OG 3.42Å; S821-S825 VanDerWaalsContact O-CB 3.28Å; S821-S825 WeakPolarHBondContact O-CB 3.47Å; S821-S825 PolarHBondContact O-N 3.44Å
822	L	75.2	Confident	66.2	Low	125 Å²	125	67.4 Å²	67.4	65%	0.654	37%	0.371	S	S	*	.	H	α-helix	trans	-73.1	-41.7	179.3	-163.5	132.2	0	0	0	111.1	E818 L820 L824 S825	E818-L822 WeakPolarHBondContact O-CB 3.48Å; E818-L822 PolarHBondContact O-N 3.4Å; L820-L822 VanDerWaalsContact C-N 3.29Å; L820-L822 PolarHBondContact O-N 3.49Å; L822-L824 VanDerWaalsContact C-N 3.33Å; L822-L824 PolarHBondContact O-N 2.75Å; L822-S825 WeakPolarHBondContact CA-OG 3.44Å; L822-S825 PolarHBondContact O-N 3.19Å; L822-S825 VanDerWaalsContact O-N 3.14Å; L822-S825 PolarHBondContact O-OG 3.01Å
823	L	72.6	Confident	66.2	Low	27 Å²	27	71.5 Å²	71.5	14%	0.141	39%	0.394	C	S	.	.	H	α-helix	trans	-66.5	-34.9	175.9	-162.9	146.5	0	0	0	112.3	Y754 L757 K758 L761 Q819 L820 S825 V826	Y754-L823 HydrophobicContact CE2-CD1 3.94Å; Y754-L823 WeakPolarHBondContact OH-CD1 3.31Å; L757-L823 HydrophobicContact CD2-CD2 3.79Å; L757-L823 HydrophobicContact CG-CD2 3.77Å; K758-L823 HydrophobicContact CB-CD1 4.5Å; L761-L823 HydrophobicContact CD2-CD2 3.62Å; Q819-L823 WeakPolarHBondContact O-CB 3.39Å; Q819-L823 PolarHBondContact O-N 3.01Å; Q819-L823 VanDerWaalsContact O-N 3.07Å; L820-L823 PolarHBondContact O-N 3.46Å; L823-S825 VanDerWaalsContact C-N 3.32Å; L823-V826 WeakPolarHBondContact O-CG2 3.29Å
824	L	70.3	Confident	65.9	Low	2 Å²	2	71.3 Å²	71.3	1%	0.01	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-7.2	174.2	-66.3	167.7	0	0	0	113.8	L757 L761 F782 R786 I789 Q790 L820 L822 V826	L757-L824 HydrophobicContact CD1-CD2 4.19Å; L757-L824 HydrophobicContact CD2-CD2 4.46Å; L761-L824 HydrophobicContact CD2-CD2 4.27Å; F782-L824 HydrophobicContact CZ-CD2 4.36Å; R786-L824 HydrophobicContact CG-CB 4.05Å; R786-L824 HydrophobicContact CG-CD1 4.24Å; I789-L824 HydrophobicContact CD1-CD2 4.2Å; I789-L824 HydrophobicContact CG2-CD1 4.12Å; Q790-L824 HydrophobicContact CG-CD1 3.88Å; L820-L824 WeakPolarHBondContact O-CB 3.49Å; L820-L824 WeakPolarHBondContact O-CD1 3.44Å; L820-L824 VanDerWaalsContact O-CG 3.24Å; L820-L824 WeakPolarHBondContact O-CG 3.45Å; L820-L824 PolarHBondContact O-N 3.04Å; L822-L824 VanDerWaalsContact C-N 3.33Å; L822-L824 PolarHBondContact O-N 2.75Å; L824-V826 VanDerWaalsContact C-N 3.34Å
825	S	67.4	Low	65.8	Low	55 Å²	55	74.6 Å²	74.6	39%	0.385	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	0.5	176.4	73.6	0	0	0	0	113.5	S821 L822 L823 S827	S821-S825 VanDerWaalsContact O-CB 3.28Å; S821-S825 WeakPolarHBondContact O-CB 3.47Å; S821-S825 PolarHBondContact O-N 3.44Å; L822-S825 WeakPolarHBondContact CA-OG 3.44Å; L822-S825 PolarHBondContact O-N 3.19Å; L822-S825 VanDerWaalsContact O-N 3.14Å; L822-S825 PolarHBondContact O-OG 3.01Å; L823-S825 VanDerWaalsContact C-N 3.32Å; S825-S827 PolarHBondContact O-N 3.36Å
826	V	56	Low	65.5	Low	100 Å²	100	79.1 Å²	79.1	61%	0.606	42%	0.417	S	S	*	.			trans	-73.3	73	177.4	-172.4	0	0	0	0	109.5	L823 L824	L823-V826 WeakPolarHBondContact O-CG2 3.29Å; L824-V826 VanDerWaalsContact C-N 3.34Å
827	S	44.8	Very low	65	Low	55 Å²	55	81.8 Å²	81.8	39%	0.385	43%	0.425	S	S	.	.			trans	-155.2	72.5	161	72.7	0	0	0	0	107.9	S825	S825-S827 PolarHBondContact O-N 3.36Å
828	K	35.9	Very low	64.6	Low	257 Å²	257	84.1 Å²	84.1	100%	1.117	44%	0.438	S	S	*	.			trans	-113.1	0	156	-92.7	-169.3	175.2	-176.8	0	108

Retrieved 828 of 828 residues in 233.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).