A0A077YUY0_TRITR Loading...

chitin synthase

AlphaFold DB , UniProt , Accession A0A077YUY0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,675 aa.

						>A0A077YUY0_TRITR|A0A077YUY0
MGPKLHEFSKRTSKRPDDAQCFTEEFKSWDVFRLLPFQVDSSGPRFWHELSLQALKLSAYAVIFLLTLLSCIFAKASFLLMATSVGWTDKNFTHCHYELQASGSVAKVNSIARIDNRNTVQWIWLTMAAVSLPEFVCTIKCFYRIWFRNVRKPTFFHFVTAFLTETCYAAGVGLLTFHLLPNMGAVRGLCLTSCTGLVPAILTPLSRKLSRWNFILVTVDIICIGIQMAPLWLWSTILKGTSDIYNWAPPLSVALISVAWWENYVSHKSPMRFVRSMATLAQKLRQGRSKVYVVVSLWKVVLYAAFAVLFATTRMNVGELFALDLFRPLPMKTLVQSSIDPSAAYVGSAWEFESPNMPSTKSSSFPRKHENPVVIDARRLIPNGLGEFVEDEEEEEDRMGDFVRMKRSTIDHTGQSFVTKLTYSNPWNSFNTCLLQFLSAFLVYQCAKFACKTKMQRISFALPLTCVQPLLVVGMAMACTSKQKDLCTLSSILPENFFWYCPTSGDDLIDFFRQPLTWAWLAWIFSQFWTTLHVWQPKCERLANTDRLFVLPWYSGILVEQSLLYNQWRDDQQKIKTEVIDFEADEDNAVSIYETISSVYARQKLSHSDIKSSEQSKEETVNPADCITKLYACATMWHETSQEMICMLKSILRLDEDQCARRNVQKYLKVVDPDYYEFEAHIFFDDAFEVNEYSEPVLNRFVRQLLQVIDVAAGAVHRTIMRVKPPEICCTPYGGRLVWTLPGKNKLTVHLKDKAKIRVRKRWSQVMYMYYLLGYRLMEKIDGIRRKEIIAENTYILTLDGDVDFKPSSVHLLVDLMKKNRRLGAACGRMHPRGKGPMIWYQKFEYAIGHWFQKATEHMFGCVLCAPGCFSLFRSAALMDDNVLRRYATTAEAAKDYIQYDQGEDRWLCTLLLQRGYRVEYCAASDALTFAPEGFNEFFNQRRRWIPSTVANIIDLLADYKNVIRLNDSISIWYIAYQFAMLLSNVLGPGTILLMIVGAVNISFNTETYVSFFLIFFPVGLFAVVCLTCTTETQLKVAQVSGALFALLMMAVIVGTAVQVQKDGIYSPHAVFLLVVICSFFIAACLHPSEFFCIVPGILYFLAIPCMYLLLTIYSVCNLHVVSWGTREVVAVADDRPKRVNATDKNVTSTTDDATVDLEGTYSLGCGSACRILCCLSPTMQSVQLSRLSAQLEAVDKRINDLDRRNHTATLNMRANPTEPSRAADRTTLFEEDIIEEEFDVASQCSEQDGSENANVWMSDVSLRSAQRECLEHDEELFWTDLREKYLYPMNQNADHQRQIAHDLRELRNQVSFGFIMMNALFVLIIFLLQLKKNCLYIEWPFSPLTNHTIIPCNKDTNEPEWTVSRLQLEPIGLVFLSFFMTLLLLQFAAMILHRFTTLAHILASTNLWCSKAANQKVSEEEVVLMNAVEIAKELQAIKGIDEDNIADKAFVEEEPISRRNVVKKLESTRKSMMKKQTETLDAAFKKRFFALSSEHLKNQPTTPILGFRKQRMLTLRRSTIRALEQRRNSLLKTSSSRPDVISSYSTASRQLQRGPARRCLERMNNKGESNVGTRFASSSGSSDEENDRNLKIIHPTTEGNGFDSTGRKARISCQKTQSPAINNRTPFSGQQRALANDTHMGIRHLRSEESRNASISKAADVTPSAKQENSNSHL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	30.4	Very low	246 Å²	246	172.8 Å²	172.8	100%	1.212	86%	0.864	S	S	*	*				0	164.5	0	-71.3	169.3	173.4	0	0	109
2	G	32.2	Very low	30.1	Very low	78 Å²	78	169.9 Å²	169.9	80%	0.804	86%	0.863	S	S	*	*			trans	-72.5	160.3	-151.9	0	0	0	0	0	118.2
3	P	48.5	Very low	29.9	Very low	114 Å²	114	165.3 Å²	165.3	74%	0.74	86%	0.856	S	S	*	*			trans	-144.4	169.2	-144.7	42.4	-22.4	0	0	0	119.4
4	K	31	Very low	30	Very low	199 Å²	199	167.7 Å²	167.7	87%	0.865	86%	0.856	S	S	*	*			trans	65.5	145.1	140	-79.9	177.1	180	-177	0	123.1
5	L	29.2	Very low	29.9	Very low	158 Å²	158	172.7 Å²	172.7	83%	0.827	86%	0.86	S	S	*	*			trans	-58.3	136.4	163	-63.3	73.9	0	0	0	112.5
6	H	26.7	Very low	30.4	Very low	173 Å²	173	168.4 Å²	168.4	80%	0.801	85%	0.848	S	S	*	*				-176.9	128.1	120.4	-117.4	-78.8	0	0	0	110.8
7	E	29.8	Very low	30	Very low	196 Å²	196	167.5 Å²	167.5	92%	0.916	85%	0.847	S	S	*	*			trans	-148	140	137	-161.9	161.8	-151.3	0	0	110.3
8	F	24.6	Very low	29.9	Very low	179 Å²	179	165.9 Å²	165.9	79%	0.785	84%	0.841	S	S	*	*			trans	-146.6	120.6	-169.8	-156	-84.2	0	0	0	108.3
9	S	24.3	Very low	29.6	Very low	104 Å²	104	162.7 Å²	162.7	73%	0.727	84%	0.843	S	S	*	*			trans	53.5	97.4	167.1	-171.7	0	0	0	0	118.2
10	K	28.7	Very low	29.6	Very low	202 Å²	202	163.3 Å²	163.3	88%	0.878	84%	0.841	S	S	*	*			trans	-166.5	94.7	145	-112.4	161.6	-173	174.1	0	114.8
11	R	27.9	Very low	29.4	Very low	252 Å²	252	160.3 Å²	160.3	95%	0.951	83%	0.833	S	S	*	*				178	131	124.6	-98.4	166.9	-178.9	-178.9	1	110.6
12	T	27.2	Very low	29.1	Very low	138 Å²	138	158 Å²	158	85%	0.847	82%	0.817	S	S	*	*			trans	-134.9	149.8	-174.5	44.1	0	0	0	0	111
13	S	27.1	Very low	28.8	Very low	110 Å²	110	160.1 Å²	160.1	77%	0.769	82%	0.815	S	S	*	*			trans	66.8	110.6	159.1	-166	0	0	0	0	118.7
14	K	31.3	Very low	27.9	Very low	199 Å²	199	161.6 Å²	161.6	87%	0.865	81%	0.812	S	S	*	*				-159.6	90.4	116	-113.5	-179.4	-178.1	-177.2	0	114.1
15	R	29.2	Very low	27.7	Very low	243 Å²	243	160.7 Å²	160.7	92%	0.917	81%	0.81	S	S	*	*			trans	62.3	161.7	152.8	-76.2	-167.9	176.1	-170.1	-1	120
16	P	37.2	Very low	27.6	Very low	103 Å²	103	162 Å²	162	67%	0.669	81%	0.81	S	S	*	*			trans	-108.8	167.1	-165.5	41.8	-33.2	0	0	0	113.6
17	D	24.2	Very low	27.7	Very low	153 Å²	153	161.4 Å²	161.4	82%	0.818	81%	0.805	S	S	*	*				-162.6	-166.8	123.2	-91.5	-31.6	0	0	0	107.8
18	D	27.8	Very low	27.8	Very low	139 Å²	139	158 Å²	158	74%	0.743	80%	0.803	S	S	*	*			trans	58.2	79	179.2	-70.2	-12.4	0	0	0	117.3	Q20	D18-Q20 PolarHBondContact O-N 2.94Å
19	A	25.2	Very low	28.8	Very low	106 Å²	106	159.2 Å²	159.2	88%	0.876	80%	0.802	S	S	*	*			trans	-70.6	76.5	159.4	0	0	0	0	0	111.2	C21	A19-C21 VanDerWaalsContact C-N 3.31Å; A19-C21 PolarHBondContact O-N 3.36Å
20	Q	28.6	Very low	29.2	Very low	173 Å²	173	158.1 Å²	158.1	81%	0.808	79%	0.788	S	S	*	*			trans	-66.2	90.8	169.8	-72.2	-168.5	-3.3	0	0	110.4	D18	D18-Q20 PolarHBondContact O-N 2.94Å
21	C	25	Very low	29.5	Very low	101 Å²	101	153.7 Å²	153.7	68%	0.682	78%	0.778	S	S	*	*			trans	-64.7	144.6	172	-167.2	0	0	0	0	110.3	A19 T23	A19-C21 VanDerWaalsContact C-N 3.31Å; A19-C21 PolarHBondContact O-N 3.36Å; C21-T23 VanDerWaalsContact C-N 3.33Å; C21-T23 PolarHBondContact O-N 3.18Å
22	F	25.6	Very low	29.4	Very low	197 Å²	197	149.9 Å²	149.9	86%	0.864	77%	0.769	S	S	*	*			trans	-68.5	87.9	172.7	-91.4	-101.7	0	0	0	110.5	E24	F22-E24 PolarHBondContact O-N 2.9Å
23	T	25.4	Very low	29.4	Very low	123 Å²	123	153.4 Å²	153.4	76%	0.755	77%	0.766	S	S	*	*			trans	-91.2	78.9	171.1	54.3	0	0	0	0	110.4	C21	C21-T23 VanDerWaalsContact C-N 3.33Å; C21-T23 PolarHBondContact O-N 3.18Å
24	E	29.7	Very low	29.5	Very low	146 Å²	146	153.5 Å²	153.5	68%	0.682	76%	0.758	S	S	*	*			trans	-70.3	137.5	160.9	-68.9	-170.7	135.2	0	0	109.7	F22 F26	F22-E24 PolarHBondContact O-N 2.9Å; E24-F26 VanDerWaalsContact O-CD2 3.25Å; E24-F26 WeakPolarHBondContact O-CD2 3.49Å; E24-F26 PolarHBondContact O-N 3.08Å; E24-F26 VanDerWaalsContact O-N 3.15Å
25	E	26.9	Very low	29.3	Very low	179 Å²	179	149.3 Å²	149.3	84%	0.836	74%	0.744	S	S	*	*			trans	-74	102.4	-178.2	-67.2	-170.1	128.1	0	0	112.3	K27	E25-K27 PolarHBondContact O-N 3.33Å
26	F	27.7	Very low	29.1	Very low	187 Å²	187	142.3 Å²	142.3	82%	0.82	73%	0.73	S	S	*	*			trans	-76	103.6	174.2	-71	-82.5	0	0	0	111.8	E24 S28	E24-F26 VanDerWaalsContact O-CD2 3.25Å; E24-F26 WeakPolarHBondContact O-CD2 3.49Å; E24-F26 PolarHBondContact O-N 3.08Å; E24-F26 VanDerWaalsContact O-N 3.15Å; F26-S28 PolarHBondContact O-N 3.03Å
27	K	28.4	Very low	28.6	Very low	160 Å²	160	143.2 Å²	143.2	70%	0.696	72%	0.724	S	S	*	*			trans	-68.4	129.2	173.5	-67.7	-176.1	179.1	178	0	110.8	E25 W29	E25-K27 PolarHBondContact O-N 3.33Å; K27-W29 PolarHBondContact O-N 3.21Å
28	S	30.9	Very low	28.8	Very low	125 Å²	125	141.6 Å²	141.6	87%	0.874	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	20.6	-161.4	47.4	0	0	0	0	117.2	F26	F26-S28 PolarHBondContact O-N 3.03Å
29	W	47.1	Very low	29	Very low	203 Å²	203	140.4 Å²	140.4	77%	0.769	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-19.1	-175.2	66.1	-96.3	0	0	0	115.9	K27 V31	K27-W29 PolarHBondContact O-N 3.21Å; W29-V31 PolarHBondContact O-N 3.44Å; W29-V31 VanDerWaalsContact O-N 3.13Å
30	D	32	Very low	29.3	Very low	81 Å²	81	138.2 Å²	138.2	43%	0.433	68%	0.682	S	S	.	*			trans	-85.6	82.1	173.7	-171.4	0.7	0	0	0	111.4	F32 R33	D30-F32 PolarHBondContact O-N 3.32Å; D30-F32 PolarHBondContact OD1-N 3.36Å; D30-F32 VanDerWaalsContact OD1-N 3.13Å; D30-R33 IonicContact OD2-NE 2.7Å
31	V	34.5	Very low	29.5	Very low	109 Å²	109	133.2 Å²	133.2	66%	0.661	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-8.9	179.1	-179	0	0	0	0	112.4	W29	W29-V31 PolarHBondContact O-N 3.44Å; W29-V31 VanDerWaalsContact O-N 3.13Å
32	F	26.6	Very low	29.8	Very low	172 Å²	172	133.5 Å²	133.5	75%	0.754	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	19.6	-160.5	-66.1	-71.8	0	0	0	115.8	D30	D30-F32 PolarHBondContact O-N 3.32Å; D30-F32 PolarHBondContact OD1-N 3.36Å; D30-F32 VanDerWaalsContact OD1-N 3.13Å
33	R	26.1	Very low	30.2	Very low	212 Å²	212	124.6 Å²	124.6	80%	0.8	63%	0.634	S	S	*	*			trans	-110.4	55.9	171.4	-70.3	-166.8	178.9	-153	2.4	114.8	D30 L35	D30-R33 IonicContact OD2-NE 2.7Å; R33-L35 PolarHBondContact O-N 2.93Å; R33-L35 VanDerWaalsContact O-N 3.12Å
34	L	30.1	Very low	31.3	Very low	112 Å²	112	124.1 Å²	124.1	59%	0.586	63%	0.633	S	S	*	*			trans	-63.7	112.6	151.5	-84.8	168.2	0	0	0	109.1	K1439	L34-K1439 PolarHBondContact O-NZ 3.02Å
35	L	26.6	Very low	32.1	Very low	111 Å²	111	123.9 Å²	123.9	58%	0.581	63%	0.626	S	S	*	*			trans	-51.1	-177.5	156.1	-75.3	163.9	0	0	0	110.9	R33 K1439	R33-L35 PolarHBondContact O-N 2.93Å; R33-L35 VanDerWaalsContact O-N 3.12Å; L35-K1439 PolarHBondContact O-NZ 3.07Å; L35-K1439 VanDerWaalsContact O-NZ 3.1Å
36	P	24.6	Very low	33.7	Very low	96 Å²	96	119.1 Å²	119.1	62%	0.623	60%	0.602	S	S	*	*	S	Bend	trans	-51.6	173	144.5	28.7	-38	0	0	0	110.1	Q38	P36-Q38 PolarHBondContact O-N 3.11Å
37	F	27.1	Very low	35.5	Very low	123 Å²	123	118 Å²	118	54%	0.539	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-58.6	119.4	150.1	-87.2	-56.6	0	0	0	105.9	V39	F37-V39 PolarHBondContact O-N 3.03Å
38	Q	28.1	Very low	37.3	Very low	118 Å²	118	115.7 Å²	115.7	55%	0.551	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-51.4	123.3	140.7	-74.6	-175.4	-16	0	0	104.2	P36 D40	P36-Q38 PolarHBondContact O-N 3.11Å; Q38-D40 VanDerWaalsContact C-N 3.26Å; Q38-D40 WeakPolarHBondContact O-CA 3.38Å; Q38-D40 PolarHBondContact O-N 2.86Å
39	V	32.7	Very low	39	Very low	114 Å²	114	114.9 Å²	114.9	69%	0.691	57%	0.567	S	S	*	*			trans	-60.1	101	169.9	173.5	0	0	0	0	104.5	F37 S41	F37-V39 PolarHBondContact O-N 3.03Å; V39-S41 VanDerWaalsContact C-N 3.33Å; V39-S41 WeakPolarHBondContact O-CA 3.47Å; V39-S41 PolarHBondContact O-N 3.14Å
40	D	30.9	Very low	40.3	Very low	60 Å²	60	108.9 Å²	108.9	32%	0.321	55%	0.549	S	S	.	.			trans	-52.2	93.8	-151.1	-58.9	-62.1	0	0	0	111.3	Q38 S42 G43 F46	Q38-D40 VanDerWaalsContact C-N 3.26Å; Q38-D40 WeakPolarHBondContact O-CA 3.38Å; Q38-D40 PolarHBondContact O-N 2.86Å; D40-S42 VanDerWaalsContact C-N 3.28Å; D40-S42 PolarHBondContact O-N 3.16Å; D40-G43 WeakPolarHBondContact O-CA 3.31Å; D40-G43 PolarHBondContact O-N 3.35Å; D40-F46 WeakPolarHBondContact O-CB 3.34Å
41	S	33.2	Very low	42.5	Very low	68 Å²	68	108.1 Å²	108.1	48%	0.476	55%	0.55	S	S	.	*	S	Bend	trans	-77.2	-23.7	-170.6	46.9	0	0	0	0	111.5	V39	V39-S41 VanDerWaalsContact C-N 3.33Å; V39-S41 WeakPolarHBondContact O-CA 3.47Å; V39-S41 PolarHBondContact O-N 3.14Å
42	S	31.1	Very low	44.5	Very low	107 Å²	107	104.5 Å²	104.5	75%	0.748	53%	0.527	S	S	*	.	S	Bend	trans	-89.9	-9	164.3	47.4	0	0	0	0	113.3	D40	D40-S42 VanDerWaalsContact C-N 3.28Å; D40-S42 PolarHBondContact O-N 3.16Å
43	G	35	Very low	47.1	Very low	11 Å²	11	98 Å²	98	11%	0.113	50%	0.499	C	S	.	.	S	Bend	trans	-88.1	161.8	180	0	0	0	0	0	113	D40 R45 F46	D40-G43 WeakPolarHBondContact O-CA 3.31Å; D40-G43 PolarHBondContact O-N 3.35Å; G43-R45 PolarHBondContact O-N 3.25Å; G43-F46 PolarHBondContact O-N 3.25Å
44	P	48.3	Very low	49.9	Very low	113 Å²	113	90.5 Å²	90.5	73%	0.734	48%	0.482	S	S	*	.	H	α-helix	trans	-62.6	-15.7	-178.6	24.7	-34.2	0	0	0	113.5	H48	P44-H48 WeakPolarHBondContact O-CB 3.45Å; P44-H48 PolarHBondContact O-N 2.87Å
45	R	47.1	Very low	52.6	Low	141 Å²	141	88.4 Å²	88.4	53%	0.532	47%	0.471	S	S	.	.	H	α-helix	trans	-69.1	-41.3	177.2	-66.7	-164	-165	-175	12.8	113.6	G43 H48 E49	G43-R45 PolarHBondContact O-N 3.25Å; R45-H48 PolarHBondContact O-N 3.22Å; R45-E49 PolarHBondContact O-N 3.35Å
46	F	58.9	Low	55.5	Low	79 Å²	79	83.7 Å²	83.7	35%	0.346	45%	0.446	S	S	.	.	H	α-helix	trans	-64.7	-45.7	179	175.5	-103	0	0	0	110.7	D40 G43 H48 E49 L50	D40-F46 WeakPolarHBondContact O-CB 3.34Å; G43-F46 PolarHBondContact O-N 3.25Å; F46-H48 VanDerWaalsContact C-N 3.32Å; F46-H48 PolarHBondContact O-N 3.31Å; F46-E49 PolarHBondContact O-N 2.74Å; F46-L50 HydrophobicContact CE1-CD2 3.94Å; F46-L50 HydrophobicContact CZ-CD2 4.14Å; F46-L50 WeakPolarHBondContact O-CB 3.15Å; F46-L50 PolarHBondContact O-N 3.27Å
47	W	65.8	Low	58.5	Low	164 Å²	164	83.1 Å²	83.1	62%	0.621	44%	0.438	S	S	*	.	H	α-helix	trans	-62.3	-36.3	173.5	-65.9	101.9	0	0	0	112.9	L50 S51	W47-L50 HydrophobicContact CE3-CD2 4.43Å; W47-L50 HydrophobicContact CZ3-CD2 4.41Å; W47-S51 WeakPolarHBondContact O-CB 3.35Å; W47-S51 PolarHBondContact O-N 3.4Å; W47-S51 PolarHBondContact O-OG 3.18Å
48	H	66.5	Low	61.5	Low	110 Å²	110	80 Å²	80	51%	0.509	43%	0.431	S	S	.	.	H	α-helix	trans	-66.7	-45.6	174.1	-177.2	-99	0	0	0	112.6	P44 R45 F46 S51 L52	P44-H48 WeakPolarHBondContact O-CB 3.45Å; P44-H48 PolarHBondContact O-N 2.87Å; R45-H48 PolarHBondContact O-N 3.22Å; F46-H48 VanDerWaalsContact C-N 3.32Å; F46-H48 PolarHBondContact O-N 3.31Å; H48-S51 WeakPolarHBondContact CA-OG 3.28Å; H48-S51 PolarHBondContact O-OG 3.38Å; H48-S51 VanDerWaalsContact O-OG 3.05Å; H48-L52 VanDerWaalsContact CE1-CD1 3.48Å; H48-L52 WeakPolarHBondContact CE1-CD1 3.46Å; H48-L52 VanDerWaalsContact O-CB 3.32Å; H48-L52 WeakPolarHBondContact O-CB 3.38Å; H48-L52 WeakPolarHBondContact O-CG 3.26Å; H48-L52 PolarHBondContact O-N 3.47Å
49	E	67	Low	64.4	Low	109 Å²	109	75.1 Å²	75.1	51%	0.509	41%	0.41	S	S	.	.	H	α-helix	trans	-71.9	-37.6	176.8	-74.1	-163.7	-154.6	0	0	112.9	R45 F46 L52 Q53	R45-E49 PolarHBondContact O-N 3.35Å; F46-E49 PolarHBondContact O-N 2.74Å; E49-L52 PolarHBondContact O-N 3.02Å; E49-Q53 WeakPolarHBondContact O-CB 3.36Å; E49-Q53 VanDerWaalsContact O-CG 3.29Å; E49-Q53 WeakPolarHBondContact O-CG 3.34Å; E49-Q53 PolarHBondContact O-N 3.22Å
50	L	73.6	Confident	67.1	Low	77 Å²	77	71.4 Å²	71.4	40%	0.403	38%	0.384	S	S	.	.	H	α-helix	trans	-63.5	-44	174.3	-177	62.8	0	0	0	111	F46 W47 Q53 A54	F46-L50 HydrophobicContact CE1-CD2 3.94Å; F46-L50 HydrophobicContact CZ-CD2 4.14Å; F46-L50 WeakPolarHBondContact O-CB 3.15Å; F46-L50 PolarHBondContact O-N 3.27Å; W47-L50 HydrophobicContact CE3-CD2 4.43Å; W47-L50 HydrophobicContact CZ3-CD2 4.41Å; L50-Q53 PolarHBondContact O-N 3.49Å; L50-A54 VanDerWaalsContact O-CB 3.29Å; L50-A54 WeakPolarHBondContact O-CB 3.39Å; L50-A54 PolarHBondContact O-N 3.22Å
51	S	79	Confident	69.9	Low	65 Å²	65	70.9 Å²	70.9	46%	0.455	39%	0.388	S	S	.	.	H	α-helix	trans	-68.4	-36.9	175.6	58	0	0	0	0	112.4	W47 H48 Q53 A54 L55	W47-S51 WeakPolarHBondContact O-CB 3.35Å; W47-S51 PolarHBondContact O-N 3.4Å; W47-S51 PolarHBondContact O-OG 3.18Å; H48-S51 WeakPolarHBondContact CA-OG 3.28Å; H48-S51 PolarHBondContact O-OG 3.38Å; H48-S51 VanDerWaalsContact O-OG 3.05Å; S51-Q53 PolarHBondContact O-N 3.08Å; S51-A54 PolarHBondContact O-N 3.22Å; S51-L55 WeakPolarHBondContact O-CB 3.33Å; S51-L55 PolarHBondContact O-N 3.39Å
52	L	76.4	Confident	72.8	Confident	33 Å²	33	71.6 Å²	71.6	17%	0.173	39%	0.39	C	S	.	.	H	α-helix	trans	-61	-41.5	170.9	-79.8	174.1	0	0	0	112.7	H48 E49 K56 I1402 T1406	H48-L52 VanDerWaalsContact CE1-CD1 3.48Å; H48-L52 WeakPolarHBondContact CE1-CD1 3.46Å; H48-L52 VanDerWaalsContact O-CB 3.32Å; H48-L52 WeakPolarHBondContact O-CB 3.38Å; H48-L52 WeakPolarHBondContact O-CG 3.26Å; H48-L52 PolarHBondContact O-N 3.47Å; E49-L52 PolarHBondContact O-N 3.02Å; L52-K56 WeakPolarHBondContact O-CB 3.48Å; L52-K56 PolarHBondContact O-N 3.47Å; L52-I1402 HydrophobicContact CD2-CG2 3.28Å; L52-T1406 HydrophobicContact CB-CG2 4.16Å; L52-T1406 HydrophobicContact CD1-CG2 4.24Å; L52-T1406 HydrophobicContact CD2-CG2 4.29Å; L52-T1406 HydrophobicContact CG-CG2 4.49Å
53	Q	81.9	Confident	75.7	Confident	35 Å²	35	67.1 Å²	67.1	16%	0.164	36%	0.357	C	S	.	.	H	α-helix	trans	-71.2	-42.3	176.9	-71.3	-175.1	49.3	0	0	111.8	E49 L50 S51 K56 L57 L1408	E49-Q53 WeakPolarHBondContact O-CB 3.36Å; E49-Q53 VanDerWaalsContact O-CG 3.29Å; E49-Q53 WeakPolarHBondContact O-CG 3.34Å; E49-Q53 PolarHBondContact O-N 3.22Å; L50-Q53 PolarHBondContact O-N 3.49Å; S51-Q53 PolarHBondContact O-N 3.08Å; Q53-K56 PolarHBondContact O-N 3.18Å; Q53-L57 WeakPolarHBondContact O-CB 3.27Å; Q53-L57 PolarHBondContact O-N 3.46Å; Q53-L1408 HydrophobicContact CB-CD2 4.42Å
54	A	84.6	Confident	78.5	Confident	55 Å²	55	69.2 Å²	69.2	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-62.1	-42.8	174.3	0	0	0	0	0	111.7	L50 S51 K56 L57 S58	L50-A54 VanDerWaalsContact O-CB 3.29Å; L50-A54 WeakPolarHBondContact O-CB 3.39Å; L50-A54 PolarHBondContact O-N 3.22Å; S51-A54 PolarHBondContact O-N 3.22Å; A54-K56 VanDerWaalsContact C-N 3.35Å; A54-K56 PolarHBondContact O-N 3.44Å; A54-L57 PolarHBondContact O-N 2.96Å; A54-S58 WeakPolarHBondContact O-CB 3.36Å; A54-S58 PolarHBondContact O-N 3.36Å; A54-S58 PolarHBondContact O-OG 3.44Å; A54-S58 VanDerWaalsContact O-OG 3.11Å
55	L	85.6	Confident	80.7	Confident	68 Å²	68	68.4 Å²	68.4	36%	0.356	35%	0.352	S	S	.	.	H	α-helix	trans	-60.4	-40.4	172.7	175.4	67.1	0	0	0	112.1	S51 S58 A59 L1399 L1403	S51-L55 WeakPolarHBondContact O-CB 3.33Å; S51-L55 PolarHBondContact O-N 3.39Å; L55-S58 PolarHBondContact O-OG 3.38Å; L55-A59 WeakPolarHBondContact O-CB 3.45Å; L55-A59 PolarHBondContact O-N 3.44Å; L55-L1399 HydrophobicContact CD1-CD1 4.5Å; L55-L1399 HydrophobicContact CD2-CD1 3.91Å; L55-L1403 HydrophobicContact CG-CD2 4.36Å
56	K	87.3	Confident	83	Confident	11 Å²	11	65.1 Å²	65.1	5%	0.048	35%	0.345	C	S	.	.	H	α-helix	trans	-69.8	-38.8	175.3	-177.6	153.4	179.6	161.1	0	112.2	L52 Q53 A54 Y60 M455 L1403 T1406 L1408	L52-K56 WeakPolarHBondContact O-CB 3.48Å; L52-K56 PolarHBondContact O-N 3.47Å; Q53-K56 PolarHBondContact O-N 3.18Å; A54-K56 VanDerWaalsContact C-N 3.35Å; A54-K56 PolarHBondContact O-N 3.44Å; K56-Y60 HydrophobicContact CG-CD2 4.13Å; K56-Y60 HydrophobicContact CG-CE2 4.06Å; K56-Y60 VanDerWaalsContact O-CD2 3.25Å; K56-Y60 WeakPolarHBondContact O-CD2 3.42Å; K56-Y60 PolarHBondContact O-N 3.31Å; K56-M455 HydrophobicContact CD-CE 4.39Å; K56-M455 HydrophobicContact CG-CE 3.82Å; K56-L1403 HydrophobicContact CB-CD2 3.72Å; K56-L1403 HydrophobicContact CD-CD2 4.46Å; K56-L1403 WeakPolarHBondContact CE-O 3.46Å; K56-L1403 HydrophobicContact CG-CD2 4.09Å; K56-L1403 PolarHBondContact NZ-O 3.21Å; K56-T1406 VanDerWaalsContact CD-OG1 3.3Å; K56-T1406 WeakPolarHBondContact CD-OG1 3.35Å; K56-T1406 PolarHBondContact NZ-O 3.05Å; K56-L1408 HydrophobicContact CB-CD2 3.92Å; K56-L1408 HydrophobicContact CD-CD2 4.43Å; K56-L1408 HydrophobicContact CD-CG 4.22Å; K56-L1408 HydrophobicContact CG-CD1 4.34Å; K56-L1408 HydrophobicContact CG-CD2 3.9Å; K56-L1408 HydrophobicContact CG-CG 3.97Å
57	L	88.6	Confident	84.6	Confident	85 Å²	85	61.4 Å²	61.4	45%	0.445	33%	0.329	S	S	.	.	H	α-helix	trans	-74.5	-38.1	-179.2	-161.9	133.4	0	0	0	112.2	Q53 A54 Y60 A61 L1408	Q53-L57 WeakPolarHBondContact O-CB 3.27Å; Q53-L57 PolarHBondContact O-N 3.46Å; A54-L57 PolarHBondContact O-N 2.96Å; L57-Y60 WeakPolarHBondContact O-CB 3.37Å; L57-Y60 PolarHBondContact O-N 3.3Å; L57-A61 PolarHBondContact O-N 3.1Å; L57-A61 VanDerWaalsContact O-N 3.13Å; L57-L1408 HydrophobicContact CB-CD2 4.26Å; L57-L1408 HydrophobicContact CD1-CD1 4.43Å; L57-L1408 HydrophobicContact CD1-CD2 4.49Å
58	S	89	Confident	85.9	Confident	58 Å²	58	54.8 Å²	54.8	41%	0.406	31%	0.305	S	S	.	.	H	α-helix	trans	-66.5	-40	170.6	68.5	0	0	0	0	111.3	A54 L55 Y60 A61 V62	A54-S58 WeakPolarHBondContact O-CB 3.36Å; A54-S58 PolarHBondContact O-N 3.36Å; A54-S58 PolarHBondContact O-OG 3.44Å; A54-S58 VanDerWaalsContact O-OG 3.11Å; L55-S58 PolarHBondContact O-OG 3.38Å; S58-Y60 PolarHBondContact O-N 3.36Å; S58-A61 PolarHBondContact O-N 3.03Å; S58-V62 WeakPolarHBondContact O-CB 3.23Å; S58-V62 VanDerWaalsContact O-CG2 3.3Å; S58-V62 WeakPolarHBondContact O-CG2 3.22Å; S58-V62 PolarHBondContact O-N 2.78Å
59	A	89	Confident	87.2	Confident	14 Å²	14	53.7 Å²	53.7	12%	0.116	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-44.7	171.8	0	0	0	0	0	112	L55 A61 V62 I63 M455 L1403	L55-A59 WeakPolarHBondContact O-CB 3.45Å; L55-A59 PolarHBondContact O-N 3.44Å; A59-A61 VanDerWaalsContact C-N 3.33Å; A59-A61 PolarHBondContact O-N 3.23Å; A59-V62 PolarHBondContact O-N 3.45Å; A59-I63 HydrophobicContact CB-CD1 4.2Å; A59-I63 VanDerWaalsContact O-CB 3.26Å; A59-I63 WeakPolarHBondContact O-CB 3.46Å; A59-I63 VanDerWaalsContact O-CD1 3.23Å; A59-I63 WeakPolarHBondContact O-CD1 3.38Å; A59-I63 WeakPolarHBondContact O-CG1 3.49Å; A59-I63 PolarHBondContact O-N 3.09Å; A59-M455 HydrophobicContact CB-CE 3.89Å; A59-L1403 HydrophobicContact CB-CD1 4.33Å; A59-L1403 HydrophobicContact CB-CD2 4.33Å
60	Y	89.8	Confident	88.5	Confident	37 Å²	37	49 Å²	49	15%	0.145	28%	0.282	C	S	.	.	H	α-helix	trans	-54.1	-48.3	173.2	-93.7	-74.4	0	0	0	112.1	K56 L57 S58 F64 M455 I458 S459 L1408	K56-Y60 HydrophobicContact CG-CD2 4.13Å; K56-Y60 HydrophobicContact CG-CE2 4.06Å; K56-Y60 VanDerWaalsContact O-CD2 3.25Å; K56-Y60 WeakPolarHBondContact O-CD2 3.42Å; K56-Y60 PolarHBondContact O-N 3.31Å; L57-Y60 WeakPolarHBondContact O-CB 3.37Å; L57-Y60 PolarHBondContact O-N 3.3Å; S58-Y60 PolarHBondContact O-N 3.36Å; Y60-F64 WeakPolarHBondContact O-CB 3.39Å; Y60-F64 PolarHBondContact O-N 2.93Å; Y60-M455 HydrophobicContact CD1-CB 4.02Å; Y60-M455 HydrophobicContact CD1-CG 4.12Å; Y60-M455 HydrophobicContact CD2-CE 4.11Å; Y60-M455 HydrophobicContact CD2-CG 4.37Å; Y60-M455 HydrophobicContact CE1-CB 3.54Å; Y60-M455 HydrophobicContact CE1-CG 3.7Å; Y60-M455 HydrophobicContact CE2-CE 4.25Å; Y60-M455 HydrophobicContact CE2-CG 3.99Å; Y60-M455 HydrophobicContact CG-CG 4.44Å; Y60-I458 HydrophobicContact CD1-CB 3.91Å; Y60-I458 HydrophobicContact CD1-CD1 4.31Å; Y60-I458 HydrophobicContact CD1-CG2 4.08Å; Y60-I458 HydrophobicContact CE1-CB 3.94Å; Y60-I458 HydrophobicContact CE1-CD1 4.06Å; Y60-I458 HydrophobicContact CE1-CG1 4.4Å; Y60-S459 WeakPolarHBondContact CD1-OG 3.23Å; Y60-S459 PolarHBondContact O-OG 3.15Å; Y60-L1408 HydrophobicContact CD2-CD1 3.62Å; Y60-L1408 HydrophobicContact CE2-CD1 3.46Å; Y60-L1408 VanDerWaalsContact CE2-CD1 3.46Å; Y60-L1408 HydrophobicContact CE2-CG 4.35Å
61	A	90.9	Very high	89.5	Confident	49 Å²	49	45.4 Å²	45.4	41%	0.405	26%	0.263	S	S	.	.	H	α-helix	trans	-68.1	-47.9	-178.8	0	0	0	0	0	112.9	L57 S58 A59 F64 L65	L57-A61 PolarHBondContact O-N 3.1Å; L57-A61 VanDerWaalsContact O-N 3.13Å; S58-A61 PolarHBondContact O-N 3.03Å; A59-A61 VanDerWaalsContact C-N 3.33Å; A59-A61 PolarHBondContact O-N 3.23Å; A61-F64 PolarHBondContact O-N 3.13Å; A61-L65 WeakPolarHBondContact O-CB 3.47Å; A61-L65 WeakPolarHBondContact O-CG 3.37Å; A61-L65 PolarHBondContact O-N 3.26Å
62	V	93.5	Very high	90.1	Very high	82 Å²	82	44.2 Å²	44.2	50%	0.497	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-45.8	178.8	169.1	0	0	0	0	110.8	S58 A59 L65 L66	S58-V62 WeakPolarHBondContact O-CB 3.23Å; S58-V62 VanDerWaalsContact O-CG2 3.3Å; S58-V62 WeakPolarHBondContact O-CG2 3.22Å; S58-V62 PolarHBondContact O-N 2.78Å; A59-V62 PolarHBondContact O-N 3.45Å; V62-L65 PolarHBondContact O-N 3.28Å; V62-L66 HydrophobicContact CG1-CD1 3.72Å; V62-L66 HydrophobicContact CG1-CG 4.32Å; V62-L66 VanDerWaalsContact O-CB 3.23Å; V62-L66 WeakPolarHBondContact O-CB 3.38Å; V62-L66 VanDerWaalsContact O-CG 3.23Å; V62-L66 WeakPolarHBondContact O-CG 3.46Å; V62-L66 PolarHBondContact O-N 2.88Å
63	I	92.7	Very high	90.8	Very high	14 Å²	14	48 Å²	48	7%	0.072	27%	0.266	C	S	.	.	H	α-helix	trans	-69.7	-35.4	179.1	-59.6	160.3	0	0	0	110.8	A59 T67 C446 F449 A450 M455	A59-I63 HydrophobicContact CB-CD1 4.2Å; A59-I63 VanDerWaalsContact O-CB 3.26Å; A59-I63 WeakPolarHBondContact O-CB 3.46Å; A59-I63 VanDerWaalsContact O-CD1 3.23Å; A59-I63 WeakPolarHBondContact O-CD1 3.38Å; A59-I63 WeakPolarHBondContact O-CG1 3.49Å; A59-I63 PolarHBondContact O-N 3.09Å; I63-T67 HydrophobicContact CG2-CG2 4.23Å; I63-T67 WeakPolarHBondContact O-CB 3.39Å; I63-T67 WeakPolarHBondContact O-CG2 3.3Å; I63-T67 PolarHBondContact O-N 3.27Å; I63-T67 PolarHBondContact O-OG1 3.48Å; I63-C446 HydrophobicContact CG2-CB 4.18Å; I63-F449 HydrophobicContact CD1-CD1 3.5Å; I63-F449 HydrophobicContact CD1-CE1 3.57Å; I63-A450 HydrophobicContact CG2-CB 4.16Å; I63-M455 HydrophobicContact CD1-SD 3.77Å
64	F	94.1	Very high	91.3	Very high	55 Å²	55	46.3 Å²	46.3	24%	0.241	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-51	174	175.1	-103.5	0	0	0	111.9	Y60 A61 T67 L68 I458 L462 P463	Y60-F64 WeakPolarHBondContact O-CB 3.39Å; Y60-F64 PolarHBondContact O-N 2.93Å; A61-F64 PolarHBondContact O-N 3.13Å; F64-T67 PolarHBondContact O-N 3.42Å; F64-T67 PolarHBondContact O-OG1 2.95Å; F64-T67 VanDerWaalsContact O-OG1 3.07Å; F64-L68 HydrophobicContact CE1-CD2 4.19Å; F64-L68 HydrophobicContact CZ-CD2 4.05Å; F64-L68 VanDerWaalsContact O-CB 3.27Å; F64-L68 WeakPolarHBondContact O-CB 3.49Å; F64-L68 PolarHBondContact O-N 2.95Å; F64-I458 VanDerWaalsContact CD2-O 3.32Å; F64-I458 WeakPolarHBondContact CD2-O 3.25Å; F64-L462 HydrophobicContact CE2-CD2 3.68Å; F64-L462 HydrophobicContact CZ-CD2 4.13Å; F64-P463 HydrophobicContact CD2-CB 3.99Å; F64-P463 HydrophobicContact CD2-CG 3.92Å; F64-P463 HydrophobicContact CE2-CB 3.86Å; F64-P463 HydrophobicContact CE2-CG 4.16Å
65	L	93.9	Very high	91.5	Very high	95 Å²	95	43.9 Å²	43.9	50%	0.497	24%	0.238	S	C	.	.	H	α-helix	trans	-63.5	-44.2	178.2	-70.8	171.4	0	0	0	111.7	A61 V62 L69	A61-L65 WeakPolarHBondContact O-CB 3.47Å; A61-L65 WeakPolarHBondContact O-CG 3.37Å; A61-L65 PolarHBondContact O-N 3.26Å; V62-L65 PolarHBondContact O-N 3.28Å; L65-L69 VanDerWaalsContact O-CB 3.27Å; L65-L69 WeakPolarHBondContact O-CB 3.23Å; L65-L69 VanDerWaalsContact O-CG 3.29Å; L65-L69 WeakPolarHBondContact O-CG 3.49Å; L65-L69 PolarHBondContact O-N 3Å
66	L	94.2	Very high	91.7	Very high	73 Å²	73	41.4 Å²	41.4	38%	0.382	23%	0.227	S	C	.	.	H	α-helix	trans	-61.5	-49.5	176.4	-76.2	174.5	0	0	0	111.9	V62 L68 S70 L442	V62-L66 HydrophobicContact CG1-CD1 3.72Å; V62-L66 HydrophobicContact CG1-CG 4.32Å; V62-L66 VanDerWaalsContact O-CB 3.23Å; V62-L66 WeakPolarHBondContact O-CB 3.38Å; V62-L66 VanDerWaalsContact O-CG 3.23Å; V62-L66 WeakPolarHBondContact O-CG 3.46Å; V62-L66 PolarHBondContact O-N 2.88Å; L66-L68 PolarHBondContact O-N 3.36Å; L66-S70 VanDerWaalsContact O-CB 3.27Å; L66-S70 WeakPolarHBondContact O-CB 3.28Å; L66-S70 PolarHBondContact O-N 3.23Å; L66-S70 PolarHBondContact O-OG 2.94Å; L66-L442 HydrophobicContact CB-CD2 3.95Å; L66-L442 HydrophobicContact CD2-CD2 4.07Å; L66-L442 HydrophobicContact CG-CD2 4.42Å
67	T	93.4	Very high	91.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-42.8	179.1	47.6	0	0	0	0	112.4	I63 F64 C71 C446 P463	I63-T67 HydrophobicContact CG2-CG2 4.23Å; I63-T67 WeakPolarHBondContact O-CB 3.39Å; I63-T67 WeakPolarHBondContact O-CG2 3.3Å; I63-T67 PolarHBondContact O-N 3.27Å; I63-T67 PolarHBondContact O-OG1 3.48Å; F64-T67 PolarHBondContact O-N 3.42Å; F64-T67 PolarHBondContact O-OG1 2.95Å; F64-T67 VanDerWaalsContact O-OG1 3.07Å; T67-C71 WeakPolarHBondContact O-CB 3.41Å; T67-C71 PolarHBondContact O-N 3.25Å; T67-C446 HydrophobicContact CG2-CB 3.46Å; T67-C446 VanDerWaalsContact CG2-CB 3.46Å; T67-P463 WeakPolarHBondContact OG1-CG 3.37Å
68	L	94	Very high	91.8	Very high	24 Å²	24	37.5 Å²	37.5	13%	0.126	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-55.9	178.7	-177.1	61.1	0	0	0	111.5	F64 L66 C71 I72 P463 C466 V467 L470	F64-L68 HydrophobicContact CE1-CD2 4.19Å; F64-L68 HydrophobicContact CZ-CD2 4.05Å; F64-L68 VanDerWaalsContact O-CB 3.27Å; F64-L68 WeakPolarHBondContact O-CB 3.49Å; F64-L68 PolarHBondContact O-N 2.95Å; L66-L68 PolarHBondContact O-N 3.36Å; L68-C71 PolarHBondContact O-N 3.03Å; L68-I72 HydrophobicContact CD1-CD1 3.97Å; L68-I72 HydrophobicContact CG-CD1 4.06Å; L68-I72 VanDerWaalsContact O-CG1 3.31Å; L68-I72 WeakPolarHBondContact O-CG1 3.34Å; L68-I72 PolarHBondContact O-N 3.43Å; L68-P463 HydrophobicContact CB-CB 4.09Å; L68-P463 HydrophobicContact CD1-CB 4.39Å; L68-C466 HydrophobicContact CD1-CB 4.49Å; L68-V467 HydrophobicContact CD1-CG2 3.91Å; L68-L470 HydrophobicContact CD1-CD1 3.95Å
69	L	93.6	Very high	91.7	Very high	87 Å²	87	34.9 Å²	34.9	46%	0.455	19%	0.19	S	C	.	.	H	α-helix	trans	-66.9	-47.1	-175.4	-66.6	171.6	0	0	0	111.8	L65 C71 I72 F73	L65-L69 VanDerWaalsContact O-CB 3.27Å; L65-L69 WeakPolarHBondContact O-CB 3.23Å; L65-L69 VanDerWaalsContact O-CG 3.29Å; L65-L69 WeakPolarHBondContact O-CG 3.49Å; L65-L69 PolarHBondContact O-N 3Å; L69-C71 VanDerWaalsContact C-N 3.29Å; L69-C71 PolarHBondContact O-N 3.26Å; L69-I72 PolarHBondContact O-N 3.2Å; L69-F73 HydrophobicContact CB-CD2 4.41Å; L69-F73 HydrophobicContact CB-CE2 4.3Å; L69-F73 WeakPolarHBondContact O-CD2 3.4Å; L69-F73 PolarHBondContact O-N 3.43Å
70	S	93.7	Very high	91.4	Very high	11 Å²	11	34.9 Å²	34.9	8%	0.077	19%	0.188	C	C	.	.	H	α-helix	trans	-67	-28.4	180	62.6	0	0	0	0	112.9	L66 A74 S439 L442 V443	L66-S70 VanDerWaalsContact O-CB 3.27Å; L66-S70 WeakPolarHBondContact O-CB 3.28Å; L66-S70 PolarHBondContact O-N 3.23Å; L66-S70 PolarHBondContact O-OG 2.94Å; S70-A74 WeakPolarHBondContact O-CB 3.48Å; S70-A74 PolarHBondContact O-N 2.94Å; S70-S439 WeakPolarHBondContact O-CB 3.41Å; S70-L442 WeakPolarHBondContact OG-CD2 3.19Å; S70-V443 VanDerWaalsContact C-CG2 3.44Å; S70-V443 WeakPolarHBondContact OG-CG2 3.39Å
71	C	93.5	Very high	91.3	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	18%	0.181	C	C	.	.	H	α-helix	trans	-76.8	-36.2	175	-161.9	0	0	0	0	112.2	T67 L68 L69 K75 V443 L464 V467	T67-C71 WeakPolarHBondContact O-CB 3.41Å; T67-C71 PolarHBondContact O-N 3.25Å; L68-C71 PolarHBondContact O-N 3.03Å; L69-C71 VanDerWaalsContact C-N 3.29Å; L69-C71 PolarHBondContact O-N 3.26Å; C71-K75 WeakPolarHBondContact O-CB 3.43Å; C71-K75 PolarHBondContact O-N 2.96Å; C71-V443 VanDerWaalsContact CA-CG2 3.48Å; C71-V443 HydrophobicContact CB-CG1 4.15Å; C71-V443 HydrophobicContact CB-CG2 3.63Å; C71-V443 VanDerWaalsContact N-CG2 3.28Å; C71-L464 HydrophobicContact CB-CD2 4.38Å; C71-V467 HydrophobicContact CB-CG1 4.33Å; C71-V467 HydrophobicContact CB-CG2 3.69Å
72	I	92.3	Very high	91.1	Very high	40 Å²	40	30.9 Å²	30.9	21%	0.205	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-52.3	168.8	-71.2	167.7	0	0	0	109.8	L68 L69 A74 K75 A76 V467 L470 L471	L68-I72 HydrophobicContact CD1-CD1 3.97Å; L68-I72 HydrophobicContact CG-CD1 4.06Å; L68-I72 VanDerWaalsContact O-CG1 3.31Å; L68-I72 WeakPolarHBondContact O-CG1 3.34Å; L68-I72 PolarHBondContact O-N 3.43Å; L69-I72 PolarHBondContact O-N 3.2Å; I72-A74 PolarHBondContact O-N 3.37Å; I72-K75 PolarHBondContact O-N 3.29Å; I72-A76 WeakPolarHBondContact O-CB 3.38Å; I72-A76 PolarHBondContact O-N 3.37Å; I72-V467 HydrophobicContact CG1-CB 4.45Å; I72-V467 HydrophobicContact CG1-CG1 3.96Å; I72-V467 HydrophobicContact CG1-CG2 4.25Å; I72-L470 HydrophobicContact CD1-CD1 4.49Å; I72-L471 HydrophobicContact CG2-CD1 4.42Å
73	F	91.5	Very high	90.6	Very high	112 Å²	112	27.1 Å²	27.1	49%	0.491	14%	0.139	S	C	.	.	H	α-helix	trans	-62.6	-44.2	179.9	-73.7	-58.7	0	0	0	112.9	L69 K75 S77	L69-F73 HydrophobicContact CB-CD2 4.41Å; L69-F73 HydrophobicContact CB-CE2 4.3Å; L69-F73 WeakPolarHBondContact O-CD2 3.4Å; L69-F73 PolarHBondContact O-N 3.43Å; F73-K75 PolarHBondContact O-N 3.02Å; F73-S77 VanDerWaalsContact O-CB 3.29Å; F73-S77 WeakPolarHBondContact O-CB 3.47Å; F73-S77 PolarHBondContact O-N 3.03Å; F73-S77 PolarHBondContact O-OG 3.08Å
74	A	91.6	Very high	90.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.3	-44.9	178.4	0	0	0	0	0	112.2	S70 I72 S77 F78 S439 A440	S70-A74 WeakPolarHBondContact O-CB 3.48Å; S70-A74 PolarHBondContact O-N 2.94Å; I72-A74 PolarHBondContact O-N 3.37Å; A74-S77 PolarHBondContact O-OG 3.1Å; A74-F78 VanDerWaalsContact O-CB 3.31Å; A74-F78 WeakPolarHBondContact O-CB 3.48Å; A74-F78 PolarHBondContact O-N 3.16Å; A74-S439 WeakPolarHBondContact CA-OG 3.39Å; A74-S439 WeakPolarHBondContact CB-OG 3.39Å; A74-S439 PolarHBondContact N-OG 3.31Å; A74-A440 HydrophobicContact CB-CB 3.99Å
75	K	90.4	Very high	89.6	Confident	5 Å²	5	24.1 Å²	24.1	2%	0.022	13%	0.126	C	C	.	.	H	α-helix	trans	-78.8	-35	-177.7	-161.6	163.6	-174.1	177.2	0	112.4	C71 I72 F73 L79 L189 T192 L471 E560	C71-K75 WeakPolarHBondContact O-CB 3.43Å; C71-K75 PolarHBondContact O-N 2.96Å; I72-K75 PolarHBondContact O-N 3.29Å; F73-K75 PolarHBondContact O-N 3.02Å; K75-L79 HydrophobicContact CG-CD1 4.17Å; K75-L79 WeakPolarHBondContact O-CB 3.47Å; K75-L79 WeakPolarHBondContact O-CD1 3.29Å; K75-L79 VanDerWaalsContact O-CG 3.27Å; K75-L79 WeakPolarHBondContact O-CG 3.23Å; K75-L79 PolarHBondContact O-N 3.45Å; K75-L189 HydrophobicContact CD-CD1 4.07Å; K75-L189 VanDerWaalsContact CE-CD1 3.5Å; K75-L189 HydrophobicContact CG-CD1 4.49Å; K75-T192 PolarHBondContact NZ-OG1 3.38Å; K75-L471 HydrophobicContact CB-CD2 3.86Å; K75-L471 HydrophobicContact CD-CD2 4.37Å; K75-L471 HydrophobicContact CG-CD2 3.92Å; K75-E560 WeakPolarHBondContact CD-OE2 3.31Å; K75-E560 VanDerWaalsContact NZ-CD 3.31Å; K75-E560 IonicContact NZ-OE1 3.99Å; K75-E560 PolarHBondContact NZ-OE1 2.89Å; K75-E560 IonicContact NZ-OE2 2.63Å
76	A	88.1	Confident	88.7	Confident	16 Å²	16	19.7 Å²	19.7	13%	0.132	10%	0.103	C	C	.	.	H	α-helix	trans	-66.7	-51.5	175.2	0	0	0	0	0	112.4	I72 F78 L79 L80 L471	I72-A76 WeakPolarHBondContact O-CB 3.38Å; I72-A76 PolarHBondContact O-N 3.37Å; A76-F78 PolarHBondContact O-N 2.77Å; A76-L79 PolarHBondContact O-N 3.41Å; A76-L80 WeakPolarHBondContact O-CG 3.49Å; A76-L80 PolarHBondContact O-N 3.34Å; A76-L471 HydrophobicContact CB-CD1 3.8Å
77	S	88.5	Confident	87.7	Confident	10 Å²	10	17.5 Å²	17.5	7%	0.07	9%	0.09	C	C	.	.	H	α-helix	trans	-59.6	-47.4	178.7	54.5	0	0	0	0	111.2	F73 A74 L79 L80 M81 Q436	F73-S77 VanDerWaalsContact O-CB 3.29Å; F73-S77 WeakPolarHBondContact O-CB 3.47Å; F73-S77 PolarHBondContact O-N 3.03Å; F73-S77 PolarHBondContact O-OG 3.08Å; A74-S77 PolarHBondContact O-OG 3.1Å; S77-L79 PolarHBondContact O-N 3.48Å; S77-L80 PolarHBondContact O-N 3.48Å; S77-M81 WeakPolarHBondContact O-CB 3.27Å; S77-M81 WeakPolarHBondContact O-CG 3.07Å; S77-M81 PolarHBondContact O-N 2.94Å; S77-Q436 WeakPolarHBondContact OG-CB 3.48Å; S77-Q436 WeakPolarHBondContact OG-CG 3.25Å
78	F	89.5	Confident	86.6	Confident	3 Å²	3	18.5 Å²	18.5	1%	0.013	10%	0.096	C	C	.	.	H	α-helix	trans	-59.7	-45.4	176.7	-173.6	-89.1	0	0	0	112.8	A74 A76 M81 A82 A129 V130 T176 L180 Q436 I557	A74-F78 VanDerWaalsContact O-CB 3.31Å; A74-F78 WeakPolarHBondContact O-CB 3.48Å; A74-F78 PolarHBondContact O-N 3.16Å; A76-F78 PolarHBondContact O-N 2.77Å; F78-M81 PolarHBondContact O-N 3.27Å; F78-A82 HydrophobicContact CE1-CB 4.09Å; F78-A82 WeakPolarHBondContact O-CB 3.38Å; F78-A82 PolarHBondContact O-N 3.17Å; F78-A129 HydrophobicContact CD2-CB 4.02Å; F78-A129 HydrophobicContact CE2-CB 4.12Å; F78-V130 HydrophobicContact CE2-CG2 3.69Å; F78-V130 HydrophobicContact CZ-CG2 3.88Å; F78-T176 HydrophobicContact CE1-CG2 4.5Å; F78-T176 HydrophobicContact CZ-CG2 3.77Å; F78-L180 HydrophobicContact CE1-CD1 4.05Å; F78-Q436 HydrophobicContact CB-CG 4.03Å; F78-I557 HydrophobicContact CD1-CB 4.37Å; F78-I557 HydrophobicContact CD1-CG1 4.19Å; F78-I557 HydrophobicContact CD1-CG2 3.89Å; F78-I557 HydrophobicContact CD2-CG1 4.34Å; F78-I557 HydrophobicContact CE1-CB 4.14Å; F78-I557 HydrophobicContact CE1-CD1 4.22Å; F78-I557 HydrophobicContact CE1-CG1 3.67Å; F78-I557 HydrophobicContact CE1-CG2 3.63Å; F78-I557 HydrophobicContact CE2-CD1 4.49Å; F78-I557 HydrophobicContact CE2-CG1 3.82Å; F78-I557 HydrophobicContact CZ-CB 4.43Å; F78-I557 HydrophobicContact CZ-CD1 3.86Å; F78-I557 HydrophobicContact CZ-CG1 3.48Å; F78-I557 VanDerWaalsContact CZ-CG1 3.48Å; F78-I557 HydrophobicContact CZ-CG2 4.33Å
79	L	86.7	Confident	85.3	Confident	4 Å²	4	21.4 Å²	21.4	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-62.9	-42.9	178.9	-80.8	167.4	0	0	0	112.3	K75 A76 S77 A82 T83 L180 L189 L471	K75-L79 HydrophobicContact CG-CD1 4.17Å; K75-L79 WeakPolarHBondContact O-CB 3.47Å; K75-L79 WeakPolarHBondContact O-CD1 3.29Å; K75-L79 VanDerWaalsContact O-CG 3.27Å; K75-L79 WeakPolarHBondContact O-CG 3.23Å; K75-L79 PolarHBondContact O-N 3.45Å; A76-L79 PolarHBondContact O-N 3.41Å; S77-L79 PolarHBondContact O-N 3.48Å; L79-A82 PolarHBondContact O-N 3.16Å; L79-T83 WeakPolarHBondContact O-CG2 3.44Å; L79-T83 PolarHBondContact O-N 3.1Å; L79-T83 PolarHBondContact O-OG1 3.46Å; L79-L180 HydrophobicContact CD2-CD1 4.26Å; L79-L180 HydrophobicContact CD2-CD2 3.73Å; L79-L189 HydrophobicContact CD1-CB 3.84Å; L79-L189 HydrophobicContact CD1-CD1 3.91Å; L79-L189 HydrophobicContact CD1-CD2 4.23Å; L79-L189 HydrophobicContact CD1-CG 4.2Å; L79-L471 HydrophobicContact CD1-CD2 4.27Å
80	L	84.5	Confident	84.1	Confident	14 Å²	14	22.1 Å²	22.1	7%	0.073	11%	0.111	C	C	.	.	H	α-helix	trans	-61.3	-47	176.8	-73	167.7	0	0	0	111.1	A76 S77 A82 T83 S84 M475 L493 F497 W499	A76-L80 WeakPolarHBondContact O-CG 3.49Å; A76-L80 PolarHBondContact O-N 3.34Å; S77-L80 PolarHBondContact O-N 3.48Å; L80-A82 VanDerWaalsContact C-N 3.34Å; L80-A82 PolarHBondContact O-N 3.43Å; L80-T83 WeakPolarHBondContact CA-OG1 3.44Å; L80-T83 PolarHBondContact O-N 3.02Å; L80-T83 VanDerWaalsContact O-N 3.13Å; L80-T83 PolarHBondContact O-OG1 2.91Å; L80-S84 PolarHBondContact O-N 2.64Å; L80-M475 HydrophobicContact CD2-CE 4.03Å; L80-M475 HydrophobicContact CG-CE 4.3Å; L80-L493 HydrophobicContact CD1-CD2 3.75Å; L80-F497 HydrophobicContact CB-CD1 3.77Å; L80-F497 HydrophobicContact CB-CE1 3.68Å; L80-W499 HydrophobicContact CD2-CB 3.86Å; L80-W499 HydrophobicContact CD2-CD2 3.73Å; L80-W499 HydrophobicContact CD2-CE3 4.08Å; L80-W499 HydrophobicContact CD2-CG 3.65Å
81	M	86.6	Confident	82.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.2	-38.7	176	-67.5	170.5	62.5	0	0	112.5	S77 F78 T83 S84 W122 L125 T126 A129 T432 C433 F497	S77-M81 WeakPolarHBondContact O-CB 3.27Å; S77-M81 WeakPolarHBondContact O-CG 3.07Å; S77-M81 PolarHBondContact O-N 2.94Å; F78-M81 PolarHBondContact O-N 3.27Å; M81-T83 VanDerWaalsContact C-N 3.35Å; M81-S84 PolarHBondContact O-OG 2.96Å; M81-W122 HydrophobicContact CB-CE3 4.36Å; M81-W122 HydrophobicContact CG-CE3 4.06Å; M81-W122 HydrophobicContact CG-CZ3 3.8Å; M81-L125 HydrophobicContact CE-CB 3.82Å; M81-L125 WeakPolarHBondContact CE-O 3.36Å; M81-T126 VanDerWaalsContact C-CG2 3.45Å; M81-T126 HydrophobicContact CB-CG2 3.66Å; M81-T126 HydrophobicContact CE-CG2 4.48Å; M81-T126 WeakPolarHBondContact O-CG2 3.43Å; M81-A129 HydrophobicContact CE-CB 4.35Å; M81-T432 HydrophobicContact SD-CG2 4.36Å; M81-C433 HydrophobicContact CE-CB 4.02Å; M81-F497 HydrophobicContact CG-CE1 3.9Å; M81-F497 HydrophobicContact CG-CZ 3.95Å
82	A	86.2	Confident	81.5	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-69.8	-31	175.4	0	0	0	0	0	112.4	F78 L79 L80 L180 P181	F78-A82 HydrophobicContact CE1-CB 4.09Å; F78-A82 WeakPolarHBondContact O-CB 3.38Å; F78-A82 PolarHBondContact O-N 3.17Å; L79-A82 PolarHBondContact O-N 3.16Å; L80-A82 VanDerWaalsContact C-N 3.34Å; L80-A82 PolarHBondContact O-N 3.43Å; A82-L180 HydrophobicContact CB-CB 3.95Å; A82-L180 HydrophobicContact CB-CD1 3.89Å; A82-P181 WeakPolarHBondContact O-CA 3.39Å; A82-P181 WeakPolarHBondContact O-CG 3.39Å
83	T	84.4	Confident	80.1	Confident	4 Å²	4	28.7 Å²	28.7	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-79.5	-26.3	177.1	54.4	0	0	0	0	114.7	L79 L80 M81 V85 G86 A185	L79-T83 WeakPolarHBondContact O-CG2 3.44Å; L79-T83 PolarHBondContact O-N 3.1Å; L79-T83 PolarHBondContact O-OG1 3.46Å; L80-T83 WeakPolarHBondContact CA-OG1 3.44Å; L80-T83 PolarHBondContact O-N 3.02Å; L80-T83 VanDerWaalsContact O-N 3.13Å; L80-T83 PolarHBondContact O-OG1 2.91Å; M81-T83 VanDerWaalsContact C-N 3.35Å; T83-V85 VanDerWaalsContact C-N 3.29Å; T83-V85 PolarHBondContact O-N 3.46Å; T83-G86 WeakPolarHBondContact O-CA 3.41Å; T83-G86 PolarHBondContact O-N 2.68Å; T83-A185 HydrophobicContact CG2-CB 4.07Å
84	S	81.8	Confident	78.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-69.5	-26.7	177.4	56.2	0	0	0	0	112.8	L80 M81 G86 W87 W122 F498	L80-S84 PolarHBondContact O-N 2.64Å; M81-S84 PolarHBondContact O-OG 2.96Å; S84-G86 PolarHBondContact O-N 3.37Å; S84-G86 VanDerWaalsContact O-N 3.08Å; S84-W87 PolarHBondContact O-N 2.97Å; S84-W122 WeakPolarHBondContact OG-CB 3.37Å; S84-W122 VanDerWaalsContact OG-CD2 3.29Å; S84-F498 WeakPolarHBondContact CA-O 3.33Å; S84-F498 WeakPolarHBondContact CB-O 3.21Å; S84-F498 PolarHBondContact N-O 2.78Å
85	V	83	Confident	77.4	Confident	6 Å²	6	25.3 Å²	25.3	4%	0.036	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-58.4	-17.4	165.8	-180	0	0	0	0	112.5	T83 W87 W122 I123 T126 P181 R314	T83-V85 VanDerWaalsContact C-N 3.29Å; T83-V85 PolarHBondContact O-N 3.46Å; V85-W87 VanDerWaalsContact C-N 3.33Å; V85-W87 PolarHBondContact O-N 3.38Å; V85-W122 HydrophobicContact CG2-CB 3.91Å; V85-I123 HydrophobicContact CB-CG1 4.48Å; V85-I123 HydrophobicContact CG1-CD1 4.39Å; V85-I123 HydrophobicContact CG1-CG1 3.77Å; V85-I123 HydrophobicContact CG2-CG1 3.97Å; V85-T126 HydrophobicContact CG2-CG2 4.46Å; V85-P181 HydrophobicContact CB-CB 4.29Å; V85-P181 HydrophobicContact CB-CG 4.23Å; V85-P181 HydrophobicContact CG1-CB 4.33Å; V85-P181 HydrophobicContact CG1-CG 4.14Å; V85-R314 PolarHBondContact O-NH1 3.18Å
86	G	76.3	Confident	76.1	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.01	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-77.4	-7.6	177.5	0	0	0	0	0	116	T83 S84 K90 P181	T83-G86 WeakPolarHBondContact O-CA 3.41Å; T83-G86 PolarHBondContact O-N 2.68Å; S84-G86 PolarHBondContact O-N 3.37Å; S84-G86 VanDerWaalsContact O-N 3.08Å; G86-K90 WeakPolarHBondContact O-CE 3.02Å; G86-K90 PolarHBondContact O-NZ 3.42Å; G86-P181 WeakPolarHBondContact CA-O 3.4Å
87	W	72.1	Confident	74.7	Confident	28 Å²	28	33 Å²	33	11%	0.106	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-106.4	8.8	-164.7	-79.3	87	0	0	0	116.3	S84 V85 D89 K90 F92 I114 F498 Y500	S84-W87 PolarHBondContact O-N 2.97Å; V85-W87 VanDerWaalsContact C-N 3.33Å; V85-W87 PolarHBondContact O-N 3.38Å; W87-D89 PolarHBondContact O-N 3.29Å; W87-D89 VanDerWaalsContact O-N 3.16Å; W87-K90 HydrophobicContact CD2-CB 4.48Å; W87-K90 HydrophobicContact CE3-CB 3.61Å; W87-K90 HydrophobicContact CE3-CD 4.46Å; W87-K90 HydrophobicContact CZ3-CB 4.01Å; W87-K90 PolarHBondContact O-N 3.05Å; W87-F92 HydrophobicContact CE3-CB 4.03Å; W87-F92 HydrophobicContact CE3-CD2 4.41Å; W87-F92 AromaticContact CH2-CD2 3.82Å; W87-F92 HydrophobicContact CH2-CD2 3.82Å; W87-F92 HydrophobicContact CZ2-CD2 4.27Å; W87-F92 HydrophobicContact CZ3-CB 3.77Å; W87-F92 AromaticContact CZ3-CD2 3.9Å; W87-F92 HydrophobicContact CZ3-CD2 3.9Å; W87-F92 HydrophobicContact CZ3-CG 4.32Å; W87-I114 HydrophobicContact CB-CD1 3.9Å; W87-I114 HydrophobicContact CD2-CD1 4.43Å; W87-I114 HydrophobicContact CE3-CD1 4.05Å; W87-I114 HydrophobicContact CG-CD1 4.41Å; W87-F498 HydrophobicContact CB-CB 3.98Å; W87-F498 HydrophobicContact CD2-CB 4.06Å; W87-F498 HydrophobicContact CG-CB 3.6Å; W87-Y500 HydrophobicContact CZ2-CD2 4.44Å
88	T	69.6	Low	73.2	Confident	21 Å²	21	36.4 Å²	36.4	13%	0.129	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.5	121.9	169.3	46.7	0	0	0	0	111.5	K90 T119 R314 M315	T88-K90 PolarHBondContact O-N 3.44Å; T88-K90 VanDerWaalsContact O-N 3.14Å; T88-T119 HydrophobicContact CG2-CG2 3.7Å; T88-R314 HydrophobicContact CG2-CB 4.25Å; T88-M315 HydrophobicContact CG2-CE 3.56Å
89	D	67	Low	71	Confident	86 Å²	86	42.7 Å²	42.7	46%	0.46	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	18.3	174.6	-126.1	-8.8	0	0	0	116.7	W87 R113	W87-D89 PolarHBondContact O-N 3.29Å; W87-D89 VanDerWaalsContact O-N 3.16Å; D89-R113 VanDerWaalsContact CG-NH2 3.25Å; D89-R113 IonicContact OD1-CZ 3.7Å; D89-R113 IonicContact OD1-NE 3.66Å; D89-R113 PolarHBondContact OD1-NE 3.08Å; D89-R113 IonicContact OD1-NH2 2.71Å; D89-R113 PolarHBondContact OD1-NH2 3.25Å; D89-R113 IonicContact OD2-NH2 2.66Å; D89-R113 PolarHBondContact OD2-NH2 3.21Å
90	K	67.8	Low	69.4	Low	102 Å²	102	47.8 Å²	47.8	44%	0.443	23%	0.233	S	C	.	.			trans	-97.9	141.4	177.2	-69.6	175.8	-170.9	164.3	0	111.9	G86 W87 T88	G86-K90 WeakPolarHBondContact O-CE 3.02Å; G86-K90 PolarHBondContact O-NZ 3.42Å; W87-K90 HydrophobicContact CD2-CB 4.48Å; W87-K90 HydrophobicContact CE3-CB 3.61Å; W87-K90 HydrophobicContact CE3-CD 4.46Å; W87-K90 HydrophobicContact CZ3-CB 4.01Å; W87-K90 PolarHBondContact O-N 3.05Å; T88-K90 PolarHBondContact O-N 3.44Å; T88-K90 VanDerWaalsContact O-N 3.14Å
91	N	67.2	Low	67.8	Low	109 Å²	109	52.7 Å²	52.7	58%	0.583	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	122.7	174.6	-68.4	-10.1	0	0	0	110.3	I111 A112	N91-I111 HydrophobicContact CB-CG2 3.97Å; N91-A112 CarbonylContact C-O 3.51Å; N91-A112 WeakPolarHBondContact CA-O 3.46Å
92	F	67	Low	66	Low	21 Å²	21	57.9 Å²	57.9	9%	0.092	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137	179.7	177.1	-107.3	0	0	0	111.1	W87 H94 A112 I114 F498	W87-F92 HydrophobicContact CE3-CB 4.03Å; W87-F92 HydrophobicContact CE3-CD2 4.41Å; W87-F92 AromaticContact CH2-CD2 3.82Å; W87-F92 HydrophobicContact CH2-CD2 3.82Å; W87-F92 HydrophobicContact CZ2-CD2 4.27Å; W87-F92 HydrophobicContact CZ3-CB 3.77Å; W87-F92 AromaticContact CZ3-CD2 3.9Å; W87-F92 HydrophobicContact CZ3-CD2 3.9Å; W87-F92 HydrophobicContact CZ3-CG 4.32Å; F92-H94 HydrophobicContact CD1-CB 4.36Å; F92-H94 HydrophobicContact CE1-CB 4.36Å; F92-H94 PolarHBondContact O-N 2.97Å; F92-A112 PolarHBondContact N-O 3.47Å; F92-A112 PolarHBondContact O-N 3.27Å; F92-I114 HydrophobicContact CB-CD1 3.79Å; F92-I114 HydrophobicContact CB-CG1 4.42Å; F92-I114 HydrophobicContact CG-CD1 4.45Å; F92-F498 AromaticContact CD1-CD1 3.84Å; F92-F498 HydrophobicContact CD1-CD1 3.84Å; F92-F498 HydrophobicContact CD1-CE1 4.17Å; F92-F498 HydrophobicContact CE1-CD1 4.06Å; F92-F498 HydrophobicContact CE1-CE1 4.43Å; F92-F498 HydrophobicContact CG-CD1 4.19Å
93	T	61.6	Low	64.1	Low	60 Å²	60	60.6 Å²	60.6	37%	0.368	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	105.8	174.7	47.8	0	0	0	0	110.5	S110 I111 L486	T93-S110 CarbonylContact C-O 3.48Å; T93-S110 WeakPolarHBondContact CA-O 3.31Å; T93-I111 HydrophobicContact CG2-CG1 4.47Å; T93-L486 HydrophobicContact CG2-CD2 4.08Å
94	H	63.6	Low	62	Low	24 Å²	24	62.9 Å²	62.9	11%	0.111	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.9	176.1	-172.4	-83.1	0	0	0	110.9	F92 S110 A112	F92-H94 HydrophobicContact CD1-CB 4.36Å; F92-H94 HydrophobicContact CE1-CB 4.36Å; F92-H94 PolarHBondContact O-N 2.97Å; H94-S110 PolarHBondContact N-O 3.01Å; H94-S110 PolarHBondContact O-N 3.15Å; H94-S110 PolarHBondContact O-OG 3.39Å; H94-A112 HydrophobicContact CB-CB 4.49Å
95	C	62.9	Low	60.7	Low	17 Å²	17	67.5 Å²	67.5	12%	0.115	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	120.2	177.8	179.1	0	0	0	0	110.6	C487	C95-C487 HydrophobicContact CB-CB 3.94Å; C95-C487 WeakPolarHBondContact CB-SG 3.45Å; C95-C487 WeakPolarHBondContact SG-CB 3.42Å; C95-C487 CovalentContact SG-SG 2.04Å; C95-C487 PolarHBondContact SG-SG 3.07Å
96	H	62.9	Low	59.2	Low	33 Å²	33	68.5 Å²	68.5	15%	0.153	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	147	-178.1	-174.8	-62.5	0	0	0	110.2	V108 K420	H96-V108 PolarHBondContact N-O 2.83Å; H96-V108 PolarHBondContact O-N 3.05Å; H96-K420 PolarHBondContact CE1-NZ 3Å; H96-K420 PolarHBondContact NE2-NZ 3.42Å
97	Y	58.8	Low	58.3	Low	150 Å²	150	74 Å²	74	59%	0.588	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	112.3	173	35.4	-90.8	0	0	0	110.6
98	E	57.3	Low	57.8	Low	81 Å²	81	75.2 Å²	75.2	38%	0.379	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.3	-179.3	-164.5	150.9	-117	0	0	110.4	Q100 A106 V108	E98-Q100 PolarHBondContact O-N 3.41Å; E98-A106 PolarHBondContact N-O 3.11Å; E98-A106 PolarHBondContact O-N 2.87Å; E98-V108 HydrophobicContact CB-CB 4.34Å; E98-V108 HydrophobicContact CB-CG2 3.81Å
99	L	44.6	Very low	57.3	Low	134 Å²	134	78.2 Å²	78.2	70%	0.702	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	112	179.4	-131.5	87.8	0	0	0	108.6	V105	L99-V105 HydrophobicContact CD1-CG2 3.87Å
100	Q	52.8	Low	57.1	Low	111 Å²	111	74.6 Å²	74.6	52%	0.519	42%	0.424	S	S	.	.			trans	-75.7	153	169.5	-68.8	-177	-36.8	0	0	110	E98 S102 G103 S104 A106	E98-Q100 PolarHBondContact O-N 3.41Å; Q100-S102 PolarHBondContact O-N 3.1Å; Q100-G103 PolarHBondContact O-N 2.71Å; Q100-S104 PolarHBondContact N-O 2.97Å; Q100-S104 PolarHBondContact OE1-OG 2.97Å; Q100-A106 HydrophobicContact CG-CB 4.19Å
101	A	49.6	Very low	56.8	Low	118 Å²	118	73.7 Å²	73.7	98%	0.975	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.4	-178.5	0	0	0	0	0	114.6	G103	A101-G103 VanDerWaalsContact C-N 3.33Å
102	S	48.7	Very low	56.6	Low	109 Å²	109	68.7 Å²	68.7	76%	0.762	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	4.7	173.8	-168.6	0	0	0	0	114.2	Q100 S104	Q100-S102 PolarHBondContact O-N 3.1Å; S102-S104 PolarHBondContact O-N 2.7Å
103	G	47.1	Very low	56.6	Low	58 Å²	58	74.2 Å²	74.2	60%	0.598	42%	0.417	S	S	*	.	S	Bend	trans	78.4	-2.9	-176.6	0	0	0	0	0	114.8	Q100 A101	Q100-G103 PolarHBondContact O-N 2.71Å; A101-G103 VanDerWaalsContact C-N 3.33Å
104	S	40	Very low	56.8	Low	51 Å²	51	71.3 Å²	71.3	36%	0.357	40%	0.4	S	S	.	.			trans	-74.5	126.6	171.3	42.8	0	0	0	0	111.2	Q100 S102 A106	Q100-S104 PolarHBondContact N-O 2.97Å; Q100-S104 PolarHBondContact OE1-OG 2.97Å; S102-S104 PolarHBondContact O-N 2.7Å; S104-A106 PolarHBondContact O-N 2.81Å
105	V	54.1	Low	57	Low	98 Å²	98	74.1 Å²	74.1	59%	0.594	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	107.8	172.6	-172	0	0	0	0	108.9	L99	L99-V105 HydrophobicContact CD1-CG2 3.87Å
106	A	53.1	Low	57.4	Low	26 Å²	26	74.6 Å²	74.6	22%	0.215	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	146.2	175.4	0	0	0	0	0	110.3	E98 Q100 S104 V108	E98-A106 PolarHBondContact N-O 3.11Å; E98-A106 PolarHBondContact O-N 2.87Å; Q100-A106 HydrophobicContact CG-CB 4.19Å; S104-A106 PolarHBondContact O-N 2.81Å; A106-V108 HydrophobicContact CB-CG2 4.41Å
107	K	57.3	Low	57.8	Low	117 Å²	117	79.3 Å²	79.3	51%	0.509	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122.3	168.5	-76.5	-164.2	179.4	-168.4	0	109.1	C487 S490	K107-C487 HydrophobicContact CB-CB 4.43Å; K107-C487 HydrophobicContact CD-CB 3.75Å; K107-C487 PolarHBondContact NZ-O 3.08Å; K107-S490 PolarHBondContact NZ-OG 3.34Å
108	V	60.3	Low	58.4	Low	53 Å²	53	72.6 Å²	72.6	32%	0.321	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	139	-175.5	-176	0	0	0	0	110	H96 E98 A106	H96-V108 PolarHBondContact N-O 2.83Å; H96-V108 PolarHBondContact O-N 3.05Å; E98-V108 HydrophobicContact CB-CB 4.34Å; E98-V108 HydrophobicContact CB-CG2 3.81Å; A106-V108 HydrophobicContact CB-CG2 4.41Å
109	N	60.8	Low	59.3	Low	85 Å²	85	68.8 Å²	68.8	46%	0.455	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.6	179.7	-65.9	-40.7	0	0	0	110.5	C487	N109-C487 PolarHBondContact OD1-SG 2.85Å
110	S	61.3	Low	61	Low	9 Å²	9	62.6 Å²	62.6	6%	0.063	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	152.2	177.4	62.6	0	0	0	0	110.8	T93 H94	T93-S110 CarbonylContact C-O 3.48Å; T93-S110 WeakPolarHBondContact CA-O 3.31Å; H94-S110 PolarHBondContact N-O 3.01Å; H94-S110 PolarHBondContact O-N 3.15Å; H94-S110 PolarHBondContact O-OG 3.39Å
111	I	61	Low	62.4	Low	83 Å²	83	57.7 Å²	57.7	43%	0.426	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	112.1	-179.5	-59	177.1	0	0	0	108.7	N91 T93 L334	N91-I111 HydrophobicContact CB-CG2 3.97Å; T93-I111 HydrophobicContact CG2-CG1 4.47Å; I111-L334 PolarHBondContact N-O 3.16Å; I111-L334 WeakPolarHBondContact O-CB 3.37Å; I111-L334 PolarHBondContact O-N 3.08Å
112	A	63.8	Low	64	Low	4 Å²	4	52.3 Å²	52.3	3%	0.033	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	141.8	173.7	0	0	0	0	0	110.6	N91 F92 H94 T333	N91-A112 CarbonylContact C-O 3.51Å; N91-A112 WeakPolarHBondContact CA-O 3.46Å; F92-A112 PolarHBondContact N-O 3.47Å; F92-A112 PolarHBondContact O-N 3.27Å; H94-A112 HydrophobicContact CB-CB 4.49Å; A112-T333 HydrophobicContact CB-CG2 3.78Å
113	R	66.2	Low	65.9	Low	137 Å²	137	47.4 Å²	47.4	52%	0.517	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.8	164.1	-174.8	169.9	173.4	172.6	-3.4	108.7	D89 K332	D89-R113 VanDerWaalsContact CG-NH2 3.25Å; D89-R113 IonicContact OD1-CZ 3.7Å; D89-R113 IonicContact OD1-NE 3.66Å; D89-R113 PolarHBondContact OD1-NE 3.08Å; D89-R113 IonicContact OD1-NH2 2.71Å; D89-R113 PolarHBondContact OD1-NH2 3.25Å; D89-R113 IonicContact OD2-NH2 2.66Å; D89-R113 PolarHBondContact OD2-NH2 3.21Å; R113-K332 PolarHBondContact N-O 2.74Å
114	I	67.1	Low	67.8	Low	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-83.2	119	-175.7	-62.4	162.9	0	0	0	109.2	W87 F92 N118 F498	W87-I114 HydrophobicContact CB-CD1 3.9Å; W87-I114 HydrophobicContact CD2-CD1 4.43Å; W87-I114 HydrophobicContact CE3-CD1 4.05Å; W87-I114 HydrophobicContact CG-CD1 4.41Å; F92-I114 HydrophobicContact CB-CD1 3.79Å; F92-I114 HydrophobicContact CB-CG1 4.42Å; F92-I114 HydrophobicContact CG-CD1 4.45Å; I114-N118 HydrophobicContact CG2-CB 4.33Å; I114-F498 HydrophobicContact CD1-CB 4.11Å; I114-F498 HydrophobicContact CD1-CD1 3.6Å; I114-F498 HydrophobicContact CD1-CD2 3.77Å; I114-F498 HydrophobicContact CD1-CE1 3.95Å; I114-F498 HydrophobicContact CD1-CE2 4.1Å; I114-F498 HydrophobicContact CD1-CG 3.5Å; I114-F498 HydrophobicContact CD1-CZ 4.19Å; I114-F498 HydrophobicContact CG1-CD1 4.46Å; I114-F498 HydrophobicContact CG1-CE1 4.33Å; I114-F498 HydrophobicContact CG1-CE2 4.41Å; I114-F498 HydrophobicContact CG1-CZ 4.31Å; I114-F498 HydrophobicContact CG2-CE2 4.26Å
115	D	68.2	Low	70	Confident	82 Å²	82	46.7 Å²	46.7	44%	0.439	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-74.5	148.8	178.3	-154.3	-35.5	0	0	0	111.2	R117 N118	D115-R117 VanDerWaalsContact C-N 3.27Å; D115-R117 PolarHBondContact O-N 3.07Å; D115-N118 PolarHBondContact O-N 2.89Å; D115-N118 VanDerWaalsContact O-N 3.1Å
116	N	71.3	Confident	71.7	Confident	27 Å²	27	42.1 Å²	42.1	14%	0.144	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-40	-172.9	-81.9	-9.7	0	0	0	112.3	N118 T119 V120 E319	N116-N118 VanDerWaalsContact C-N 3.26Å; N116-N118 PolarHBondContact O-N 3.11Å; N116-T119 WeakPolarHBondContact O-CA 3.39Å; N116-T119 WeakPolarHBondContact O-CB 3.46Å; N116-T119 PolarHBondContact O-N 2.93Å; N116-V120 PolarHBondContact O-N 3.43Å; N116-E319 WeakPolarHBondContact CB-OE2 3.26Å; N116-E319 PolarHBondContact ND2-OE2 3.39Å
117	R	69.8	Low	73.4	Confident	132 Å²	132	41.6 Å²	41.6	50%	0.498	19%	0.192	S	C	.	.	H	α-helix	trans	-57.7	-34.9	179.5	-72	-175.8	171.1	-166	-3.8	113.3	D115 T119 V120 L329	D115-R117 VanDerWaalsContact C-N 3.27Å; D115-R117 PolarHBondContact O-N 3.07Å; R117-T119 PolarHBondContact O-N 3.39Å; R117-V120 WeakPolarHBondContact O-CB 3.33Å; R117-V120 PolarHBondContact O-N 2.99Å; R117-L329 HydrophobicContact CB-CD1 3.96Å
118	N	71.3	Confident	74.9	Confident	10 Å²	10	37.5 Å²	37.5	5%	0.053	18%	0.18	C	C	.	.	H	α-helix	trans	-70.6	-21.9	177.7	-69.4	10.6	0	0	0	112	I114 D115 N116 M331	I114-N118 HydrophobicContact CG2-CB 4.33Å; D115-N118 PolarHBondContact O-N 2.89Å; D115-N118 VanDerWaalsContact O-N 3.1Å; N116-N118 VanDerWaalsContact C-N 3.26Å; N116-N118 PolarHBondContact O-N 3.11Å; N118-M331 WeakPolarHBondContact ND2-CG 3.22Å
119	T	77	Confident	76.3	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-85.1	-28.8	175.9	-46.3	0	0	0	0	112	T88 N116 R117 Q121 W122 I123 M315	T88-T119 HydrophobicContact CG2-CG2 3.7Å; N116-T119 WeakPolarHBondContact O-CA 3.39Å; N116-T119 WeakPolarHBondContact O-CB 3.46Å; N116-T119 PolarHBondContact O-N 2.93Å; R117-T119 PolarHBondContact O-N 3.39Å; T119-Q121 VanDerWaalsContact C-N 3.29Å; T119-Q121 PolarHBondContact O-N 3.12Å; T119-W122 PolarHBondContact O-N 2.73Å; T119-W122 VanDerWaalsContact O-N 3.12Å; T119-I123 PolarHBondContact O-N 2.75Å; T119-M315 HydrophobicContact CG2-CE 4.41Å
120	V	81.1	Confident	77.7	Confident	5 Å²	5	31.2 Å²	31.2	3%	0.03	15%	0.145	C	C	.	.	H	α-helix	trans	-56.7	-40.9	174.7	172.4	0	0	0	0	111.8	N116 R117 W122 I123 W124 M315 L320 L325	N116-V120 PolarHBondContact O-N 3.43Å; R117-V120 WeakPolarHBondContact O-CB 3.33Å; R117-V120 PolarHBondContact O-N 2.99Å; V120-W122 VanDerWaalsContact C-N 3.32Å; V120-W122 PolarHBondContact O-N 3.2Å; V120-I123 PolarHBondContact O-N 2.96Å; V120-W124 PolarHBondContact O-N 3.21Å; V120-W124 VanDerWaalsContact O-N 3.14Å; V120-M315 HydrophobicContact CG2-CE 4.02Å; V120-M315 HydrophobicContact CG2-SD 3.56Å; V120-M315 VanDerWaalsContact CG2-SD 3.56Å; V120-L320 HydrophobicContact CG1-CD1 4.42Å; V120-L325 HydrophobicContact CG1-CD1 3.78Å
121	Q	81.2	Confident	79.1	Confident	8 Å²	8	31 Å²	31	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-56	-44.8	175.1	-71.1	-176	-1.9	0	0	112.3	T119 I123 W124 L125 L325	T119-Q121 VanDerWaalsContact C-N 3.29Å; T119-Q121 PolarHBondContact O-N 3.12Å; Q121-I123 PolarHBondContact O-N 3.47Å; Q121-W124 PolarHBondContact O-N 3.5Å; Q121-L125 WeakPolarHBondContact O-CB 3.29Å; Q121-L125 VanDerWaalsContact O-CG 3.25Å; Q121-L125 WeakPolarHBondContact O-CG 3.39Å; Q121-L125 PolarHBondContact O-N 3.12Å; Q121-L325 VanDerWaalsContact CG-O 3.26Å; Q121-L325 WeakPolarHBondContact CG-O 3.35Å; Q121-L325 PolarHBondContact NE2-O 3.09Å
122	W	83.9	Confident	80.4	Confident	4 Å²	4	30 Å²	30	2%	0.015	14%	0.139	C	C	.	.	H	α-helix	trans	-69.7	-29.9	179.6	-67.9	122	0	0	0	113.1	M81 S84 V85 T119 V120 L125 T126 N496 F497	M81-W122 HydrophobicContact CB-CE3 4.36Å; M81-W122 HydrophobicContact CG-CE3 4.06Å; M81-W122 HydrophobicContact CG-CZ3 3.8Å; S84-W122 WeakPolarHBondContact OG-CB 3.37Å; S84-W122 VanDerWaalsContact OG-CD2 3.29Å; V85-W122 HydrophobicContact CG2-CB 3.91Å; T119-W122 PolarHBondContact O-N 2.73Å; T119-W122 VanDerWaalsContact O-N 3.12Å; V120-W122 VanDerWaalsContact C-N 3.32Å; V120-W122 PolarHBondContact O-N 3.2Å; W122-L125 HydrophobicContact CE3-CB 4.49Å; W122-L125 HydrophobicContact CE3-CD1 4.11Å; W122-L125 HydrophobicContact CZ3-CD1 4.17Å; W122-T126 WeakPolarHBondContact O-CB 3.12Å; W122-T126 WeakPolarHBondContact O-CG2 3.33Å; W122-T126 PolarHBondContact O-N 2.99Å; W122-T126 PolarHBondContact O-OG1 3.35Å; W122-N496 HydrophobicContact CZ2-CB 3.85Å; W122-N496 WeakPolarHBondContact CZ2-O 3.31Å; W122-N496 PolarHBondContact NE1-O 3.09Å; W122-F497 HydrophobicContact CH2-CD1 4.3Å; W122-F497 HydrophobicContact CH2-CD2 4.29Å; W122-F497 AromaticContact CH2-CE1 3.67Å; W122-F497 HydrophobicContact CH2-CE1 3.67Å; W122-F497 AromaticContact CH2-CE2 3.68Å; W122-F497 HydrophobicContact CH2-CE2 3.68Å; W122-F497 AromaticContact CH2-CZ 3.32Å; W122-F497 HydrophobicContact CH2-CZ 3.32Å; W122-F497 HydrophobicContact CZ2-CD1 4.33Å; W122-F497 HydrophobicContact CZ2-CE1 4.12Å; W122-F497 HydrophobicContact CZ2-CE2 4.33Å; W122-F497 HydrophobicContact CZ2-CZ 4.11Å; W122-F497 AromaticContact CZ3-CE1 3.98Å; W122-F497 HydrophobicContact CZ3-CE1 3.98Å; W122-F497 HydrophobicContact CZ3-CE2 4.47Å; W122-F497 AromaticContact CZ3-CZ 3.72Å; W122-F497 HydrophobicContact CZ3-CZ 3.72Å
123	I	87.7	Confident	81.6	Confident	7 Å²	7	30.1 Å²	30.1	4%	0.036	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-47.1	173.1	-64.2	167.2	0	0	0	110.5	V85 T119 V120 Q121 T126 M127 A311 M315 L320	V85-I123 HydrophobicContact CB-CG1 4.48Å; V85-I123 HydrophobicContact CG1-CD1 4.39Å; V85-I123 HydrophobicContact CG1-CG1 3.77Å; V85-I123 HydrophobicContact CG2-CG1 3.97Å; T119-I123 PolarHBondContact O-N 2.75Å; V120-I123 PolarHBondContact O-N 2.96Å; Q121-I123 PolarHBondContact O-N 3.47Å; I123-T126 PolarHBondContact O-OG1 3.2Å; I123-M127 WeakPolarHBondContact O-CB 3.49Å; I123-M127 PolarHBondContact O-N 3.44Å; I123-A311 HydrophobicContact CD1-CB 4.02Å; I123-M315 HydrophobicContact CD1-CE 3.77Å; I123-M315 HydrophobicContact CD1-SD 3.79Å; I123-L320 HydrophobicContact CD1-CD1 4.31Å; I123-L320 HydrophobicContact CG2-CD1 4.28Å
124	W	87.2	Confident	82.7	Confident	85 Å²	85	24.3 Å²	24.3	32%	0.322	12%	0.118	S	C	.	.	H	α-helix	trans	-72.8	-32.2	179	-72	110	0	0	0	113.6	V120 Q121 M127 A128 L320 F321 L325	V120-W124 PolarHBondContact O-N 3.21Å; V120-W124 VanDerWaalsContact O-N 3.14Å; Q121-W124 PolarHBondContact O-N 3.5Å; W124-M127 HydrophobicContact CE3-CG 4.49Å; W124-M127 WeakPolarHBondContact O-CB 3.33Å; W124-M127 PolarHBondContact O-N 3.29Å; W124-A128 PolarHBondContact O-N 3.32Å; W124-L320 PolarHBondContact NE1-O 3.03Å; W124-F321 AromaticContact CH2-CE1 3.87Å; W124-F321 HydrophobicContact CH2-CE1 3.87Å; W124-F321 AromaticContact CZ2-CD1 3.99Å; W124-F321 HydrophobicContact CZ2-CD1 3.99Å; W124-F321 AromaticContact CZ2-CE1 3.65Å; W124-F321 HydrophobicContact CZ2-CE1 3.65Å; W124-F321 HydrophobicContact CZ2-CZ 4.34Å; W124-L325 HydrophobicContact CB-CD2 4.07Å; W124-L325 HydrophobicContact CG-CD2 4.02Å
125	L	87.7	Confident	83.8	Confident	9 Å²	9	28.9 Å²	28.9	5%	0.047	14%	0.137	C	C	.	.	H	α-helix	trans	-74.6	-37.1	174.9	-68.5	167.5	0	0	0	112.6	M81 Q121 W122 A128 A129 S429 C433	M81-L125 HydrophobicContact CE-CB 3.82Å; M81-L125 WeakPolarHBondContact CE-O 3.36Å; Q121-L125 WeakPolarHBondContact O-CB 3.29Å; Q121-L125 VanDerWaalsContact O-CG 3.25Å; Q121-L125 WeakPolarHBondContact O-CG 3.39Å; Q121-L125 PolarHBondContact O-N 3.12Å; W122-L125 HydrophobicContact CE3-CB 4.49Å; W122-L125 HydrophobicContact CE3-CD1 4.11Å; W122-L125 HydrophobicContact CZ3-CD1 4.17Å; L125-A128 PolarHBondContact O-N 3.42Å; L125-A129 PolarHBondContact O-N 3Å; L125-S429 VanDerWaalsContact CD1-CB 3.48Å; L125-C433 HydrophobicContact CD2-CB 3.91Å
126	T	88.6	Confident	84.7	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-65.2	-39.9	169.9	48.9	0	0	0	0	111.2	M81 V85 W122 I123 A128 A129 V130	M81-T126 VanDerWaalsContact C-CG2 3.45Å; M81-T126 HydrophobicContact CB-CG2 3.66Å; M81-T126 HydrophobicContact CE-CG2 4.48Å; M81-T126 WeakPolarHBondContact O-CG2 3.43Å; V85-T126 HydrophobicContact CG2-CG2 4.46Å; W122-T126 WeakPolarHBondContact O-CB 3.12Å; W122-T126 WeakPolarHBondContact O-CG2 3.33Å; W122-T126 PolarHBondContact O-N 2.99Å; W122-T126 PolarHBondContact O-OG1 3.35Å; I123-T126 PolarHBondContact O-OG1 3.2Å; T126-A128 PolarHBondContact O-N 3.43Å; T126-A129 PolarHBondContact O-N 3.03Å; T126-V130 WeakPolarHBondContact O-CG2 3.34Å; T126-V130 PolarHBondContact O-N 3.07Å; T126-V130 VanDerWaalsContact O-N 3.12Å
127	M	89.8	Confident	85.4	Confident	16 Å²	16	25.4 Å²	25.4	8%	0.079	12%	0.12	C	C	.	.	H	α-helix	trans	-53	-49.9	171.1	179.1	48.2	54.6	0	0	112.5	I123 W124 A129 V130 S131 F177 Y303 A307	I123-M127 WeakPolarHBondContact O-CB 3.49Å; I123-M127 PolarHBondContact O-N 3.44Å; W124-M127 HydrophobicContact CE3-CG 4.49Å; W124-M127 WeakPolarHBondContact O-CB 3.33Å; W124-M127 PolarHBondContact O-N 3.29Å; M127-A129 PolarHBondContact O-N 3.46Å; M127-V130 PolarHBondContact O-N 3.05Å; M127-S131 VanDerWaalsContact O-CB 3.27Å; M127-S131 WeakPolarHBondContact O-CB 3.48Å; M127-S131 PolarHBondContact O-N 3.06Å; M127-S131 PolarHBondContact O-OG 3.36Å; M127-S131 PolarHBondContact SD-OG 3.45Å; M127-S131 VanDerWaalsContact SD-OG 3.33Å; M127-F177 HydrophobicContact CE-CE1 4.3Å; M127-F177 HydrophobicContact CE-CE2 3.86Å; M127-F177 HydrophobicContact CE-CZ 3.49Å; M127-F177 VanDerWaalsContact CE-CZ 3.49Å; M127-Y303 WeakPolarHBondContact CE-O 3.12Å; M127-A307 HydrophobicContact CE-CB 3.29Å
128	A	88.9	Confident	86.3	Confident	31 Å²	31	20 Å²	20	26%	0.256	10%	0.102	S	C	.	.	H	α-helix	trans	-60	-46.4	178.4	0	0	0	0	0	111.9	W124 L125 T126 V130 S131 L132	W124-A128 PolarHBondContact O-N 3.32Å; L125-A128 PolarHBondContact O-N 3.42Å; T126-A128 PolarHBondContact O-N 3.43Å; A128-V130 VanDerWaalsContact C-N 3.32Å; A128-V130 PolarHBondContact O-N 2.98Å; A128-S131 PolarHBondContact O-N 3.48Å; A128-S131 VanDerWaalsContact O-N 3.1Å; A128-L132 HydrophobicContact CB-CD1 4.17Å; A128-L132 WeakPolarHBondContact O-CD1 3.26Å; A128-L132 PolarHBondContact O-N 3.29Å
129	A	89.5	Confident	87.1	Confident	1 Å²	1	25 Å²	25	1%	0.008	13%	0.128	C	C	.	.	H	α-helix	trans	-59.6	-35.9	179.2	0	0	0	0	0	113.9	F78 M81 L125 T126 M127 P133 Q436	F78-A129 HydrophobicContact CD2-CB 4.02Å; F78-A129 HydrophobicContact CE2-CB 4.12Å; M81-A129 HydrophobicContact CE-CB 4.35Å; L125-A129 PolarHBondContact O-N 3Å; T126-A129 PolarHBondContact O-N 3.03Å; M127-A129 PolarHBondContact O-N 3.46Å; A129-P133 WeakPolarHBondContact O-CD 3.34Å; A129-Q436 HydrophobicContact CB-CG 4.47Å
130	V	90.2	Very high	87.3	Confident	5 Å²	5	28.4 Å²	28.4	3%	0.03	14%	0.142	C	C	.	.	H	α-helix	trans	-77	-34.3	174.5	-171.5	0	0	0	0	111.9	F78 T126 M127 A128 V172 T176 Y303 I557	F78-V130 HydrophobicContact CE2-CG2 3.69Å; F78-V130 HydrophobicContact CZ-CG2 3.88Å; T126-V130 WeakPolarHBondContact O-CG2 3.34Å; T126-V130 PolarHBondContact O-N 3.07Å; T126-V130 VanDerWaalsContact O-N 3.12Å; M127-V130 PolarHBondContact O-N 3.05Å; A128-V130 VanDerWaalsContact C-N 3.32Å; A128-V130 PolarHBondContact O-N 2.98Å; V130-V172 HydrophobicContact CG1-CG1 4.37Å; V130-T176 HydrophobicContact CG2-CG2 4.24Å; V130-Y303 HydrophobicContact CB-CD2 4.43Å; V130-Y303 HydrophobicContact CG1-CD1 4.1Å; V130-Y303 HydrophobicContact CG1-CD2 3.64Å; V130-Y303 HydrophobicContact CG1-CE1 4.01Å; V130-Y303 HydrophobicContact CG1-CE2 3.57Å; V130-Y303 HydrophobicContact CG1-CG 3.94Å; V130-I557 HydrophobicContact CB-CD1 4.42Å; V130-I557 HydrophobicContact CG1-CD1 3.9Å; V130-I557 HydrophobicContact CG2-CD1 3.62Å; V130-I557 HydrophobicContact CG2-CG1 3.96Å
131	S	90.4	Very high	87.4	Confident	5 Å²	5	28.6 Å²	28.6	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-83.7	-34.5	-172.1	-60	0	0	0	0	114.4	M127 A128 E134 F135	M127-S131 VanDerWaalsContact O-CB 3.27Å; M127-S131 WeakPolarHBondContact O-CB 3.48Å; M127-S131 PolarHBondContact O-N 3.06Å; M127-S131 PolarHBondContact O-OG 3.36Å; M127-S131 PolarHBondContact SD-OG 3.45Å; M127-S131 VanDerWaalsContact SD-OG 3.33Å; A128-S131 PolarHBondContact O-N 3.48Å; A128-S131 VanDerWaalsContact O-N 3.1Å; S131-E134 PolarHBondContact O-N 2.74Å; S131-F135 WeakPolarHBondContact O-CD2 3.46Å; S131-F135 PolarHBondContact O-N 3.17Å
132	L	88.7	Confident	87.4	Confident	62 Å²	62	32.8 Å²	32.8	33%	0.325	16%	0.162	S	C	.	.	H	α-helix	trans	-55.3	-44.6	-176.7	-103.8	80.2	0	0	0	113.9	A128 E134 F135 V136 F437	A128-L132 HydrophobicContact CB-CD1 4.17Å; A128-L132 WeakPolarHBondContact O-CD1 3.26Å; A128-L132 PolarHBondContact O-N 3.29Å; L132-E134 VanDerWaalsContact C-N 3.25Å; L132-E134 PolarHBondContact O-N 3.4Å; L132-F135 PolarHBondContact O-N 2.66Å; L132-V136 WeakPolarHBondContact O-CG2 3.36Å; L132-V136 PolarHBondContact O-N 3.21Å; L132-F437 HydrophobicContact CB-CD2 3.74Å; L132-F437 HydrophobicContact CB-CE2 4Å; L132-F437 HydrophobicContact CB-CG 4.46Å; L132-F437 HydrophobicContact CD2-CB 4.08Å; L132-F437 HydrophobicContact CD2-CD1 3.81Å; L132-F437 HydrophobicContact CD2-CD2 3.58Å; L132-F437 HydrophobicContact CD2-CE1 4.13Å; L132-F437 HydrophobicContact CD2-CE2 3.92Å; L132-F437 HydrophobicContact CD2-CG 3.51Å; L132-F437 HydrophobicContact CD2-CZ 4.18Å; L132-F437 HydrophobicContact CG-CD2 4.28Å; L132-F437 HydrophobicContact CG-CE2 4.49Å
133	P	88.3	Confident	87.2	Confident	5 Å²	5	38 Å²	38	3%	0.032	18%	0.183	C	C	.	.	H	α-helix	trans	-58.5	-34.6	176.2	-26.6	35.9	0	0	0	113.7	A129 C137 Y554	A129-P133 WeakPolarHBondContact O-CD 3.34Å; P133-C137 WeakPolarHBondContact O-CB 3.4Å; P133-C137 PolarHBondContact O-N 3.47Å; P133-Y554 HydrophobicContact CB-CE2 4.16Å; P133-Y554 HydrophobicContact CG-CE2 4Å
134	E	89.8	Confident	86.4	Confident	16 Å²	16	42 Å²	42	8%	0.075	20%	0.197	C	C	.	.	H	α-helix	trans	-76.4	-36.5	177.3	-64	-67.1	178.1	0	0	111.5	S131 L132 C137 T138 S296 K299 V300 Y303	S131-E134 PolarHBondContact O-N 2.74Å; L132-E134 VanDerWaalsContact C-N 3.25Å; L132-E134 PolarHBondContact O-N 3.4Å; E134-C137 CarbonylContact O-C 3.57Å; E134-C137 WeakPolarHBondContact O-CA 3.32Å; E134-C137 VanDerWaalsContact O-CB 3.24Å; E134-C137 WeakPolarHBondContact O-CB 3.43Å; E134-C137 PolarHBondContact O-N 3.41Å; E134-C137 VanDerWaalsContact O-N 3.16Å; E134-T138 PolarHBondContact O-N 3.35Å; E134-T138 PolarHBondContact O-OG1 3.12Å; E134-S296 WeakPolarHBondContact O-CB 3.3Å; E134-S296 PolarHBondContact O-OG 3.04Å; E134-S296 WeakPolarHBondContact OE2-CB 3.42Å; E134-K299 HydrophobicContact CG-CB 4.37Å; E134-K299 HydrophobicContact CG-CD 4.08Å; E134-K299 WeakPolarHBondContact OE1-CD 3.22Å; E134-K299 IonicContact OE1-NZ 2.6Å; E134-K299 PolarHBondContact OE1-NZ 2.84Å; E134-K299 IonicContact OE2-NZ 2.68Å; E134-V300 HydrophobicContact CB-CG2 4.03Å; E134-Y303 HydrophobicContact CG-CE2 4.21Å
135	F	89.2	Confident	85.8	Confident	95 Å²	95	40.4 Å²	40.4	42%	0.417	19%	0.194	S	C	.	.	H	α-helix	trans	-62.1	-45.4	169.7	-84.2	-71.4	0	0	0	112.5	S131 L132 C137 T138 I139 L297 V300	S131-F135 WeakPolarHBondContact O-CD2 3.46Å; S131-F135 PolarHBondContact O-N 3.17Å; L132-F135 PolarHBondContact O-N 2.66Å; F135-C137 PolarHBondContact O-N 2.93Å; F135-T138 WeakPolarHBondContact O-CB 3.34Å; F135-T138 PolarHBondContact O-N 2.96Å; F135-T138 VanDerWaalsContact O-N 3.08Å; F135-I139 WeakPolarHBondContact O-CG1 3.02Å; F135-I139 PolarHBondContact O-N 3.29Å; F135-L297 HydrophobicContact CD1-CD2 4.33Å; F135-L297 HydrophobicContact CE1-CD2 4.06Å; F135-V300 HydrophobicContact CD2-CG2 4.24Å; F135-V300 HydrophobicContact CE2-CG1 3.85Å; F135-V300 HydrophobicContact CE2-CG2 4.05Å; F135-V300 HydrophobicContact CZ-CG1 4.12Å
136	V	87	Confident	84.9	Confident	36 Å²	36	46.7 Å²	46.7	22%	0.218	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-30.1	174.7	177.9	0	0	0	0	110.5	L132 K140 F437 W553	L132-V136 WeakPolarHBondContact O-CG2 3.36Å; L132-V136 PolarHBondContact O-N 3.21Å; V136-K140 WeakPolarHBondContact O-CB 3.38Å; V136-K140 PolarHBondContact O-N 3.47Å; V136-K140 VanDerWaalsContact O-N 3.13Å; V136-F437 HydrophobicContact CG2-CE2 4.03Å; V136-F437 HydrophobicContact CG2-CZ 3.95Å; V136-W553 HydrophobicContact CG1-CH2 3.51Å; V136-W553 HydrophobicContact CG1-CZ2 3.78Å; V136-W553 HydrophobicContact CG1-CZ3 4.39Å; V136-W553 WeakPolarHBondContact O-CZ2 3.48Å
137	C	87.1	Confident	83.8	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-49.3	167.9	173.8	0	0	0	0	112.9	P133 E134 F135 I139 K140 C141 W553	P133-C137 WeakPolarHBondContact O-CB 3.4Å; P133-C137 PolarHBondContact O-N 3.47Å; E134-C137 CarbonylContact O-C 3.57Å; E134-C137 WeakPolarHBondContact O-CA 3.32Å; E134-C137 VanDerWaalsContact O-CB 3.24Å; E134-C137 WeakPolarHBondContact O-CB 3.43Å; E134-C137 PolarHBondContact O-N 3.41Å; E134-C137 VanDerWaalsContact O-N 3.16Å; F135-C137 PolarHBondContact O-N 2.93Å; C137-I139 VanDerWaalsContact C-N 3.35Å; C137-I139 PolarHBondContact O-N 3.15Å; C137-K140 PolarHBondContact O-N 2.93Å; C137-C141 VanDerWaalsContact O-CB 3.32Å; C137-C141 WeakPolarHBondContact O-CB 3.24Å; C137-C141 PolarHBondContact O-N 3.09Å; C137-C141 PolarHBondContact O-SG 2.63Å; C137-W553 VanDerWaalsContact CA-NE1 3.28Å; C137-W553 VanDerWaalsContact CB-CD1 3.42Å; C137-W553 HydrophobicContact CB-CG 4.12Å
138	T	88.7	Confident	82.5	Confident	17 Å²	17	53.1 Å²	53.1	10%	0.104	24%	0.242	C	C	.	.	H	α-helix	trans	-53.4	-51.9	175.3	-46.7	0	0	0	0	110.6	E134 F135 K140 C141 F142 V293 S296 L297	E134-T138 PolarHBondContact O-N 3.35Å; E134-T138 PolarHBondContact O-OG1 3.12Å; F135-T138 WeakPolarHBondContact O-CB 3.34Å; F135-T138 PolarHBondContact O-N 2.96Å; F135-T138 VanDerWaalsContact O-N 3.08Å; T138-K140 PolarHBondContact O-N 3.31Å; T138-C141 PolarHBondContact O-N 2.98Å; T138-F142 VanDerWaalsContact O-CB 3.29Å; T138-F142 WeakPolarHBondContact O-CB 3.39Å; T138-F142 PolarHBondContact O-N 3.36Å; T138-V293 HydrophobicContact CG2-CG1 4.25Å; T138-S296 PolarHBondContact OG1-OG 2.92Å; T138-L297 HydrophobicContact CG2-CD1 4.07Å; T138-L297 HydrophobicContact CG2-CD2 4.09Å; T138-L297 HydrophobicContact CG2-CG 3.95Å
139	I	86.3	Confident	81.2	Confident	117 Å²	117	55 Å²	55	60%	0.6	25%	0.248	S	C	*	.	H	α-helix	trans	-59.6	-48.6	-177.2	-66.5	164.9	0	0	0	111.7	F135 C137 C141 F142 Y143	F135-I139 WeakPolarHBondContact O-CG1 3.02Å; F135-I139 PolarHBondContact O-N 3.29Å; C137-I139 VanDerWaalsContact C-N 3.35Å; C137-I139 PolarHBondContact O-N 3.15Å; I139-C141 PolarHBondContact O-N 3.25Å; I139-F142 PolarHBondContact O-N 3.34Å; I139-Y143 WeakPolarHBondContact O-CB 3.46Å; I139-Y143 PolarHBondContact O-N 3.13Å
140	K	81.4	Confident	80.1	Confident	71 Å²	71	56 Å²	56	31%	0.309	25%	0.254	S	S	.	.	H	α-helix	trans	-69.4	-32	178.9	-179.7	-171.8	174.9	-167.5	0	112.7	V136 C137 T138 R144 Y444 P552 W553	V136-K140 WeakPolarHBondContact O-CB 3.38Å; V136-K140 PolarHBondContact O-N 3.47Å; V136-K140 VanDerWaalsContact O-N 3.13Å; C137-K140 PolarHBondContact O-N 2.93Å; T138-K140 PolarHBondContact O-N 3.31Å; K140-R144 VanDerWaalsContact O-CB 3.28Å; K140-R144 WeakPolarHBondContact O-CB 3.43Å; K140-R144 PolarHBondContact O-N 3.27Å; K140-Y444 PolarHBondContact NZ-OH 3.15Å; K140-P552 PolarHBondContact NZ-O 3.21Å; K140-W553 HydrophobicContact CB-CZ2 3.79Å; K140-W553 VanDerWaalsContact CD-CE2 3.47Å; K140-W553 HydrophobicContact CD-CH2 3.67Å; K140-W553 HydrophobicContact CD-CZ2 3Å; K140-W553 HydrophobicContact CG-CZ2 4.1Å; K140-W553 VanDerWaalsContact NZ-CZ2 3.31Å
141	C	84.2	Confident	79.1	Confident	8 Å²	8	63.3 Å²	63.3	5%	0.054	28%	0.281	C	S	.	.	H	α-helix	trans	-72	-39.7	175	-68.8	0	0	0	0	111.4	C137 T138 I139 R144 I145 V293	C137-C141 VanDerWaalsContact O-CB 3.32Å; C137-C141 WeakPolarHBondContact O-CB 3.24Å; C137-C141 PolarHBondContact O-N 3.09Å; C137-C141 PolarHBondContact O-SG 2.63Å; T138-C141 PolarHBondContact O-N 2.98Å; I139-C141 PolarHBondContact O-N 3.25Å; C141-R144 CarbonylContact O-C 3.55Å; C141-R144 PolarHBondContact O-N 3.4Å; C141-I145 WeakPolarHBondContact O-CD1 3.37Å; C141-I145 VanDerWaalsContact O-CG1 3.26Å; C141-I145 WeakPolarHBondContact O-CG1 3.45Å; C141-I145 PolarHBondContact O-N 3.29Å; C141-I145 VanDerWaalsContact O-N 3.08Å; C141-V293 HydrophobicContact CB-CG2 3.61Å
142	F	81.9	Confident	78.3	Confident	97 Å²	97	71.6 Å²	71.6	43%	0.425	32%	0.316	S	S	.	.	H	α-helix	trans	-63.3	-48.8	172.9	-169.7	-91.4	0	0	0	111.4	T138 I139 R144 I145 W146 V293	T138-F142 VanDerWaalsContact O-CB 3.29Å; T138-F142 WeakPolarHBondContact O-CB 3.39Å; T138-F142 PolarHBondContact O-N 3.36Å; I139-F142 PolarHBondContact O-N 3.34Å; F142-R144 VanDerWaalsContact C-N 3.29Å; F142-R144 PolarHBondContact O-N 3.49Å; F142-I145 WeakPolarHBondContact O-CA 3.03Å; F142-I145 WeakPolarHBondContact O-CB 3.03Å; F142-I145 PolarHBondContact O-N 3.29Å; F142-W146 HydrophobicContact CD1-CD2 4.47Å; F142-W146 AromaticContact CE1-CD1 3.97Å; F142-W146 AromaticContact CE1-CD2 3.79Å; F142-W146 HydrophobicContact CE1-CD2 3.79Å; F142-W146 AromaticContact CE1-CE2 3.47Å; F142-W146 VanDerWaalsContact CE1-CE2 3.47Å; F142-W146 HydrophobicContact CE1-CE3 4.38Å; F142-W146 HydrophobicContact CE1-CG 4.13Å; F142-W146 HydrophobicContact CE1-CH2 4.43Å; F142-W146 AromaticContact CE1-CZ2 3.84Å; F142-W146 HydrophobicContact CE1-CZ2 3.84Å; F142-W146 AromaticContact CE1-NE1 3.57Å; F142-W146 HydrophobicContact CZ-CD2 4.45Å; F142-W146 AromaticContact CZ-CE2 3.71Å; F142-W146 AromaticContact CZ-CZ2 3.99Å; F142-W146 HydrophobicContact CZ-CZ2 3.99Å; F142-W146 AromaticContact CZ-NE1 3.48Å; F142-W146 PolarHBondContact O-N 3.4Å; F142-V293 HydrophobicContact CB-CG2 4.44Å
143	Y	78.2	Confident	77.9	Confident	114 Å²	114	70.6 Å²	70.6	45%	0.447	31%	0.313	S	S	.	.	H	α-helix	trans	-52	-47	169.6	176.4	-86.7	0	0	0	111.3	I139 I145 W146 F147	I139-Y143 WeakPolarHBondContact O-CB 3.46Å; I139-Y143 PolarHBondContact O-N 3.13Å; Y143-I145 PolarHBondContact O-N 2.95Å; Y143-W146 PolarHBondContact O-N 3.48Å; Y143-F147 HydrophobicContact CD1-CB 4.48Å; Y143-F147 HydrophobicContact CD1-CD2 4.36Å; Y143-F147 AromaticContact CD2-CD2 3.36Å; Y143-F147 HydrophobicContact CD2-CD2 3.36Å; Y143-F147 AromaticContact CD2-CE2 3.46Å; Y143-F147 HydrophobicContact CD2-CE2 3.46Å; Y143-F147 VanDerWaalsContact CD2-CE2 3.46Å; Y143-F147 HydrophobicContact CD2-CG 4.12Å; Y143-F147 HydrophobicContact CD2-CZ 4.28Å; Y143-F147 HydrophobicContact CE1-CB 4.09Å; Y143-F147 HydrophobicContact CE1-CD2 4.34Å; Y143-F147 HydrophobicContact CE1-CG 4.23Å; Y143-F147 HydrophobicContact CE2-CB 4.42Å; Y143-F147 HydrophobicContact CE2-CD1 4.05Å; Y143-F147 AromaticContact CE2-CD2 3.33Å; Y143-F147 HydrophobicContact CE2-CD2 3.33Å; Y143-F147 HydrophobicContact CE2-CE1 4.1Å; Y143-F147 AromaticContact CE2-CE2 3.41Å; Y143-F147 HydrophobicContact CE2-CE2 3.41Å; Y143-F147 VanDerWaalsContact CE2-CE2 3.41Å; Y143-F147 AromaticContact CE2-CG 3.68Å; Y143-F147 HydrophobicContact CE2-CG 3.68Å; Y143-F147 AromaticContact CE2-CZ 3.8Å; Y143-F147 HydrophobicContact CE2-CZ 3.8Å; Y143-F147 AromaticContact CG-CD2 3.89Å; Y143-F147 HydrophobicContact CG-CD2 3.89Å; Y143-F147 HydrophobicContact CG-CE2 4.38Å; Y143-F147 AromaticContact CZ-CD2 3.85Å; Y143-F147 AromaticContact CZ-CG 3.72Å; Y143-F147 WeakPolarHBondContact O-CB 3.27Å; Y143-F147 WeakPolarHBondContact O-CD2 3.37Å; Y143-F147 PolarHBondContact O-N 2.88Å
144	R	72.4	Confident	77.7	Confident	90 Å²	90	74 Å²	74	34%	0.34	33%	0.334	S	S	.	.	H	α-helix	trans	-67.7	-12.4	177.4	-173.2	169.5	177.3	164.9	1	114.1	K140 C141 F142 D546	K140-R144 VanDerWaalsContact O-CB 3.28Å; K140-R144 WeakPolarHBondContact O-CB 3.43Å; K140-R144 PolarHBondContact O-N 3.27Å; C141-R144 CarbonylContact O-C 3.55Å; C141-R144 PolarHBondContact O-N 3.4Å; F142-R144 VanDerWaalsContact C-N 3.29Å; F142-R144 PolarHBondContact O-N 3.49Å; R144-D546 IonicContact CZ-OD2 2.88Å; R144-D546 VanDerWaalsContact NH1-CG 3.34Å; R144-D546 IonicContact NH1-OD1 2.69Å; R144-D546 PolarHBondContact NH1-OD1 3.4Å; R144-D546 VanDerWaalsContact NH1-OD1 3.12Å; R144-D546 IonicContact NH1-OD2 2.8Å; R144-D546 PolarHBondContact NH1-OD2 3.07Å; R144-D546 IonicContact NH2-OD2 3.92Å; R144-D546 PolarHBondContact NH2-OD2 2.68Å
145	I	73.8	Confident	77.6	Confident	52 Å²	52	81.3 Å²	81.3	27%	0.267	37%	0.366	S	S	.	.	H	α-helix	trans	-95.7	-31.2	174.2	-68.6	158.4	0	0	0	111.5	C141 F142 Y143 K290 V293	C141-I145 WeakPolarHBondContact O-CD1 3.37Å; C141-I145 VanDerWaalsContact O-CG1 3.26Å; C141-I145 WeakPolarHBondContact O-CG1 3.45Å; C141-I145 PolarHBondContact O-N 3.29Å; C141-I145 VanDerWaalsContact O-N 3.08Å; F142-I145 WeakPolarHBondContact O-CA 3.03Å; F142-I145 WeakPolarHBondContact O-CB 3.03Å; F142-I145 PolarHBondContact O-N 3.29Å; Y143-I145 PolarHBondContact O-N 2.95Å; I145-K290 HydrophobicContact CD1-CB 4.44Å; I145-K290 HydrophobicContact CD1-CG 3.67Å; I145-K290 HydrophobicContact CG1-CG 3.86Å; I145-V293 HydrophobicContact CD1-CG2 3.7Å
146	W	68.8	Low	77.6	Confident	140 Å²	140	83 Å²	83	53%	0.53	37%	0.373	S	S	.	.	H	α-helix	trans	-77.2	-42	172.6	-91.3	23	0	0	0	113.1	F142 Y143 W973	F142-W146 HydrophobicContact CD1-CD2 4.47Å; F142-W146 AromaticContact CE1-CD1 3.97Å; F142-W146 AromaticContact CE1-CD2 3.79Å; F142-W146 HydrophobicContact CE1-CD2 3.79Å; F142-W146 AromaticContact CE1-CE2 3.47Å; F142-W146 VanDerWaalsContact CE1-CE2 3.47Å; F142-W146 HydrophobicContact CE1-CE3 4.38Å; F142-W146 HydrophobicContact CE1-CG 4.13Å; F142-W146 HydrophobicContact CE1-CH2 4.43Å; F142-W146 AromaticContact CE1-CZ2 3.84Å; F142-W146 HydrophobicContact CE1-CZ2 3.84Å; F142-W146 AromaticContact CE1-NE1 3.57Å; F142-W146 HydrophobicContact CZ-CD2 4.45Å; F142-W146 AromaticContact CZ-CE2 3.71Å; F142-W146 AromaticContact CZ-CZ2 3.99Å; F142-W146 HydrophobicContact CZ-CZ2 3.99Å; F142-W146 AromaticContact CZ-NE1 3.48Å; F142-W146 PolarHBondContact O-N 3.4Å; Y143-W146 PolarHBondContact O-N 3.48Å; W146-W973 HydrophobicContact CE3-CZ2 4.23Å; W146-W973 AromaticContact CE3-NE1 3.64Å; W146-W973 AromaticContact CZ3-CZ2 3.86Å; W146-W973 HydrophobicContact CZ3-CZ2 3.86Å
147	F	64.2	Low	77.5	Confident	39 Å²	39	82.8 Å²	82.8	17%	0.171	37%	0.37	C	S	.	.	S	Bend	trans	-96.6	-2.8	-174.2	-70.6	-98.7	0	0	0	113.8	Y143 S971 W973	Y143-F147 HydrophobicContact CD1-CB 4.48Å; Y143-F147 HydrophobicContact CD1-CD2 4.36Å; Y143-F147 AromaticContact CD2-CD2 3.36Å; Y143-F147 HydrophobicContact CD2-CD2 3.36Å; Y143-F147 AromaticContact CD2-CE2 3.46Å; Y143-F147 HydrophobicContact CD2-CE2 3.46Å; Y143-F147 VanDerWaalsContact CD2-CE2 3.46Å; Y143-F147 HydrophobicContact CD2-CG 4.12Å; Y143-F147 HydrophobicContact CD2-CZ 4.28Å; Y143-F147 HydrophobicContact CE1-CB 4.09Å; Y143-F147 HydrophobicContact CE1-CD2 4.34Å; Y143-F147 HydrophobicContact CE1-CG 4.23Å; Y143-F147 HydrophobicContact CE2-CB 4.42Å; Y143-F147 HydrophobicContact CE2-CD1 4.05Å; Y143-F147 AromaticContact CE2-CD2 3.33Å; Y143-F147 HydrophobicContact CE2-CD2 3.33Å; Y143-F147 HydrophobicContact CE2-CE1 4.1Å; Y143-F147 AromaticContact CE2-CE2 3.41Å; Y143-F147 HydrophobicContact CE2-CE2 3.41Å; Y143-F147 VanDerWaalsContact CE2-CE2 3.41Å; Y143-F147 AromaticContact CE2-CG 3.68Å; Y143-F147 HydrophobicContact CE2-CG 3.68Å; Y143-F147 AromaticContact CE2-CZ 3.8Å; Y143-F147 HydrophobicContact CE2-CZ 3.8Å; Y143-F147 AromaticContact CG-CD2 3.89Å; Y143-F147 HydrophobicContact CG-CD2 3.89Å; Y143-F147 HydrophobicContact CG-CE2 4.38Å; Y143-F147 AromaticContact CZ-CD2 3.85Å; Y143-F147 AromaticContact CZ-CG 3.72Å; Y143-F147 WeakPolarHBondContact O-CB 3.27Å; Y143-F147 WeakPolarHBondContact O-CD2 3.37Å; Y143-F147 PolarHBondContact O-N 2.88Å; F147-S971 WeakPolarHBondContact O-CB 3.09Å; F147-W973 HydrophobicContact CD1-CB 4.09Å; F147-W973 AromaticContact CD1-CD1 3.91Å; F147-W973 HydrophobicContact CD1-CG 4.3Å; F147-W973 HydrophobicContact CE1-CB 3.49Å; F147-W973 VanDerWaalsContact CE1-CB 3.49Å; F147-W973 AromaticContact CE1-CD1 3.45Å; F147-W973 VanDerWaalsContact CE1-CD1 3.45Å; F147-W973 AromaticContact CE1-CG 3.58Å; F147-W973 HydrophobicContact CE1-CG 3.58Å; F147-W973 AromaticContact CE2-CD1 3.74Å; F147-W973 HydrophobicContact CE2-CG 4.5Å; F147-W973 HydrophobicContact CZ-CB 4.11Å; F147-W973 AromaticContact CZ-CD1 3.34Å; F147-W973 HydrophobicContact CZ-CD2 4.4Å; F147-W973 AromaticContact CZ-CG 3.7Å; F147-W973 HydrophobicContact CZ-CG 3.7Å; F147-W973 AromaticContact CZ-NE1 3.88Å
148	R	62.9	Low	77.6	Confident	113 Å²	113	85.4 Å²	85.4	43%	0.426	38%	0.381	S	S	.	.	S	Bend	trans	-145.7	144	170.8	-65.6	-165.5	165.3	176.8	-6.7	111.8	D968	R148-D968 VanDerWaalsContact CG-O 3.3Å; R148-D968 WeakPolarHBondContact CG-O 3.25Å
149	N	61.5	Low	77.7	Confident	72 Å²	72	87 Å²	87	39%	0.385	39%	0.391	S	S	.	.			trans	-69.1	137.1	166.9	-164.6	-0.9	0	0	0	109.6	R965	N149-R965 PolarHBondContact ND2-O 3.15Å
150	V	67.9	Low	77.8	Confident	22 Å²	22	82.7 Å²	82.7	13%	0.133	37%	0.37	C	S	.	.			trans	-143.8	130.8	-177.5	-175.2	0	0	0	0	109.4	K290	V150-K290 WeakPolarHBondContact O-CE 3.35Å; V150-K290 PolarHBondContact O-NZ 3.49Å
151	R	68.1	Low	78.1	Confident	157 Å²	157	79.5 Å²	79.5	59%	0.592	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-58.5	143.3	178.3	-70.9	-178.6	170.3	-178.9	-6.4	111.8
152	K	73.5	Confident	78.5	Confident	179 Å²	179	81.9 Å²	81.9	78%	0.778	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-71.2	136.5	172.5	-66.4	-176.4	178.9	-178	0	109.2
153	P	80	Confident	79	Confident	41 Å²	41	82.1 Å²	82.1	27%	0.266	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-67.2	156.4	168.4	30.6	-35.2	0	0	0	110.6	H157 V291	P153-H157 HydrophobicContact CB-CB 4.47Å; P153-V291 HydrophobicContact CB-CG2 3.98Å; P153-V291 HydrophobicContact CG-CG2 3.85Å
154	T	85.2	Confident	79.6	Confident	77 Å²	77	78.1 Å²	78.1	47%	0.472	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-79.2	158.3	164.4	62.4	0	0	0	0	109.8	F156 H157 F158	T154-F156 VanDerWaalsContact C-N 3.31Å; T154-F156 PolarHBondContact O-N 3.23Å; T154-H157 PolarHBondContact O-N 3.33Å; T154-H157 VanDerWaalsContact O-N 3.1Å; T154-H157 PolarHBondContact OG1-CE1 3.46Å; T154-H157 VanDerWaalsContact OG1-CG 3.3Å; T154-H157 PolarHBondContact OG1-ND1 2.66Å; T154-F158 PolarHBondContact O-N 3.4Å
155	F	87	Confident	80.5	Confident	170 Å²	170	74.1 Å²	74.1	75%	0.746	34%	0.344	S	S	*	.	H	α-helix	trans	-54.4	-44.9	-179	-175	-106.1	0	0	0	112.7	H157 F158 V159	F155-H157 PolarHBondContact O-N 3.16Å; F155-F158 WeakPolarHBondContact O-CB 3.24Å; F155-F158 PolarHBondContact O-N 2.96Å; F155-F158 VanDerWaalsContact O-N 3.13Å; F155-V159 HydrophobicContact CD1-CG2 4.09Å; F155-V159 HydrophobicContact CD2-CG2 4.44Å; F155-V159 HydrophobicContact CE1-CG2 3.71Å; F155-V159 HydrophobicContact CE2-CG2 4.1Å; F155-V159 HydrophobicContact CG-CG2 4.44Å; F155-V159 HydrophobicContact CZ-CG2 3.72Å; F155-V159 WeakPolarHBondContact O-CG2 3.36Å; F155-V159 PolarHBondContact O-N 2.04Å
156	F	88.6	Confident	81.4	Confident	130 Å²	130	73.2 Å²	73.2	57%	0.57	34%	0.341	S	S	*	.	H	α-helix	trans	-59.1	-41.6	176.9	-178.3	-101.2	0	0	0	113.3	T154 T160 L280	T154-F156 VanDerWaalsContact C-N 3.31Å; T154-F156 PolarHBondContact O-N 3.23Å; F156-T160 WeakPolarHBondContact O-CB 3.38Å; F156-T160 PolarHBondContact O-N 3.23Å; F156-T160 PolarHBondContact O-OG1 3.46Å; F156-L280 HydrophobicContact CD1-CD1 4.38Å; F156-L280 HydrophobicContact CE1-CD1 3.91Å; F156-L280 HydrophobicContact CE1-CD2 4.38Å
157	H	86.2	Confident	82.6	Confident	32 Å²	32	68.7 Å²	68.7	15%	0.148	33%	0.331	C	S	.	.	H	α-helix	trans	-66.6	-38	176	-61.7	153.8	0	0	0	111.6	P153 T154 F155 A161 L284	P153-H157 HydrophobicContact CB-CB 4.47Å; T154-H157 PolarHBondContact O-N 3.33Å; T154-H157 VanDerWaalsContact O-N 3.1Å; T154-H157 PolarHBondContact OG1-CE1 3.46Å; T154-H157 VanDerWaalsContact OG1-CG 3.3Å; T154-H157 PolarHBondContact OG1-ND1 2.66Å; F155-H157 PolarHBondContact O-N 3.16Å; H157-A161 PolarHBondContact O-N 3.16Å; H157-L284 HydrophobicContact CB-CD2 3.98Å; H157-L284 WeakPolarHBondContact O-CD2 3.47Å
158	F	88.9	Confident	83.9	Confident	56 Å²	56	67.3 Å²	67.3	25%	0.246	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-51.7	174.8	176.9	-94.7	0	0	0	111.7	T154 F155 T160 A161 F162 V291 V294 V295	T154-F158 PolarHBondContact O-N 3.4Å; F155-F158 WeakPolarHBondContact O-CB 3.24Å; F155-F158 PolarHBondContact O-N 2.96Å; F155-F158 VanDerWaalsContact O-N 3.13Å; F158-T160 VanDerWaalsContact C-N 3.33Å; F158-T160 PolarHBondContact O-N 3.08Å; F158-A161 PolarHBondContact O-N 2.68Å; F158-F162 HydrophobicContact CE1-CB 4.42Å; F158-F162 HydrophobicContact CE1-CD2 4.27Å; F158-F162 HydrophobicContact CZ-CD2 4.06Å; F158-F162 VanDerWaalsContact O-CB 3.32Å; F158-F162 WeakPolarHBondContact O-CB 3.35Å; F158-F162 PolarHBondContact O-N 2.91Å; F158-V291 HydrophobicContact CD2-CB 4.47Å; F158-V291 HydrophobicContact CD2-CG1 4.11Å; F158-V291 HydrophobicContact CD2-CG2 4.27Å; F158-V291 HydrophobicContact CE2-CG1 4.47Å; F158-V294 HydrophobicContact CE2-CB 4.18Å; F158-V294 HydrophobicContact CE2-CG1 4.31Å; F158-V294 HydrophobicContact CZ-CB 4.44Å; F158-V294 HydrophobicContact CZ-CG1 4.07Å; F158-V295 HydrophobicContact CE2-CG2 4.48Å
159	V	90.9	Very high	85.3	Confident	50 Å²	50	61.9 Å²	61.9	30%	0.303	30%	0.304	S	S	.	.	H	α-helix	trans	-59.3	-42.3	-179.9	172.1	0	0	0	0	111.8	F155 A161 F162 L163	F155-V159 HydrophobicContact CD1-CG2 4.09Å; F155-V159 HydrophobicContact CD2-CG2 4.44Å; F155-V159 HydrophobicContact CE1-CG2 3.71Å; F155-V159 HydrophobicContact CE2-CG2 4.1Å; F155-V159 HydrophobicContact CG-CG2 4.44Å; F155-V159 HydrophobicContact CZ-CG2 3.72Å; F155-V159 WeakPolarHBondContact O-CG2 3.36Å; F155-V159 PolarHBondContact O-N 2.04Å; V159-A161 PolarHBondContact O-N 3.03Å; V159-F162 PolarHBondContact O-N 3.41Å; V159-L163 HydrophobicContact CG1-CD1 3.94Å; V159-L163 WeakPolarHBondContact O-CG 3.29Å; V159-L163 PolarHBondContact O-N 3.25Å
160	T	89.1	Confident	86.8	Confident	26 Å²	26	59.4 Å²	59.4	16%	0.16	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-50.5	177.8	-53.8	0	0	0	0	111.3	F156 F158 L163 T164 L280	F156-T160 WeakPolarHBondContact O-CB 3.38Å; F156-T160 PolarHBondContact O-N 3.23Å; F156-T160 PolarHBondContact O-OG1 3.46Å; F158-T160 VanDerWaalsContact C-N 3.33Å; F158-T160 PolarHBondContact O-N 3.08Å; T160-L163 PolarHBondContact O-N 3.32Å; T160-T164 PolarHBondContact O-N 3.23Å; T160-T164 VanDerWaalsContact O-N 3.14Å; T160-T164 PolarHBondContact O-OG1 2.92Å; T160-L280 HydrophobicContact CG2-CD2 4.17Å
161	A	87.7	Confident	88	Confident	4 Å²	4	58.3 Å²	58.3	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-42.5	179.7	0	0	0	0	0	112.4	H157 F158 V159 L163 T164 E165 L284 V291	H157-A161 PolarHBondContact O-N 3.16Å; F158-A161 PolarHBondContact O-N 2.68Å; V159-A161 PolarHBondContact O-N 3.03Å; A161-L163 VanDerWaalsContact C-N 3.34Å; A161-L163 PolarHBondContact O-N 3.25Å; A161-T164 PolarHBondContact O-N 3.37Å; A161-T164 PolarHBondContact O-OG1 3.5Å; A161-E165 WeakPolarHBondContact O-CB 3.14Å; A161-E165 WeakPolarHBondContact O-CG 3.49Å; A161-E165 PolarHBondContact O-N 2.71Å; A161-L284 HydrophobicContact CB-CD2 4.08Å; A161-V291 HydrophobicContact CB-CG1 3.72Å
162	F	91.6	Very high	89.1	Confident	58 Å²	58	50.9 Å²	50.9	25%	0.254	26%	0.259	S	S	.	.	H	α-helix	trans	-58.5	-44.5	178.6	-176.9	-87.1	0	0	0	111.5	F158 V159 T166 V295 W298	F158-F162 HydrophobicContact CE1-CB 4.42Å; F158-F162 HydrophobicContact CE1-CD2 4.27Å; F158-F162 HydrophobicContact CZ-CD2 4.06Å; F158-F162 VanDerWaalsContact O-CB 3.32Å; F158-F162 WeakPolarHBondContact O-CB 3.35Å; F158-F162 PolarHBondContact O-N 2.91Å; V159-F162 PolarHBondContact O-N 3.41Å; F162-T166 WeakPolarHBondContact O-CB 3.46Å; F162-T166 PolarHBondContact O-N 3.36Å; F162-T166 PolarHBondContact O-OG1 3.37Å; F162-V295 HydrophobicContact CB-CG2 4.43Å; F162-V295 HydrophobicContact CD2-CG2 4.13Å; F162-W298 AromaticContact CE1-NE1 3.86Å; F162-W298 HydrophobicContact CE2-CB 4.24Å; F162-W298 AromaticContact CE2-CD1 3.45Å; F162-W298 VanDerWaalsContact CE2-CD1 3.45Å; F162-W298 HydrophobicContact CE2-CD2 4.07Å; F162-W298 AromaticContact CE2-CG 3.66Å; F162-W298 HydrophobicContact CE2-CG 3.66Å; F162-W298 AromaticContact CE2-NE1 3.72Å; F162-W298 AromaticContact CZ-CD1 3.55Å; F162-W298 AromaticContact CZ-CD2 3.91Å; F162-W298 HydrophobicContact CZ-CD2 3.91Å; F162-W298 AromaticContact CZ-CE2 3.54Å; F162-W298 AromaticContact CZ-CG 3.92Å; F162-W298 HydrophobicContact CZ-CG 3.92Å; F162-W298 HydrophobicContact CZ-CZ2 4.16Å; F162-W298 AromaticContact CZ-NE1 3.27Å; F162-W298 VanDerWaalsContact CZ-NE1 3.27Å
163	L	92.9	Very high	89.9	Confident	102 Å²	102	42.4 Å²	42.4	53%	0.534	22%	0.222	S	C	.	.	H	α-helix	trans	-64	-50.6	175.4	-75.7	167	0	0	0	112	V159 T160 A161 E165 T166 C167	V159-L163 HydrophobicContact CG1-CD1 3.94Å; V159-L163 WeakPolarHBondContact O-CG 3.29Å; V159-L163 PolarHBondContact O-N 3.25Å; T160-L163 PolarHBondContact O-N 3.32Å; A161-L163 VanDerWaalsContact C-N 3.34Å; A161-L163 PolarHBondContact O-N 3.25Å; L163-E165 VanDerWaalsContact C-N 3.33Å; L163-E165 PolarHBondContact O-N 3.5Å; L163-T166 WeakPolarHBondContact O-CB 3.4Å; L163-T166 PolarHBondContact O-N 3.05Å; L163-C167 PolarHBondContact O-N 3.16Å; L163-C167 PolarHBondContact O-SG 3.31Å; L163-C167 VanDerWaalsContact O-SG 3.36Å
164	T	90.3	Very high	90.4	Very high	31 Å²	31	41.3 Å²	41.3	19%	0.19	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-37	-177.1	50.7	0	0	0	0	113.3	T160 A161 Y168 V258	T160-T164 PolarHBondContact O-N 3.23Å; T160-T164 VanDerWaalsContact O-N 3.14Å; T160-T164 PolarHBondContact O-OG1 2.92Å; A161-T164 PolarHBondContact O-N 3.37Å; A161-T164 PolarHBondContact O-OG1 3.5Å; T164-Y168 PolarHBondContact O-N 3.17Å; T164-V258 HydrophobicContact CG2-CG1 4.29Å
165	E	91	Very high	90.5	Very high	6 Å²	6	37.8 Å²	37.8	3%	0.028	19%	0.192	C	C	.	.	H	α-helix	trans	-80.2	-25.9	178.3	-69.5	-79	-163.8	0	0	112.3	A161 L163 A169 Y292 V295 K299	A161-E165 WeakPolarHBondContact O-CB 3.14Å; A161-E165 WeakPolarHBondContact O-CG 3.49Å; A161-E165 PolarHBondContact O-N 2.71Å; L163-E165 VanDerWaalsContact C-N 3.33Å; L163-E165 PolarHBondContact O-N 3.5Å; E165-A169 WeakPolarHBondContact O-CB 3.41Å; E165-A169 PolarHBondContact O-N 3.17Å; E165-Y292 VanDerWaalsContact OE1-CE1 3.25Å; E165-Y292 WeakPolarHBondContact OE1-CE1 3.36Å; E165-Y292 PolarHBondContact OE1-OH 2.91Å; E165-V295 HydrophobicContact CB-CG1 3.49Å; E165-V295 VanDerWaalsContact CB-CG1 3.49Å; E165-V295 HydrophobicContact CG-CG1 3.92Å; E165-K299 IonicContact OE1-NZ 3.89Å; E165-K299 WeakPolarHBondContact OE2-CE 3.37Å; E165-K299 IonicContact OE2-NZ 3.44Å; E165-K299 PolarHBondContact OE2-NZ 3Å
166	T	94.1	Very high	90.6	Very high	32 Å²	32	29.9 Å²	29.9	20%	0.196	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-46.5	168.6	-68.5	0	0	0	0	111	F162 L163 Y168 A169 A170 W298 L302	F162-T166 WeakPolarHBondContact O-CB 3.46Å; F162-T166 PolarHBondContact O-N 3.36Å; F162-T166 PolarHBondContact O-OG1 3.37Å; L163-T166 WeakPolarHBondContact O-CB 3.4Å; L163-T166 PolarHBondContact O-N 3.05Å; T166-Y168 VanDerWaalsContact C-N 3.32Å; T166-Y168 PolarHBondContact O-N 3.28Å; T166-A169 PolarHBondContact O-N 3.13Å; T166-A170 WeakPolarHBondContact O-CB 3.49Å; T166-A170 PolarHBondContact O-N 3.42Å; T166-W298 PolarHBondContact OG1-NE1 3.13Å; T166-L302 HydrophobicContact CG2-CD1 3.93Å
167	C	93.4	Very high	90.7	Very high	46 Å²	46	24 Å²	24	31%	0.311	13%	0.131	S	C	.	.	H	α-helix	trans	-56.5	-47.3	174.1	-67.7	0	0	0	0	111.3	L163 A170 G171 L255	L163-C167 PolarHBondContact O-N 3.16Å; L163-C167 PolarHBondContact O-SG 3.31Å; L163-C167 VanDerWaalsContact O-SG 3.36Å; C167-A170 PolarHBondContact O-N 3.37Å; C167-G171 PolarHBondContact O-N 3.17Å; C167-L255 HydrophobicContact CB-CD2 3.92Å
168	Y	92.2	Very high	90.7	Very high	9 Å²	9	23.1 Å²	23.1	4%	0.035	13%	0.128	C	C	.	.	H	α-helix	trans	-56.8	-52.8	176.5	178.4	-101.9	0	0	0	112.4	T164 T166 A170 G171 V172 I256 A259 S555	T164-Y168 PolarHBondContact O-N 3.17Å; T166-Y168 VanDerWaalsContact C-N 3.32Å; T166-Y168 PolarHBondContact O-N 3.28Å; Y168-A170 VanDerWaalsContact C-N 3.35Å; Y168-A170 PolarHBondContact O-N 3.12Å; Y168-G171 PolarHBondContact O-N 3.15Å; Y168-V172 HydrophobicContact CD1-CG2 4.25Å; Y168-V172 HydrophobicContact CD2-CG2 4.38Å; Y168-V172 HydrophobicContact CE1-CG2 3.74Å; Y168-V172 HydrophobicContact CE2-CG2 3.91Å; Y168-V172 WeakPolarHBondContact O-CG2 3.5Å; Y168-V172 PolarHBondContact O-N 2.99Å; Y168-I256 WeakPolarHBondContact CD2-O 3.14Å; Y168-I256 HydrophobicContact CE2-CG2 4.07Å; Y168-A259 HydrophobicContact CD2-CB 3.36Å; Y168-A259 HydrophobicContact CE2-CB 3.95Å; Y168-A259 HydrophobicContact CG-CB 3.78Å; Y168-S555 WeakPolarHBondContact OH-CB 3.22Å; Y168-S555 PolarHBondContact OH-OG 3.18Å; Y168-S555 VanDerWaalsContact OH-OG 3.07Å
169	A	92.1	Very high	90.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.5	-36.9	-177.1	0	0	0	0	0	113	E165 T166 V172 G173 K299 L302 Y303	E165-A169 WeakPolarHBondContact O-CB 3.41Å; E165-A169 PolarHBondContact O-N 3.17Å; T166-A169 PolarHBondContact O-N 3.13Å; A169-V172 PolarHBondContact O-N 3.38Å; A169-G173 PolarHBondContact O-N 3.34Å; A169-K299 HydrophobicContact CB-CB 4.23Å; A169-K299 HydrophobicContact CB-CG 3.88Å; A169-L302 HydrophobicContact CB-CB 4.39Å; A169-L302 HydrophobicContact CB-CD1 4.12Å; A169-Y303 HydrophobicContact CB-CE1 3.76Å
170	A	93.1	Very high	90.1	Very high	19 Å²	19	18.3 Å²	18.3	16%	0.157	10%	0.103	C	C	.	.	H	α-helix	trans	-63.1	-44	172.9	0	0	0	0	0	112.1	T166 C167 Y168 V172 G173 L174 F306	T166-A170 WeakPolarHBondContact O-CB 3.49Å; T166-A170 PolarHBondContact O-N 3.42Å; C167-A170 PolarHBondContact O-N 3.37Å; Y168-A170 VanDerWaalsContact C-N 3.35Å; Y168-A170 PolarHBondContact O-N 3.12Å; A170-V172 VanDerWaalsContact C-N 3.33Å; A170-V172 PolarHBondContact O-N 2.84Å; A170-G173 PolarHBondContact O-N 3.42Å; A170-L174 WeakPolarHBondContact O-CB 3.48Å; A170-L174 PolarHBondContact O-N 2.95Å; A170-F306 HydrophobicContact CB-CE2 4.18Å; A170-F306 HydrophobicContact CB-CZ 3.82Å; A170-F306 WeakPolarHBondContact O-CE1 3.48Å
171	G	91.6	Very high	89.8	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.2	-39.2	176.1	0	0	0	0	0	113	C167 Y168 L175 S252	C167-G171 PolarHBondContact O-N 3.17Å; Y168-G171 PolarHBondContact O-N 3.15Å; G171-L175 PolarHBondContact O-N 3.19Å; G171-L175 VanDerWaalsContact O-N 3.08Å; G171-S252 PolarHBondContact O-OG 3.28Å
172	V	91.1	Very high	89.3	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-69.5	-42.2	175.6	169.8	0	0	0	0	112.5	V130 Y168 A169 A170 L175 T176 I256 Y303 I557	V130-V172 HydrophobicContact CG1-CG1 4.37Å; Y168-V172 HydrophobicContact CD1-CG2 4.25Å; Y168-V172 HydrophobicContact CD2-CG2 4.38Å; Y168-V172 HydrophobicContact CE1-CG2 3.74Å; Y168-V172 HydrophobicContact CE2-CG2 3.91Å; Y168-V172 WeakPolarHBondContact O-CG2 3.5Å; Y168-V172 PolarHBondContact O-N 2.99Å; A169-V172 PolarHBondContact O-N 3.38Å; A170-V172 VanDerWaalsContact C-N 3.33Å; A170-V172 PolarHBondContact O-N 2.84Å; V172-L175 WeakPolarHBondContact O-CB 3.29Å; V172-L175 PolarHBondContact O-N 3.17Å; V172-T176 WeakPolarHBondContact O-CB 3.21Å; V172-T176 PolarHBondContact O-N 3.47Å; V172-T176 PolarHBondContact O-OG1 3.14Å; V172-I256 HydrophobicContact CG2-CD1 4.41Å; V172-I256 HydrophobicContact CG2-CG1 3.94Å; V172-Y303 HydrophobicContact CB-CE1 4.14Å; V172-Y303 HydrophobicContact CG1-CE1 3.86Å; V172-I557 HydrophobicContact CG1-CD1 3.37Å
173	G	90.7	Very high	88.5	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-43.8	175.5	0	0	0	0	0	111.9	A169 A170 L175 T176 F177 F306	A169-G173 PolarHBondContact O-N 3.34Å; A170-G173 PolarHBondContact O-N 3.42Å; G173-L175 PolarHBondContact O-N 2.84Å; G173-T176 PolarHBondContact O-N 2.97Å; G173-F177 PolarHBondContact O-N 3.18Å; G173-F306 VanDerWaalsContact C-CD1 3.49Å
174	L	90.2	Very high	87.5	Confident	18 Å²	18	12.4 Å²	12.4	9%	0.094	7%	0.074	C	C	.	.	H	α-helix	trans	-63.3	-39.7	175.6	-168.3	63.4	0	0	0	112	A170 T176 H178 L179 A248 L251 F306 F310	A170-L174 WeakPolarHBondContact O-CB 3.48Å; A170-L174 PolarHBondContact O-N 2.95Å; L174-T176 VanDerWaalsContact C-N 3.33Å; L174-T176 PolarHBondContact O-N 2.77Å; L174-H178 HydrophobicContact CD1-CB 4.01Å; L174-H178 WeakPolarHBondContact O-CB 3.47Å; L174-H178 PolarHBondContact O-N 3.09Å; L174-L179 PolarHBondContact O-N 3.27Å; L174-L179 VanDerWaalsContact O-N 3.17Å; L174-A248 HydrophobicContact CD1-CB 4.43Å; L174-A248 HydrophobicContact CD2-CB 4.28Å; L174-A248 HydrophobicContact CG-CB 4.46Å; L174-L251 HydrophobicContact CD2-CD2 4.29Å; L174-L251 HydrophobicContact CD2-CG 4.38Å; L174-F306 HydrophobicContact CB-CE1 4.07Å; L174-F310 HydrophobicContact CD1-CE2 3.89Å; L174-F310 HydrophobicContact CD1-CZ 3.7Å
175	L	88.5	Confident	87	Confident	4 Å²	4	11 Å²	11	2%	0.021	7%	0.065	C	C	.	.	I	π-helix	trans	-60.9	-43.7	173.4	-174.7	58.9	0	0	0	111.6	G171 V172 G173 L179 L180 L191 S252 I256	G171-L175 PolarHBondContact O-N 3.19Å; G171-L175 VanDerWaalsContact O-N 3.08Å; V172-L175 WeakPolarHBondContact O-CB 3.29Å; V172-L175 PolarHBondContact O-N 3.17Å; G173-L175 PolarHBondContact O-N 2.84Å; L175-L179 HydrophobicContact CD1-CB 4.31Å; L175-L179 HydrophobicContact CD1-CD1 4.28Å; L175-L180 HydrophobicContact CD1-CG 4.31Å; L175-L180 HydrophobicContact CG-CD1 4.38Å; L175-L180 HydrophobicContact CG-CG 4.32Å; L175-L180 WeakPolarHBondContact O-CB 3.48Å; L175-L180 WeakPolarHBondContact O-CG 3.4Å; L175-L180 PolarHBondContact O-N 3.13Å; L175-L191 HydrophobicContact CD1-CD2 3.84Å; L175-S252 WeakPolarHBondContact CB-OG 3.29Å; L175-I256 HydrophobicContact CB-CD1 4.21Å; L175-I256 HydrophobicContact CD2-CD1 3.82Å
176	T	89.3	Confident	86.5	Confident	3 Å²	3	11 Å²	11	2%	0.018	7%	0.066	C	C	.	.	I	π-helix	trans	-78.2	-52.5	-168.6	-55.6	0	0	0	0	113.6	F78 V130 V172 G173 L174 P181 I557	F78-T176 HydrophobicContact CE1-CG2 4.5Å; F78-T176 HydrophobicContact CZ-CG2 3.77Å; V130-T176 HydrophobicContact CG2-CG2 4.24Å; V172-T176 WeakPolarHBondContact O-CB 3.21Å; V172-T176 PolarHBondContact O-N 3.47Å; V172-T176 PolarHBondContact O-OG1 3.14Å; G173-T176 PolarHBondContact O-N 2.97Å; L174-T176 VanDerWaalsContact C-N 3.33Å; L174-T176 PolarHBondContact O-N 2.77Å; T176-P181 VanDerWaalsContact O-CD 3.29Å; T176-P181 WeakPolarHBondContact O-CD 3.5Å; T176-P181 WeakPolarHBondContact O-CG 3.47Å; T176-I557 WeakPolarHBondContact OG1-CD1 3.4Å
177	F	89	Confident	85.8	Confident	6 Å²	6	12.9 Å²	12.9	3%	0.026	7%	0.069	C	C	.	.	I	π-helix	trans	-97.4	-13.5	-168.8	-58.9	-71.1	0	0	0	113.5	M127 G173 F306 A307 F310	M127-F177 HydrophobicContact CE-CE1 4.3Å; M127-F177 HydrophobicContact CE-CE2 3.86Å; M127-F177 HydrophobicContact CE-CZ 3.49Å; M127-F177 VanDerWaalsContact CE-CZ 3.49Å; G173-F177 PolarHBondContact O-N 3.18Å; F177-F306 HydrophobicContact CD2-CB 4.24Å; F177-A307 HydrophobicContact CD1-CB 3.84Å; F177-A307 HydrophobicContact CD2-CB 4.04Å; F177-A307 HydrophobicContact CE1-CB 3.72Å; F177-A307 HydrophobicContact CE2-CB 3.94Å; F177-A307 HydrophobicContact CG-CB 4.01Å; F177-A307 HydrophobicContact CZ-CB 3.8Å; F177-F310 HydrophobicContact CB-CB 4.06Å; F177-F310 HydrophobicContact CB-CD2 4.21Å
178	H	86.1	Confident	85.2	Confident	15 Å²	15	10.7 Å²	10.7	7%	0.069	5%	0.054	C	C	.	.	I	π-helix	trans	-113.5	-51	179.5	-170.7	77.9	0	0	0	113.1	L174 Y245 F310	L174-H178 HydrophobicContact CD1-CB 4.01Å; L174-H178 WeakPolarHBondContact O-CB 3.47Å; L174-H178 PolarHBondContact O-N 3.09Å; H178-Y245 AromaticContact CE1-CD1 3.85Å; H178-Y245 AromaticContact CE1-CE1 3.46Å; H178-Y245 VanDerWaalsContact CE1-CE1 3.46Å; H178-Y245 WeakPolarHBondContact CE1-CE1 3.43Å; H178-Y245 AromaticContact NE2-CD1 3.39Å; H178-Y245 WeakPolarHBondContact NE2-CD1 3.2Å; H178-Y245 AromaticContact NE2-CE1 3.48Å; H178-Y245 WeakPolarHBondContact NE2-CE1 3.21Å; H178-F310 HydrophobicContact CB-CD1 4.02Å; H178-F310 HydrophobicContact CB-CD2 3.95Å; H178-F310 HydrophobicContact CB-CE1 4Å; H178-F310 HydrophobicContact CB-CE2 3.94Å; H178-F310 HydrophobicContact CB-CG 4Å; H178-F310 HydrophobicContact CB-CZ 3.96Å; H178-F310 AromaticContact CE1-CE1 3.92Å; H178-F310 AromaticContact CG-CD1 3.99Å; H178-F310 AromaticContact CG-CE1 3.75Å; H178-F310 AromaticContact ND1-CD1 3.34Å; H178-F310 VanDerWaalsContact ND1-CD1 3.34Å; H178-F310 WeakPolarHBondContact ND1-CD1 3.49Å; H178-F310 AromaticContact ND1-CE1 3.22Å; H178-F310 WeakPolarHBondContact ND1-CE1 3.44Å; H178-F310 AromaticContact ND1-CZ 3.96Å
179	L	84.6	Confident	84.8	Confident	4 Å²	4	10.3 Å²	10.3	2%	0.021	5%	0.053	C	C	.	.	I	π-helix	trans	-83	-55	-171.7	-68.2	175.7	0	0	0	114.5	L174 L175 P181 N182 M183 A248 P249	L174-L179 PolarHBondContact O-N 3.27Å; L174-L179 VanDerWaalsContact O-N 3.17Å; L175-L179 HydrophobicContact CD1-CB 4.31Å; L175-L179 HydrophobicContact CD1-CD1 4.28Å; L179-P181 VanDerWaalsContact C-CD 3.46Å; L179-N182 PolarHBondContact O-N 3.45Å; L179-M183 HydrophobicContact CB-CE 4.3Å; L179-M183 PolarHBondContact O-N 3.33Å; L179-M183 VanDerWaalsContact O-N 3.13Å; L179-A248 HydrophobicContact CD2-CB 3.89Å; L179-A248 HydrophobicContact CG-CB 4.46Å; L179-P249 HydrophobicContact CD2-CG 3.86Å
180	L	84.5	Confident	84.5	Confident	1 Å²	1	10.5 Å²	10.5	1%	0.005	5%	0.054	C	C	.	.	H	α-helix	trans	-57.2	-41.1	-177.9	-75.7	177	0	0	0	114.7	F78 L79 A82 L175 N182	F78-L180 HydrophobicContact CE1-CD1 4.05Å; L79-L180 HydrophobicContact CD2-CD1 4.26Å; L79-L180 HydrophobicContact CD2-CD2 3.73Å; A82-L180 HydrophobicContact CB-CB 3.95Å; A82-L180 HydrophobicContact CB-CD1 3.89Å; L175-L180 HydrophobicContact CD1-CG 4.31Å; L175-L180 HydrophobicContact CG-CD1 4.38Å; L175-L180 HydrophobicContact CG-CG 4.32Å; L175-L180 WeakPolarHBondContact O-CB 3.48Å; L175-L180 WeakPolarHBondContact O-CG 3.4Å; L175-L180 PolarHBondContact O-N 3.13Å; L180-N182 PolarHBondContact O-N 3.45Å; L180-N182 VanDerWaalsContact O-N 3.16Å
181	P	82.1	Confident	84	Confident	8 Å²	8	10 Å²	10	5%	0.052	5%	0.049	C	C	.	.	H	α-helix	trans	-65.6	-19.5	-179.4	-21.1	33.7	0	0	0	113.5	A82 V85 G86 T176 L179	A82-P181 WeakPolarHBondContact O-CA 3.39Å; A82-P181 WeakPolarHBondContact O-CG 3.39Å; V85-P181 HydrophobicContact CB-CB 4.29Å; V85-P181 HydrophobicContact CB-CG 4.23Å; V85-P181 HydrophobicContact CG1-CB 4.33Å; V85-P181 HydrophobicContact CG1-CG 4.14Å; G86-P181 WeakPolarHBondContact CA-O 3.4Å; T176-P181 VanDerWaalsContact O-CD 3.29Å; T176-P181 WeakPolarHBondContact O-CD 3.5Å; T176-P181 WeakPolarHBondContact O-CG 3.47Å; L179-P181 VanDerWaalsContact C-CD 3.46Å
182	N	77.2	Confident	83.8	Confident	47 Å²	47	10.1 Å²	10.1	25%	0.251	5%	0.05	S	C	.	.	H	α-helix	trans	-105.1	-30.9	-173	-68.7	10	0	0	0	113	L179 L180 Y245 R314	L179-N182 PolarHBondContact O-N 3.45Å; L180-N182 PolarHBondContact O-N 3.45Å; L180-N182 VanDerWaalsContact O-N 3.16Å; N182-Y245 WeakPolarHBondContact ND2-CE1 3.44Å; N182-Y245 VanDerWaalsContact ND2-CZ 3.26Å; N182-Y245 PolarHBondContact ND2-OH 2.84Å; N182-R314 PolarHBondContact OD1-NH1 3.5Å; N182-R314 PolarHBondContact OD1-NH2 2.99Å
183	M	73.8	Confident	83.5	Confident	9 Å²	9	10.1 Å²	10.1	4%	0.044	5%	0.049	C	C	.	.	H	α-helix	trans	-86.7	-14.2	-178	-66.3	-157.9	-64.3	0	0	114.8	L179 R187 L191 L238	L179-M183 HydrophobicContact CB-CE 4.3Å; L179-M183 PolarHBondContact O-N 3.33Å; L179-M183 VanDerWaalsContact O-N 3.13Å; M183-R187 HydrophobicContact CB-CB 4.29Å; M183-L191 HydrophobicContact CE-CD2 4.05Å; M183-L238 HydrophobicContact CG-CD2 4Å; M183-L238 HydrophobicContact SD-CD1 4.3Å; M183-L238 HydrophobicContact SD-CD2 4.12Å; M183-L238 HydrophobicContact SD-CG 4.33Å
184	G	73.4	Confident	83.3	Confident	2 Å²	2	10.1 Å²	10.1	2%	0.021	5%	0.049	C	C	.	.			trans	75	163.2	-174.6	0	0	0	0	0	113.4	V186 G188	G184-V186 PolarHBondContact O-N 2.96Å; G184-G188 PolarHBondContact O-N 3.41Å
185	A	79	Confident	83	Confident	1 Å²	1	9.3 Å²	9.3	1%	0.008	5%	0.046	C	C	.	.	H	α-helix	trans	-63	-43.8	-163.5	0	0	0	0	0	113.3	T83 L189 M475 W499	T83-A185 HydrophobicContact CG2-CB 4.07Å; A185-L189 VanDerWaalsContact O-CB 3.24Å; A185-L189 WeakPolarHBondContact O-CB 3.27Å; A185-L189 PolarHBondContact O-N 3.43Å; A185-M475 HydrophobicContact CB-CE 3.62Å; A185-W499 HydrophobicContact CB-CE3 4.08Å; A185-W499 HydrophobicContact CB-CZ3 4.43Å
186	V	81	Confident	82.8	Confident	7 Å²	7	9.1 Å²	9.1	4%	0.042	5%	0.045	C	C	.	.	H	α-helix	trans	-67.7	-50.2	-175.7	-175.4	0	0	0	0	111.4	G184 G188 L189 C190 M475 F511	G184-V186 PolarHBondContact O-N 2.96Å; V186-G188 PolarHBondContact O-N 3.19Å; V186-L189 PolarHBondContact O-N 3.4Å; V186-C190 PolarHBondContact O-N 3.45Å; V186-C190 PolarHBondContact O-SG 3.08Å; V186-M475 HydrophobicContact CG2-CB 4.14Å; V186-F511 HydrophobicContact CG1-CE2 3.86Å; V186-F511 HydrophobicContact CG1-CZ 4.34Å
187	R	79.2	Confident	82.7	Confident	70 Å²	70	9.9 Å²	9.9	26%	0.264	5%	0.048	S	C	.	.	H	α-helix	trans	-66.4	-39.3	178.8	-60.6	-171.6	-175.8	175.8	10.5	111.7	M183 C190 L191 I237 P502 L516	M183-R187 HydrophobicContact CB-CB 4.29Å; R187-C190 PolarHBondContact O-N 3.24Å; R187-L191 PolarHBondContact O-N 3.41Å; R187-L191 VanDerWaalsContact O-N 3.11Å; R187-I237 PolarHBondContact NH1-O 2.6Å; R187-I237 VanDerWaalsContact NH1-O 3.08Å; R187-P502 HydrophobicContact CG-CG 4.1Å; R187-L516 HydrophobicContact CB-CD2 4.41Å; R187-L516 HydrophobicContact CG-CD2 3.86Å
188	G	80.6	Confident	82.7	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-59.5	-46	174.2	0	0	0	0	0	113	G184 V186 C190 L191 T192	G184-G188 PolarHBondContact O-N 3.41Å; V186-G188 PolarHBondContact O-N 3.19Å; G188-C190 PolarHBondContact O-N 3.19Å; G188-L191 WeakPolarHBondContact O-CB 3.5Å; G188-L191 PolarHBondContact O-N 3.31Å; G188-T192 PolarHBondContact O-N 2.98Å
189	L	84	Confident	82.8	Confident	1 Å²	1	10.6 Å²	10.6	1%	0.005	5%	0.054	C	C	.	.	H	α-helix	trans	-62.2	-42.1	175.8	176.7	57.1	0	0	0	112.2	K75 L79 A185 V186 L191 T192 Q468 L471 V472	K75-L189 HydrophobicContact CD-CD1 4.07Å; K75-L189 VanDerWaalsContact CE-CD1 3.5Å; K75-L189 HydrophobicContact CG-CD1 4.49Å; L79-L189 HydrophobicContact CD1-CB 3.84Å; L79-L189 HydrophobicContact CD1-CD1 3.91Å; L79-L189 HydrophobicContact CD1-CD2 4.23Å; L79-L189 HydrophobicContact CD1-CG 4.2Å; A185-L189 VanDerWaalsContact O-CB 3.24Å; A185-L189 WeakPolarHBondContact O-CB 3.27Å; A185-L189 PolarHBondContact O-N 3.43Å; V186-L189 PolarHBondContact O-N 3.4Å; L189-L191 VanDerWaalsContact C-N 3.32Å; L189-L191 PolarHBondContact O-N 3.49Å; L189-T192 PolarHBondContact O-N 2.98Å; L189-T192 PolarHBondContact O-OG1 3.44Å; L189-Q468 HydrophobicContact CD1-CG 4.38Å; L189-Q468 PolarHBondContact O-NE2 3.47Å; L189-L471 HydrophobicContact CD1-CD2 4.12Å; L189-L471 HydrophobicContact CD2-CB 3.96Å; L189-L471 HydrophobicContact CD2-CD2 3.83Å; L189-L471 HydrophobicContact CD2-CG 3.58Å; L189-V472 HydrophobicContact CB-CG2 4.43Å; L189-V472 HydrophobicContact CD2-CB 4.27Å; L189-V472 HydrophobicContact CD2-CG2 3.44Å; L189-V472 VanDerWaalsContact CD2-CG2 3.44Å; L189-V472 HydrophobicContact CG-CG2 3.55Å
190	C	84.7	Confident	82.9	Confident	5 Å²	5	10.5 Å²	10.5	3%	0.034	5%	0.054	C	C	.	.	H	α-helix	trans	-58.3	-42.5	174.6	-67.9	0	0	0	0	112.1	V186 R187 G188 T192 S193 W520 W523	V186-C190 PolarHBondContact O-N 3.45Å; V186-C190 PolarHBondContact O-SG 3.08Å; R187-C190 PolarHBondContact O-N 3.24Å; G188-C190 PolarHBondContact O-N 3.19Å; C190-T192 VanDerWaalsContact C-N 3.29Å; C190-T192 PolarHBondContact O-N 3.07Å; C190-S193 WeakPolarHBondContact O-CB 3.49Å; C190-S193 PolarHBondContact O-N 3.25Å; C190-S193 PolarHBondContact O-OG 3.02Å; C190-W520 HydrophobicContact CB-CB 4.25Å; C190-W520 HydrophobicContact CB-CG 4.12Å; C190-W523 HydrophobicContact CB-CZ3 4.48Å
191	L	83.7	Confident	83.2	Confident	7 Å²	7	13.7 Å²	13.7	4%	0.037	7%	0.07	C	C	.	.	H	α-helix	trans	-60	-35.8	178.5	-164.4	88.2	0	0	0	112.7	L175 M183 R187 G188 L189 S193 C194 V253	L175-L191 HydrophobicContact CD1-CD2 3.84Å; M183-L191 HydrophobicContact CE-CD2 4.05Å; R187-L191 PolarHBondContact O-N 3.41Å; R187-L191 VanDerWaalsContact O-N 3.11Å; G188-L191 WeakPolarHBondContact O-CB 3.5Å; G188-L191 PolarHBondContact O-N 3.31Å; L189-L191 VanDerWaalsContact C-N 3.32Å; L189-L191 PolarHBondContact O-N 3.49Å; L191-S193 PolarHBondContact O-N 2.68Å; L191-C194 PolarHBondContact O-N 3.34Å; L191-V253 HydrophobicContact CD1-CG2 4.46Å; L191-V253 HydrophobicContact CD2-CG2 4.01Å; L191-V253 HydrophobicContact CG-CG2 4.09Å
192	T	86.2	Confident	83.4	Confident	4 Å²	4	14.1 Å²	14.1	3%	0.025	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-61	-17.9	-178.7	65.6	0	0	0	0	114.2	K75 G188 L189 C190 C194 T195 Q468 L558	K75-T192 PolarHBondContact NZ-OG1 3.38Å; G188-T192 PolarHBondContact O-N 2.98Å; L189-T192 PolarHBondContact O-N 2.98Å; L189-T192 PolarHBondContact O-OG1 3.44Å; C190-T192 VanDerWaalsContact C-N 3.29Å; C190-T192 PolarHBondContact O-N 3.07Å; T192-C194 VanDerWaalsContact C-N 3.27Å; T192-C194 PolarHBondContact O-N 3.14Å; T192-T195 PolarHBondContact O-OG1 2.97Å; T192-Q468 PolarHBondContact OG1-NE2 3.03Å; T192-Q468 VanDerWaalsContact OG1-NE2 3.08Å; T192-L558 HydrophobicContact CG2-CD2 3.72Å
193	S	86.2	Confident	83.8	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-68.4	-22.5	174.4	-30.1	0	0	0	0	113.6	C190 L191 Q468 W520 Q527	C190-S193 WeakPolarHBondContact O-CB 3.49Å; C190-S193 PolarHBondContact O-N 3.25Å; C190-S193 PolarHBondContact O-OG 3.02Å; L191-S193 PolarHBondContact O-N 2.68Å; S193-Q468 PolarHBondContact OG-NE2 3.06Å; S193-W520 VanDerWaalsContact OG-CD1 3.31Å; S193-W520 PolarHBondContact OG-NE1 2.96Å; S193-Q527 PolarHBondContact O-OE1 3.25Å
194	C	85.1	Confident	84.2	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-94	9.9	-170.7	-154.6	0	0	0	0	113.9	L191 T192 G196 Q227 P230 V253 W523	L191-C194 PolarHBondContact O-N 3.34Å; T192-C194 VanDerWaalsContact C-N 3.27Å; T192-C194 PolarHBondContact O-N 3.14Å; C194-G196 PolarHBondContact O-N 3.36Å; C194-G196 VanDerWaalsContact O-N 3.12Å; C194-Q227 PolarHBondContact O-OE1 3.06Å; C194-Q227 PolarHBondContact SG-O 2.96Å; C194-P230 HydrophobicContact CB-CG 4.1Å; C194-P230 WeakPolarHBondContact SG-CD 3.41Å; C194-P230 WeakPolarHBondContact SG-CG 3.18Å; C194-V253 HydrophobicContact CB-CG1 4.29Å; C194-V253 WeakPolarHBondContact O-CG1 3.46Å; C194-W523 HydrophobicContact CB-CD2 4.16Å; C194-W523 HydrophobicContact CB-CG 4.24Å
195	T	84.7	Confident	84.7	Confident	2 Å²	2	15.4 Å²	15.4	1%	0.012	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	3.9	-177.9	62.1	0	0	0	0	113.9	T192 L197 I256 S257 W260 L558	T192-T195 PolarHBondContact O-OG1 2.97Å; T195-L197 VanDerWaalsContact C-N 3.35Å; T195-L197 PolarHBondContact O-N 3.22Å; T195-I256 HydrophobicContact CG2-CB 4.46Å; T195-I256 HydrophobicContact CG2-CG2 3.75Å; T195-S257 WeakPolarHBondContact O-CA 3.16Å; T195-S257 WeakPolarHBondContact O-CB 3.36Å; T195-W260 WeakPolarHBondContact O-CZ3 3.29Å; T195-L558 HydrophobicContact CG2-CD1 4.24Å
196	G	84.2	Confident	84.6	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	10.1	-171.7	0	0	0	0	0	115.9	C194 P199 A200 Y565	C194-G196 PolarHBondContact O-N 3.36Å; C194-G196 VanDerWaalsContact O-N 3.12Å; G196-P199 WeakPolarHBondContact O-CB 3.49Å; G196-P199 WeakPolarHBondContact O-CD 3.33Å; G196-A200 WeakPolarHBondContact O-CB 3.44Å; G196-A200 PolarHBondContact O-N 3.46Å; G196-Y565 WeakPolarHBondContact CA-OH 3.25Å
197	L	88	Confident	84.2	Confident	19 Å²	19	18.3 Å²	18.3	10%	0.099	9%	0.092	C	C	.	.	H	α-helix	trans	-59.4	-59.9	-166.9	-178.9	57.6	0	0	0	114.9	T195 A200 I201 Q227 M228	T195-L197 VanDerWaalsContact C-N 3.35Å; T195-L197 PolarHBondContact O-N 3.22Å; L197-A200 WeakPolarHBondContact O-CB 3.29Å; L197-A200 PolarHBondContact O-N 2.98Å; L197-A200 VanDerWaalsContact O-N 3.11Å; L197-I201 HydrophobicContact CD1-CD1 3.89Å; L197-I201 HydrophobicContact CD1-CG1 4.37Å; L197-I201 HydrophobicContact CG-CD1 4.09Å; L197-I201 WeakPolarHBondContact O-CG1 3.29Å; L197-I201 PolarHBondContact O-N 3.23Å; L197-Q227 HydrophobicContact CB-CB 4.44Å; L197-Q227 HydrophobicContact CD1-CB 4.08Å; L197-M228 HydrophobicContact CD1-CG 3.81Å; L197-M228 HydrophobicContact CD1-SD 3.54Å; L197-M228 VanDerWaalsContact CD1-SD 3.54Å; L197-M228 HydrophobicContact CD2-SD 3.89Å; L197-M228 HydrophobicContact CG-SD 4.36Å
198	V	89	Confident	83.7	Confident	36 Å²	36	19.8 Å²	19.8	22%	0.218	10%	0.1	C	C	.	.	H	α-helix	trans	-59	-43.9	176.8	163	0	0	0	0	112.7	A200 I201 L202 S257 W261	V198-A200 VanDerWaalsContact C-N 3.34Å; V198-A200 PolarHBondContact O-N 3Å; V198-I201 PolarHBondContact O-N 3.09Å; V198-L202 HydrophobicContact CG1-CD1 3.63Å; V198-L202 HydrophobicContact CG1-CG 4.34Å; V198-L202 WeakPolarHBondContact O-CG 3.3Å; V198-L202 PolarHBondContact O-N 3.25Å; V198-S257 WeakPolarHBondContact CG2-OG 3.39Å; V198-S257 PolarHBondContact N-OG 3.35Å; V198-W261 HydrophobicContact CG1-CB 4.1Å
199	P	87.6	Confident	82.7	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-52.1	-42.7	168.2	-32.4	37.3	0	0	0	115.2	G196 T203 W260 Y264 Y565	G196-P199 WeakPolarHBondContact O-CB 3.49Å; G196-P199 WeakPolarHBondContact O-CD 3.33Å; P199-T203 VanDerWaalsContact O-CB 3.29Å; P199-T203 WeakPolarHBondContact O-CB 3.49Å; P199-T203 PolarHBondContact O-N 2.89Å; P199-T203 VanDerWaalsContact O-N 3.08Å; P199-T203 PolarHBondContact O-OG1 3.16Å; P199-W260 HydrophobicContact CG-CB 4.06Å; P199-W260 HydrophobicContact CG-CE3 4.39Å; P199-Y264 HydrophobicContact CB-CD1 4.49Å; P199-Y264 HydrophobicContact CB-CD2 3.91Å; P199-Y264 HydrophobicContact CB-CE1 4.23Å; P199-Y264 HydrophobicContact CB-CE2 3.64Å; P199-Y264 HydrophobicContact CB-CG 4.34Å; P199-Y264 HydrophobicContact CG-CD2 4.24Å; P199-Y264 HydrophobicContact CG-CE2 4Å; P199-Y565 HydrophobicContact CB-CD1 4.16Å; P199-Y565 HydrophobicContact CB-CE1 4.37Å; P199-Y565 HydrophobicContact CG-CD1 4.15Å; P199-Y565 HydrophobicContact CG-CG 4.46Å
200	A	87.5	Confident	81.9	Confident	2 Å²	2	30.4 Å²	30.4	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-65.7	-40.2	178.2	0	0	0	0	0	112	G196 L197 V198 P204 I224 Q227 T530	G196-A200 WeakPolarHBondContact O-CB 3.44Å; G196-A200 PolarHBondContact O-N 3.46Å; L197-A200 WeakPolarHBondContact O-CB 3.29Å; L197-A200 PolarHBondContact O-N 2.98Å; L197-A200 VanDerWaalsContact O-N 3.11Å; V198-A200 VanDerWaalsContact C-N 3.34Å; V198-A200 PolarHBondContact O-N 3Å; A200-P204 WeakPolarHBondContact O-CD 3.5Å; A200-I224 HydrophobicContact CB-CG1 3.99Å; A200-Q227 HydrophobicContact CB-CG 4.22Å; A200-T530 HydrophobicContact CB-CG2 3.9Å
201	I	89.3	Confident	81.1	Confident	67 Å²	67	42 Å²	42	34%	0.344	20%	0.204	S	C	.	.	H	α-helix	trans	-70	-42.3	179	-65.1	166.4	0	0	0	111.8	L197 V198 T203 P204 L205 I224	L197-I201 HydrophobicContact CD1-CD1 3.89Å; L197-I201 HydrophobicContact CD1-CG1 4.37Å; L197-I201 HydrophobicContact CG-CD1 4.09Å; L197-I201 WeakPolarHBondContact O-CG1 3.29Å; L197-I201 PolarHBondContact O-N 3.23Å; V198-I201 PolarHBondContact O-N 3.09Å; I201-T203 VanDerWaalsContact C-N 3.34Å; I201-P204 WeakPolarHBondContact O-CD 3.44Å; I201-L205 HydrophobicContact CG2-CD1 4.29Å; I201-L205 WeakPolarHBondContact O-CD1 3.22Å; I201-L205 WeakPolarHBondContact O-CG 3.46Å; I201-I224 HydrophobicContact CG1-CG1 4.29Å; I201-I224 HydrophobicContact CG1-CG2 4.26Å
202	L	87.1	Confident	80.7	Confident	17 Å²	17	50.5 Å²	50.5	9%	0.089	24%	0.236	C	C	.	.	H	α-helix	trans	-76.4	-20.5	-178.9	-67.9	171.2	0	0	0	113.4	V198 L205 S206 W261 Y264 V265	V198-L202 HydrophobicContact CG1-CD1 3.63Å; V198-L202 HydrophobicContact CG1-CG 4.34Å; V198-L202 WeakPolarHBondContact O-CG 3.3Å; V198-L202 PolarHBondContact O-N 3.25Å; L202-L205 HydrophobicContact CD2-CD1 4.4Å; L202-L205 PolarHBondContact O-N 3.13Å; L202-S206 PolarHBondContact O-N 3.33Å; L202-S206 PolarHBondContact O-OG 2.88Å; L202-W261 HydrophobicContact CD1-CB 4.02Å; L202-Y264 VanDerWaalsContact CB-CB 3.47Å; L202-V265 HydrophobicContact CD1-CG2 4.12Å; L202-V265 HydrophobicContact CD2-CG2 4.2Å
203	T	84.6	Confident	80.1	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.012	24%	0.242	C	C	.	.	H	α-helix	trans	-57.3	-53.7	179.5	-79.2	0	0	0	0	114.7	P199 I201 S206 Y264	P199-T203 VanDerWaalsContact O-CB 3.29Å; P199-T203 WeakPolarHBondContact O-CB 3.49Å; P199-T203 PolarHBondContact O-N 2.89Å; P199-T203 VanDerWaalsContact O-N 3.08Å; P199-T203 PolarHBondContact O-OG1 3.16Å; I201-T203 VanDerWaalsContact C-N 3.34Å; T203-S206 PolarHBondContact O-OG 3.07Å; T203-S206 VanDerWaalsContact O-OG 3.05Å; T203-Y264 VanDerWaalsContact OG1-CD1 3.23Å; T203-Y264 WeakPolarHBondContact OG1-CD1 3.47Å; T203-Y264 WeakPolarHBondContact OG1-CE1 3.4Å
204	P	83.9	Confident	79.7	Confident	27 Å²	27	59.6 Å²	59.6	18%	0.175	28%	0.277	C	S	.	.	H	α-helix	trans	-69.4	-37.4	177.4	24.2	-32.4	0	0	0	112.3	A200 I201 S206 R207 D220 I224	A200-P204 WeakPolarHBondContact O-CD 3.5Å; I201-P204 WeakPolarHBondContact O-CD 3.44Å; P204-S206 PolarHBondContact O-N 2.75Å; P204-S206 VanDerWaalsContact O-N 3.1Å; P204-R207 PolarHBondContact O-N 3.25Å; P204-R207 VanDerWaalsContact O-N 3.16Å; P204-D220 WeakPolarHBondContact CA-OD2 3.32Å; P204-D220 HydrophobicContact CB-CB 3.96Å; P204-D220 WeakPolarHBondContact CB-OD2 3.4Å; P204-D220 HydrophobicContact CG-CB 4.08Å; P204-I224 HydrophobicContact CG-CD1 4.19Å
205	L	82.8	Confident	79.7	Confident	56 Å²	56	64.1 Å²	64.1	29%	0.293	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-19.2	-178.7	-59.7	175.2	0	0	0	113.6	I201 L202 M271 V274	I201-L205 HydrophobicContact CG2-CD1 4.29Å; I201-L205 WeakPolarHBondContact O-CD1 3.22Å; I201-L205 WeakPolarHBondContact O-CG 3.46Å; L202-L205 HydrophobicContact CD2-CD1 4.4Å; L202-L205 PolarHBondContact O-N 3.13Å; L205-M271 HydrophobicContact CD2-CE 3.56Å; L205-M271 HydrophobicContact CD2-SD 3.87Å; L205-V274 HydrophobicContact CB-CG2 4.39Å
206	S	76.4	Confident	79.6	Confident	13 Å²	13	66.3 Å²	66.3	9%	0.091	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-2	-179.9	53.5	0	0	0	0	114.9	L202 T203 P204 Y264 R569	L202-S206 PolarHBondContact O-N 3.33Å; L202-S206 PolarHBondContact O-OG 2.88Å; T203-S206 PolarHBondContact O-OG 3.07Å; T203-S206 VanDerWaalsContact O-OG 3.05Å; P204-S206 PolarHBondContact O-N 2.75Å; P204-S206 VanDerWaalsContact O-N 3.1Å; S206-Y264 VanDerWaalsContact CB-O 3.27Å; S206-Y264 WeakPolarHBondContact CB-O 3.31Å; S206-Y264 PolarHBondContact OG-O 3.31Å; S206-Y264 VanDerWaalsContact OG-O 3.08Å; S206-R569 PolarHBondContact OG-NH1 3.1Å
207	R	73.6	Confident	79.5	Confident	56 Å²	56	68.6 Å²	68.6	21%	0.211	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-70.9	142.9	179.7	-68.8	-169	-172.9	-105.5	7	112.6	P204 D220	P204-R207 PolarHBondContact O-N 3.25Å; P204-R207 VanDerWaalsContact O-N 3.16Å; R207-D220 IonicContact CZ-OD1 3.32Å; R207-D220 IonicContact CZ-OD2 2.8Å; R207-D220 VanDerWaalsContact CZ-OD2 3.32Å; R207-D220 IonicContact NE-OD1 2.7Å; R207-D220 IonicContact NE-OD2 2.67Å; R207-D220 PolarHBondContact NE-OD2 3.42Å; R207-D220 VanDerWaalsContact NH2-CG 3.29Å; R207-D220 IonicContact NH2-OD1 3.1Å; R207-D220 PolarHBondContact NH2-OD1 3.27Å; R207-D220 IonicContact NH2-OD2 3.72Å; R207-D220 PolarHBondContact NH2-OD2 3Å; R207-D220 VanDerWaalsContact NH2-OD2 3.1Å
208	K	67.7	Low	79.4	Confident	102 Å²	102	70.4 Å²	70.4	44%	0.443	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-76.1	152	166.3	-61.5	165.6	-174.9	168.5	0	109.5	N213 D571	K208-N213 PolarHBondContact O-ND2 3.13Å; K208-N213 PolarHBondContact O-OD1 3.45Å; K208-D571 IonicContact NZ-OD2 3.7Å; K208-D571 PolarHBondContact NZ-OD2 3.06Å
209	L	61.3	Low	79.4	Confident	158 Å²	158	70.4 Å²	70.4	83%	0.827	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-68.7	135.4	173.7	-92.2	68.3	0	0	0	111.5
210	S	66.9	Low	79.3	Confident	65 Å²	65	70.5 Å²	70.5	46%	0.455	34%	0.337	S	S	.	.			trans	-151.7	164.2	173.1	83.3	0	0	0	0	110.2	W212 N213	S210-W212 PolarHBondContact O-N 3.41Å; S210-W212 PolarHBondContact OG-N 3.05Å; S210-N213 WeakPolarHBondContact CB-OD1 3.49Å; S210-N213 PolarHBondContact N-OD1 3.01Å; S210-N213 WeakPolarHBondContact O-CB 3.25Å; S210-N213 PolarHBondContact O-N 3.17Å; S210-N213 VanDerWaalsContact O-N 3.08Å; S210-N213 PolarHBondContact O-OD1 2.8Å; S210-N213 PolarHBondContact OG-OD1 3.41Å
211	R	66.4	Low	79.4	Confident	250 Å²	250	75.4 Å²	75.4	94%	0.943	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-29	178.9	-74.5	-175.3	175.7	171.1	-1.1	113.8
212	W	75.8	Confident	79.4	Confident	184 Å²	184	76.7 Å²	76.7	70%	0.697	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	4	-179.4	-65	112.2	0	0	0	113.8	S210 F214 I215 L216	S210-W212 PolarHBondContact O-N 3.41Å; S210-W212 PolarHBondContact OG-N 3.05Å; W212-F214 VanDerWaalsContact C-N 3.28Å; W212-F214 PolarHBondContact O-N 3.26Å; W212-I215 HydrophobicContact CE3-CD1 3.92Å; W212-I215 HydrophobicContact CZ3-CD1 3.94Å; W212-I215 PolarHBondContact O-N 3.04Å; W212-L216 HydrophobicContact CB-CD1 4.24Å; W212-L216 WeakPolarHBondContact O-CG 3.43Å; W212-L216 PolarHBondContact O-N 3.49Å
213	N	74.2	Confident	79.5	Confident	28 Å²	28	75.9 Å²	75.9	15%	0.15	37%	0.365	C	S	.	.	H	α-helix	trans	-60.5	-32.7	-174	-91.6	42	0	0	0	114.4	K208 S210 L216 V217	K208-N213 PolarHBondContact O-ND2 3.13Å; K208-N213 PolarHBondContact O-OD1 3.45Å; S210-N213 WeakPolarHBondContact CB-OD1 3.49Å; S210-N213 PolarHBondContact N-OD1 3.01Å; S210-N213 WeakPolarHBondContact O-CB 3.25Å; S210-N213 PolarHBondContact O-N 3.17Å; S210-N213 VanDerWaalsContact O-N 3.08Å; S210-N213 PolarHBondContact O-OD1 2.8Å; S210-N213 PolarHBondContact OG-OD1 3.41Å; N213-L216 PolarHBondContact O-N 3.25Å; N213-V217 WeakPolarHBondContact O-CB 3.14Å; N213-V217 VanDerWaalsContact O-CG2 3.27Å; N213-V217 WeakPolarHBondContact O-CG2 3.27Å; N213-V217 PolarHBondContact O-N 3.07Å
214	F	78.6	Confident	79.8	Confident	168 Å²	168	77.8 Å²	77.8	74%	0.737	37%	0.374	S	S	*	.	H	α-helix	trans	-58.4	-57.3	-179	-174.3	-98.2	0	0	0	110.6	W212 L216 V217 T218	W212-F214 VanDerWaalsContact C-N 3.28Å; W212-F214 PolarHBondContact O-N 3.26Å; F214-L216 VanDerWaalsContact C-N 3.33Å; F214-L216 PolarHBondContact O-N 3.39Å; F214-V217 PolarHBondContact O-N 2.6Å; F214-T218 PolarHBondContact O-N 3.17Å; F214-T218 PolarHBondContact O-OG1 3.4Å
215	I	84.2	Confident	79.9	Confident	95 Å²	95	78.7 Å²	78.7	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-58.4	-44.9	178.1	-54.2	-176.6	0	0	0	111.1	W212 V217 T218 V219	W212-I215 HydrophobicContact CE3-CD1 3.92Å; W212-I215 HydrophobicContact CZ3-CD1 3.94Å; W212-I215 PolarHBondContact O-N 3.04Å; I215-V217 VanDerWaalsContact C-N 3.31Å; I215-V217 PolarHBondContact O-N 3.02Å; I215-T218 WeakPolarHBondContact O-CB 3.32Å; I215-T218 PolarHBondContact O-N 2.69Å; I215-V219 WeakPolarHBondContact O-CG2 3.23Å; I215-V219 PolarHBondContact O-N 3.25Å
216	L	82.6	Confident	80.2	Confident	48 Å²	48	77.7 Å²	77.7	25%	0.251	38%	0.384	S	S	.	.	H	α-helix	trans	-61.7	-37.7	-179.9	-68.9	170.4	0	0	0	112.7	W212 N213 F214 D220 W529	W212-L216 HydrophobicContact CB-CD1 4.24Å; W212-L216 WeakPolarHBondContact O-CG 3.43Å; W212-L216 PolarHBondContact O-N 3.49Å; N213-L216 PolarHBondContact O-N 3.25Å; F214-L216 VanDerWaalsContact C-N 3.33Å; F214-L216 PolarHBondContact O-N 3.39Å; L216-D220 PolarHBondContact O-N 3.35Å; L216-D220 VanDerWaalsContact O-N 3.13Å; L216-W529 HydrophobicContact CD2-CH2 3.85Å; L216-W529 HydrophobicContact CD2-CZ2 3.98Å
217	V	82.5	Confident	80.7	Confident	48 Å²	48	77.2 Å²	77.2	29%	0.291	38%	0.38	S	S	.	.	H	α-helix	trans	-75.8	-34.1	176.1	170.8	0	0	0	0	111.4	N213 F214 I215 V219 D220 I221	N213-V217 WeakPolarHBondContact O-CB 3.14Å; N213-V217 VanDerWaalsContact O-CG2 3.27Å; N213-V217 WeakPolarHBondContact O-CG2 3.27Å; N213-V217 PolarHBondContact O-N 3.07Å; F214-V217 PolarHBondContact O-N 2.6Å; I215-V217 VanDerWaalsContact C-N 3.31Å; I215-V217 PolarHBondContact O-N 3.02Å; V217-V219 VanDerWaalsContact C-N 3.34Å; V217-V219 PolarHBondContact O-N 3.48Å; V217-D220 PolarHBondContact O-N 3.44Å; V217-I221 HydrophobicContact CG1-CD1 3.93Å; V217-I221 HydrophobicContact CG1-CG1 4.43Å; V217-I221 VanDerWaalsContact O-CG1 3.31Å; V217-I221 WeakPolarHBondContact O-CG1 3.43Å; V217-I221 PolarHBondContact O-N 2.92Å
218	T	85.9	Confident	81.2	Confident	57 Å²	57	77.5 Å²	77.5	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-59.1	-44.8	172	-47.9	0	0	0	0	111.3	F214 I215 I221 I222	F214-T218 PolarHBondContact O-N 3.17Å; F214-T218 PolarHBondContact O-OG1 3.4Å; I215-T218 WeakPolarHBondContact O-CB 3.32Å; I215-T218 PolarHBondContact O-N 2.69Å; T218-I221 PolarHBondContact O-N 3.03Å; T218-I222 HydrophobicContact CG2-CD1 4.35Å; T218-I222 WeakPolarHBondContact O-CG1 3.33Å; T218-I222 PolarHBondContact O-N 2.85Å; T218-I222 VanDerWaalsContact O-N 3.08Å
219	V	88.4	Confident	81.8	Confident	35 Å²	35	73.8 Å²	73.8	21%	0.212	37%	0.373	C	S	.	.	H	α-helix	trans	-67.8	-38.4	176.8	-176.6	0	0	0	0	111.6	I215 V217 I221 I222 C223 W529	I215-V219 WeakPolarHBondContact O-CG2 3.23Å; I215-V219 PolarHBondContact O-N 3.25Å; V217-V219 VanDerWaalsContact C-N 3.34Å; V217-V219 PolarHBondContact O-N 3.48Å; V219-I221 VanDerWaalsContact C-N 3.32Å; V219-I221 PolarHBondContact O-N 3.26Å; V219-I222 PolarHBondContact O-N 3.47Å; V219-C223 PolarHBondContact O-N 2.94Å; V219-W529 HydrophobicContact CB-CH2 4.33Å; V219-W529 HydrophobicContact CB-CZ2 3.75Å; V219-W529 HydrophobicContact CG1-CD2 3.64Å; V219-W529 HydrophobicContact CG1-CE3 4.11Å; V219-W529 HydrophobicContact CG1-CG 4.07Å; V219-W529 HydrophobicContact CG1-CH2 4.14Å; V219-W529 HydrophobicContact CG1-CZ2 3.67Å; V219-W529 HydrophobicContact CG1-CZ3 4.34Å; V219-W529 HydrophobicContact CG2-CZ2 4.47Å
220	D	86	Confident	82.4	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.011	33%	0.334	C	S	.	.	H	α-helix	trans	-58.6	-42.6	173.2	-68.9	-14.8	0	0	0	111.9	P204 R207 L216 V217 C223 I224 W529	P204-D220 WeakPolarHBondContact CA-OD2 3.32Å; P204-D220 HydrophobicContact CB-CB 3.96Å; P204-D220 WeakPolarHBondContact CB-OD2 3.4Å; P204-D220 HydrophobicContact CG-CB 4.08Å; R207-D220 IonicContact CZ-OD1 3.32Å; R207-D220 IonicContact CZ-OD2 2.8Å; R207-D220 VanDerWaalsContact CZ-OD2 3.32Å; R207-D220 IonicContact NE-OD1 2.7Å; R207-D220 IonicContact NE-OD2 2.67Å; R207-D220 PolarHBondContact NE-OD2 3.42Å; R207-D220 VanDerWaalsContact NH2-CG 3.29Å; R207-D220 IonicContact NH2-OD1 3.1Å; R207-D220 PolarHBondContact NH2-OD1 3.27Å; R207-D220 IonicContact NH2-OD2 3.72Å; R207-D220 PolarHBondContact NH2-OD2 3Å; R207-D220 VanDerWaalsContact NH2-OD2 3.1Å; L216-D220 PolarHBondContact O-N 3.35Å; L216-D220 VanDerWaalsContact O-N 3.13Å; V217-D220 PolarHBondContact O-N 3.44Å; D220-C223 WeakPolarHBondContact O-CB 3.16Å; D220-C223 PolarHBondContact O-N 3.38Å; D220-I224 WeakPolarHBondContact O-CG1 3.47Å; D220-I224 PolarHBondContact O-N 2.9Å; D220-W529 PolarHBondContact OD1-NE1 3.19Å
221	I	88.6	Confident	82.7	Confident	105 Å²	105	66.7 Å²	66.7	54%	0.538	33%	0.33	S	S	.	.	H	α-helix	trans	-64	-42.8	177.2	-69.2	164.4	0	0	0	111.3	V217 T218 V219 C223 I224 G225	V217-I221 HydrophobicContact CG1-CD1 3.93Å; V217-I221 HydrophobicContact CG1-CG1 4.43Å; V217-I221 VanDerWaalsContact O-CG1 3.31Å; V217-I221 WeakPolarHBondContact O-CG1 3.43Å; V217-I221 PolarHBondContact O-N 2.92Å; T218-I221 PolarHBondContact O-N 3.03Å; V219-I221 VanDerWaalsContact C-N 3.32Å; V219-I221 PolarHBondContact O-N 3.26Å; I221-C223 VanDerWaalsContact C-N 3.3Å; I221-C223 PolarHBondContact O-N 3.05Å; I221-I224 PolarHBondContact O-N 3.36Å; I221-G225 PolarHBondContact O-N 3.15Å
222	I	90	Very high	83.1	Confident	94 Å²	94	64.6 Å²	64.6	48%	0.482	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-42.2	174.9	-67.4	165	0	0	0	110.4	T218 V219 I224 G225 I226	T218-I222 HydrophobicContact CG2-CD1 4.35Å; T218-I222 WeakPolarHBondContact O-CG1 3.33Å; T218-I222 PolarHBondContact O-N 2.85Å; T218-I222 VanDerWaalsContact O-N 3.08Å; V219-I222 PolarHBondContact O-N 3.47Å; I222-I224 PolarHBondContact O-N 2.77Å; I222-G225 PolarHBondContact O-N 2.98Å; I222-I226 HydrophobicContact CG2-CD1 3.89Å; I222-I226 WeakPolarHBondContact O-CG1 3.27Å; I222-I226 PolarHBondContact O-N 2.85Å
223	C	90	Very high	82.8	Confident	1 Å²	1	59 Å²	59	1%	0.007	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-36.7	175.3	-79.3	0	0	0	0	113.6	V219 D220 I221 I226 Q227 S526 W529	V219-C223 PolarHBondContact O-N 2.94Å; D220-C223 WeakPolarHBondContact O-CB 3.16Å; D220-C223 PolarHBondContact O-N 3.38Å; I221-C223 VanDerWaalsContact C-N 3.3Å; I221-C223 PolarHBondContact O-N 3.05Å; C223-I226 PolarHBondContact O-N 3.4Å; C223-Q227 WeakPolarHBondContact O-CG 3.36Å; C223-Q227 PolarHBondContact O-N 2.99Å; C223-S526 PolarHBondContact O-OG 2.99Å; C223-W529 VanDerWaalsContact SG-CD1 3.58Å
224	I	89.3	Confident	82.5	Confident	41 Å²	41	60.3 Å²	60.3	21%	0.21	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-46.4	172.4	-67.5	161.4	0	0	0	110.2	A200 I201 P204 D220 I221 I222 I226 Q227 M228	A200-I224 HydrophobicContact CB-CG1 3.99Å; I201-I224 HydrophobicContact CG1-CG1 4.29Å; I201-I224 HydrophobicContact CG1-CG2 4.26Å; P204-I224 HydrophobicContact CG-CD1 4.19Å; D220-I224 WeakPolarHBondContact O-CG1 3.47Å; D220-I224 PolarHBondContact O-N 2.9Å; I221-I224 PolarHBondContact O-N 3.36Å; I222-I224 PolarHBondContact O-N 2.77Å; I224-I226 VanDerWaalsContact C-N 3.31Å; I224-I226 PolarHBondContact O-N 3.48Å; I224-Q227 PolarHBondContact O-N 3.34Å; I224-M228 HydrophobicContact CG2-CG 4.27Å; I224-M228 WeakPolarHBondContact O-CB 3.2Å; I224-M228 WeakPolarHBondContact O-CG 3.43Å; I224-M228 PolarHBondContact O-N 3.31Å
225	G	87.2	Confident	81.7	Confident	47 Å²	47	55.7 Å²	55.7	49%	0.485	30%	0.297	S	S	.	.	H	α-helix	trans	-57.6	-42.1	176.4	0	0	0	0	0	113.1	I221 I222 M228 A229	I221-G225 PolarHBondContact O-N 3.15Å; I222-G225 PolarHBondContact O-N 2.98Å; G225-M228 PolarHBondContact O-N 3.18Å; G225-A229 PolarHBondContact O-N 3.22Å
226	I	87.7	Confident	80.7	Confident	35 Å²	35	55 Å²	55	18%	0.179	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-44.3	176.8	-71.1	167	0	0	0	112.1	I222 C223 I224 M228 A229 A522 W523	I222-I226 HydrophobicContact CG2-CD1 3.89Å; I222-I226 WeakPolarHBondContact O-CG1 3.27Å; I222-I226 PolarHBondContact O-N 2.85Å; C223-I226 PolarHBondContact O-N 3.4Å; I224-I226 VanDerWaalsContact C-N 3.31Å; I224-I226 PolarHBondContact O-N 3.48Å; I226-M228 VanDerWaalsContact C-N 3.27Å; I226-M228 PolarHBondContact O-N 3.03Å; I226-A229 VanDerWaalsContact O-CB 3.23Å; I226-A229 WeakPolarHBondContact O-CB 3.34Å; I226-A229 PolarHBondContact O-N 3.15Å; I226-A522 HydrophobicContact CD1-CB 4.37Å; I226-A522 HydrophobicContact CG1-CB 4.45Å; I226-A522 HydrophobicContact CG2-CB 4.05Å; I226-A522 WeakPolarHBondContact CG2-O 3.42Å; I226-W523 PolarHBondContact O-NE1 3.17Å
227	Q	86.8	Confident	79.6	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.009	29%	0.289	C	S	.	.	H	α-helix	trans	-71.5	-21	177.3	-64.8	-71.8	-35.7	0	0	113	C194 L197 A200 C223 I224 A229 P230 S526	C194-Q227 PolarHBondContact O-OE1 3.06Å; C194-Q227 PolarHBondContact SG-O 2.96Å; L197-Q227 HydrophobicContact CB-CB 4.44Å; L197-Q227 HydrophobicContact CD1-CB 4.08Å; A200-Q227 HydrophobicContact CB-CG 4.22Å; C223-Q227 WeakPolarHBondContact O-CG 3.36Å; C223-Q227 PolarHBondContact O-N 2.99Å; I224-Q227 PolarHBondContact O-N 3.34Å; Q227-A229 VanDerWaalsContact C-N 3.32Å; Q227-P230 WeakPolarHBondContact O-CD 3.3Å; Q227-S526 VanDerWaalsContact CG-OG 3.31Å; Q227-S526 WeakPolarHBondContact CG-OG 3.44Å; Q227-S526 PolarHBondContact NE2-OG 2.65Å
228	M	85.3	Confident	78.5	Confident	62 Å²	62	52.5 Å²	52.5	31%	0.305	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-10	173.1	-71.2	-73.5	-78.2	0	0	113.2	L197 I224 G225 I226 P230 L231	L197-M228 HydrophobicContact CD1-CG 3.81Å; L197-M228 HydrophobicContact CD1-SD 3.54Å; L197-M228 VanDerWaalsContact CD1-SD 3.54Å; L197-M228 HydrophobicContact CD2-SD 3.89Å; L197-M228 HydrophobicContact CG-SD 4.36Å; I224-M228 HydrophobicContact CG2-CG 4.27Å; I224-M228 WeakPolarHBondContact O-CB 3.2Å; I224-M228 WeakPolarHBondContact O-CG 3.43Å; I224-M228 PolarHBondContact O-N 3.31Å; G225-M228 PolarHBondContact O-N 3.18Å; I226-M228 VanDerWaalsContact C-N 3.27Å; I226-M228 PolarHBondContact O-N 3.03Å; M228-P230 VanDerWaalsContact C-N 3.34Å; M228-P230 VanDerWaalsContact O-N 3.17Å; M228-L231 HydrophobicContact CE-CD1 3.43Å; M228-L231 VanDerWaalsContact CE-CD1 3.43Å; M228-L231 WeakPolarHBondContact O-CB 3.5Å; M228-L231 PolarHBondContact O-N 3.46Å; M228-L231 HydrophobicContact SD-CD1 3.6Å; M228-L231 VanDerWaalsContact SD-CD1 3.6Å
229	A	80.2	Confident	77	Confident	24 Å²	24	58.6 Å²	58.6	20%	0.198	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-52.7	-36.4	-175.1	0	0	0	0	0	115.5	G225 I226 Q227 L231 W232 L233 W523	G225-A229 PolarHBondContact O-N 3.22Å; I226-A229 VanDerWaalsContact O-CB 3.23Å; I226-A229 WeakPolarHBondContact O-CB 3.34Å; I226-A229 PolarHBondContact O-N 3.15Å; Q227-A229 VanDerWaalsContact C-N 3.32Å; A229-L231 PolarHBondContact O-N 3.02Å; A229-L231 VanDerWaalsContact O-N 3.11Å; A229-W232 PolarHBondContact O-N 2.83Å; A229-L233 WeakPolarHBondContact O-CB 3.38Å; A229-L233 PolarHBondContact O-N 2.99Å; A229-W523 HydrophobicContact CB-CZ2 4.49Å
230	P	73.4	Confident	75.4	Confident	4 Å²	4	61 Å²	61	3%	0.026	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-61.1	-17.9	176.6	-25	35.5	0	0	0	115.3	C194 Q227 M228 W234 W523	C194-P230 HydrophobicContact CB-CG 4.1Å; C194-P230 WeakPolarHBondContact SG-CD 3.41Å; C194-P230 WeakPolarHBondContact SG-CG 3.18Å; Q227-P230 WeakPolarHBondContact O-CD 3.3Å; M228-P230 VanDerWaalsContact C-N 3.34Å; M228-P230 VanDerWaalsContact O-N 3.17Å; P230-W234 WeakPolarHBondContact O-CB 3.48Å; P230-W523 HydrophobicContact CG-CZ2 4.3Å
231	L	73.9	Confident	73.7	Confident	70 Å²	70	64.1 Å²	64.1	37%	0.366	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-76.6	-22.7	174.7	-72.5	157.7	0	0	0	112.9	M228 A229 P250	M228-L231 HydrophobicContact CE-CD1 3.43Å; M228-L231 VanDerWaalsContact CE-CD1 3.43Å; M228-L231 WeakPolarHBondContact O-CB 3.5Å; M228-L231 PolarHBondContact O-N 3.46Å; M228-L231 HydrophobicContact SD-CD1 3.6Å; M228-L231 VanDerWaalsContact SD-CD1 3.6Å; A229-L231 PolarHBondContact O-N 3.02Å; A229-L231 VanDerWaalsContact O-N 3.11Å; L231-P250 HydrophobicContact CD2-CB 3.56Å; L231-P250 HydrophobicContact CD2-CG 4.3Å; L231-P250 HydrophobicContact CG-CB 3.99Å
232	W	74.2	Confident	72	Confident	206 Å²	206	62.7 Å²	62.7	78%	0.78	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	-28.3	-170.7	-54.1	84.4	0	0	0	113.3	A229	A229-W232 PolarHBondContact O-N 2.83Å
233	L	70.1	Confident	70.3	Confident	66 Å²	66	64.5 Å²	64.5	35%	0.346	37%	0.365	S	S	.	.	S	Bend	trans	-96.8	-6.3	-175.1	-146.6	81.3	0	0	0	113.8	A229 S235 T236 A519	A229-L233 WeakPolarHBondContact O-CB 3.38Å; A229-L233 PolarHBondContact O-N 2.99Å; L233-S235 PolarHBondContact O-N 2.9Å; L233-S235 VanDerWaalsContact O-N 3.14Å; L233-T236 PolarHBondContact O-N 3.29Å; L233-T236 PolarHBondContact O-OG1 3.18Å; L233-A519 HydrophobicContact CD2-CB 3.98Å
234	W	67.6	Low	68.6	Low	57 Å²	57	71 Å²	71	22%	0.216	40%	0.399	C	S	.	.	H	α-helix	trans	-60.6	-30	-167.6	66	-96.4	0	0	0	114.1	P230 T236 I237 L238 N246	P230-W234 WeakPolarHBondContact O-CB 3.48Å; W234-T236 PolarHBondContact O-N 3.46Å; W234-T236 VanDerWaalsContact O-N 3.16Å; W234-I237 WeakPolarHBondContact O-CB 3.07Å; W234-I237 PolarHBondContact O-N 2.96Å; W234-L238 PolarHBondContact O-N 3.17Å; W234-N246 HydrophobicContact CE3-CB 4.34Å; W234-N246 HydrophobicContact CH2-CB 3.44Å; W234-N246 VanDerWaalsContact CH2-CB 3.44Å; W234-N246 HydrophobicContact CZ2-CB 4.07Å; W234-N246 HydrophobicContact CZ3-CB 3.59Å; W234-N246 VanDerWaalsContact CZ3-OD1 3.28Å; W234-N246 WeakPolarHBondContact CZ3-OD1 3.38Å
235	S	62.6	Low	67.2	Low	70 Å²	70	71.8 Å²	71.8	49%	0.49	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-21.3	176.5	58.8	0	0	0	0	113.7	L233	L233-S235 PolarHBondContact O-N 2.9Å; L233-S235 VanDerWaalsContact O-N 3.14Å
236	T	61.7	Low	66.2	Low	82 Å²	82	71 Å²	71	50%	0.503	38%	0.383	S	S	.	.	H	α-helix	trans	-89.1	-17.6	173.1	69.9	0	0	0	0	113.4	L233 W234	L233-T236 PolarHBondContact O-N 3.29Å; L233-T236 PolarHBondContact O-OG1 3.18Å; W234-T236 PolarHBondContact O-N 3.46Å; W234-T236 VanDerWaalsContact O-N 3.16Å
237	I	60.2	Low	65.7	Low	12 Å²	12	78 Å²	78	6%	0.062	41%	0.408	C	S	.	.	H	α-helix	trans	-83.7	-33	-175.8	-50.1	-176.4	0	0	0	111	R187 W234 L516 W523	R187-I237 PolarHBondContact NH1-O 2.6Å; R187-I237 VanDerWaalsContact NH1-O 3.08Å; W234-I237 WeakPolarHBondContact O-CB 3.07Å; W234-I237 PolarHBondContact O-N 2.96Å; I237-L516 HydrophobicContact CD1-CD1 4.23Å; I237-L516 HydrophobicContact CG1-CD1 4.09Å; I237-L516 HydrophobicContact CG2-CD1 4.21Å; I237-W523 HydrophobicContact CD1-CH2 4.32Å
238	L	59.9	Low	65.4	Low	30 Å²	30	78.4 Å²	78.4	16%	0.157	41%	0.411	C	S	.	.			trans	-123.6	53.7	-172.3	-76.4	165	0	0	0	112.8	M183 W234 G240 P249	M183-L238 HydrophobicContact CG-CD2 4Å; M183-L238 HydrophobicContact SD-CD1 4.3Å; M183-L238 HydrophobicContact SD-CD2 4.12Å; M183-L238 HydrophobicContact SD-CG 4.33Å; W234-L238 PolarHBondContact O-N 3.17Å; L238-G240 PolarHBondContact O-N 2.61Å; L238-P249 HydrophobicContact CD1-CG 4.09Å
239	K	54.1	Low	65.1	Low	186 Å²	186	75.7 Å²	75.7	81%	0.809	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	117.9	164.7	-83.8	-170.2	171.3	-174.9	0	110.1
240	G	54.9	Low	65.3	Low	84 Å²	84	75 Å²	75	87%	0.866	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.3	9	166	0	0	0	0	0	117.5	L238	L238-G240 PolarHBondContact O-N 2.61Å
241	T	49.6	Very low	65.9	Low	69 Å²	69	79.5 Å²	79.5	42%	0.423	42%	0.416	S	S	.	.	S	Bend	trans	-121.9	150	176.9	50.9	0	0	0	0	111.9
242	S	53	Low	66.6	Low	75 Å²	75	76.2 Å²	76.2	52%	0.524	40%	0.398	S	S	.	.			trans	-66	158.6	-168	49.7	0	0	0	0	116	I244 Y245	S242-I244 PolarHBondContact O-N 2.97Å; S242-Y245 VanDerWaalsContact O-CD2 3.28Å; S242-Y245 WeakPolarHBondContact O-CD2 3.49Å; S242-Y245 PolarHBondContact O-N 2.65Å
243	D	54	Low	67.2	Low	131 Å²	131	66.7 Å²	66.7	70%	0.701	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-57.8	-20.3	-165.6	-63	-69.5	0	0	0	116.8	Y245 N246	D243-Y245 PolarHBondContact O-N 2.88Å; D243-N246 WeakPolarHBondContact CA-ND2 2.92Å; D243-N246 VanDerWaalsContact O-CB 3.26Å; D243-N246 WeakPolarHBondContact O-CB 3.46Å; D243-N246 PolarHBondContact O-N 2.98Å; D243-N246 PolarHBondContact O-ND2 2.83Å; D243-N246 PolarHBondContact OD1-ND2 3.38Å
244	I	54.3	Low	68.1	Low	139 Å²	139	65.4 Å²	65.4	71%	0.713	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-64.3	-28.1	177.5	-63	174.5	0	0	0	111.2	S242 N246	S242-I244 PolarHBondContact O-N 2.97Å; I244-N246 VanDerWaalsContact C-N 3.26Å; I244-N246 PolarHBondContact O-N 2.82Å
245	Y	60.5	Low	69.3	Low	57 Å²	57	64.6 Å²	64.6	22%	0.224	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-75.1	-11.1	179.9	-65	-68.1	0	0	0	114.1	H178 N182 S242 D243 W247 P249	H178-Y245 AromaticContact CE1-CD1 3.85Å; H178-Y245 AromaticContact CE1-CE1 3.46Å; H178-Y245 VanDerWaalsContact CE1-CE1 3.46Å; H178-Y245 WeakPolarHBondContact CE1-CE1 3.43Å; H178-Y245 AromaticContact NE2-CD1 3.39Å; H178-Y245 WeakPolarHBondContact NE2-CD1 3.2Å; H178-Y245 AromaticContact NE2-CE1 3.48Å; H178-Y245 WeakPolarHBondContact NE2-CE1 3.21Å; N182-Y245 WeakPolarHBondContact ND2-CE1 3.44Å; N182-Y245 VanDerWaalsContact ND2-CZ 3.26Å; N182-Y245 PolarHBondContact ND2-OH 2.84Å; S242-Y245 VanDerWaalsContact O-CD2 3.28Å; S242-Y245 WeakPolarHBondContact O-CD2 3.49Å; S242-Y245 PolarHBondContact O-N 2.65Å; D243-Y245 PolarHBondContact O-N 2.88Å; Y245-W247 PolarHBondContact O-N 3.24Å; Y245-P249 VanDerWaalsContact O-CD 3.23Å; Y245-P249 WeakPolarHBondContact O-CD 3.41Å
246	N	66.3	Low	70.6	Confident	29 Å²	29	61.3 Å²	61.3	16%	0.155	34%	0.338	C	S	.	.	S	Bend	trans	-64.1	-38.3	-167	-67.3	-6.6	0	0	0	114.1	W234 D243 I244	W234-N246 HydrophobicContact CE3-CB 4.34Å; W234-N246 HydrophobicContact CH2-CB 3.44Å; W234-N246 VanDerWaalsContact CH2-CB 3.44Å; W234-N246 HydrophobicContact CZ2-CB 4.07Å; W234-N246 HydrophobicContact CZ3-CB 3.59Å; W234-N246 VanDerWaalsContact CZ3-OD1 3.28Å; W234-N246 WeakPolarHBondContact CZ3-OD1 3.38Å; D243-N246 WeakPolarHBondContact CA-ND2 2.92Å; D243-N246 VanDerWaalsContact O-CB 3.26Å; D243-N246 WeakPolarHBondContact O-CB 3.46Å; D243-N246 PolarHBondContact O-N 2.98Å; D243-N246 PolarHBondContact O-ND2 2.83Å; D243-N246 PolarHBondContact OD1-ND2 3.38Å; I244-N246 VanDerWaalsContact C-N 3.26Å; I244-N246 PolarHBondContact O-N 2.82Å
247	W	77.8	Confident	72	Confident	183 Å²	183	57.4 Å²	57.4	69%	0.693	32%	0.315	S	S	*	.	S	Bend	trans	-101.1	-11.8	-174.6	-71.1	101.5	0	0	0	115.1	Y245 P250 L251	Y245-W247 PolarHBondContact O-N 3.24Å; W247-P250 WeakPolarHBondContact O-CD 3.43Å; W247-P250 WeakPolarHBondContact O-CG 3.12Å; W247-L251 WeakPolarHBondContact O-CB 3.43Å; W247-L251 PolarHBondContact O-N 3.09Å
248	A	80.3	Confident	73.4	Confident	10 Å²	10	58.7 Å²	58.7	8%	0.083	32%	0.323	C	S	.	.	H	α-helix	trans	-66.3	-41	-176.1	0	0	0	0	0	114.4	L174 L179 S252	L174-A248 HydrophobicContact CD1-CB 4.43Å; L174-A248 HydrophobicContact CD2-CB 4.28Å; L174-A248 HydrophobicContact CG-CB 4.46Å; L179-A248 HydrophobicContact CD2-CB 3.89Å; L179-A248 HydrophobicContact CG-CB 4.46Å; A248-S252 WeakPolarHBondContact O-CB 3.41Å; A248-S252 PolarHBondContact O-N 3.45Å
249	P	79.2	Confident	74.7	Confident	6 Å²	6	57.7 Å²	57.7	4%	0.039	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-54.1	178.7	-20.7	30.2	0	0	0	114.9	L179 L238 Y245 L251 S252 V253	L179-P249 HydrophobicContact CD2-CG 3.86Å; L238-P249 HydrophobicContact CD1-CG 4.09Å; Y245-P249 VanDerWaalsContact O-CD 3.23Å; Y245-P249 WeakPolarHBondContact O-CD 3.41Å; P249-L251 VanDerWaalsContact C-N 3.34Å; P249-L251 PolarHBondContact O-N 3.2Å; P249-S252 PolarHBondContact O-N 2.98Å; P249-V253 WeakPolarHBondContact O-CG2 3.46Å; P249-V253 PolarHBondContact O-N 2.76Å; P249-V253 VanDerWaalsContact O-N 3.12Å
250	P	83.1	Confident	76.3	Confident	10 Å²	10	49.1 Å²	49.1	7%	0.065	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-35.5	-179.8	25	-33.3	0	0	0	112.6	L231 W247 V253 A254	L231-P250 HydrophobicContact CD2-CB 3.56Å; L231-P250 HydrophobicContact CD2-CG 4.3Å; L231-P250 HydrophobicContact CG-CB 3.99Å; W247-P250 WeakPolarHBondContact O-CD 3.43Å; W247-P250 WeakPolarHBondContact O-CG 3.12Å; P250-V253 PolarHBondContact O-N 2.82Å; P250-A254 VanDerWaalsContact O-CB 3.29Å; P250-A254 WeakPolarHBondContact O-CB 3.33Å; P250-A254 PolarHBondContact O-N 2.95Å
251	L	87.4	Confident	77.9	Confident	98 Å²	98	46.1 Å²	46.1	51%	0.513	24%	0.244	S	C	.	.	H	α-helix	trans	-63.6	-47	177	-179.1	60.9	0	0	0	111.8	L174 W247 P249 L255	L174-L251 HydrophobicContact CD2-CD2 4.29Å; L174-L251 HydrophobicContact CD2-CG 4.38Å; W247-L251 WeakPolarHBondContact O-CB 3.43Å; W247-L251 PolarHBondContact O-N 3.09Å; P249-L251 VanDerWaalsContact C-N 3.34Å; P249-L251 PolarHBondContact O-N 3.2Å; L251-L255 HydrophobicContact CD1-CD1 3.89Å; L251-L255 HydrophobicContact CD1-CG 4.14Å; L251-L255 HydrophobicContact CG-CD1 3.94Å; L251-L255 WeakPolarHBondContact O-CB 3.38Å; L251-L255 VanDerWaalsContact O-CG 3.26Å; L251-L255 WeakPolarHBondContact O-CG 3.5Å; L251-L255 PolarHBondContact O-N 3.35Å
252	S	88.2	Confident	79.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.5	-51.2	175.9	174	0	0	0	0	111.5	G171 L175 A248 P249 A254 L255 I256	G171-S252 PolarHBondContact O-OG 3.28Å; L175-S252 WeakPolarHBondContact CB-OG 3.29Å; A248-S252 WeakPolarHBondContact O-CB 3.41Å; A248-S252 PolarHBondContact O-N 3.45Å; P249-S252 PolarHBondContact O-N 2.98Å; S252-A254 PolarHBondContact O-N 2.77Å; S252-L255 PolarHBondContact O-N 3.39Å; S252-I256 WeakPolarHBondContact O-CB 3.22Å; S252-I256 WeakPolarHBondContact O-CD1 3.26Å; S252-I256 VanDerWaalsContact O-CG1 3.22Å; S252-I256 WeakPolarHBondContact O-CG1 3.42Å; S252-I256 PolarHBondContact O-N 3.01Å
253	V	87.4	Confident	81.2	Confident	6 Å²	6	40.3 Å²	40.3	4%	0.036	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-43.1	-177	171.1	0	0	0	0	111.9	L191 C194 P249 P250 S257	L191-V253 HydrophobicContact CD1-CG2 4.46Å; L191-V253 HydrophobicContact CD2-CG2 4.01Å; L191-V253 HydrophobicContact CG-CG2 4.09Å; C194-V253 HydrophobicContact CB-CG1 4.29Å; C194-V253 WeakPolarHBondContact O-CG1 3.46Å; P249-V253 WeakPolarHBondContact O-CG2 3.46Å; P249-V253 PolarHBondContact O-N 2.76Å; P249-V253 VanDerWaalsContact O-N 3.12Å; P250-V253 PolarHBondContact O-N 2.82Å; V253-S257 PolarHBondContact O-N 3.36Å
254	A	88.4	Confident	82.7	Confident	39 Å²	39	34.1 Å²	34.1	32%	0.322	17%	0.171	S	C	.	.	H	α-helix	trans	-62.6	-49.1	176.9	0	0	0	0	0	111.8	P250 S252 I256 S257	P250-A254 VanDerWaalsContact O-CB 3.29Å; P250-A254 WeakPolarHBondContact O-CB 3.33Å; P250-A254 PolarHBondContact O-N 2.95Å; S252-A254 PolarHBondContact O-N 2.77Å; A254-I256 PolarHBondContact O-N 3.41Å; A254-S257 PolarHBondContact O-N 3.05Å; A254-S257 PolarHBondContact O-OG 2.88Å
255	L	91.6	Very high	84.2	Confident	41 Å²	41	28.5 Å²	28.5	22%	0.215	14%	0.143	C	C	.	.	H	α-helix	trans	-60.8	-42	179.6	-76.8	173.7	0	0	0	112.8	C167 L251 S252 S257 V258	C167-L255 HydrophobicContact CB-CD2 3.92Å; L251-L255 HydrophobicContact CD1-CD1 3.89Å; L251-L255 HydrophobicContact CD1-CG 4.14Å; L251-L255 HydrophobicContact CG-CD1 3.94Å; L251-L255 WeakPolarHBondContact O-CB 3.38Å; L251-L255 VanDerWaalsContact O-CG 3.26Å; L251-L255 WeakPolarHBondContact O-CG 3.5Å; L251-L255 PolarHBondContact O-N 3.35Å; S252-L255 PolarHBondContact O-N 3.39Å; L255-S257 VanDerWaalsContact C-N 3.31Å; L255-S257 PolarHBondContact O-N 3.35Å; L255-V258 PolarHBondContact O-N 2.95Å
256	I	90.7	Very high	85	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.3	-41.1	175.6	-71.2	166.2	0	0	0	111	Y168 V172 L175 T195 S252 A254 V258 W260 L558	Y168-I256 WeakPolarHBondContact CD2-O 3.14Å; Y168-I256 HydrophobicContact CE2-CG2 4.07Å; V172-I256 HydrophobicContact CG2-CD1 4.41Å; V172-I256 HydrophobicContact CG2-CG1 3.94Å; L175-I256 HydrophobicContact CB-CD1 4.21Å; L175-I256 HydrophobicContact CD2-CD1 3.82Å; T195-I256 HydrophobicContact CG2-CB 4.46Å; T195-I256 HydrophobicContact CG2-CG2 3.75Å; S252-I256 WeakPolarHBondContact O-CB 3.22Å; S252-I256 WeakPolarHBondContact O-CD1 3.26Å; S252-I256 VanDerWaalsContact O-CG1 3.22Å; S252-I256 WeakPolarHBondContact O-CG1 3.42Å; S252-I256 PolarHBondContact O-N 3.01Å; A254-I256 PolarHBondContact O-N 3.41Å; I256-V258 PolarHBondContact O-N 3.44Å; I256-V258 VanDerWaalsContact O-N 3.15Å; I256-W260 HydrophobicContact CG2-CH2 3.75Å; I256-W260 HydrophobicContact CG2-CZ3 3.96Å; I256-L558 HydrophobicContact CD1-CD1 4.34Å; I256-L558 HydrophobicContact CG2-CD1 3.62Å
257	S	91.1	Very high	85.4	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.007	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-21.5	-174.8	78.5	0	0	0	0	114.3	T195 V198 V253 A254 L255 A259	T195-S257 WeakPolarHBondContact O-CA 3.16Å; T195-S257 WeakPolarHBondContact O-CB 3.36Å; V198-S257 WeakPolarHBondContact CG2-OG 3.39Å; V198-S257 PolarHBondContact N-OG 3.35Å; V253-S257 PolarHBondContact O-N 3.36Å; A254-S257 PolarHBondContact O-N 3.05Å; A254-S257 PolarHBondContact O-OG 2.88Å; L255-S257 VanDerWaalsContact C-N 3.31Å; L255-S257 PolarHBondContact O-N 3.35Å; S257-A259 VanDerWaalsContact C-N 3.33Å; S257-A259 PolarHBondContact O-N 3.2Å
258	V	90	Very high	85	Confident	38 Å²	38	26.8 Å²	26.8	23%	0.23	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-59.4	-39	-177.1	178.4	0	0	0	0	112.4	T164 L255 I256 W260 W261	T164-V258 HydrophobicContact CG2-CG1 4.29Å; L255-V258 PolarHBondContact O-N 2.95Å; I256-V258 PolarHBondContact O-N 3.44Å; I256-V258 VanDerWaalsContact O-N 3.15Å; V258-W260 PolarHBondContact O-N 3.13Å; V258-W261 WeakPolarHBondContact O-CB 3.46Å; V258-W261 VanDerWaalsContact O-CD1 3.24Å; V258-W261 PolarHBondContact O-N 3.44Å; V258-W261 VanDerWaalsContact O-N 3.13Å
259	A	86.1	Confident	84.8	Confident	9 Å²	9	26.5 Å²	26.5	7%	0.074	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-58.5	-25.4	-170.7	0	0	0	0	0	114.9	Y168 S257 L551	Y168-A259 HydrophobicContact CD2-CB 3.36Å; Y168-A259 HydrophobicContact CE2-CB 3.95Å; Y168-A259 HydrophobicContact CG-CB 3.78Å; S257-A259 VanDerWaalsContact C-N 3.33Å; S257-A259 PolarHBondContact O-N 3.2Å; A259-L551 HydrophobicContact CB-CD1 4.46Å
260	W	87.7	Confident	84.6	Confident	7 Å²	7	30.3 Å²	30.3	3%	0.027	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-92.7	5.9	-175.9	-55.7	-61.3	0	0	0	114.3	T195 P199 I256 V258 E262 N263 Y565	T195-W260 WeakPolarHBondContact O-CZ3 3.29Å; P199-W260 HydrophobicContact CG-CB 4.06Å; P199-W260 HydrophobicContact CG-CE3 4.39Å; I256-W260 HydrophobicContact CG2-CH2 3.75Å; I256-W260 HydrophobicContact CG2-CZ3 3.96Å; V258-W260 PolarHBondContact O-N 3.13Å; W260-E262 VanDerWaalsContact C-N 3.27Å; W260-E262 PolarHBondContact O-N 3.31Å; W260-N263 PolarHBondContact O-N 2.93Å; W260-Y565 HydrophobicContact CD2-CD2 4.11Å; W260-Y565 HydrophobicContact CD2-CG 4.18Å; W260-Y565 AromaticContact CE3-CD2 3.9Å; W260-Y565 HydrophobicContact CE3-CD2 3.9Å; W260-Y565 HydrophobicContact CE3-CG 4.22Å; W260-Y565 HydrophobicContact CG-CG 4.49Å; W260-Y565 HydrophobicContact CH2-CD2 4.12Å; W260-Y565 HydrophobicContact CZ2-CD2 4.31Å; W260-Y565 AromaticContact CZ3-CD2 3.9Å; W260-Y565 HydrophobicContact CZ3-CD2 3.9Å; W260-Y565 HydrophobicContact CZ3-CE2 4.42Å
261	W	89.6	Confident	84.5	Confident	20 Å²	20	34.2 Å²	34.2	8%	0.076	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-53.5	-39.9	-175.4	76.9	-99.1	0	0	0	113.6	V198 L202 V258 N263 Y264 V265 M277 A281 L284	V198-W261 HydrophobicContact CG1-CB 4.1Å; L202-W261 HydrophobicContact CD1-CB 4.02Å; V258-W261 WeakPolarHBondContact O-CB 3.46Å; V258-W261 VanDerWaalsContact O-CD1 3.24Å; V258-W261 PolarHBondContact O-N 3.44Å; V258-W261 VanDerWaalsContact O-N 3.13Å; W261-N263 PolarHBondContact O-N 3.29Å; W261-N263 VanDerWaalsContact O-N 3.12Å; W261-Y264 PolarHBondContact O-N 3.07Å; W261-V265 HydrophobicContact CE3-CG2 4.24Å; W261-V265 WeakPolarHBondContact O-CG2 3.18Å; W261-M277 HydrophobicContact CD2-CE 4.16Å; W261-M277 HydrophobicContact CE3-CE 3.51Å; W261-M277 HydrophobicContact CZ3-CB 3.98Å; W261-M277 HydrophobicContact CZ3-CE 3.89Å; W261-A281 HydrophobicContact CH2-CB 3.96Å; W261-A281 HydrophobicContact CZ3-CB 4.07Å; W261-L284 HydrophobicContact CH2-CD1 4.25Å; W261-L284 HydrophobicContact CZ2-CD1 3.92Å
262	E	86.3	Confident	84.3	Confident	15 Å²	15	39.7 Å²	39.7	7%	0.07	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-58.7	-27.1	-176	-72.3	-171.9	-173.7	0	0	113.5	W260 A281 R288 V550	W260-E262 VanDerWaalsContact C-N 3.27Å; W260-E262 PolarHBondContact O-N 3.31Å; E262-A281 HydrophobicContact CB-CB 4.18Å; E262-A281 HydrophobicContact CG-CB 3.87Å; E262-R288 IonicContact OE1-CZ 3.03Å; E262-R288 IonicContact OE1-NH1 2.8Å; E262-R288 IonicContact OE1-NH2 3.29Å; E262-R288 PolarHBondContact OE1-NH2 2.82Å; E262-R288 IonicContact OE2-CZ 3.82Å; E262-R288 VanDerWaalsContact OE2-CZ 3.31Å; E262-R288 IonicContact OE2-NH1 3.38Å; E262-R288 PolarHBondContact OE2-NH1 2.84Å; E262-R288 IonicContact OE2-NH2 3.42Å; E262-R288 PolarHBondContact OE2-NH2 2.82Å; E262-V550 HydrophobicContact CB-CG1 3.54Å; E262-V550 HydrophobicContact CG-CG1 4.43Å; E262-V550 WeakPolarHBondContact OE2-CG1 3.31Å
263	N	85.4	Confident	84.2	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.037	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-81.5	-23.3	-174.4	-165.6	24	0	0	0	113.9	W260 W261 V550 Y565 Q567 W568 R569	W260-N263 PolarHBondContact O-N 2.93Å; W261-N263 PolarHBondContact O-N 3.29Å; W261-N263 VanDerWaalsContact O-N 3.12Å; N263-V550 HydrophobicContact CB-CG2 3.82Å; N263-Y565 PolarHBondContact ND2-O 3.02Å; N263-Q567 PolarHBondContact ND2-O 2.79Å; N263-Q567 PolarHBondContact OD1-O 2.77Å; N263-W568 VanDerWaalsContact OD1-CA 3.3Å; N263-W568 WeakPolarHBondContact OD1-CA 3.32Å; N263-R569 PolarHBondContact OD1-N 3.44Å
264	Y	85.7	Confident	84.1	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.008	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-103.5	17.2	-171.1	-69.1	-90	0	0	0	113.1	P199 L202 T203 S206 W261 T530	P199-Y264 HydrophobicContact CB-CD1 4.49Å; P199-Y264 HydrophobicContact CB-CD2 3.91Å; P199-Y264 HydrophobicContact CB-CE1 4.23Å; P199-Y264 HydrophobicContact CB-CE2 3.64Å; P199-Y264 HydrophobicContact CB-CG 4.34Å; P199-Y264 HydrophobicContact CG-CD2 4.24Å; P199-Y264 HydrophobicContact CG-CE2 4Å; L202-Y264 VanDerWaalsContact CB-CB 3.47Å; T203-Y264 VanDerWaalsContact OG1-CD1 3.23Å; T203-Y264 WeakPolarHBondContact OG1-CD1 3.47Å; T203-Y264 WeakPolarHBondContact OG1-CE1 3.4Å; S206-Y264 VanDerWaalsContact CB-O 3.27Å; S206-Y264 WeakPolarHBondContact CB-O 3.31Å; S206-Y264 PolarHBondContact OG-O 3.31Å; S206-Y264 VanDerWaalsContact OG-O 3.08Å; W261-Y264 PolarHBondContact O-N 3.07Å; Y264-T530 PolarHBondContact OH-O 2.87Å
265	V	84.7	Confident	83.9	Confident	20 Å²	20	49.6 Å²	49.6	12%	0.121	23%	0.234	C	C	.	.			trans	-121.1	136.8	-170.7	168.3	0	0	0	0	109.8	L202 W261 V274 M277 A278	L202-V265 HydrophobicContact CD1-CG2 4.12Å; L202-V265 HydrophobicContact CD2-CG2 4.2Å; W261-V265 HydrophobicContact CE3-CG2 4.24Å; W261-V265 WeakPolarHBondContact O-CG2 3.18Å; V265-V274 HydrophobicContact CB-CG1 4.44Å; V265-V274 HydrophobicContact CG1-CG1 3.95Å; V265-V274 WeakPolarHBondContact CG1-O 2.98Å; V265-M277 HydrophobicContact CG1-CB 3.66Å; V265-M277 HydrophobicContact CG2-CB 4.47Å; V265-M277 HydrophobicContact CG2-CE 4.36Å; V265-A278 HydrophobicContact CG1-CB 3.74Å
266	S	78.8	Confident	83.7	Confident	40 Å²	40	51.5 Å²	51.5	28%	0.28	25%	0.25	S	S	.	.			trans	-141.1	137.1	-173.7	-171.6	0	0	0	0	114.4	K268 S269	S266-K268 PolarHBondContact O-N 3.2Å; S266-K268 VanDerWaalsContact O-N 3.17Å; S266-K268 PolarHBondContact OG-N 3.48Å; S266-S269 WeakPolarHBondContact O-CB 3.43Å; S266-S269 PolarHBondContact O-N 2.99Å; S266-S269 PolarHBondContact O-OG 3.18Å
267	H	73.7	Confident	83.5	Confident	88 Å²	88	53.2 Å²	53.2	41%	0.407	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-20	170.6	-71.9	-89	0	0	0	113.9	R275 A278 T279	H267-R275 VanDerWaalsContact O-CD 3.29Å; H267-R275 WeakPolarHBondContact O-CD 3.48Å; H267-R275 WeakPolarHBondContact O-CG 3.5Å; H267-A278 VanDerWaalsContact CD2-CB 3.44Å; H267-A278 WeakPolarHBondContact CD2-CB 3.41Å; H267-A278 WeakPolarHBondContact NE2-CB 3.41Å; H267-T279 PolarHBondContact CE1-N 2.89Å; H267-T279 PolarHBondContact CE1-OG1 2.78Å; H267-T279 VanDerWaalsContact CE1-OG1 3.23Å
268	K	70.9	Confident	83.2	Confident	106 Å²	106	53.5 Å²	53.5	46%	0.461	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	9.6	-178.8	-66.2	176	179.3	169.4	0	113.4	S266	S266-K268 PolarHBondContact O-N 3.2Å; S266-K268 VanDerWaalsContact O-N 3.17Å; S266-K268 PolarHBondContact OG-N 3.48Å
269	S	75.3	Confident	82.8	Confident	4 Å²	4	54.2 Å²	54.2	3%	0.028	27%	0.266	C	S	.	.	S	Bend	trans	-74.8	149.9	173.9	59.6	0	0	0	0	111.9	S266 M271 V274 R275	S266-S269 WeakPolarHBondContact O-CB 3.43Å; S266-S269 PolarHBondContact O-N 2.99Å; S266-S269 PolarHBondContact O-OG 3.18Å; S269-M271 VanDerWaalsContact C-N 3.32Å; S269-M271 PolarHBondContact O-N 3.16Å; S269-V274 WeakPolarHBondContact OG-CB 3.31Å; S269-V274 VanDerWaalsContact OG-CG1 3.26Å; S269-V274 WeakPolarHBondContact OG-CG1 3.31Å; S269-R275 VanDerWaalsContact O-CD 3.31Å; S269-R275 WeakPolarHBondContact O-CD 3.19Å; S269-R275 PolarHBondContact O-NE 3.49Å; S269-R275 VanDerWaalsContact O-NE 3.09Å
270	P	74.8	Confident	82.9	Confident	85 Å²	85	55.6 Å²	55.6	55%	0.552	27%	0.272	S	S	*	.	S	Bend	trans	-67.7	-31.4	178	26.4	-33.6	0	0	0	112.5	R275	P270-R275 PolarHBondContact O-NH2 3.08Å
271	M	80.5	Confident	82.7	Confident	93 Å²	93	55.8 Å²	55.8	46%	0.458	27%	0.274	S	S	.	.			trans	-74.4	138.2	-175.2	-60.5	-167.8	-178.5	0	0	112.6	L205 S269 V274 R275	L205-M271 HydrophobicContact CD2-CE 3.56Å; L205-M271 HydrophobicContact CD2-SD 3.87Å; S269-M271 VanDerWaalsContact C-N 3.32Å; S269-M271 PolarHBondContact O-N 3.16Å; M271-V274 HydrophobicContact CB-CB 4.44Å; M271-V274 HydrophobicContact CB-CG2 4.13Å; M271-R275 WeakPolarHBondContact O-CG 3.33Å; M271-R275 PolarHBondContact O-N 3.33Å; M271-R275 PolarHBondContact O-NE 2.72Å
272	R	82.9	Confident	82.1	Confident	213 Å²	213	60 Å²	60	80%	0.804	30%	0.295	S	S	*	.	H	α-helix	trans	-67.7	-39.1	177.6	-70.1	-176.1	177.8	-179.3	-1	112.4	R275 S276	R272-R275 PolarHBondContact O-N 3.42Å; R272-S276 PolarHBondContact O-N 2.76Å
273	F	86.9	Confident	81.9	Confident	150 Å²	150	64.5 Å²	64.5	66%	0.658	31%	0.314	S	S	*	.	H	α-helix	trans	-59.1	-51.7	-180	177.1	-112.4	0	0	0	112.5	R275 S276 M277	F273-R275 VanDerWaalsContact C-N 3.29Å; F273-R275 PolarHBondContact O-N 2.94Å; F273-S276 WeakPolarHBondContact O-CA 3.3Å; F273-S276 WeakPolarHBondContact O-CB 3.46Å; F273-S276 PolarHBondContact O-N 3.23Å; F273-M277 HydrophobicContact CD1-SD 3.93Å; F273-M277 HydrophobicContact CE1-CG 4.38Å; F273-M277 HydrophobicContact CE1-SD 3.33Å; F273-M277 WeakPolarHBondContact CE1-SD 3.36Å; F273-M277 HydrophobicContact CE2-CG 4.4Å; F273-M277 HydrophobicContact CE2-SD 4.26Å; F273-M277 HydrophobicContact CZ-CG 4.22Å; F273-M277 HydrophobicContact CZ-SD 3.52Å; F273-M277 VanDerWaalsContact CZ-SD 3.52Å; F273-M277 PolarHBondContact O-N 3.03Å
274	V	84.9	Confident	81.6	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-60.4	-36.8	178	-179.1	0	0	0	0	111.6	L205 V265 S269 M271 M277 A278	L205-V274 HydrophobicContact CB-CG2 4.39Å; V265-V274 HydrophobicContact CB-CG1 4.44Å; V265-V274 HydrophobicContact CG1-CG1 3.95Å; V265-V274 WeakPolarHBondContact CG1-O 2.98Å; S269-V274 WeakPolarHBondContact OG-CB 3.31Å; S269-V274 VanDerWaalsContact OG-CG1 3.26Å; S269-V274 WeakPolarHBondContact OG-CG1 3.31Å; M271-V274 HydrophobicContact CB-CB 4.44Å; M271-V274 HydrophobicContact CB-CG2 4.13Å; V274-M277 PolarHBondContact O-N 3.4Å; V274-A278 PolarHBondContact O-N 3.41Å
275	R	84.4	Confident	81.1	Confident	101 Å²	101	68.2 Å²	68.2	38%	0.381	33%	0.328	S	S	.	.	H	α-helix	trans	-66.4	-35.5	173.8	-69.6	-174.8	-88.7	164.7	-14.2	113.2	H267 S269 P270 M271 R272 F273 A278 T279	H267-R275 VanDerWaalsContact O-CD 3.29Å; H267-R275 WeakPolarHBondContact O-CD 3.48Å; H267-R275 WeakPolarHBondContact O-CG 3.5Å; S269-R275 VanDerWaalsContact O-CD 3.31Å; S269-R275 WeakPolarHBondContact O-CD 3.19Å; S269-R275 PolarHBondContact O-NE 3.49Å; S269-R275 VanDerWaalsContact O-NE 3.09Å; P270-R275 PolarHBondContact O-NH2 3.08Å; M271-R275 WeakPolarHBondContact O-CG 3.33Å; M271-R275 PolarHBondContact O-N 3.33Å; M271-R275 PolarHBondContact O-NE 2.72Å; R272-R275 PolarHBondContact O-N 3.42Å; F273-R275 VanDerWaalsContact C-N 3.29Å; F273-R275 PolarHBondContact O-N 2.94Å; R275-A278 PolarHBondContact O-N 2.77Å; R275-T279 PolarHBondContact O-N 3.13Å; R275-T279 PolarHBondContact O-OG1 2.69Å
276	S	86.4	Confident	80.6	Confident	80 Å²	80	72.1 Å²	72.1	56%	0.559	35%	0.345	S	S	*	.	H	α-helix	trans	-64.9	-47.8	172.7	-168.7	0	0	0	0	111.3	R272 F273 A278 T279 L280	R272-S276 PolarHBondContact O-N 2.76Å; F273-S276 WeakPolarHBondContact O-CA 3.3Å; F273-S276 WeakPolarHBondContact O-CB 3.46Å; F273-S276 PolarHBondContact O-N 3.23Å; S276-A278 VanDerWaalsContact C-N 3.31Å; S276-A278 PolarHBondContact O-N 3Å; S276-T279 WeakPolarHBondContact O-CB 3.41Å; S276-T279 PolarHBondContact O-N 3.04Å; S276-T279 VanDerWaalsContact O-N 3.13Å; S276-L280 PolarHBondContact O-N 2.83Å
277	M	88.3	Confident	80.3	Confident	37 Å²	37	70.4 Å²	70.4	18%	0.182	33%	0.334	C	S	.	.	H	α-helix	trans	-58	-39.6	176	-68.3	-179.3	75.2	0	0	112.7	W261 V265 F273 V274 T279 L280 A281	W261-M277 HydrophobicContact CD2-CE 4.16Å; W261-M277 HydrophobicContact CE3-CE 3.51Å; W261-M277 HydrophobicContact CZ3-CB 3.98Å; W261-M277 HydrophobicContact CZ3-CE 3.89Å; V265-M277 HydrophobicContact CG1-CB 3.66Å; V265-M277 HydrophobicContact CG2-CB 4.47Å; V265-M277 HydrophobicContact CG2-CE 4.36Å; F273-M277 HydrophobicContact CD1-SD 3.93Å; F273-M277 HydrophobicContact CE1-CG 4.38Å; F273-M277 HydrophobicContact CE1-SD 3.33Å; F273-M277 WeakPolarHBondContact CE1-SD 3.36Å; F273-M277 HydrophobicContact CE2-CG 4.4Å; F273-M277 HydrophobicContact CE2-SD 4.26Å; F273-M277 HydrophobicContact CZ-CG 4.22Å; F273-M277 HydrophobicContact CZ-SD 3.52Å; F273-M277 VanDerWaalsContact CZ-SD 3.52Å; F273-M277 PolarHBondContact O-N 3.03Å; V274-M277 PolarHBondContact O-N 3.4Å; M277-T279 VanDerWaalsContact C-N 3.33Å; M277-T279 PolarHBondContact O-N 3.21Å; M277-L280 PolarHBondContact O-N 3.33Å; M277-A281 PolarHBondContact O-N 2.99Å
278	A	83.2	Confident	80.7	Confident	7 Å²	7	67.2 Å²	67.2	6%	0.058	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-44.8	176.8	0	0	0	0	0	111.6	V265 H267 V274 R275 S276 L280 A281 Q282	V265-A278 HydrophobicContact CG1-CB 3.74Å; H267-A278 VanDerWaalsContact CD2-CB 3.44Å; H267-A278 WeakPolarHBondContact CD2-CB 3.41Å; H267-A278 WeakPolarHBondContact NE2-CB 3.41Å; V274-A278 PolarHBondContact O-N 3.41Å; R275-A278 PolarHBondContact O-N 2.77Å; S276-A278 VanDerWaalsContact C-N 3.31Å; S276-A278 PolarHBondContact O-N 3Å; A278-L280 VanDerWaalsContact C-N 3.3Å; A278-L280 PolarHBondContact O-N 2.91Å; A278-A281 PolarHBondContact O-N 3.24Å; A278-Q282 PolarHBondContact O-N 2.85Å
279	T	83.3	Confident	81.2	Confident	53 Å²	53	62.7 Å²	62.7	33%	0.325	30%	0.3	S	S	.	.	H	α-helix	trans	-63.5	-36.9	178	-47.3	0	0	0	0	111.6	H267 R275 S276 M277 K283	H267-T279 PolarHBondContact CE1-N 2.89Å; H267-T279 PolarHBondContact CE1-OG1 2.78Å; H267-T279 VanDerWaalsContact CE1-OG1 3.23Å; R275-T279 PolarHBondContact O-N 3.13Å; R275-T279 PolarHBondContact O-OG1 2.69Å; S276-T279 WeakPolarHBondContact O-CB 3.41Å; S276-T279 PolarHBondContact O-N 3.04Å; S276-T279 VanDerWaalsContact O-N 3.13Å; M277-T279 VanDerWaalsContact C-N 3.33Å; M277-T279 PolarHBondContact O-N 3.21Å; T279-K283 WeakPolarHBondContact O-CG 3.5Å; T279-K283 PolarHBondContact O-N 3.45Å
280	L	86.6	Confident	81.6	Confident	38 Å²	38	65.5 Å²	65.5	20%	0.199	31%	0.312	C	S	.	.	H	α-helix	trans	-68.1	-46.5	175.9	-177.3	54.2	0	0	0	111.8	F156 T160 S276 M277 A278 Q282 K283 L284	F156-L280 HydrophobicContact CD1-CD1 4.38Å; F156-L280 HydrophobicContact CE1-CD1 3.91Å; F156-L280 HydrophobicContact CE1-CD2 4.38Å; T160-L280 HydrophobicContact CG2-CD2 4.17Å; S276-L280 PolarHBondContact O-N 2.83Å; M277-L280 PolarHBondContact O-N 3.33Å; A278-L280 VanDerWaalsContact C-N 3.3Å; A278-L280 PolarHBondContact O-N 2.91Å; L280-Q282 VanDerWaalsContact C-N 3.33Å; L280-Q282 PolarHBondContact O-N 3.34Å; L280-K283 PolarHBondContact O-N 2.98Å; L280-K283 VanDerWaalsContact O-N 3.13Å; L280-L284 HydrophobicContact CD1-CD1 4.34Å; L280-L284 HydrophobicContact CD1-CG 4.36Å; L280-L284 HydrophobicContact CG-CD1 3.99Å; L280-L284 WeakPolarHBondContact O-CG 3.31Å; L280-L284 PolarHBondContact O-N 2.96Å
281	A	83.7	Confident	82.2	Confident	10 Å²	10	61.6 Å²	61.6	8%	0.083	29%	0.286	C	S	.	.	H	α-helix	trans	-58.1	-42.5	175.3	0	0	0	0	0	112.3	W261 E262 M277 A278 K283 L284 R285	W261-A281 HydrophobicContact CH2-CB 3.96Å; W261-A281 HydrophobicContact CZ3-CB 4.07Å; E262-A281 HydrophobicContact CB-CB 4.18Å; E262-A281 HydrophobicContact CG-CB 3.87Å; M277-A281 PolarHBondContact O-N 2.99Å; A278-A281 PolarHBondContact O-N 3.24Å; A281-K283 VanDerWaalsContact C-N 3.32Å; A281-K283 PolarHBondContact O-N 3.5Å; A281-L284 PolarHBondContact O-N 3.34Å; A281-R285 WeakPolarHBondContact O-CB 3.04Å; A281-R285 PolarHBondContact O-N 2.99Å; A281-R285 VanDerWaalsContact O-N 3.1Å
282	Q	78.4	Confident	82.6	Confident	109 Å²	109	57.7 Å²	57.7	51%	0.509	27%	0.266	S	S	.	.	H	α-helix	trans	-62.3	-37	176.1	-171.2	-178.8	-1.2	0	0	112.7	A278 L280	A278-Q282 PolarHBondContact O-N 2.85Å; L280-Q282 VanDerWaalsContact C-N 3.33Å; L280-Q282 PolarHBondContact O-N 3.34Å
283	K	80.4	Confident	82.8	Confident	110 Å²	110	48.9 Å²	48.9	48%	0.478	24%	0.237	S	C	.	.	H	α-helix	trans	-73.4	-43.1	176.7	-72.2	176.1	178.6	-178.7	0	112.3	T279 L280 A281 R285 Q286	T279-K283 WeakPolarHBondContact O-CG 3.5Å; T279-K283 PolarHBondContact O-N 3.45Å; L280-K283 PolarHBondContact O-N 2.98Å; L280-K283 VanDerWaalsContact O-N 3.13Å; A281-K283 VanDerWaalsContact C-N 3.32Å; A281-K283 PolarHBondContact O-N 3.5Å; K283-R285 VanDerWaalsContact C-N 3.29Å; K283-R285 PolarHBondContact O-N 2.87Å; K283-Q286 PolarHBondContact O-N 3.18Å; K283-Q286 VanDerWaalsContact O-N 3.15Å
284	L	80	Confident	83	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.037	23%	0.227	C	C	.	.	H	α-helix	trans	-53.4	-45.5	174.7	-76.8	164	0	0	0	111.9	H157 A161 W261 L280 A281 Q286 G287 R288	H157-L284 HydrophobicContact CB-CD2 3.98Å; H157-L284 WeakPolarHBondContact O-CD2 3.47Å; A161-L284 HydrophobicContact CB-CD2 4.08Å; W261-L284 HydrophobicContact CH2-CD1 4.25Å; W261-L284 HydrophobicContact CZ2-CD1 3.92Å; L280-L284 HydrophobicContact CD1-CD1 4.34Å; L280-L284 HydrophobicContact CD1-CG 4.36Å; L280-L284 HydrophobicContact CG-CD1 3.99Å; L280-L284 WeakPolarHBondContact O-CG 3.31Å; L280-L284 PolarHBondContact O-N 2.96Å; A281-L284 PolarHBondContact O-N 3.34Å; L284-Q286 PolarHBondContact O-N 3.46Å; L284-Q286 VanDerWaalsContact O-N 3.15Å; L284-G287 PolarHBondContact O-N 3.44Å; L284-G287 VanDerWaalsContact O-N 3.16Å; L284-R288 PolarHBondContact O-N 3.18Å
285	R	75.8	Confident	83.2	Confident	79 Å²	79	45.2 Å²	45.2	30%	0.298	23%	0.226	S	C	.	.	H	α-helix	trans	-56.1	-28.8	179.2	-163.6	179.7	-174.9	-177.9	7.4	114	A281 K283 D546 W568	A281-R285 WeakPolarHBondContact O-CB 3.04Å; A281-R285 PolarHBondContact O-N 2.99Å; A281-R285 VanDerWaalsContact O-N 3.1Å; K283-R285 VanDerWaalsContact C-N 3.29Å; K283-R285 PolarHBondContact O-N 2.87Å; R285-D546 PolarHBondContact NE-O 3.21Å; R285-D546 PolarHBondContact NH2-O 2.93Å; R285-W568 VanDerWaalsContact NH1-CH2 3.35Å; R285-W568 VanDerWaalsContact NH2-CZ2 3.29Å
286	Q	72.7	Confident	83.5	Confident	103 Å²	103	40.4 Å²	40.4	48%	0.481	21%	0.208	S	C	.	.	H	α-helix	trans	-74.3	-34.8	179.2	-61.8	-170.3	24.1	0	0	113.4	K283 L284	K283-Q286 PolarHBondContact O-N 3.18Å; K283-Q286 VanDerWaalsContact O-N 3.15Å; L284-Q286 PolarHBondContact O-N 3.46Å; L284-Q286 VanDerWaalsContact O-N 3.15Å
287	G	74.3	Confident	83.8	Confident	4 Å²	4	40.1 Å²	40.1	4%	0.041	20%	0.2	C	C	.	.	H	α-helix	trans	-93.3	-2.8	179.4	0	0	0	0	0	114.4	L284 S289 K290 V291	L284-G287 PolarHBondContact O-N 3.44Å; L284-G287 VanDerWaalsContact O-N 3.16Å; G287-S289 PolarHBondContact O-N 3.03Å; G287-K290 PolarHBondContact O-N 3.27Å; G287-V291 PolarHBondContact O-N 3.18Å
288	R	81.5	Confident	84.1	Confident	21 Å²	21	42.9 Å²	42.9	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-51.5	-47.5	-161.5	176.9	154	-86.3	147.9	11.4	114.7	E262 L284 K290 V291 Y292 V550	E262-R288 IonicContact OE1-CZ 3.03Å; E262-R288 IonicContact OE1-NH1 2.8Å; E262-R288 IonicContact OE1-NH2 3.29Å; E262-R288 PolarHBondContact OE1-NH2 2.82Å; E262-R288 IonicContact OE2-CZ 3.82Å; E262-R288 VanDerWaalsContact OE2-CZ 3.31Å; E262-R288 IonicContact OE2-NH1 3.38Å; E262-R288 PolarHBondContact OE2-NH1 2.84Å; E262-R288 IonicContact OE2-NH2 3.42Å; E262-R288 PolarHBondContact OE2-NH2 2.82Å; L284-R288 PolarHBondContact O-N 3.18Å; R288-K290 VanDerWaalsContact C-N 3.31Å; R288-K290 PolarHBondContact O-N 2.98Å; R288-V291 PolarHBondContact O-N 3Å; R288-Y292 HydrophobicContact CG-CD2 3.75Å; R288-Y292 HydrophobicContact CG-CE2 3.76Å; R288-Y292 WeakPolarHBondContact O-CD2 3.06Å; R288-Y292 PolarHBondContact O-N 3.01Å; R288-V550 PolarHBondContact NH1-O 3.38Å
289	S	80.5	Confident	84.5	Confident	11 Å²	11	42.9 Å²	42.9	8%	0.077	21%	0.207	C	C	.	.	H	α-helix	trans	-63.8	-33.9	-178.6	55.9	0	0	0	0	113.6	G287 Y292 V293	G287-S289 PolarHBondContact O-N 3.03Å; S289-Y292 PolarHBondContact O-N 3.46Å; S289-V293 PolarHBondContact O-N 3.39Å
290	K	84.4	Confident	84.9	Confident	62 Å²	62	41.4 Å²	41.4	27%	0.27	20%	0.198	S	C	.	.	H	α-helix	trans	-72.7	-34.9	176.8	-76.7	-179.1	171.2	174	0	112.6	I145 V150 G287 R288	I145-K290 HydrophobicContact CD1-CB 4.44Å; I145-K290 HydrophobicContact CD1-CG 3.67Å; I145-K290 HydrophobicContact CG1-CG 3.86Å; V150-K290 WeakPolarHBondContact O-CE 3.35Å; V150-K290 PolarHBondContact O-NZ 3.49Å; G287-K290 PolarHBondContact O-N 3.27Å; R288-K290 VanDerWaalsContact C-N 3.31Å; R288-K290 PolarHBondContact O-N 2.98Å
291	V	88	Confident	85.3	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.024	21%	0.212	C	C	.	.	H	α-helix	trans	-64.5	-46.6	171.8	177.6	0	0	0	0	110.5	P153 F158 A161 G287 R288 V293 V294 V295	P153-V291 HydrophobicContact CB-CG2 3.98Å; P153-V291 HydrophobicContact CG-CG2 3.85Å; F158-V291 HydrophobicContact CD2-CB 4.47Å; F158-V291 HydrophobicContact CD2-CG1 4.11Å; F158-V291 HydrophobicContact CD2-CG2 4.27Å; F158-V291 HydrophobicContact CE2-CG1 4.47Å; A161-V291 HydrophobicContact CB-CG1 3.72Å; G287-V291 PolarHBondContact O-N 3.18Å; R288-V291 PolarHBondContact O-N 3Å; V291-V293 PolarHBondContact O-N 3.1Å; V291-V294 PolarHBondContact O-N 3.38Å; V291-V295 HydrophobicContact CG1-CG2 3.74Å; V291-V295 WeakPolarHBondContact O-CG2 3.37Å; V291-V295 PolarHBondContact O-N 3.49Å
292	Y	87.8	Confident	85.8	Confident	10 Å²	10	44.2 Å²	44.2	4%	0.039	21%	0.214	C	C	.	.	H	α-helix	trans	-73.3	-24.5	-169.8	-82.4	-112.6	0	0	0	114	E165 R288 S289 V294 V295 S296 L551	E165-Y292 VanDerWaalsContact OE1-CE1 3.25Å; E165-Y292 WeakPolarHBondContact OE1-CE1 3.36Å; E165-Y292 PolarHBondContact OE1-OH 2.91Å; R288-Y292 HydrophobicContact CG-CD2 3.75Å; R288-Y292 HydrophobicContact CG-CE2 3.76Å; R288-Y292 WeakPolarHBondContact O-CD2 3.06Å; R288-Y292 PolarHBondContact O-N 3.01Å; S289-Y292 PolarHBondContact O-N 3.46Å; Y292-V294 PolarHBondContact O-N 3Å; Y292-V295 PolarHBondContact O-N 3.39Å; Y292-S296 WeakPolarHBondContact O-CB 3.14Å; Y292-S296 PolarHBondContact O-N 2.73Å; Y292-S296 PolarHBondContact O-OG 2.94Å; Y292-L551 WeakPolarHBondContact OH-CD2 3.42Å
293	V	87.6	Confident	86.5	Confident	29 Å²	29	39.1 Å²	39.1	18%	0.176	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-37.3	171	170.3	0	0	0	0	112	T138 C141 F142 I145 S289 V291 L297	T138-V293 HydrophobicContact CG2-CG1 4.25Å; C141-V293 HydrophobicContact CB-CG2 3.61Å; F142-V293 HydrophobicContact CB-CG2 4.44Å; I145-V293 HydrophobicContact CD1-CG2 3.7Å; S289-V293 PolarHBondContact O-N 3.39Å; V291-V293 PolarHBondContact O-N 3.1Å; V293-L297 WeakPolarHBondContact O-CD1 3.27Å; V293-L297 WeakPolarHBondContact O-CG 3.5Å
294	V	90.4	Very high	87	Confident	75 Å²	75	35.7 Å²	35.7	46%	0.455	18%	0.182	S	C	.	.	H	α-helix	trans	-83.4	-45.5	176.7	-177.5	0	0	0	0	110.8	F158 V291 Y292 L297 W298	F158-V294 HydrophobicContact CE2-CB 4.18Å; F158-V294 HydrophobicContact CE2-CG1 4.31Å; F158-V294 HydrophobicContact CZ-CB 4.44Å; F158-V294 HydrophobicContact CZ-CG1 4.07Å; V291-V294 PolarHBondContact O-N 3.38Å; Y292-V294 PolarHBondContact O-N 3Å; V294-L297 PolarHBondContact O-N 3.17Å; V294-W298 PolarHBondContact O-N 3.3Å
295	V	90.6	Very high	87.6	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.1	-38.3	-174	172.6	0	0	0	0	112.7	F158 F162 E165 V291 Y292 W298 K299	F158-V295 HydrophobicContact CE2-CG2 4.48Å; F162-V295 HydrophobicContact CB-CG2 4.43Å; F162-V295 HydrophobicContact CD2-CG2 4.13Å; E165-V295 HydrophobicContact CB-CG1 3.49Å; E165-V295 VanDerWaalsContact CB-CG1 3.49Å; E165-V295 HydrophobicContact CG-CG1 3.92Å; V291-V295 HydrophobicContact CG1-CG2 3.74Å; V291-V295 WeakPolarHBondContact O-CG2 3.37Å; V291-V295 PolarHBondContact O-N 3.49Å; Y292-V295 PolarHBondContact O-N 3.39Å; V295-W298 PolarHBondContact O-N 3.27Å; V295-K299 WeakPolarHBondContact O-CG 3.35Å; V295-K299 PolarHBondContact O-N 3.38Å
296	S	90.2	Very high	88.4	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.4	-37.6	178.2	58.7	0	0	0	0	112.2	E134 T138 Y292 K299 V300	E134-S296 WeakPolarHBondContact O-CB 3.3Å; E134-S296 PolarHBondContact O-OG 3.04Å; E134-S296 WeakPolarHBondContact OE2-CB 3.42Å; T138-S296 PolarHBondContact OG1-OG 2.92Å; Y292-S296 WeakPolarHBondContact O-CB 3.14Å; Y292-S296 PolarHBondContact O-N 2.73Å; Y292-S296 PolarHBondContact O-OG 2.94Å; S296-K299 WeakPolarHBondContact O-CB 3.31Å; S296-K299 PolarHBondContact O-N 2.67Å; S296-V300 PolarHBondContact O-N 3.2Å
297	L	91.7	Very high	89.2	Confident	73 Å²	73	31.5 Å²	31.5	38%	0.382	18%	0.176	S	C	.	.	H	α-helix	trans	-65.1	-41.6	171.8	-66.5	176.9	0	0	0	111.9	F135 T138 V293 V294 K299 V300 V301	F135-L297 HydrophobicContact CD1-CD2 4.33Å; F135-L297 HydrophobicContact CE1-CD2 4.06Å; T138-L297 HydrophobicContact CG2-CD1 4.07Å; T138-L297 HydrophobicContact CG2-CD2 4.09Å; T138-L297 HydrophobicContact CG2-CG 3.95Å; V293-L297 WeakPolarHBondContact O-CD1 3.27Å; V293-L297 WeakPolarHBondContact O-CG 3.5Å; V294-L297 PolarHBondContact O-N 3.17Å; L297-K299 VanDerWaalsContact C-N 3.29Å; L297-K299 PolarHBondContact O-N 3.47Å; L297-V300 PolarHBondContact O-N 2.93Å; L297-V300 VanDerWaalsContact O-N 3.14Å; L297-V301 PolarHBondContact O-N 3.45Å; L297-V301 VanDerWaalsContact O-N 3.14Å
298	W	94.6	Very high	89.9	Confident	95 Å²	95	33.6 Å²	33.6	36%	0.36	19%	0.188	S	C	.	.	H	α-helix	trans	-60.3	-36.5	174.8	177.2	-115.5	0	0	0	112.8	F162 T166 V294 V295 V301 L302	F162-W298 AromaticContact CE1-NE1 3.86Å; F162-W298 HydrophobicContact CE2-CB 4.24Å; F162-W298 AromaticContact CE2-CD1 3.45Å; F162-W298 VanDerWaalsContact CE2-CD1 3.45Å; F162-W298 HydrophobicContact CE2-CD2 4.07Å; F162-W298 AromaticContact CE2-CG 3.66Å; F162-W298 HydrophobicContact CE2-CG 3.66Å; F162-W298 AromaticContact CE2-NE1 3.72Å; F162-W298 AromaticContact CZ-CD1 3.55Å; F162-W298 AromaticContact CZ-CD2 3.91Å; F162-W298 HydrophobicContact CZ-CD2 3.91Å; F162-W298 AromaticContact CZ-CE2 3.54Å; F162-W298 AromaticContact CZ-CG 3.92Å; F162-W298 HydrophobicContact CZ-CG 3.92Å; F162-W298 HydrophobicContact CZ-CZ2 4.16Å; F162-W298 AromaticContact CZ-NE1 3.27Å; F162-W298 VanDerWaalsContact CZ-NE1 3.27Å; T166-W298 PolarHBondContact OG1-NE1 3.13Å; V294-W298 PolarHBondContact O-N 3.3Å; V295-W298 PolarHBondContact O-N 3.27Å; W298-V301 HydrophobicContact CE3-CB 4.35Å; W298-V301 HydrophobicContact CE3-CG1 4.37Å; W298-V301 HydrophobicContact CZ3-CG1 4.17Å; W298-V301 PolarHBondContact O-N 2.91Å; W298-L302 HydrophobicContact CZ2-CD1 4.38Å; W298-L302 HydrophobicContact CZ2-CG 4.29Å; W298-L302 PolarHBondContact O-N 2.87Å
299	K	92.4	Very high	90.3	Very high	8 Å²	8	37.4 Å²	37.4	4%	0.035	21%	0.21	C	C	.	.	H	α-helix	trans	-62.4	-41.7	172.7	-68.5	179.4	172.8	179.4	0	112.9	E134 E165 A169 V295 S296 L297 V301 L302 Y303	E134-K299 HydrophobicContact CG-CB 4.37Å; E134-K299 HydrophobicContact CG-CD 4.08Å; E134-K299 WeakPolarHBondContact OE1-CD 3.22Å; E134-K299 IonicContact OE1-NZ 2.6Å; E134-K299 PolarHBondContact OE1-NZ 2.84Å; E134-K299 IonicContact OE2-NZ 2.68Å; E165-K299 IonicContact OE1-NZ 3.89Å; E165-K299 WeakPolarHBondContact OE2-CE 3.37Å; E165-K299 IonicContact OE2-NZ 3.44Å; E165-K299 PolarHBondContact OE2-NZ 3Å; A169-K299 HydrophobicContact CB-CB 4.23Å; A169-K299 HydrophobicContact CB-CG 3.88Å; V295-K299 WeakPolarHBondContact O-CG 3.35Å; V295-K299 PolarHBondContact O-N 3.38Å; S296-K299 WeakPolarHBondContact O-CB 3.31Å; S296-K299 PolarHBondContact O-N 2.67Å; L297-K299 VanDerWaalsContact C-N 3.29Å; L297-K299 PolarHBondContact O-N 3.47Å; K299-V301 VanDerWaalsContact C-N 3.3Å; K299-V301 PolarHBondContact O-N 3.39Å; K299-L302 WeakPolarHBondContact O-CB 3.39Å; K299-L302 PolarHBondContact O-N 2.89Å; K299-L302 VanDerWaalsContact O-N 3.17Å; K299-Y303 HydrophobicContact CB-CE2 3.93Å; K299-Y303 WeakPolarHBondContact O-CD2 3.38Å; K299-Y303 PolarHBondContact O-N 3.23Å
300	V	92.4	Very high	90.5	Very high	22 Å²	22	38.3 Å²	38.3	13%	0.133	21%	0.212	C	C	.	.	H	α-helix	trans	-60.7	-41.9	176.2	176.9	0	0	0	0	110.6	E134 F135 S296 L297 Y303 A304	E134-V300 HydrophobicContact CB-CG2 4.03Å; F135-V300 HydrophobicContact CD2-CG2 4.24Å; F135-V300 HydrophobicContact CE2-CG1 3.85Å; F135-V300 HydrophobicContact CE2-CG2 4.05Å; F135-V300 HydrophobicContact CZ-CG1 4.12Å; S296-V300 PolarHBondContact O-N 3.2Å; L297-V300 PolarHBondContact O-N 2.93Å; L297-V300 VanDerWaalsContact O-N 3.14Å; V300-Y303 PolarHBondContact O-N 2.86Å; V300-A304 WeakPolarHBondContact O-CB 3.13Å; V300-A304 PolarHBondContact O-N 3.43Å
301	V	94.5	Very high	90.4	Very high	83 Å²	83	35.5 Å²	35.5	50%	0.503	20%	0.201	S	C	.	.	H	α-helix	trans	-62.5	-42.2	173.6	177.3	0	0	0	0	111.7	L297 W298 K299 A304 A305	L297-V301 PolarHBondContact O-N 3.45Å; L297-V301 VanDerWaalsContact O-N 3.14Å; W298-V301 HydrophobicContact CE3-CB 4.35Å; W298-V301 HydrophobicContact CE3-CG1 4.37Å; W298-V301 HydrophobicContact CZ3-CG1 4.17Å; W298-V301 PolarHBondContact O-N 2.91Å; K299-V301 VanDerWaalsContact C-N 3.3Å; K299-V301 PolarHBondContact O-N 3.39Å; V301-A304 PolarHBondContact O-N 3.44Å; V301-A305 WeakPolarHBondContact O-CB 3.43Å; V301-A305 PolarHBondContact O-N 3.31Å
302	L	93.8	Very high	90.1	Very high	23 Å²	23	38.2 Å²	38.2	12%	0.12	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-44	174.6	-89.9	165.9	0	0	0	112.7	T166 A169 W298 K299 A304 A305 F306	T166-L302 HydrophobicContact CG2-CD1 3.93Å; A169-L302 HydrophobicContact CB-CB 4.39Å; A169-L302 HydrophobicContact CB-CD1 4.12Å; W298-L302 HydrophobicContact CZ2-CD1 4.38Å; W298-L302 HydrophobicContact CZ2-CG 4.29Å; W298-L302 PolarHBondContact O-N 2.87Å; K299-L302 WeakPolarHBondContact O-CB 3.39Å; K299-L302 PolarHBondContact O-N 2.89Å; K299-L302 VanDerWaalsContact O-N 3.17Å; L302-A304 VanDerWaalsContact C-N 3.34Å; L302-A304 PolarHBondContact O-N 3.2Å; L302-A305 PolarHBondContact O-N 3.2Å; L302-F306 HydrophobicContact CD2-CE2 4.32Å; L302-F306 VanDerWaalsContact O-CD2 3.29Å; L302-F306 WeakPolarHBondContact O-CD2 3.47Å; L302-F306 PolarHBondContact O-N 2.84Å
303	Y	92.9	Very high	89.7	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-45.9	175.3	-58.1	-40.1	0	0	0	110.3	M127 V130 E134 A169 V172 K299 V300 A305 F306 A307	M127-Y303 WeakPolarHBondContact CE-O 3.12Å; V130-Y303 HydrophobicContact CB-CD2 4.43Å; V130-Y303 HydrophobicContact CG1-CD1 4.1Å; V130-Y303 HydrophobicContact CG1-CD2 3.64Å; V130-Y303 HydrophobicContact CG1-CE1 4.01Å; V130-Y303 HydrophobicContact CG1-CE2 3.57Å; V130-Y303 HydrophobicContact CG1-CG 3.94Å; E134-Y303 HydrophobicContact CG-CE2 4.21Å; A169-Y303 HydrophobicContact CB-CE1 3.76Å; V172-Y303 HydrophobicContact CB-CE1 4.14Å; V172-Y303 HydrophobicContact CG1-CE1 3.86Å; K299-Y303 HydrophobicContact CB-CE2 3.93Å; K299-Y303 WeakPolarHBondContact O-CD2 3.38Å; K299-Y303 PolarHBondContact O-N 3.23Å; V300-Y303 PolarHBondContact O-N 2.86Å; Y303-A305 PolarHBondContact O-N 2.84Å; Y303-F306 PolarHBondContact O-N 3.47Å; Y303-A307 WeakPolarHBondContact O-CB 3.38Å; Y303-A307 PolarHBondContact O-N 3.29Å
304	A	91.5	Very high	89.1	Confident	38 Å²	38	43.5 Å²	43.5	31%	0.314	25%	0.245	S	C	.	.	H	α-helix	trans	-57.8	-45.2	176.4	0	0	0	0	0	112.4	V300 V301 L302 F306 A307 V308	V300-A304 WeakPolarHBondContact O-CB 3.13Å; V300-A304 PolarHBondContact O-N 3.43Å; V301-A304 PolarHBondContact O-N 3.44Å; L302-A304 VanDerWaalsContact C-N 3.34Å; L302-A304 PolarHBondContact O-N 3.2Å; A304-F306 PolarHBondContact O-N 3.12Å; A304-A307 PolarHBondContact O-N 3.2Å; A304-V308 WeakPolarHBondContact O-CG2 3.21Å; A304-V308 PolarHBondContact O-N 3.04Å
305	A	92.7	Very high	88.5	Confident	55 Å²	55	40.5 Å²	40.5	46%	0.455	23%	0.226	S	C	.	.	H	α-helix	trans	-59.4	-44.7	174.9	0	0	0	0	0	112.1	V301 L302 Y303 L309	V301-A305 WeakPolarHBondContact O-CB 3.43Å; V301-A305 PolarHBondContact O-N 3.31Å; L302-A305 PolarHBondContact O-N 3.2Å; Y303-A305 PolarHBondContact O-N 2.84Å; A305-L309 WeakPolarHBondContact O-CB 3.36Å; A305-L309 PolarHBondContact O-N 2.99Å
306	F	91.9	Very high	87.9	Confident	39 Å²	39	46 Å²	46	17%	0.171	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-39.2	177.4	-89.4	-110.8	0	0	0	113	A170 G173 L174 F177 L302 Y303 A304 F310	A170-F306 HydrophobicContact CB-CE2 4.18Å; A170-F306 HydrophobicContact CB-CZ 3.82Å; A170-F306 WeakPolarHBondContact O-CE1 3.48Å; G173-F306 VanDerWaalsContact C-CD1 3.49Å; L174-F306 HydrophobicContact CB-CE1 4.07Å; F177-F306 HydrophobicContact CD2-CB 4.24Å; L302-F306 HydrophobicContact CD2-CE2 4.32Å; L302-F306 VanDerWaalsContact O-CD2 3.29Å; L302-F306 WeakPolarHBondContact O-CD2 3.47Å; L302-F306 PolarHBondContact O-N 2.84Å; Y303-F306 PolarHBondContact O-N 3.47Å; A304-F306 PolarHBondContact O-N 3.12Å; F306-F310 HydrophobicContact CD1-CD2 4.33Å; F306-F310 AromaticContact CD1-CE2 3.78Å; F306-F310 HydrophobicContact CD1-CE2 3.78Å; F306-F310 HydrophobicContact CE1-CE2 4.23Å; F306-F310 VanDerWaalsContact O-CD2 3.27Å; F306-F310 WeakPolarHBondContact O-CD2 2.88Å; F306-F310 PolarHBondContact O-N 3.06Å; F306-F310 VanDerWaalsContact O-N 3.09Å
307	A	89.1	Confident	87.3	Confident	7 Å²	7	50 Å²	50	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-65.7	-45.7	177.6	0	0	0	0	0	111.7	M127 F177 Y303 A304 A311	M127-A307 HydrophobicContact CE-CB 3.29Å; F177-A307 HydrophobicContact CD1-CB 3.84Å; F177-A307 HydrophobicContact CD2-CB 4.04Å; F177-A307 HydrophobicContact CE1-CB 3.72Å; F177-A307 HydrophobicContact CE2-CB 3.94Å; F177-A307 HydrophobicContact CG-CB 4.01Å; F177-A307 HydrophobicContact CZ-CB 3.8Å; Y303-A307 WeakPolarHBondContact O-CB 3.38Å; Y303-A307 PolarHBondContact O-N 3.29Å; A304-A307 PolarHBondContact O-N 3.2Å; A307-A311 WeakPolarHBondContact O-CB 3.09Å; A307-A311 PolarHBondContact O-N 3.43Å
308	V	89	Confident	86.4	Confident	48 Å²	48	49.5 Å²	49.5	29%	0.291	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-48.3	175.2	175.6	0	0	0	0	110.4	A304 F310 A311 T312 L320 F321	A304-V308 WeakPolarHBondContact O-CG2 3.21Å; A304-V308 PolarHBondContact O-N 3.04Å; V308-F310 VanDerWaalsContact C-N 3.27Å; V308-F310 PolarHBondContact O-N 2.9Å; V308-A311 PolarHBondContact O-N 3.39Å; V308-T312 HydrophobicContact CG1-CG2 4.28Å; V308-T312 WeakPolarHBondContact O-CG2 3.24Å; V308-T312 PolarHBondContact O-N 3.06Å; V308-T312 PolarHBondContact O-OG1 2.86Å; V308-L320 HydrophobicContact CG1-CD2 4.39Å; V308-L320 HydrophobicContact CG2-CD2 4.26Å; V308-F321 HydrophobicContact CG2-CZ 4.26Å
309	L	89.2	Confident	85.3	Confident	102 Å²	102	47.9 Å²	47.9	53%	0.534	29%	0.289	S	S	.	.	H	α-helix	trans	-56.8	-36.4	-178.9	-173.7	74.8	0	0	0	113.5	A305 T312	A305-L309 WeakPolarHBondContact O-CB 3.36Å; A305-L309 PolarHBondContact O-N 2.99Å; L309-T312 PolarHBondContact O-OG1 3.42Å
310	F	85.6	Confident	84.5	Confident	30 Å²	30	47.6 Å²	47.6	13%	0.132	29%	0.288	C	S	.	.	H	α-helix	trans	-97.4	-11.8	178.8	-67.9	-59.2	0	0	0	114.5	L174 F177 H178 F306 V308 T313	L174-F310 HydrophobicContact CD1-CE2 3.89Å; L174-F310 HydrophobicContact CD1-CZ 3.7Å; F177-F310 HydrophobicContact CB-CB 4.06Å; F177-F310 HydrophobicContact CB-CD2 4.21Å; H178-F310 HydrophobicContact CB-CD1 4.02Å; H178-F310 HydrophobicContact CB-CD2 3.95Å; H178-F310 HydrophobicContact CB-CE1 4Å; H178-F310 HydrophobicContact CB-CE2 3.94Å; H178-F310 HydrophobicContact CB-CG 4Å; H178-F310 HydrophobicContact CB-CZ 3.96Å; H178-F310 AromaticContact CE1-CE1 3.92Å; H178-F310 AromaticContact CG-CD1 3.99Å; H178-F310 AromaticContact CG-CE1 3.75Å; H178-F310 AromaticContact ND1-CD1 3.34Å; H178-F310 VanDerWaalsContact ND1-CD1 3.34Å; H178-F310 WeakPolarHBondContact ND1-CD1 3.49Å; H178-F310 AromaticContact ND1-CE1 3.22Å; H178-F310 WeakPolarHBondContact ND1-CE1 3.44Å; H178-F310 AromaticContact ND1-CZ 3.96Å; F306-F310 HydrophobicContact CD1-CD2 4.33Å; F306-F310 AromaticContact CD1-CE2 3.78Å; F306-F310 HydrophobicContact CD1-CE2 3.78Å; F306-F310 HydrophobicContact CE1-CE2 4.23Å; F306-F310 VanDerWaalsContact O-CD2 3.27Å; F306-F310 WeakPolarHBondContact O-CD2 2.88Å; F306-F310 PolarHBondContact O-N 3.06Å; F306-F310 VanDerWaalsContact O-N 3.09Å; V308-F310 VanDerWaalsContact C-N 3.27Å; V308-F310 PolarHBondContact O-N 2.9Å; F310-T313 PolarHBondContact O-OG1 3.01Å
311	A	82.1	Confident	83.9	Confident	3 Å²	3	52 Å²	52	3%	0.025	31%	0.306	C	S	.	.	H	α-helix	trans	-75.2	-40.8	166.3	0	0	0	0	0	111.1	I123 A307 V308 T313 R314 M315 L320	I123-A311 HydrophobicContact CD1-CB 4.02Å; A307-A311 WeakPolarHBondContact O-CB 3.09Å; A307-A311 PolarHBondContact O-N 3.43Å; V308-A311 PolarHBondContact O-N 3.39Å; A311-T313 PolarHBondContact O-N 3.27Å; A311-T313 VanDerWaalsContact O-N 3.16Å; A311-R314 WeakPolarHBondContact O-CA 3.36Å; A311-R314 PolarHBondContact O-N 3.37Å; A311-M315 VanDerWaalsContact O-CG 3.26Å; A311-M315 WeakPolarHBondContact O-CG 3.47Å; A311-M315 PolarHBondContact O-N 3.5Å; A311-L320 HydrophobicContact CB-CD1 3.98Å; A311-L320 HydrophobicContact CB-CD2 3.87Å
312	T	82.3	Confident	82.6	Confident	60 Å²	60	49.4 Å²	49.4	37%	0.368	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.7	179.8	55.3	0	0	0	0	114.2	V308 L309 R314 M315 V317	V308-T312 HydrophobicContact CG1-CG2 4.28Å; V308-T312 WeakPolarHBondContact O-CG2 3.24Å; V308-T312 PolarHBondContact O-N 3.06Å; V308-T312 PolarHBondContact O-OG1 2.86Å; L309-T312 PolarHBondContact O-OG1 3.42Å; T312-R314 VanDerWaalsContact C-N 3.26Å; T312-M315 WeakPolarHBondContact CA-O 3.46Å; T312-V317 HydrophobicContact CG2-CG2 3.91Å
313	T	79.6	Confident	80.9	Confident	101 Å²	101	56.4 Å²	56.4	62%	0.62	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.8	168.3	64.5	0	0	0	0	113.7	F310 A311	F310-T313 PolarHBondContact O-OG1 3.01Å; A311-T313 PolarHBondContact O-N 3.27Å; A311-T313 VanDerWaalsContact O-N 3.16Å
314	R	74.8	Confident	79.5	Confident	49 Å²	49	60.3 Å²	60.3	19%	0.185	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	-29.9	-176.7	-54	178.3	-171.4	-122.4	-15.6	114	V85 T88 N182 A311 T312	V85-R314 PolarHBondContact O-NH1 3.18Å; T88-R314 HydrophobicContact CG2-CB 4.25Å; N182-R314 PolarHBondContact OD1-NH1 3.5Å; N182-R314 PolarHBondContact OD1-NH2 2.99Å; A311-R314 WeakPolarHBondContact O-CA 3.36Å; A311-R314 PolarHBondContact O-N 3.37Å; T312-R314 VanDerWaalsContact C-N 3.26Å
315	M	77.9	Confident	78.1	Confident	12 Å²	12	60.3 Å²	60.3	6%	0.059	35%	0.346	C	S	.	.	S	Bend	trans	-151.3	155.3	-170.9	52.3	177.4	63.7	0	0	111.4	T88 T119 V120 I123 A311 T312 L320	T88-M315 HydrophobicContact CG2-CE 3.56Å; T119-M315 HydrophobicContact CG2-CE 4.41Å; V120-M315 HydrophobicContact CG2-CE 4.02Å; V120-M315 HydrophobicContact CG2-SD 3.56Å; V120-M315 VanDerWaalsContact CG2-SD 3.56Å; I123-M315 HydrophobicContact CD1-CE 3.77Å; I123-M315 HydrophobicContact CD1-SD 3.79Å; A311-M315 VanDerWaalsContact O-CG 3.26Å; A311-M315 WeakPolarHBondContact O-CG 3.47Å; A311-M315 PolarHBondContact O-N 3.5Å; T312-M315 WeakPolarHBondContact CA-O 3.46Å; M315-L320 HydrophobicContact SD-CD1 4.14Å
316	N	77.4	Confident	76.8	Confident	116 Å²	116	62.7 Å²	62.7	62%	0.62	35%	0.346	S	S	*	.			trans	-70.5	146.1	-178.6	-76.2	-50.5	0	0	0	112.3	G318 E319 L320	N316-G318 PolarHBondContact O-N 2.81Å; N316-G318 VanDerWaalsContact O-N 3.17Å; N316-E319 HydrophobicContact CB-CG 4.43Å; N316-E319 WeakPolarHBondContact O-CB 3.4Å; N316-E319 PolarHBondContact O-N 3.31Å; N316-L320 PolarHBondContact O-N 2.83Å
317	V	77.8	Confident	75.5	Confident	83 Å²	83	68.3 Å²	68.3	50%	0.503	37%	0.366	S	S	.	.	H	α-helix	trans	-55.9	-38.3	-177.8	-164	0	0	0	0	112.2	T312 E319 L320 F321	T312-V317 HydrophobicContact CG2-CG2 3.91Å; V317-E319 VanDerWaalsContact C-N 3.28Å; V317-E319 PolarHBondContact O-N 3.43Å; V317-L320 PolarHBondContact O-N 3.21Å; V317-F321 HydrophobicContact CG1-CD2 4.08Å; V317-F321 HydrophobicContact CG1-CE2 4.07Å; V317-F321 WeakPolarHBondContact O-CD2 3.31Å
318	G	72.7	Confident	73.9	Confident	64 Å²	64	71.6 Å²	71.6	66%	0.66	39%	0.387	S	S	*	.	H	α-helix	trans	-68.2	-20.8	177.8	0	0	0	0	0	114.9	N316	N316-G318 PolarHBondContact O-N 2.81Å; N316-G318 VanDerWaalsContact O-N 3.17Å
319	E	72.6	Confident	72.4	Confident	60 Å²	60	71.1 Å²	71.1	28%	0.28	38%	0.382	S	S	.	.	H	α-helix	trans	-81.2	-31.1	174.2	-67.9	169.3	-154.2	0	0	111.5	N116 N316 V317 F321	N116-E319 WeakPolarHBondContact CB-OE2 3.26Å; N116-E319 PolarHBondContact ND2-OE2 3.39Å; N316-E319 HydrophobicContact CB-CG 4.43Å; N316-E319 WeakPolarHBondContact O-CB 3.4Å; N316-E319 PolarHBondContact O-N 3.31Å; V317-E319 VanDerWaalsContact C-N 3.28Å; V317-E319 PolarHBondContact O-N 3.43Å; E319-F321 VanDerWaalsContact C-N 3.34Å; E319-F321 PolarHBondContact O-N 2.97Å
320	L	75.6	Confident	70.8	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-70.4	-26.8	-178.5	-174	63.8	0	0	0	113.7	V120 I123 W124 V308 A311 M315 N316 V317	V120-L320 HydrophobicContact CG1-CD1 4.42Å; I123-L320 HydrophobicContact CD1-CD1 4.31Å; I123-L320 HydrophobicContact CG2-CD1 4.28Å; W124-L320 PolarHBondContact NE1-O 3.03Å; V308-L320 HydrophobicContact CG1-CD2 4.39Å; V308-L320 HydrophobicContact CG2-CD2 4.26Å; A311-L320 HydrophobicContact CB-CD1 3.98Å; A311-L320 HydrophobicContact CB-CD2 3.87Å; M315-L320 HydrophobicContact SD-CD1 4.14Å; N316-L320 PolarHBondContact O-N 2.83Å; V317-L320 PolarHBondContact O-N 3.21Å
321	F	78.9	Confident	69.3	Low	114 Å²	114	67.7 Å²	67.7	50%	0.5	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	22.8	-175.9	-67.4	-76.6	0	0	0	113.8	W124 V308 V317 E319	W124-F321 AromaticContact CH2-CE1 3.87Å; W124-F321 HydrophobicContact CH2-CE1 3.87Å; W124-F321 AromaticContact CZ2-CD1 3.99Å; W124-F321 HydrophobicContact CZ2-CD1 3.99Å; W124-F321 AromaticContact CZ2-CE1 3.65Å; W124-F321 HydrophobicContact CZ2-CE1 3.65Å; W124-F321 HydrophobicContact CZ2-CZ 4.34Å; V308-F321 HydrophobicContact CG2-CZ 4.26Å; V317-F321 HydrophobicContact CG1-CD2 4.08Å; V317-F321 HydrophobicContact CG1-CE2 4.07Å; V317-F321 WeakPolarHBondContact O-CD2 3.31Å; E319-F321 VanDerWaalsContact C-N 3.34Å; E319-F321 PolarHBondContact O-N 2.97Å
322	A	67.9	Low	68	Low	30 Å²	30	73.8 Å²	73.8	25%	0.248	39%	0.394	C	S	.	.			trans	-65.4	134.4	174.8	0	0	0	0	0	111.6	D324	A322-D324 PolarHBondContact O-N 3.38Å
323	L	57	Low	66.6	Low	169 Å²	169	71 Å²	71	89%	0.885	38%	0.377	S	S	*	.	S	Bend	trans	-60.7	-41.5	-172.9	-113.2	71.3	0	0	0	114.1	L325	L323-L325 PolarHBondContact O-N 3.46Å
324	D	64.8	Low	65.1	Low	85 Å²	85	70.2 Å²	70.2	46%	0.455	37%	0.368	S	S	.	.			trans	-74.6	45.3	-175.9	-78.7	26	0	0	0	113.2	A322 F326 R327	A322-D324 PolarHBondContact O-N 3.38Å; D324-F326 PolarHBondContact O-N 2.86Å; D324-F326 VanDerWaalsContact O-N 3.08Å; D324-R327 HydrophobicContact CB-CB 4.22Å; D324-R327 PolarHBondContact O-N 3.04Å; D324-R327 WeakPolarHBondContact OD2-CD 3.4Å; D324-R327 IonicContact OD2-CZ 2.85Å; D324-R327 IonicContact OD2-NE 3.78Å; D324-R327 IonicContact OD2-NH1 2.69Å; D324-R327 PolarHBondContact OD2-NH1 2.04Å
325	L	61.6	Low	63.9	Low	38 Å²	38	69.2 Å²	69.2	20%	0.199	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.5	-168.9	-147.3	91.6	0	0	0	114.1	V120 Q121 W124 L323	V120-L325 HydrophobicContact CG1-CD1 3.78Å; Q121-L325 VanDerWaalsContact CG-O 3.26Å; Q121-L325 WeakPolarHBondContact CG-O 3.35Å; Q121-L325 PolarHBondContact NE2-O 3.09Å; W124-L325 HydrophobicContact CB-CD2 4.07Å; W124-L325 HydrophobicContact CG-CD2 4.02Å; L323-L325 PolarHBondContact O-N 3.46Å
326	F	65.1	Low	62.3	Low	104 Å²	104	75.6 Å²	75.6	46%	0.456	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	14.2	-173.3	-63.2	-70.3	0	0	0	114.5	D324 P426	D324-F326 PolarHBondContact O-N 2.86Å; D324-F326 VanDerWaalsContact O-N 3.08Å; F326-P426 WeakPolarHBondContact O-CB 3.18Å; F326-P426 VanDerWaalsContact O-CG 3.27Å; F326-P426 WeakPolarHBondContact O-CG 3.49Å
327	R	63.4	Low	60.5	Low	158 Å²	158	72.8 Å²	72.8	60%	0.596	39%	0.387	S	S	*	.	S	Bend	trans	-70.5	143.7	176.5	-162.9	167.7	-173	165.8	3.9	110.8	D324 L329	D324-R327 HydrophobicContact CB-CB 4.22Å; D324-R327 PolarHBondContact O-N 3.04Å; D324-R327 WeakPolarHBondContact OD2-CD 3.4Å; D324-R327 IonicContact OD2-CZ 2.85Å; D324-R327 IonicContact OD2-NE 3.78Å; D324-R327 IonicContact OD2-NH1 2.69Å; D324-R327 PolarHBondContact OD2-NH1 2.04Å; R327-L329 PolarHBondContact O-N 3.05Å
328	P	57.2	Low	58.6	Low	76 Å²	76	74.3 Å²	74.3	49%	0.494	40%	0.401	S	S	.	.			trans	-61.6	118.4	172.9	-22.5	33.8	0	0	0	110.9	P426	P328-P426 HydrophobicContact CG-CG 4.45Å
329	L	56.8	Low	56.7	Low	37 Å²	37	78.1 Å²	78.1	19%	0.194	41%	0.405	C	S	.	.			trans	-112.8	138.1	-175.6	-75.8	164.1	0	0	0	111	R117 R327 S424	R117-L329 HydrophobicContact CB-CD1 3.96Å; R327-L329 PolarHBondContact O-N 3.05Å; L329-S424 PolarHBondContact O-N 2.98Å
330	P	55.2	Low	54.7	Low	46 Å²	46	82 Å²	82	30%	0.299	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	122.7	179.9	31.3	-32.3	0	0	0	112.2	L421 Y423	P330-L421 HydrophobicContact CB-CB 4.12Å; P330-L421 HydrophobicContact CB-CD2 4.02Å; P330-L421 HydrophobicContact CG-CD2 4.49Å; P330-Y423 HydrophobicContact CB-CD1 3.94Å; P330-Y423 HydrophobicContact CB-CE1 3.71Å; P330-Y423 HydrophobicContact CB-CE2 4.34Å; P330-Y423 HydrophobicContact CB-CG 4.37Å; P330-Y423 HydrophobicContact CG-CD1 4.49Å; P330-Y423 HydrophobicContact CG-CE1 3.98Å
331	M	55	Low	52.6	Low	14 Å²	14	88 Å²	88	7%	0.069	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	135.4	165.2	-70.1	-173.3	-73.9	0	0	110.7	N118 T333 L421 T422 F498	N118-M331 WeakPolarHBondContact ND2-CG 3.22Å; M331-T333 PolarHBondContact O-N 2.78Å; M331-L421 WeakPolarHBondContact O-CA 3.35Å; M331-T422 PolarHBondContact N-O 3.5Å; M331-T422 PolarHBondContact O-N 3.47Å; M331-T422 PolarHBondContact O-OG1 2.94Å; M331-T422 VanDerWaalsContact O-OG1 3.11Å; M331-F498 HydrophobicContact SD-CE1 4.37Å; M331-F498 HydrophobicContact SD-CZ 3.81Å
332	K	54.3	Low	50.2	Low	132 Å²	132	87.4 Å²	87.4	57%	0.574	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	109	173	-68.9	168.9	-178	161.7	0	109.6	R113 L421	R113-K332 PolarHBondContact N-O 2.74Å; K332-L421 HydrophobicContact CG-CD2 3.97Å
333	T	52.4	Low	48.4	Very low	2 Å²	2	91 Å²	91	1%	0.012	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129.9	172.3	25.6	0	0	0	0	110.1	A112 M331 T419 K420 T422	A112-T333 HydrophobicContact CB-CG2 3.78Å; M331-T333 PolarHBondContact O-N 2.78Å; T333-T419 CarbonylContact O-C 3.53Å; T333-T419 WeakPolarHBondContact O-CA 3.47Å; T333-K420 PolarHBondContact N-O 3.46Å; T333-K420 PolarHBondContact O-N 3.07Å; T333-K420 PolarHBondContact OG1-O 2.83Å; T333-T422 PolarHBondContact OG1-OG1 3.19Å
334	L	49.2	Very low	47	Very low	83 Å²	83	87.2 Å²	87.2	44%	0.435	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	117.7	168.1	-71	164.9	0	0	0	108.4	I111 F417 T419	I111-L334 PolarHBondContact N-O 3.16Å; I111-L334 WeakPolarHBondContact O-CB 3.37Å; I111-L334 PolarHBondContact O-N 3.08Å; L334-F417 HydrophobicContact CD2-CB 4.31Å; L334-T419 HydrophobicContact CD2-CG2 3.67Å
335	V	49.1	Very low	45.4	Very low	29 Å²	29	93.6 Å²	93.6	18%	0.176	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.6	174.2	-174	0	0	0	0	108.4	V418 K420	V335-V418 HydrophobicContact CB-CB 4.47Å; V335-V418 PolarHBondContact N-O 3.42Å; V335-V418 PolarHBondContact O-N 2.92Å; V335-K420 HydrophobicContact CG2-CB 4.48Å
336	Q	43.8	Very low	43.8	Very low	145 Å²	145	98.5 Å²	98.5	68%	0.678	55%	0.55	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	111.4	175.5	-178.8	172.6	-12.5	0	0	108.7	S338	Q336-S338 PolarHBondContact O-N 2.94Å
337	S	39.5	Very low	41.9	Very low	57 Å²	57	96.4 Å²	96.4	40%	0.399	56%	0.558	S	S	.	*			trans	-75.6	112.7	-179.9	57.8	0	0	0	0	111	S416	S337-S416 PolarHBondContact OG-O 2.89Å; S337-S416 PolarHBondContact OG-OG 2.91Å
338	S	38	Very low	40	Very low	115 Å²	115	95 Å²	95	80%	0.804	57%	0.572	S	S	*	*			trans	-111.5	99.5	167.2	48.6	0	0	0	0	109	Q336	Q336-S338 PolarHBondContact O-N 2.94Å
339	I	33.1	Very low	38.5	Very low	144 Å²	144	95.5 Å²	95.5	74%	0.738	58%	0.583	S	S	*	*			trans	-121.5	85.9	177.3	-55.6	178.9	0	0	0	107.8
340	D	30.1	Very low	37	Very low	141 Å²	141	106.4 Å²	106.4	75%	0.754	62%	0.622	S	S	*	*			trans	-135	94.5	167.3	-96	-50.4	0	0	0	108.6	S342	D340-S342 PolarHBondContact O-N 3.13Å
341	P	33	Very low	35.5	Very low	129 Å²	129	113 Å²	113	84%	0.838	65%	0.649	S	S	*	*			trans	-84.6	57.9	-177.1	35	-35.5	0	0	0	111.4
342	S	28.4	Very low	34.1	Very low	102 Å²	102	121.5 Å²	121.5	71%	0.713	69%	0.685	S	S	*	*			trans	-140.2	16.1	-167.4	55.2	0	0	0	0	115.6	D340	D340-S342 PolarHBondContact O-N 3.13Å
343	A	29.9	Very low	32.7	Very low	105 Å²	105	123.5 Å²	123.5	87%	0.868	70%	0.697	S	S	*	*			trans	-134.6	99.4	173.5	0	0	0	0	0	111.9
344	A	28	Very low	31.3	Very low	90 Å²	90	128.7 Å²	128.7	74%	0.744	73%	0.733	S	S	*	*			trans	-119.3	157.5	171.7	0	0	0	0	0	110.6
345	Y	30	Very low	30.9	Very low	219 Å²	219	130 Å²	130	86%	0.859	75%	0.747	S	S	*	*			trans	77.8	113.2	-179.1	-75.8	-98.1	0	0	0	118.3
346	V	28.2	Very low	29.8	Very low	140 Å²	140	136.7 Å²	136.7	85%	0.848	78%	0.781	S	S	*	*			trans	43.9	125.3	131	-172	0	0	0	0	118.5
347	G	25.2	Very low	28.9	Very low	60 Å²	60	138 Å²	138	62%	0.619	79%	0.789	S	S	*	*			cis	160.3	155.6	-1.4	0	0	0	0	0	113
348	S	24.5	Very low	28.6	Very low	128 Å²	128	140.4 Å²	140.4	90%	0.895	80%	0.804	S	S	*	*			trans	43.1	88.5	164.2	60.2	0	0	0	0	119.1
349	A	24.5	Very low	27.9	Very low	88 Å²	88	140.2 Å²	140.2	73%	0.727	80%	0.803	S	S	*	*			trans	-160.2	117.8	147	0	0	0	0	0	110.9
350	W	25	Very low	27.7	Very low	265 Å²	265	140 Å²	140	100%	1.004	81%	0.808	S	S	*	*			trans	-149.7	108.6	163.1	-78.2	112.8	0	0	0	108.9
351	E	23.5	Very low	27.4	Very low	186 Å²	186	142.5 Å²	142.5	87%	0.869	81%	0.812	S	S	*	*			trans	-134	129.2	175.6	-167.7	161.3	-135.4	0	0	108.5
352	F	26	Very low	27	Very low	191 Å²	191	141.3 Å²	141.3	84%	0.838	81%	0.807	S	S	*	*			trans	19.4	123.4	158.9	-106.3	-105.4	0	0	0	120.6
353	E	24.7	Very low	26.8	Very low	174 Å²	174	141.7 Å²	141.7	81%	0.813	81%	0.81	S	S	*	*				-176.9	-178.1	99.1	-104.1	-168.8	164.7	0	0	114.2
354	S	24.6	Very low	26.6	Very low	111 Å²	111	142.6 Å²	142.6	78%	0.776	81%	0.81	S	S	*	*			trans	-158	176.3	-179.4	-65.7	0	0	0	0	109.2
355	P	39.8	Very low	26.5	Very low	112 Å²	112	148 Å²	148	73%	0.727	82%	0.817	S	S	*	*				-125	175.7	-58.1	39	-26.9	0	0	0	111
356	N	25.8	Very low	26.7	Very low	168 Å²	168	142.2 Å²	142.2	90%	0.898	81%	0.806	S	S	*	*			trans	-164.2	165.5	147.5	-110.9	-47.4	0	0	0	117.2
357	M	25.9	Very low	26.5	Very low	172 Å²	172	146.6 Å²	146.6	85%	0.847	81%	0.807	S	S	*	*			trans	-84.9	-170.4	-175.9	-119.8	-174.5	176.1	0	0	113.1
358	P	32.6	Very low	26.5	Very low	109 Å²	109	151.5 Å²	151.5	71%	0.708	81%	0.812	S	S	*	*			cis	-138.6	165.5	-16.9	34.5	-15.3	0	0	0	117.1
359	S	24.2	Very low	26.5	Very low	110 Å²	110	151.9 Å²	151.9	77%	0.769	80%	0.799	S	S	*	*			trans	-163.6	158.8	162.5	58.5	0	0	0	0	109.8
360	T	28.5	Very low	26.6	Very low	140 Å²	140	154.4 Å²	154.4	86%	0.859	80%	0.796	S	S	*	*			cis	-151.1	-156.2	-18	14.5	0	0	0	0	107.8
361	K	24.2	Very low	26.7	Very low	193 Å²	193	147.8 Å²	147.8	84%	0.839	78%	0.78	S	S	*	*			trans	-140.2	146.6	176	-57.7	179.2	175.6	175.6	0	114.1
362	S	23.5	Very low	27	Very low	104 Å²	104	144.8 Å²	144.8	73%	0.727	78%	0.777	S	S	*	*			trans	40.6	153.3	134.2	68.6	0	0	0	0	123.1
363	S	25.2	Very low	27.1	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	77%	0.774	S	S	*	*			cis	172.7	141.5	-20.1	55.8	0	0	0	0	110.2
364	S	25.6	Very low	27.2	Very low	123 Å²	123	139.5 Å²	139.5	86%	0.86	77%	0.771	S	S	*	*			trans	-162.3	152.2	161	48.3	0	0	0	0	114.9
365	F	25.6	Very low	27.5	Very low	204 Å²	204	141.7 Å²	141.7	90%	0.895	77%	0.773	S	S	*	*			trans	-91.9	-170.6	179.3	-91.1	-101.5	0	0	0	111.3
366	P	34.1	Very low	26.8	Very low	98 Å²	98	141.9 Å²	141.9	64%	0.636	77%	0.768	S	S	*	*			cis	-143.4	170.5	6.5	29.8	-5.2	0	0	0	119.8
367	R	23.9	Very low	27	Very low	231 Å²	231	139 Å²	139	87%	0.872	77%	0.767	S	S	*	*			trans	66.8	155.4	147.4	-75.6	168.5	-170.4	-169.8	5	119.7
368	K	24.8	Very low	27	Very low	164 Å²	164	140.5 Å²	140.5	71%	0.713	76%	0.763	S	S	*	*			cis	-174.6	154.5	-24.5	-159.2	-171.3	174.3	-134.9	0	109.1
369	H	25.2	Very low	26.7	Very low	135 Å²	135	146.3 Å²	146.3	63%	0.625	77%	0.771	S	S	*	*			trans	68.3	153.6	178.8	-64.6	-108.9	0	0	0	114.4
370	E	25.5	Very low	27	Very low	142 Å²	142	149.3 Å²	149.3	66%	0.664	78%	0.778	S	S	*	*			cis	-155.4	170.1	-0.5	-136.7	158.1	-123.3	0	0	113.3
371	N	27.1	Very low	26.9	Very low	125 Å²	125	149 Å²	149	67%	0.668	77%	0.769	S	S	*	*			trans	59.2	122.3	159.3	-60.2	-38.9	0	0	0	121.7
372	P	30.1	Very low	27.4	Very low	124 Å²	124	145.8 Å²	145.8	81%	0.805	77%	0.768	S	S	*	*			trans	-89.7	114.6	158.8	33.8	-27.4	0	0	0	111.1
373	V	28.7	Very low	27.5	Very low	128 Å²	128	148 Å²	148	78%	0.776	77%	0.772	S	S	*	*			trans	-83.5	119.8	171.6	176.9	0	0	0	0	109.9	I375	V373-I375 PolarHBondContact O-N 3.26Å
374	V	26.2	Very low	27.7	Very low	125 Å²	125	146 Å²	146	76%	0.758	77%	0.769	S	S	*	*			trans	-71.1	123.3	171.8	177.4	0	0	0	0	109.4	D376	V374-D376 HydrophobicContact CG1-CB 4.3Å
375	I	30.5	Very low	27.9	Very low	158 Å²	158	149 Å²	149	81%	0.81	77%	0.774	S	S	*	*			trans	-106.5	104.5	162.7	-62	-177.6	0	0	0	107.3	V373 A377	V373-I375 PolarHBondContact O-N 3.26Å; I375-A377 PolarHBondContact O-N 3.45Å
376	D	24.8	Very low	27.9	Very low	115 Å²	115	142.4 Å²	142.4	62%	0.615	77%	0.765	S	S	*	*			trans	-82.6	98.2	-169.8	-171.9	20.8	0	0	0	111.5	V374 R378	V374-D376 HydrophobicContact CG1-CB 4.3Å; D376-R378 PolarHBondContact O-N 2.96Å; D376-R378 WeakPolarHBondContact OD1-CB 3.48Å
377	A	31.1	Very low	27.5	Very low	107 Å²	107	145.9 Å²	145.9	88%	0.884	77%	0.772	S	S	*	*			trans	-75.3	39.8	178.7	0	0	0	0	0	113.2	I375	I375-A377 PolarHBondContact O-N 3.45Å
378	R	25.2	Very low	27.4	Very low	205 Å²	205	143.7 Å²	143.7	77%	0.774	77%	0.769	S	S	*	*			trans	-116.3	31.8	-171.3	-150.6	174.9	-152.6	-116.4	2.7	113.5	D376	D376-R378 PolarHBondContact O-N 2.96Å; D376-R378 WeakPolarHBondContact OD1-CB 3.48Å
379	R	26	Very low	27.5	Very low	230 Å²	230	141.1 Å²	141.1	87%	0.868	77%	0.767	S	S	*	*			trans	-137.2	93.3	172.4	-75.2	-172.7	178.2	-176.9	0	112.3
380	L	30.8	Very low	27.5	Very low	174 Å²	174	142 Å²	142	91%	0.911	77%	0.771	S	S	*	*			trans	-165.2	64.8	148.6	-108.8	167.6	0	0	0	108.8
381	I	27.1	Very low	27.5	Very low	132 Å²	132	142.9 Å²	142.9	68%	0.677	78%	0.781	S	S	*	*			trans	-118.7	110.3	173.2	-60	174.1	0	0	0	107.5	N383	I381-N383 WeakPolarHBondContact CG2-OD1 3.4Å
382	P	33.4	Very low	27.6	Very low	126 Å²	126	145.7 Å²	145.7	82%	0.818	79%	0.79	S	S	*	*			trans	-86.8	105.9	160.1	31.9	-26.1	0	0	0	108.9
383	N	27.5	Very low	27.4	Very low	150 Å²	150	149 Å²	149	80%	0.802	80%	0.795	S	S	*	*			trans	-96.4	134.1	170.6	-84.5	-5.6	0	0	0	110.1	I381	I381-N383 WeakPolarHBondContact CG2-OD1 3.4Å
384	G	29	Very low	27.3	Very low	70 Å²	70	152.3 Å²	152.3	72%	0.722	80%	0.802	S	S	*	*			trans	115.3	105	173.9	0	0	0	0	0	111.6
385	L	29.5	Very low	27.3	Very low	185 Å²	185	156 Å²	156	97%	0.969	81%	0.811	S	S	*	*				-133.4	-167.6	52	-112.3	67.4	0	0	0	112.7
386	G	25	Very low	27.2	Very low	67 Å²	67	157.5 Å²	157.5	69%	0.691	81%	0.814	S	S	*	*			trans	-157.4	-169.1	170.4	0	0	0	0	0	112.5
387	E	25	Very low	27.3	Very low	171 Å²	171	159.3 Å²	159.3	80%	0.799	82%	0.824	S	S	*	*			trans	75.4	128.1	173.2	-114.6	176.1	-164.2	0	0	117.8
388	F	23.8	Very low	27.2	Very low	184 Å²	184	165.2 Å²	165.2	81%	0.807	82%	0.823	S	S	*	*			trans	63.7	147.5	169.9	-66.1	-82.6	0	0	0	117.5
389	V	25.9	Very low	27.2	Very low	110 Å²	110	164.9 Å²	164.9	67%	0.667	83%	0.833	S	S	*	*			cis	-150.5	-156	-19.2	81.5	0	0	0	0	109.6
390	E	26.1	Very low	27.3	Very low	153 Å²	153	157.1 Å²	157.1	72%	0.715	83%	0.825	S	S	*	*			trans	-47.9	154.1	165.5	-61.6	135	142.5	0	0	112
391	D	25.2	Very low	27.1	Very low	162 Å²	162	155.6 Å²	155.6	87%	0.866	82%	0.818	S	S	*	*				-154.7	-171.3	53.9	-90.1	-54	0	0	0	113.7
392	E	27.7	Very low	27.2	Very low	184 Å²	184	159.5 Å²	159.5	86%	0.86	83%	0.83	S	S	*	*			trans	-91.3	-179.7	177	-61.6	-169.4	121.4	0	0	114.6
393	E	26.3	Very low	27	Very low	192 Å²	192	160.8 Å²	160.8	90%	0.897	84%	0.835	S	S	*	*			trans	86	169	166.8	-51.8	-156.6	129.6	0	0	120.1
394	E	26.5	Very low	26.9	Very low	198 Å²	198	164.5 Å²	164.5	93%	0.925	84%	0.838	S	S	*	*			trans	64.4	69.3	-173.9	-59.7	-161.6	162.2	0	0	119.1
395	E	26.4	Very low	26.8	Very low	204 Å²	204	170 Å²	170	95%	0.953	85%	0.847	S	S	*	*			trans	-105	53.4	162	-161.1	-177.1	-147.8	0	0	112.8
396	E	28.7	Very low	26.6	Very low	188 Å²	188	171.2 Å²	171.2	88%	0.879	84%	0.844	S	S	*	*			trans	-144	47.4	176.1	-152.1	170	-133.8	0	0	115.9
397	D	27.5	Very low	26.5	Very low	153 Å²	153	180 Å²	180	82%	0.818	86%	0.857	S	S	*	*			trans	-165.4	98.7	146.7	-127.2	-18.9	0	0	0	115.2
398	R	28.3	Very low	26.6	Very low	232 Å²	232	176.6 Å²	176.6	88%	0.875	85%	0.852	S	S	*	*			trans	-164.2	27.6	158.2	-128.4	161.1	-71.8	-165.7	2.2	118.1	G400	R398-G400 PolarHBondContact O-N 3.41Å
399	M	26	Very low	26.7	Very low	197 Å²	197	174.1 Å²	174.1	97%	0.97	85%	0.852	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	47.1	174.1	-165.6	66.7	75.5	0	0	112.2
400	G	27.3	Very low	26.9	Very low	68 Å²	68	176.5 Å²	176.5	70%	0.701	86%	0.859	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.8	-8.2	-159.4	0	0	0	0	0	119.7	R398	R398-G400 PolarHBondContact O-N 3.41Å
401	D	26.4	Very low	27.1	Very low	142 Å²	142	176.1 Å²	176.1	76%	0.759	86%	0.862	S	S	*	*	S	Bend	trans	-148.2	36.8	-170.7	-132.7	-15.3	0	0	0	117
402	F	29.9	Very low	27.4	Very low	214 Å²	214	176.3 Å²	176.3	94%	0.939	86%	0.858	S	S	*	*			trans	-115.3	24.7	179.3	-134.8	-92.2	0	0	0	115.2
403	V	29.4	Very low	27.4	Very low	152 Å²	152	174.3 Å²	174.3	92%	0.921	86%	0.858	S	S	*	*	S	Bend	trans	-109.5	-0.5	-175.2	-176.2	0	0	0	0	113
404	R	25.7	Very low	27.7	Very low	228 Å²	228	168.6 Å²	168.6	86%	0.86	85%	0.851	S	S	*	*	S	Bend	trans	-129.5	49.5	-170.9	-159.6	-174.8	-89.1	178.7	-5.3	116
405	M	25.4	Very low	28	Very low	187 Å²	187	166.6 Å²	166.6	92%	0.921	84%	0.841	S	S	*	*			trans	-158.1	87.8	156.2	-120.3	-171.6	-164.2	0	0	116.5
406	K	26	Very low	28.4	Very low	209 Å²	209	161.1 Å²	161.1	91%	0.909	83%	0.826	S	S	*	*			trans	-175.1	106	130.5	-108.8	177.6	177.9	179.8	0	110.9
407	R	23.6	Very low	29.1	Very low	253 Å²	253	157.2 Å²	157.2	96%	0.955	81%	0.806	S	S	*	*			trans	-142.6	80	171.4	-166.3	179.2	-163.7	166.9	7.3	110.8
408	S	27.1	Very low	30.1	Very low	99 Å²	99	153.9 Å²	153.9	69%	0.692	79%	0.791	S	S	*	*			trans	-158	145.2	170.2	47.9	0	0	0	0	109.5
409	T	26.3	Very low	31	Very low	131 Å²	131	147.7 Å²	147.7	80%	0.804	78%	0.779	S	S	*	*			trans	50.5	110.6	176.6	51.4	0	0	0	0	115
410	I	30.2	Very low	32.1	Very low	161 Å²	161	142.4 Å²	142.4	83%	0.826	75%	0.751	S	S	*	*				-152.8	144.2	67	-82.9	155	0	0	0	110.1
411	D	28.7	Very low	33.4	Very low	144 Å²	144	143.8 Å²	143.8	77%	0.77	74%	0.741	S	S	*	*			trans	-105.1	161.9	166	-104.5	-54.3	0	0	0	111.2
412	H	31.2	Very low	34.8	Very low	167 Å²	167	138.4 Å²	138.4	77%	0.773	71%	0.714	S	S	*	*			trans	82.2	138	175.2	-54.2	-68.2	0	0	0	119.8
413	T	28.6	Very low	36.2	Very low	141 Å²	141	135.6 Å²	135.6	87%	0.865	70%	0.698	S	S	*	*	S	Bend	trans	60	100.8	164	53.5	0	0	0	0	119.6
414	G	31.8	Very low	37.8	Very low	73 Å²	73	128.8 Å²	128.8	75%	0.753	66%	0.658	S	S	*	*	S	Bend	trans	74.6	112.7	133	0	0	0	0	0	119.2
415	Q	33.2	Very low	39.9	Very low	155 Å²	155	121.8 Å²	121.8	72%	0.724	64%	0.637	S	S	*	*			trans	63.1	91	171.1	-60.1	-174.3	-6.9	0	0	115.5	F417	Q415-F417 HydrophobicContact CB-CD2 4.4Å; Q415-F417 HydrophobicContact CB-CE2 3.83Å; Q415-F417 HydrophobicContact CB-CZ 4.41Å; Q415-F417 WeakPolarHBondContact O-CD2 3.31Å; Q415-F417 PolarHBondContact O-N 2.85Å; Q415-F417 VanDerWaalsContact O-N 3.09Å
416	S	35.5	Very low	41.9	Very low	89 Å²	89	113.5 Å²	113.5	62%	0.622	60%	0.597	S	S	*	*			trans	-75.1	90.9	173.2	49.8	0	0	0	0	112.3	S337	S337-S416 PolarHBondContact OG-O 2.89Å; S337-S416 PolarHBondContact OG-OG 2.91Å
417	F	43.2	Very low	44.3	Very low	106 Å²	106	111.8 Å²	111.8	47%	0.465	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.4	128.2	166.9	-64.8	-86.1	0	0	0	110.5	L334 Q415	L334-F417 HydrophobicContact CD2-CB 4.31Å; Q415-F417 HydrophobicContact CB-CD2 4.4Å; Q415-F417 HydrophobicContact CB-CE2 3.83Å; Q415-F417 HydrophobicContact CB-CZ 4.41Å; Q415-F417 WeakPolarHBondContact O-CD2 3.31Å; Q415-F417 PolarHBondContact O-N 2.85Å; Q415-F417 VanDerWaalsContact O-N 3.09Å
418	V	49	Very low	46.8	Very low	84 Å²	84	102.7 Å²	102.7	51%	0.509	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.7	114.9	176.1	-179.5	0	0	0	0	109.1	V335	V335-V418 HydrophobicContact CB-CB 4.47Å; V335-V418 PolarHBondContact N-O 3.42Å; V335-V418 PolarHBondContact O-N 2.92Å
419	T	47.1	Very low	49.2	Very low	102 Å²	102	98 Å²	98	63%	0.626	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	116.1	171.4	47.2	0	0	0	0	110.7	T333 L334	T333-T419 CarbonylContact O-C 3.53Å; T333-T419 WeakPolarHBondContact O-CA 3.47Å; L334-T419 HydrophobicContact CD2-CG2 3.67Å
420	K	49.2	Very low	51.9	Low	85 Å²	85	96.6 Å²	96.6	37%	0.37	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	154	172.1	-159.3	176.2	-172.9	-177.7	0	110	H96 T333 V335	H96-K420 PolarHBondContact CE1-NZ 3Å; H96-K420 PolarHBondContact NE2-NZ 3.42Å; T333-K420 PolarHBondContact N-O 3.46Å; T333-K420 PolarHBondContact O-N 3.07Å; T333-K420 PolarHBondContact OG1-O 2.83Å; V335-K420 HydrophobicContact CG2-CB 4.48Å
421	L	53.4	Low	54.5	Low	97 Å²	97	93 Å²	93	51%	0.508	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.5	177.1	-68	166.4	0	0	0	108.4	P330 M331 K332	P330-L421 HydrophobicContact CB-CB 4.12Å; P330-L421 HydrophobicContact CB-CD2 4.02Å; P330-L421 HydrophobicContact CG-CD2 4.49Å; M331-L421 WeakPolarHBondContact O-CA 3.35Å; K332-L421 HydrophobicContact CG-CD2 3.97Å
422	T	56.9	Low	57	Low	30 Å²	30	87 Å²	87	18%	0.184	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	114.3	-173.5	29	0	0	0	0	109.4	M331 T333	M331-T422 PolarHBondContact N-O 3.5Å; M331-T422 PolarHBondContact O-N 3.47Å; M331-T422 PolarHBondContact O-OG1 2.94Å; M331-T422 VanDerWaalsContact O-OG1 3.11Å; T333-T422 PolarHBondContact OG1-OG1 3.19Å
423	Y	58.3	Low	59.6	Low	154 Å²	154	79.6 Å²	79.6	60%	0.604	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.3	-173.7	-66.1	-94.9	0	0	0	111.4	P330	P330-Y423 HydrophobicContact CB-CD1 3.94Å; P330-Y423 HydrophobicContact CB-CE1 3.71Å; P330-Y423 HydrophobicContact CB-CE2 4.34Å; P330-Y423 HydrophobicContact CB-CG 4.37Å; P330-Y423 HydrophobicContact CG-CD1 4.49Å; P330-Y423 HydrophobicContact CG-CE1 3.98Å
424	S	63.8	Low	62.5	Low	10 Å²	10	76.4 Å²	76.4	7%	0.07	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-87	132.6	175	53.9	0	0	0	0	112	L329 P426 N496	L329-S424 PolarHBondContact O-N 2.98Å; S424-P426 WeakPolarHBondContact O-CD 3.37Å; S424-N496 WeakPolarHBondContact CB-OD1 3.4Å
425	N	68.8	Low	65.3	Low	80 Å²	80	77 Å²	77	43%	0.428	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-74.7	120.7	173.1	-173.1	-27.8	0	0	0	110.6	W427 N496	N425-W427 PolarHBondContact O-N 3.29Å; N425-W427 WeakPolarHBondContact OD1-CB 3.33Å; N425-W427 PolarHBondContact OD1-N 3.48Å; N425-N496 PolarHBondContact O-ND2 3.09Å; N425-N496 VanDerWaalsContact O-ND2 3.1Å
426	P	68	Low	68	Low	14 Å²	14	69.6 Å²	69.6	9%	0.091	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-27.4	-176.2	29.3	-37	0	0	0	113.7	F326 P328 S424 N428 S429 F430	F326-P426 WeakPolarHBondContact O-CB 3.18Å; F326-P426 VanDerWaalsContact O-CG 3.27Å; F326-P426 WeakPolarHBondContact O-CG 3.49Å; P328-P426 HydrophobicContact CG-CG 4.45Å; S424-P426 WeakPolarHBondContact O-CD 3.37Å; P426-N428 PolarHBondContact O-N 2.92Å; P426-S429 WeakPolarHBondContact O-CB 3.33Å; P426-S429 PolarHBondContact O-N 2.91Å; P426-S429 VanDerWaalsContact O-N 3.08Å; P426-F430 PolarHBondContact O-N 3.31Å
427	W	75.6	Confident	70.6	Confident	172 Å²	172	67 Å²	67	65%	0.652	33%	0.329	S	S	*	.	H	α-helix	trans	-62.5	-29.9	-177.7	-66.7	106.3	0	0	0	112.7	N425 S429 F430 N431	N425-W427 PolarHBondContact O-N 3.29Å; N425-W427 WeakPolarHBondContact OD1-CB 3.33Å; N425-W427 PolarHBondContact OD1-N 3.48Å; W427-S429 VanDerWaalsContact C-N 3.29Å; W427-S429 PolarHBondContact O-N 2.95Å; W427-F430 PolarHBondContact O-N 3.06Å; W427-N431 WeakPolarHBondContact O-CB 3.49Å; W427-N431 VanDerWaalsContact O-CG 3.23Å; W427-N431 PolarHBondContact O-N 3.41Å; W427-N431 PolarHBondContact O-ND2 2.94Å
428	N	77.2	Confident	72.9	Confident	62 Å²	62	66.4 Å²	66.4	33%	0.332	33%	0.33	S	S	.	.	H	α-helix	trans	-60.5	-38.1	175.3	-69.8	-17.2	0	0	0	112.3	P426 T432 P494	P426-N428 PolarHBondContact O-N 2.92Å; N428-T432 PolarHBondContact O-N 3.47Å; N428-T432 VanDerWaalsContact O-N 3.16Å; N428-T432 PolarHBondContact O-OG1 3.22Å; N428-P494 HydrophobicContact CB-CB 4.26Å
429	S	77.3	Confident	75	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.007	31%	0.309	C	S	.	.	H	α-helix	trans	-70.4	-42.4	179.4	-48.7	0	0	0	0	110.9	L125 P426 W427 T432 C433 N496	L125-S429 VanDerWaalsContact CD1-CB 3.48Å; P426-S429 WeakPolarHBondContact O-CB 3.33Å; P426-S429 PolarHBondContact O-N 2.91Å; P426-S429 VanDerWaalsContact O-N 3.08Å; W427-S429 VanDerWaalsContact C-N 3.29Å; W427-S429 PolarHBondContact O-N 2.95Å; S429-T432 PolarHBondContact O-N 3.03Å; S429-C433 PolarHBondContact O-N 3.08Å; S429-N496 PolarHBondContact OG-ND2 2.92Å
430	F	81.8	Confident	77.1	Confident	102 Å²	102	58 Å²	58	45%	0.447	28%	0.279	S	S	.	.	H	α-helix	trans	-63.6	-48.7	174.4	-178.5	-95.1	0	0	0	112.2	P426 W427 T432 C433 L434	P426-F430 PolarHBondContact O-N 3.31Å; W427-F430 PolarHBondContact O-N 3.06Å; F430-T432 PolarHBondContact O-N 3.02Å; F430-C433 WeakPolarHBondContact O-CB 3.25Å; F430-C433 PolarHBondContact O-N 2.72Å; F430-L434 PolarHBondContact O-N 3.26Å
431	N	84.9	Confident	79.1	Confident	85 Å²	85	57.3 Å²	57.3	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-57.9	-33.8	178.7	-74.3	-20.2	0	0	0	112.3	W427 L434 L435	W427-N431 WeakPolarHBondContact O-CB 3.49Å; W427-N431 VanDerWaalsContact O-CG 3.23Å; W427-N431 PolarHBondContact O-N 3.41Å; W427-N431 PolarHBondContact O-ND2 2.94Å; N431-L434 PolarHBondContact O-N 3.48Å; N431-L435 WeakPolarHBondContact O-CB 3.46Å; N431-L435 PolarHBondContact O-N 3.46Å
432	T	83.1	Confident	80.9	Confident	18 Å²	18	55.7 Å²	55.7	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-72.5	-36	176.5	-49.6	0	0	0	0	112.6	M81 N428 S429 F430 L435 Q436 F497	M81-T432 HydrophobicContact SD-CG2 4.36Å; N428-T432 PolarHBondContact O-N 3.47Å; N428-T432 VanDerWaalsContact O-N 3.16Å; N428-T432 PolarHBondContact O-OG1 3.22Å; S429-T432 PolarHBondContact O-N 3.03Å; F430-T432 PolarHBondContact O-N 3.02Å; T432-L435 PolarHBondContact O-N 3.03Å; T432-Q436 PolarHBondContact O-N 3.26Å; T432-F497 HydrophobicContact CG2-CE2 3.82Å; T432-F497 HydrophobicContact CG2-CZ 3.58Å
433	C	85.9	Confident	82.6	Confident	11 Å²	11	54.2 Å²	54.2	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-40.1	172.2	-171.2	0	0	0	0	111.7	M81 L125 S429 F430 Q436 F437	M81-C433 HydrophobicContact CE-CB 4.02Å; L125-C433 HydrophobicContact CD2-CB 3.91Å; S429-C433 PolarHBondContact O-N 3.08Å; F430-C433 WeakPolarHBondContact O-CB 3.25Å; F430-C433 PolarHBondContact O-N 2.72Å; C433-Q436 PolarHBondContact O-N 3.25Å; C433-F437 PolarHBondContact O-N 3.34Å
434	L	89.1	Confident	84.2	Confident	74 Å²	74	47 Å²	47	39%	0.387	23%	0.231	S	C	.	.	H	α-helix	trans	-63	-42.3	174.3	-178.6	61.1	0	0	0	111.6	F430 N431 F437 L438	F430-L434 PolarHBondContact O-N 3.26Å; N431-L434 PolarHBondContact O-N 3.48Å; L434-F437 PolarHBondContact O-N 3.44Å; L434-L438 HydrophobicContact CD1-CD1 4.03Å; L434-L438 HydrophobicContact CD1-CG 4.13Å; L434-L438 HydrophobicContact CG-CD1 3.9Å; L434-L438 HydrophobicContact CG-CG 4.41Å; L434-L438 WeakPolarHBondContact O-CB 3.04Å; L434-L438 WeakPolarHBondContact O-CG 3.33Å; L434-L438 PolarHBondContact O-N 2.89Å
435	L	89.6	Confident	85.4	Confident	85 Å²	85	49.2 Å²	49.2	45%	0.445	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-43.2	174.1	178.5	62.5	0	0	0	112.1	N431 T432 S439	N431-L435 WeakPolarHBondContact O-CB 3.46Å; N431-L435 PolarHBondContact O-N 3.46Å; T432-L435 PolarHBondContact O-N 3.03Å; L435-S439 VanDerWaalsContact O-CB 3.25Å; L435-S439 WeakPolarHBondContact O-CB 3.15Å; L435-S439 PolarHBondContact O-N 3.38Å; L435-S439 PolarHBondContact O-OG 3.01Å
436	Q	90.7	Very high	86.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.3	-47.6	175.9	-171.1	-79.1	-17.7	0	0	111	S77 F78 A129 T432 C433 S439 A440 G556	S77-Q436 WeakPolarHBondContact OG-CB 3.48Å; S77-Q436 WeakPolarHBondContact OG-CG 3.25Å; F78-Q436 HydrophobicContact CB-CG 4.03Å; A129-Q436 HydrophobicContact CB-CG 4.47Å; T432-Q436 PolarHBondContact O-N 3.26Å; C433-Q436 PolarHBondContact O-N 3.25Å; Q436-S439 PolarHBondContact O-OG 3.32Å; Q436-S439 VanDerWaalsContact O-OG 3.05Å; Q436-A440 VanDerWaalsContact O-CB 3.31Å; Q436-A440 WeakPolarHBondContact O-CB 3.4Å; Q436-A440 PolarHBondContact O-N 3.16Å; Q436-G556 PolarHBondContact NE2-O 3.48Å
437	F	89.7	Confident	87.5	Confident	34 Å²	34	45.6 Å²	45.6	15%	0.149	22%	0.221	C	C	.	.	H	α-helix	trans	-65.8	-49.4	180	169.9	-109.1	0	0	0	112.5	L132 V136 C433 L434 S439 A440 F441	L132-F437 HydrophobicContact CB-CD2 3.74Å; L132-F437 HydrophobicContact CB-CE2 4Å; L132-F437 HydrophobicContact CB-CG 4.46Å; L132-F437 HydrophobicContact CD2-CB 4.08Å; L132-F437 HydrophobicContact CD2-CD1 3.81Å; L132-F437 HydrophobicContact CD2-CD2 3.58Å; L132-F437 HydrophobicContact CD2-CE1 4.13Å; L132-F437 HydrophobicContact CD2-CE2 3.92Å; L132-F437 HydrophobicContact CD2-CG 3.51Å; L132-F437 HydrophobicContact CD2-CZ 4.18Å; L132-F437 HydrophobicContact CG-CD2 4.28Å; L132-F437 HydrophobicContact CG-CE2 4.49Å; V136-F437 HydrophobicContact CG2-CE2 4.03Å; V136-F437 HydrophobicContact CG2-CZ 3.95Å; C433-F437 PolarHBondContact O-N 3.34Å; L434-F437 PolarHBondContact O-N 3.44Å; F437-S439 VanDerWaalsContact C-N 3.34Å; F437-S439 PolarHBondContact O-N 2.99Å; F437-A440 PolarHBondContact O-N 2.97Å; F437-F441 WeakPolarHBondContact O-CB 3.47Å; F437-F441 PolarHBondContact O-N 3.48Å
438	L	91.8	Very high	88.1	Confident	94 Å²	94	39.5 Å²	39.5	49%	0.492	20%	0.199	S	C	.	.	H	α-helix	trans	-60.9	-43.9	-179.5	-74.2	173.4	0	0	0	111.4	L434 L442	L434-L438 HydrophobicContact CD1-CD1 4.03Å; L434-L438 HydrophobicContact CD1-CG 4.13Å; L434-L438 HydrophobicContact CG-CD1 3.9Å; L434-L438 HydrophobicContact CG-CG 4.41Å; L434-L438 WeakPolarHBondContact O-CB 3.04Å; L434-L438 WeakPolarHBondContact O-CG 3.33Å; L434-L438 PolarHBondContact O-N 2.89Å; L438-L442 VanDerWaalsContact O-CB 3.26Å; L438-L442 WeakPolarHBondContact O-CB 3.44Å; L438-L442 PolarHBondContact O-N 3.14Å
439	S	93.1	Very high	88.6	Confident	9 Å²	9	37.6 Å²	37.6	6%	0.063	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-47.7	177.9	58.6	0	0	0	0	111.7	S70 A74 L435 Q436 F437 F441 L442 V443	S70-S439 WeakPolarHBondContact O-CB 3.41Å; A74-S439 WeakPolarHBondContact CA-OG 3.39Å; A74-S439 WeakPolarHBondContact CB-OG 3.39Å; A74-S439 PolarHBondContact N-OG 3.31Å; L435-S439 VanDerWaalsContact O-CB 3.25Å; L435-S439 WeakPolarHBondContact O-CB 3.15Å; L435-S439 PolarHBondContact O-N 3.38Å; L435-S439 PolarHBondContact O-OG 3.01Å; Q436-S439 PolarHBondContact O-OG 3.32Å; Q436-S439 VanDerWaalsContact O-OG 3.05Å; F437-S439 VanDerWaalsContact C-N 3.34Å; F437-S439 PolarHBondContact O-N 2.99Å; S439-F441 PolarHBondContact O-N 3.44Å; S439-L442 PolarHBondContact O-N 3.44Å; S439-L442 VanDerWaalsContact O-N 3.12Å; S439-V443 WeakPolarHBondContact O-CG2 3.48Å; S439-V443 PolarHBondContact O-N 3.27Å
440	A	91.1	Very high	89.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-39.7	178	0	0	0	0	0	113	A74 Q436 F437 Y444 Y554 V559	A74-A440 HydrophobicContact CB-CB 3.99Å; Q436-A440 VanDerWaalsContact O-CB 3.31Å; Q436-A440 WeakPolarHBondContact O-CB 3.4Å; Q436-A440 PolarHBondContact O-N 3.16Å; F437-A440 PolarHBondContact O-N 2.97Å; A440-Y444 PolarHBondContact O-N 2.93Å; A440-Y554 HydrophobicContact CB-CE2 3.73Å; A440-V559 HydrophobicContact CB-CG2 4.04Å
441	F	91	Very high	89.3	Confident	71 Å²	71	32.7 Å²	32.7	31%	0.311	17%	0.167	S	C	.	.	H	α-helix	trans	-63.3	-42.7	173	178.6	-96.9	0	0	0	111.9	F437 S439 Y444 Q445 Y554	F437-F441 WeakPolarHBondContact O-CB 3.47Å; F437-F441 PolarHBondContact O-N 3.48Å; S439-F441 PolarHBondContact O-N 3.44Å; F441-Y444 PolarHBondContact O-N 3.41Å; F441-Q445 HydrophobicContact CD1-CG 4.18Å; F441-Q445 HydrophobicContact CE1-CG 3.85Å; F441-Q445 HydrophobicContact CE2-CG 4.46Å; F441-Q445 VanDerWaalsContact CE2-NE2 3.29Å; F441-Q445 HydrophobicContact CZ-CG 4.03Å; F441-Q445 WeakPolarHBondContact O-CG 3.45Å; F441-Q445 PolarHBondContact O-N 2.91Å; F441-Q445 VanDerWaalsContact O-N 3.07Å; F441-Y554 PolarHBondContact N-OH 2.88Å
442	L	92.3	Very high	89.2	Confident	63 Å²	63	31.1 Å²	31.1	33%	0.33	16%	0.156	S	C	.	.	H	α-helix	trans	-64.3	-42	179.7	-165.7	152	0	0	0	111.7	L66 S70 L438 S439 Y444 Q445 C446	L66-L442 HydrophobicContact CB-CD2 3.95Å; L66-L442 HydrophobicContact CD2-CD2 4.07Å; L66-L442 HydrophobicContact CG-CD2 4.42Å; S70-L442 WeakPolarHBondContact OG-CD2 3.19Å; L438-L442 VanDerWaalsContact O-CB 3.26Å; L438-L442 WeakPolarHBondContact O-CB 3.44Å; L438-L442 PolarHBondContact O-N 3.14Å; S439-L442 PolarHBondContact O-N 3.44Å; S439-L442 VanDerWaalsContact O-N 3.12Å; L442-Y444 PolarHBondContact O-N 2.99Å; L442-Q445 PolarHBondContact O-N 3.32Å; L442-C446 VanDerWaalsContact CD2-SG 3.56Å; L442-C446 WeakPolarHBondContact O-CB 3.41Å; L442-C446 PolarHBondContact O-N 2.72Å; L442-C446 PolarHBondContact O-SG 3.37Å
443	V	92.6	Very high	89.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-54	-52.4	172.2	-178.3	0	0	0	0	110.4	S70 C71 S439 Q445 C446 A447 L464 V559 L563	S70-V443 VanDerWaalsContact C-CG2 3.44Å; S70-V443 WeakPolarHBondContact OG-CG2 3.39Å; C71-V443 VanDerWaalsContact CA-CG2 3.48Å; C71-V443 HydrophobicContact CB-CG1 4.15Å; C71-V443 HydrophobicContact CB-CG2 3.63Å; C71-V443 VanDerWaalsContact N-CG2 3.28Å; S439-V443 WeakPolarHBondContact O-CG2 3.48Å; S439-V443 PolarHBondContact O-N 3.27Å; V443-Q445 PolarHBondContact O-N 2.72Å; V443-C446 PolarHBondContact O-N 2.99Å; V443-A447 WeakPolarHBondContact O-CB 3.46Å; V443-A447 PolarHBondContact O-N 2.77Å; V443-L464 HydrophobicContact CG1-CD2 4.17Å; V443-V559 HydrophobicContact CB-CG1 3.95Å; V443-V559 HydrophobicContact CG1-CG1 3.76Å; V443-V559 HydrophobicContact CG2-CG1 4.38Å; V443-L563 HydrophobicContact CG1-CD1 3.66Å
444	Y	90.9	Very high	88.8	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-42.1	-177.9	165.6	-90.7	0	0	0	112.6	K140 A440 F441 L442 K448 P552 W553 Y554 L563	K140-Y444 PolarHBondContact NZ-OH 3.15Å; A440-Y444 PolarHBondContact O-N 2.93Å; F441-Y444 PolarHBondContact O-N 3.41Å; L442-Y444 PolarHBondContact O-N 2.99Å; Y444-K448 HydrophobicContact CE1-CD 4.01Å; Y444-K448 WeakPolarHBondContact O-CB 3.45Å; Y444-K448 PolarHBondContact O-N 2.94Å; Y444-P552 PolarHBondContact OH-O 3.04Å; Y444-W553 HydrophobicContact CD1-CE3 4.18Å; Y444-W553 AromaticContact CD1-CZ3 3.93Å; Y444-W553 HydrophobicContact CD1-CZ3 3.93Å; Y444-W553 HydrophobicContact CD2-CE3 4.44Å; Y444-W553 AromaticContact CE1-CE3 3.69Å; Y444-W553 HydrophobicContact CE1-CE3 3.69Å; Y444-W553 AromaticContact CE1-CZ3 3.48Å; Y444-W553 HydrophobicContact CE1-CZ3 3.48Å; Y444-W553 VanDerWaalsContact CE1-CZ3 3.48Å; Y444-W553 AromaticContact CE2-CE3 3.96Å; Y444-W553 HydrophobicContact CE2-CE3 3.96Å; Y444-W553 AromaticContact CZ-CE3 3.55Å; Y444-W553 AromaticContact CZ-CZ3 3.83Å; Y444-Y554 VanDerWaalsContact CB-CD1 3.4Å; Y444-Y554 HydrophobicContact CD1-CD1 4.25Å; Y444-Y554 HydrophobicContact CD1-CE1 4.41Å; Y444-Y554 AromaticContact CD2-CD1 3.59Å; Y444-Y554 HydrophobicContact CD2-CD1 3.59Å; Y444-Y554 HydrophobicContact CD2-CE1 4.5Å; Y444-Y554 HydrophobicContact CD2-CG 4.28Å; Y444-Y554 HydrophobicContact CE2-CD1 4.42Å; Y444-Y554 AromaticContact CG-CD1 3.48Å; Y444-Y554 HydrophobicContact CG-CD1 3.48Å; Y444-Y554 VanDerWaalsContact CG-CD1 3.48Å; Y444-Y554 AromaticContact CG-CE1 3.99Å; Y444-Y554 HydrophobicContact CG-CE1 3.99Å; Y444-Y554 HydrophobicContact CG-CG 4.37Å; Y444-L563 HydrophobicContact CD2-CD2 4.19Å
445	Q	90.1	Very high	88.6	Confident	57 Å²	57	31.2 Å²	31.2	27%	0.266	15%	0.15	S	C	.	.	H	α-helix	trans	-68.6	-41.8	178.5	-59.6	-65.7	-1	0	0	111.7	F441 L442 V443 K448 F449	F441-Q445 HydrophobicContact CD1-CG 4.18Å; F441-Q445 HydrophobicContact CE1-CG 3.85Å; F441-Q445 HydrophobicContact CE2-CG 4.46Å; F441-Q445 VanDerWaalsContact CE2-NE2 3.29Å; F441-Q445 HydrophobicContact CZ-CG 4.03Å; F441-Q445 WeakPolarHBondContact O-CG 3.45Å; F441-Q445 PolarHBondContact O-N 2.91Å; F441-Q445 VanDerWaalsContact O-N 3.07Å; L442-Q445 PolarHBondContact O-N 3.32Å; V443-Q445 PolarHBondContact O-N 2.72Å; Q445-K448 PolarHBondContact O-N 3.1Å; Q445-F449 WeakPolarHBondContact O-CB 3.46Å; Q445-F449 PolarHBondContact O-N 3.21Å
446	C	91.6	Very high	88.4	Confident	18 Å²	18	27.3 Å²	27.3	12%	0.122	13%	0.13	C	C	.	.	H	α-helix	trans	-66.4	-43.9	178.2	-66.7	0	0	0	0	111.8	I63 T67 L442 V443 F449 A450	I63-C446 HydrophobicContact CG2-CB 4.18Å; T67-C446 HydrophobicContact CG2-CB 3.46Å; T67-C446 VanDerWaalsContact CG2-CB 3.46Å; L442-C446 VanDerWaalsContact CD2-SG 3.56Å; L442-C446 WeakPolarHBondContact O-CB 3.41Å; L442-C446 PolarHBondContact O-N 2.72Å; L442-C446 PolarHBondContact O-SG 3.37Å; V443-C446 PolarHBondContact O-N 2.99Å; C446-F449 PolarHBondContact O-N 3.38Å; C446-A450 WeakPolarHBondContact O-CB 3.13Å; C446-A450 PolarHBondContact O-N 3.1Å
447	A	88.9	Confident	88.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.1	-50.8	172.9	0	0	0	0	0	112.5	V443 F449 A450 C451 F460 L563	V443-A447 WeakPolarHBondContact O-CB 3.46Å; V443-A447 PolarHBondContact O-N 2.77Å; A447-F449 VanDerWaalsContact C-N 3.3Å; A447-F449 PolarHBondContact O-N 3.12Å; A447-A450 PolarHBondContact O-N 3.33Å; A447-C451 PolarHBondContact O-N 2.54Å; A447-C451 PolarHBondContact O-SG 3.5Å; A447-F460 HydrophobicContact CB-CD2 3.46Å; A447-F460 VanDerWaalsContact CB-CD2 3.46Å; A447-F460 HydrophobicContact CB-CE2 3.61Å; A447-L563 HydrophobicContact CB-CD1 4.01Å; A447-L563 HydrophobicContact CB-CD2 4.2Å
448	K	87.1	Confident	88.2	Confident	43 Å²	43	37.1 Å²	37.1	19%	0.187	17%	0.172	C	C	.	.	H	α-helix	trans	-60	-36.9	175.9	169.1	-176	150.9	-151.2	0	112.5	Y444 Q445 K452 T545 F549	Y444-K448 HydrophobicContact CE1-CD 4.01Å; Y444-K448 WeakPolarHBondContact O-CB 3.45Å; Y444-K448 PolarHBondContact O-N 2.94Å; Q445-K448 PolarHBondContact O-N 3.1Å; K448-K452 WeakPolarHBondContact O-CG 3.36Å; K448-K452 PolarHBondContact O-N 2.99Å; K448-T545 HydrophobicContact CD-CG2 3.95Å; K448-T545 HydrophobicContact CG-CG2 4.21Å; K448-F549 HydrophobicContact CB-CE2 4.15Å
449	F	88.3	Confident	88	Confident	22 Å²	22	32.6 Å²	32.6	10%	0.096	15%	0.148	C	C	.	.	H	α-helix	trans	-69.4	-50	175.1	-173.1	-85.7	0	0	0	111.5	I63 Q445 C446 A447 C451 K452 T453 F1396 A1400 L1403	I63-F449 HydrophobicContact CD1-CD1 3.5Å; I63-F449 HydrophobicContact CD1-CE1 3.57Å; Q445-F449 WeakPolarHBondContact O-CB 3.46Å; Q445-F449 PolarHBondContact O-N 3.21Å; C446-F449 PolarHBondContact O-N 3.38Å; A447-F449 VanDerWaalsContact C-N 3.3Å; A447-F449 PolarHBondContact O-N 3.12Å; F449-C451 PolarHBondContact O-N 2.79Å; F449-K452 WeakPolarHBondContact O-CB 3.49Å; F449-K452 PolarHBondContact O-N 3.41Å; F449-T453 HydrophobicContact CD1-CG2 3.94Å; F449-T453 HydrophobicContact CE1-CG2 3.54Å; F449-T453 HydrophobicContact CE2-CG2 4.35Å; F449-T453 HydrophobicContact CZ-CG2 3.79Å; F449-T453 PolarHBondContact O-N 3.12Å; F449-T453 PolarHBondContact O-OG1 3.38Å; F449-T453 VanDerWaalsContact O-OG1 3.08Å; F449-F1396 AromaticContact CD2-CE1 3.61Å; F449-F1396 HydrophobicContact CD2-CE1 3.61Å; F449-F1396 HydrophobicContact CD2-CE2 4.23Å; F449-F1396 AromaticContact CD2-CZ 3.31Å; F449-F1396 HydrophobicContact CD2-CZ 3.31Å; F449-F1396 AromaticContact CE2-CE1 3.74Å; F449-F1396 HydrophobicContact CE2-CE1 3.74Å; F449-F1396 AromaticContact CE2-CE2 3.84Å; F449-F1396 HydrophobicContact CE2-CE2 3.84Å; F449-F1396 AromaticContact CE2-CZ 3.35Å; F449-F1396 HydrophobicContact CE2-CZ 3.35Å; F449-F1396 HydrophobicContact CG-CZ 4.36Å; F449-F1396 HydrophobicContact CZ-CZ 4.42Å; F449-A1400 HydrophobicContact CE2-CB 3.83Å; F449-A1400 HydrophobicContact CZ-CB 4.27Å; F449-L1403 HydrophobicContact CE1-CD1 4.15Å; F449-L1403 HydrophobicContact CZ-CD1 3.79Å
450	A	88.9	Confident	87.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57	-36.8	179.2	0	0	0	0	0	112.9	I63 C446 A447 T453 K454 M455 Q456 S459 F460	I63-A450 HydrophobicContact CG2-CB 4.16Å; C446-A450 WeakPolarHBondContact O-CB 3.13Å; C446-A450 PolarHBondContact O-N 3.1Å; A447-A450 PolarHBondContact O-N 3.33Å; A450-T453 PolarHBondContact O-OG1 3.41Å; A450-K454 PolarHBondContact O-N 3.39Å; A450-M455 HydrophobicContact CB-CB 4.28Å; A450-M455 PolarHBondContact O-N 2.91Å; A450-Q456 PolarHBondContact O-N 3.18Å; A450-Q456 VanDerWaalsContact O-N 3.16Å; A450-S459 WeakPolarHBondContact CB-O 3.35Å; A450-F460 HydrophobicContact CB-CB 4.13Å
451	C	85.6	Confident	87.9	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.007	15%	0.146	C	C	.	.	H	α-helix	trans	-69.5	-40.5	174.3	-63.3	0	0	0	0	112.2	A447 F449 L548	A447-C451 PolarHBondContact O-N 2.54Å; A447-C451 PolarHBondContact O-SG 3.5Å; F449-C451 PolarHBondContact O-N 2.79Å; C451-L548 HydrophobicContact CB-CD1 4.11Å; C451-L548 HydrophobicContact CB-CD2 4.12Å
452	K	82.1	Confident	87.9	Confident	52 Å²	52	32 Å²	32	23%	0.226	15%	0.147	C	C	.	.	H	α-helix	trans	-64.6	-37.4	176.7	-81.7	-174.7	169.6	-164.1	0	114	K448 F449 K454 L542 A543 L548	K448-K452 WeakPolarHBondContact O-CG 3.36Å; K448-K452 PolarHBondContact O-N 2.99Å; F449-K452 WeakPolarHBondContact O-CB 3.49Å; F449-K452 PolarHBondContact O-N 3.41Å; K452-K454 VanDerWaalsContact C-N 3.35Å; K452-L542 PolarHBondContact O-N 2.85Å; K452-L542 VanDerWaalsContact O-N 3.15Å; K452-A543 WeakPolarHBondContact CE-O 3.2Å; K452-L548 HydrophobicContact CB-CD1 4.48Å; K452-L548 HydrophobicContact CG-CD1 3.5Å
453	T	80.8	Confident	88	Confident	0 Å²	0	29 Å²	29	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	6.1	-176.6	55.7	0	0	0	0	114	F449 A450 M455 A1400 L1403	F449-T453 HydrophobicContact CD1-CG2 3.94Å; F449-T453 HydrophobicContact CE1-CG2 3.54Å; F449-T453 HydrophobicContact CE2-CG2 4.35Å; F449-T453 HydrophobicContact CZ-CG2 3.79Å; F449-T453 PolarHBondContact O-N 3.12Å; F449-T453 PolarHBondContact O-OG1 3.38Å; F449-T453 VanDerWaalsContact O-OG1 3.08Å; A450-T453 PolarHBondContact O-OG1 3.41Å; T453-M455 PolarHBondContact O-N 3Å; T453-M455 VanDerWaalsContact OG1-CG 3.23Å; T453-M455 WeakPolarHBondContact OG1-CG 3.23Å; T453-M455 PolarHBondContact OG1-SD 3.48Å; T453-A1400 HydrophobicContact CG2-CB 4.23Å; T453-L1403 HydrophobicContact CG2-CB 4.03Å
454	K	79.9	Confident	87.9	Confident	104 Å²	104	29.1 Å²	29.1	45%	0.452	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	19.8	-173.6	-57.1	-171.6	172.6	-164.7	0	114.5	A450 K452 Q456 C539 R541	A450-K454 PolarHBondContact O-N 3.39Å; K452-K454 VanDerWaalsContact C-N 3.35Å; K454-Q456 PolarHBondContact O-N 3.19Å; K454-C539 WeakPolarHBondContact CE-O 3.27Å; K454-C539 PolarHBondContact NZ-O 3.14Å; K454-R541 HydrophobicContact CD-CG 4.41Å
455	M	84.5	Confident	87.9	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	14%	0.14	C	C	.	.			trans	-78.9	-4.5	174.5	-64.7	174.3	164.9	0	0	113.7	K56 A59 Y60 I63 A450 T453 R457 I458 S459 L1403	K56-M455 HydrophobicContact CD-CE 4.39Å; K56-M455 HydrophobicContact CG-CE 3.82Å; A59-M455 HydrophobicContact CB-CE 3.89Å; Y60-M455 HydrophobicContact CD1-CB 4.02Å; Y60-M455 HydrophobicContact CD1-CG 4.12Å; Y60-M455 HydrophobicContact CD2-CE 4.11Å; Y60-M455 HydrophobicContact CD2-CG 4.37Å; Y60-M455 HydrophobicContact CE1-CB 3.54Å; Y60-M455 HydrophobicContact CE1-CG 3.7Å; Y60-M455 HydrophobicContact CE2-CE 4.25Å; Y60-M455 HydrophobicContact CE2-CG 3.99Å; Y60-M455 HydrophobicContact CG-CG 4.44Å; I63-M455 HydrophobicContact CD1-SD 3.77Å; A450-M455 HydrophobicContact CB-CB 4.28Å; A450-M455 PolarHBondContact O-N 2.91Å; T453-M455 PolarHBondContact O-N 3Å; T453-M455 VanDerWaalsContact OG1-CG 3.23Å; T453-M455 WeakPolarHBondContact OG1-CG 3.23Å; T453-M455 PolarHBondContact OG1-SD 3.48Å; M455-R457 VanDerWaalsContact C-N 3.32Å; M455-R457 PolarHBondContact O-N 3.19Å; M455-I458 PolarHBondContact O-N 3.15Å; M455-I458 VanDerWaalsContact O-N 3.14Å; M455-S459 PolarHBondContact O-N 3.16Å; M455-S459 VanDerWaalsContact O-N 3.09Å; M455-L1403 HydrophobicContact CE-CB 4.39Å; M455-L1403 HydrophobicContact CE-CD2 4.08Å
456	Q	86.2	Confident	87.9	Confident	3 Å²	3	29.6 Å²	29.6	1%	0.014	14%	0.141	C	C	.	.	H	α-helix	trans	-42.3	-42	-168.7	-174.6	176.1	-44.5	0	0	116.9	A450 K454 I458 F460 A461 V534 P537	A450-Q456 PolarHBondContact O-N 3.18Å; A450-Q456 VanDerWaalsContact O-N 3.16Å; K454-Q456 PolarHBondContact O-N 3.19Å; Q456-I458 PolarHBondContact O-N 3.22Å; Q456-F460 HydrophobicContact CG-CB 4.26Å; Q456-F460 HydrophobicContact CG-CD1 3.72Å; Q456-F460 HydrophobicContact CG-CG 4.36Å; Q456-F460 WeakPolarHBondContact O-CB 3.41Å; Q456-F460 PolarHBondContact O-N 3.3Å; Q456-F460 VanDerWaalsContact O-N 3.16Å; Q456-A461 PolarHBondContact O-N 2.99Å; Q456-V534 PolarHBondContact NE2-O 3.29Å; Q456-P537 HydrophobicContact CB-CG 4.34Å; Q456-P537 HydrophobicContact CG-CG 4.37Å
457	R	86.6	Confident	88	Confident	146 Å²	146	28.8 Å²	28.8	55%	0.551	14%	0.135	S	C	*	.	I	π-helix	trans	-60.8	-46.9	-177.5	-76.2	-179.9	169	170.9	-3.2	112.5	M455 L462 W535	M455-R457 VanDerWaalsContact C-N 3.32Å; M455-R457 PolarHBondContact O-N 3.19Å; R457-L462 PolarHBondContact O-N 3.35Å; R457-W535 PolarHBondContact NE-O 3.26Å; R457-W535 PolarHBondContact NH2-O 3.35Å
458	I	88.4	Confident	87.9	Confident	93 Å²	93	28.9 Å²	28.9	48%	0.477	14%	0.135	S	C	.	.	I	π-helix	trans	-89.3	-44.8	-173.5	-62.3	172.1	0	0	0	110.3	Y60 F64 M455 Q456 P463	Y60-I458 HydrophobicContact CD1-CB 3.91Å; Y60-I458 HydrophobicContact CD1-CD1 4.31Å; Y60-I458 HydrophobicContact CD1-CG2 4.08Å; Y60-I458 HydrophobicContact CE1-CB 3.94Å; Y60-I458 HydrophobicContact CE1-CD1 4.06Å; Y60-I458 HydrophobicContact CE1-CG1 4.4Å; F64-I458 VanDerWaalsContact CD2-O 3.32Å; F64-I458 WeakPolarHBondContact CD2-O 3.25Å; M455-I458 PolarHBondContact O-N 3.15Å; M455-I458 VanDerWaalsContact O-N 3.14Å; Q456-I458 PolarHBondContact O-N 3.22Å; I458-P463 WeakPolarHBondContact O-CD 3.38Å
459	S	89.2	Confident	88.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-106.8	20.3	-170.4	-47	0	0	0	0	114.5	Y60 A450 M455	Y60-S459 WeakPolarHBondContact CD1-OG 3.23Å; Y60-S459 PolarHBondContact O-OG 3.15Å; A450-S459 WeakPolarHBondContact CB-O 3.35Å; M455-S459 PolarHBondContact O-N 3.16Å; M455-S459 VanDerWaalsContact O-N 3.09Å
460	F	90.8	Very high	88.2	Confident	1 Å²	1	32.2 Å²	32.2	0%	0.004	16%	0.158	C	C	.	.	I	π-helix	trans	-145.2	-59.3	170.4	170.5	-99.2	0	0	0	111.8	A447 A450 Q456 P463 L464 V534 F549 L563 L564 Q567	A447-F460 HydrophobicContact CB-CD2 3.46Å; A447-F460 VanDerWaalsContact CB-CD2 3.46Å; A447-F460 HydrophobicContact CB-CE2 3.61Å; A450-F460 HydrophobicContact CB-CB 4.13Å; Q456-F460 HydrophobicContact CG-CB 4.26Å; Q456-F460 HydrophobicContact CG-CD1 3.72Å; Q456-F460 HydrophobicContact CG-CG 4.36Å; Q456-F460 WeakPolarHBondContact O-CB 3.41Å; Q456-F460 PolarHBondContact O-N 3.3Å; Q456-F460 VanDerWaalsContact O-N 3.16Å; F460-P463 WeakPolarHBondContact O-CG 3.42Å; F460-L464 HydrophobicContact CD2-CD1 3.58Å; F460-L464 HydrophobicContact CE1-CD1 4.48Å; F460-L464 HydrophobicContact CE2-CD1 3.32Å; F460-L464 HydrophobicContact CG-CD1 4.29Å; F460-L464 HydrophobicContact CZ-CD1 3.84Å; F460-L464 WeakPolarHBondContact O-CB 3.33Å; F460-L464 VanDerWaalsContact O-CG 3.27Å; F460-L464 WeakPolarHBondContact O-CG 3.36Å; F460-L464 PolarHBondContact O-N 3.28Å; F460-V534 HydrophobicContact CD1-CG1 3.84Å; F460-V534 HydrophobicContact CE1-CG1 3.59Å; F460-F549 HydrophobicContact CE2-CE1 4.4Å; F460-F549 HydrophobicContact CE2-CZ 4.39Å; F460-F549 HydrophobicContact CZ-CE1 4.18Å; F460-L563 HydrophobicContact CE2-CB 4.02Å; F460-L563 HydrophobicContact CZ-CB 4.24Å; F460-L564 HydrophobicContact CE1-CD2 4.37Å; F460-Q567 VanDerWaalsContact CE1-OE1 3.3Å
461	A	90.5	Very high	88.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.161	C	C	.	.	I	π-helix	trans	-62.4	-59.4	-175	0	0	0	0	0	111.2	Q456 L464 T465 V534 W535	Q456-A461 PolarHBondContact O-N 2.99Å; A461-L464 PolarHBondContact O-N 3.27Å; A461-T465 WeakPolarHBondContact O-CG2 3.47Å; A461-T465 PolarHBondContact O-N 2.94Å; A461-T465 PolarHBondContact O-OG1 3.45Å; A461-T465 VanDerWaalsContact O-OG1 3.06Å; A461-V534 HydrophobicContact CB-CG1 3.72Å; A461-W535 HydrophobicContact CB-CD2 3.98Å; A461-W535 HydrophobicContact CB-CE3 4.23Å; A461-W535 HydrophobicContact CB-CH2 4.24Å; A461-W535 HydrophobicContact CB-CZ2 3.96Å; A461-W535 HydrophobicContact CB-CZ3 4.36Å
462	L	91.7	Very high	88.4	Confident	67 Å²	67	32.7 Å²	32.7	35%	0.351	16%	0.16	S	C	.	.	H	α-helix	trans	-57.2	-53.9	-179	-164.5	147.3	0	0	0	113.4	F64 R457 L464 T465 C466 W535	F64-L462 HydrophobicContact CE2-CD2 3.68Å; F64-L462 HydrophobicContact CZ-CD2 4.13Å; R457-L462 PolarHBondContact O-N 3.35Å; L462-L464 PolarHBondContact O-N 3.14Å; L462-T465 WeakPolarHBondContact CA-OG1 3.43Å; L462-T465 PolarHBondContact O-N 3.35Å; L462-T465 PolarHBondContact O-OG1 3.37Å; L462-C466 WeakPolarHBondContact O-CB 3.28Å; L462-C466 PolarHBondContact O-N 3.36Å; L462-C466 PolarHBondContact O-SG 3.39Å; L462-W535 HydrophobicContact CB-CH2 3.76Å; L462-W535 HydrophobicContact CB-CZ3 4.3Å; L462-W535 HydrophobicContact CD1-CH2 4.34Å; L462-W535 HydrophobicContact CG-CH2 4.18Å
463	P	92.9	Very high	88.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-46.1	-179.3	21.1	-31.7	0	0	0	111.9	F64 T67 L68 I458 F460 T465 C466 V467	F64-P463 HydrophobicContact CD2-CB 3.99Å; F64-P463 HydrophobicContact CD2-CG 3.92Å; F64-P463 HydrophobicContact CE2-CB 3.86Å; F64-P463 HydrophobicContact CE2-CG 4.16Å; T67-P463 WeakPolarHBondContact OG1-CG 3.37Å; L68-P463 HydrophobicContact CB-CB 4.09Å; L68-P463 HydrophobicContact CD1-CB 4.39Å; I458-P463 WeakPolarHBondContact O-CD 3.38Å; F460-P463 WeakPolarHBondContact O-CG 3.42Å; P463-T465 VanDerWaalsContact C-N 3.29Å; P463-T465 PolarHBondContact O-N 3.17Å; P463-C466 PolarHBondContact O-N 3.36Å; P463-V467 VanDerWaalsContact O-CG2 3.3Å; P463-V467 WeakPolarHBondContact O-CG2 3.38Å; P463-V467 PolarHBondContact O-N 2.83Å
464	L	91	Very high	88.9	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-30	179.4	-65.9	-178.8	0	0	0	113.2	C71 V443 F460 A461 L462 E560 L563 L564	C71-L464 HydrophobicContact CB-CD2 4.38Å; V443-L464 HydrophobicContact CG1-CD2 4.17Å; F460-L464 HydrophobicContact CD2-CD1 3.58Å; F460-L464 HydrophobicContact CE1-CD1 4.48Å; F460-L464 HydrophobicContact CE2-CD1 3.32Å; F460-L464 HydrophobicContact CG-CD1 4.29Å; F460-L464 HydrophobicContact CZ-CD1 3.84Å; F460-L464 WeakPolarHBondContact O-CB 3.33Å; F460-L464 VanDerWaalsContact O-CG 3.27Å; F460-L464 WeakPolarHBondContact O-CG 3.36Å; F460-L464 PolarHBondContact O-N 3.28Å; A461-L464 PolarHBondContact O-N 3.27Å; L462-L464 PolarHBondContact O-N 3.14Å; L464-E560 HydrophobicContact CB-CB 4.49Å; L464-E560 HydrophobicContact CD2-CB 4.07Å; L464-L563 HydrophobicContact CD1-CB 3.84Å; L464-L563 HydrophobicContact CD1-CD1 4.11Å; L464-L564 HydrophobicContact CB-CD1 4.21Å; L464-L564 HydrophobicContact CB-CD2 4.14Å; L464-L564 HydrophobicContact CB-CG 4.19Å; L464-L564 HydrophobicContact CD1-CD2 4.3Å; L464-L564 HydrophobicContact CD1-CG 4.3Å
465	T	90	Very high	89.1	Confident	29 Å²	29	29.3 Å²	29.3	18%	0.178	16%	0.158	C	C	.	.	H	α-helix	trans	-75.5	-23.9	170.3	53.7	0	0	0	0	113.9	A461 L462 P463 P469 F528 W535	A461-T465 WeakPolarHBondContact O-CG2 3.47Å; A461-T465 PolarHBondContact O-N 2.94Å; A461-T465 PolarHBondContact O-OG1 3.45Å; A461-T465 VanDerWaalsContact O-OG1 3.06Å; L462-T465 WeakPolarHBondContact CA-OG1 3.43Å; L462-T465 PolarHBondContact O-N 3.35Å; L462-T465 PolarHBondContact O-OG1 3.37Å; P463-T465 VanDerWaalsContact C-N 3.29Å; P463-T465 PolarHBondContact O-N 3.17Å; T465-P469 VanDerWaalsContact O-CD 3.25Å; T465-P469 WeakPolarHBondContact O-CD 3.22Å; T465-F528 HydrophobicContact CG2-CD2 4.28Å; T465-W535 HydrophobicContact CG2-CZ2 4.09Å
466	C	91.5	Very high	89	Confident	41 Å²	41	29.4 Å²	29.4	28%	0.277	16%	0.158	S	C	.	.	H	α-helix	trans	-88.4	-26.7	180	-69.4	0	0	0	0	114	L68 L462 P463 Q468 P469 L470	L68-C466 HydrophobicContact CD1-CB 4.49Å; L462-C466 WeakPolarHBondContact O-CB 3.28Å; L462-C466 PolarHBondContact O-N 3.36Å; L462-C466 PolarHBondContact O-SG 3.39Å; P463-C466 PolarHBondContact O-N 3.36Å; C466-Q468 VanDerWaalsContact C-N 3.32Å; C466-Q468 PolarHBondContact O-N 3.05Å; C466-P469 VanDerWaalsContact O-CD 3.29Å; C466-P469 WeakPolarHBondContact O-CD 3.28Å; C466-P469 WeakPolarHBondContact O-CG 3.16Å; C466-L470 HydrophobicContact CB-CD1 4.12Å; C466-L470 VanDerWaalsContact O-CB 3.3Å; C466-L470 WeakPolarHBondContact O-CB 3.23Å; C466-L470 WeakPolarHBondContact O-CD1 3.09Å; C466-L470 VanDerWaalsContact O-CG 3.29Å; C466-L470 WeakPolarHBondContact O-CG 3.44Å; C466-L470 PolarHBondContact O-N 3.26Å
467	V	92.4	Very high	88.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-54.1	-48.1	179.4	172.5	0	0	0	0	111.1	L68 C71 I72 P463 L470 L471 E560	L68-V467 HydrophobicContact CD1-CG2 3.91Å; C71-V467 HydrophobicContact CB-CG1 4.33Å; C71-V467 HydrophobicContact CB-CG2 3.69Å; I72-V467 HydrophobicContact CG1-CB 4.45Å; I72-V467 HydrophobicContact CG1-CG1 3.96Å; I72-V467 HydrophobicContact CG1-CG2 4.25Å; P463-V467 VanDerWaalsContact O-CG2 3.3Å; P463-V467 WeakPolarHBondContact O-CG2 3.38Å; P463-V467 PolarHBondContact O-N 2.83Å; V467-L470 PolarHBondContact O-N 3.31Å; V467-L471 VanDerWaalsContact O-CB 3.23Å; V467-L471 WeakPolarHBondContact O-CB 3.02Å; V467-L471 PolarHBondContact O-N 3.14Å; V467-E560 WeakPolarHBondContact CG1-OE2 3.32Å
468	Q	88.3	Confident	88.6	Confident	2 Å²	2	27 Å²	27	1%	0.009	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-50.8	-174.1	-160	161.4	20.3	0	0	114	L189 T192 S193 C466 L471 V472 I524 Q527 E560	L189-Q468 HydrophobicContact CD1-CG 4.38Å; L189-Q468 PolarHBondContact O-NE2 3.47Å; T192-Q468 PolarHBondContact OG1-NE2 3.03Å; T192-Q468 VanDerWaalsContact OG1-NE2 3.08Å; S193-Q468 PolarHBondContact OG-NE2 3.06Å; C466-Q468 VanDerWaalsContact C-N 3.32Å; C466-Q468 PolarHBondContact O-N 3.05Å; Q468-L471 PolarHBondContact O-N 3.36Å; Q468-V472 WeakPolarHBondContact O-CG2 3.43Å; Q468-V472 PolarHBondContact O-N 3.14Å; Q468-I524 HydrophobicContact CG-CD1 4.5Å; Q468-Q527 VanDerWaalsContact OE1-NE2 3.1Å; Q468-E560 WeakPolarHBondContact CB-OE1 3.27Å; Q468-E560 VanDerWaalsContact CD-OE1 3.29Å; Q468-E560 PolarHBondContact OE1-OE1 3.13Å
469	P	90	Very high	88.1	Confident	42 Å²	42	22.6 Å²	22.6	27%	0.273	13%	0.134	S	C	.	.	H	α-helix	trans	-65.9	-37.8	173.8	24.6	-32.8	0	0	0	113.4	T465 C466 L471 V472 V473 W520 I524	T465-P469 VanDerWaalsContact O-CD 3.25Å; T465-P469 WeakPolarHBondContact O-CD 3.22Å; C466-P469 VanDerWaalsContact O-CD 3.29Å; C466-P469 WeakPolarHBondContact O-CD 3.28Å; C466-P469 WeakPolarHBondContact O-CG 3.16Å; P469-L471 VanDerWaalsContact C-N 3.34Å; P469-L471 PolarHBondContact O-N 3.02Å; P469-V472 PolarHBondContact O-N 2.93Å; P469-V473 WeakPolarHBondContact O-CB 3.47Å; P469-V473 WeakPolarHBondContact O-CG2 3.34Å; P469-V473 PolarHBondContact O-N 3.32Å; P469-W520 HydrophobicContact CB-CH2 4.12Å; P469-W520 HydrophobicContact CB-CZ2 4.26Å; P469-I524 HydrophobicContact CB-CD1 4.43Å
470	L	91.8	Very high	87.6	Confident	94 Å²	94	23.5 Å²	23.5	49%	0.492	14%	0.14	S	C	.	.	H	α-helix	trans	-61.9	-41.8	175.6	-76.4	167.7	0	0	0	112	L68 I72 C466 V467 G474	L68-L470 HydrophobicContact CD1-CD1 3.95Å; I72-L470 HydrophobicContact CD1-CD1 4.49Å; C466-L470 HydrophobicContact CB-CD1 4.12Å; C466-L470 VanDerWaalsContact O-CB 3.3Å; C466-L470 WeakPolarHBondContact O-CB 3.23Å; C466-L470 WeakPolarHBondContact O-CD1 3.09Å; C466-L470 VanDerWaalsContact O-CG 3.29Å; C466-L470 WeakPolarHBondContact O-CG 3.44Å; C466-L470 PolarHBondContact O-N 3.26Å; V467-L470 PolarHBondContact O-N 3.31Å; L470-G474 WeakPolarHBondContact O-CA 3.42Å; L470-G474 PolarHBondContact O-N 3Å
471	L	90.2	Very high	87	Confident	10 Å²	10	26.2 Å²	26.2	5%	0.052	16%	0.159	C	C	.	.	H	α-helix	trans	-75	-36.1	-179.5	-173.4	63.8	0	0	0	112.2	I72 K75 A76 L79 L189 V467 Q468 P469 M475	I72-L471 HydrophobicContact CG2-CD1 4.42Å; K75-L471 HydrophobicContact CB-CD2 3.86Å; K75-L471 HydrophobicContact CD-CD2 4.37Å; K75-L471 HydrophobicContact CG-CD2 3.92Å; A76-L471 HydrophobicContact CB-CD1 3.8Å; L79-L471 HydrophobicContact CD1-CD2 4.27Å; L189-L471 HydrophobicContact CD1-CD2 4.12Å; L189-L471 HydrophobicContact CD2-CB 3.96Å; L189-L471 HydrophobicContact CD2-CD2 3.83Å; L189-L471 HydrophobicContact CD2-CG 3.58Å; V467-L471 VanDerWaalsContact O-CB 3.23Å; V467-L471 WeakPolarHBondContact O-CB 3.02Å; V467-L471 PolarHBondContact O-N 3.14Å; Q468-L471 PolarHBondContact O-N 3.36Å; P469-L471 VanDerWaalsContact C-N 3.34Å; P469-L471 PolarHBondContact O-N 3.02Å; L471-M475 HydrophobicContact CD1-CG 3.84Å; L471-M475 HydrophobicContact CD1-SD 4.42Å; L471-M475 HydrophobicContact CG-CG 4.18Å; L471-M475 VanDerWaalsContact O-CB 3.27Å; L471-M475 WeakPolarHBondContact O-CB 3.11Å; L471-M475 WeakPolarHBondContact O-CG 3.1Å; L471-M475 PolarHBondContact O-N 3.42Å
472	V	87.9	Confident	86.2	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.2	-50.3	173.7	168.7	0	0	0	0	110.8	L189 Q468 P469 M475 A476 F511 W520	L189-V472 HydrophobicContact CB-CG2 4.43Å; L189-V472 HydrophobicContact CD2-CB 4.27Å; L189-V472 HydrophobicContact CD2-CG2 3.44Å; L189-V472 VanDerWaalsContact CD2-CG2 3.44Å; L189-V472 HydrophobicContact CG-CG2 3.55Å; Q468-V472 WeakPolarHBondContact O-CG2 3.43Å; Q468-V472 PolarHBondContact O-N 3.14Å; P469-V472 PolarHBondContact O-N 2.93Å; V472-M475 PolarHBondContact O-N 2.83Å; V472-A476 VanDerWaalsContact O-CB 3.32Å; V472-A476 WeakPolarHBondContact O-CB 3.42Å; V472-A476 PolarHBondContact O-N 2.94Å; V472-F511 HydrophobicContact CG1-CE1 4.19Å; V472-F511 HydrophobicContact CG1-CZ 3.67Å; V472-W520 HydrophobicContact CB-CH2 3.85Å; V472-W520 HydrophobicContact CB-CZ2 3.53Å; V472-W520 HydrophobicContact CG1-CD2 4.4Å; V472-W520 HydrophobicContact CG1-CE3 4.39Å; V472-W520 HydrophobicContact CG1-CH2 3.72Å; V472-W520 HydrophobicContact CG1-CZ2 3.72Å; V472-W520 HydrophobicContact CG1-CZ3 4.07Å; V472-W520 HydrophobicContact CG2-CH2 4.35Å; V472-W520 HydrophobicContact CG2-CZ2 3.54Å
473	V	86.4	Confident	85.2	Confident	41 Å²	41	28 Å²	28	25%	0.248	17%	0.165	C	C	.	.	H	α-helix	trans	-67.8	-39.5	179.8	178.6	0	0	0	0	110.9	P469 A476 M477	P469-V473 WeakPolarHBondContact O-CB 3.47Å; P469-V473 WeakPolarHBondContact O-CG2 3.34Å; P469-V473 PolarHBondContact O-N 3.32Å; V473-A476 PolarHBondContact O-N 3.07Å; V473-M477 HydrophobicContact CG1-CE 4.11Å; V473-M477 HydrophobicContact CG1-CG 4.48Å; V473-M477 HydrophobicContact CG1-SD 4.34Å; V473-M477 WeakPolarHBondContact O-CB 3.42Å; V473-M477 WeakPolarHBondContact O-CG 3.17Å; V473-M477 PolarHBondContact O-N 3.43Å
474	G	87.4	Confident	84.2	Confident	28 Å²	28	33.7 Å²	33.7	29%	0.289	19%	0.189	S	C	.	.	H	α-helix	trans	-61.5	-46	175.3	0	0	0	0	0	113.6	L470 M477 A478	L470-G474 WeakPolarHBondContact O-CA 3.42Å; L470-G474 PolarHBondContact O-N 3Å; G474-M477 PolarHBondContact O-N 3.27Å; G474-A478 WeakPolarHBondContact O-CB 3.36Å; G474-A478 PolarHBondContact O-N 3.31Å
475	M	83.7	Confident	83.2	Confident	17 Å²	17	38.6 Å²	38.6	8%	0.084	22%	0.216	C	C	.	.	H	α-helix	trans	-70.7	-32.7	177.3	-66.5	-69.8	-81.4	0	0	112.1	L80 A185 V186 L471 V472 C479 W499	L80-M475 HydrophobicContact CD2-CE 4.03Å; L80-M475 HydrophobicContact CG-CE 4.3Å; A185-M475 HydrophobicContact CB-CE 3.62Å; V186-M475 HydrophobicContact CG2-CB 4.14Å; L471-M475 HydrophobicContact CD1-CG 3.84Å; L471-M475 HydrophobicContact CD1-SD 4.42Å; L471-M475 HydrophobicContact CG-CG 4.18Å; L471-M475 VanDerWaalsContact O-CB 3.27Å; L471-M475 WeakPolarHBondContact O-CB 3.11Å; L471-M475 WeakPolarHBondContact O-CG 3.1Å; L471-M475 PolarHBondContact O-N 3.42Å; V472-M475 PolarHBondContact O-N 2.83Å; M475-C479 PolarHBondContact O-N 2.75Å; M475-W499 HydrophobicContact CE-CE3 3.9Å; M475-W499 HydrophobicContact CE-CH2 4.19Å; M475-W499 HydrophobicContact CE-CZ3 3.55Å; M475-W499 HydrophobicContact SD-CH2 4.4Å; M475-W499 HydrophobicContact SD-CZ3 4.28Å
476	A	82.1	Confident	82.1	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-46.9	171.9	0	0	0	0	0	111.7	V472 V473 A478 C479 T480 F511	V472-A476 VanDerWaalsContact O-CB 3.32Å; V472-A476 WeakPolarHBondContact O-CB 3.42Å; V472-A476 PolarHBondContact O-N 2.94Å; V473-A476 PolarHBondContact O-N 3.07Å; A476-A478 PolarHBondContact O-N 2.77Å; A476-C479 WeakPolarHBondContact O-CB 3.5Å; A476-C479 PolarHBondContact O-N 3.03Å; A476-C479 VanDerWaalsContact O-N 3.15Å; A476-T480 PolarHBondContact O-N 2.99Å; A476-T480 PolarHBondContact O-OG1 3.2Å; A476-F511 HydrophobicContact CB-CD1 4.35Å; A476-F511 HydrophobicContact CB-CD2 4.32Å; A476-F511 HydrophobicContact CB-CE1 4.37Å; A476-F511 HydrophobicContact CB-CE2 4.34Å; A476-F511 HydrophobicContact CB-CG 4.33Å; A476-F511 HydrophobicContact CB-CZ 4.36Å
477	M	82.6	Confident	81	Confident	84 Å²	84	39.6 Å²	39.6	41%	0.414	22%	0.218	S	C	.	.	H	α-helix	trans	-61	-42	174.7	-72.5	-174.7	-56	0	0	112.2	V473 G474 C479 T480 S481 L508	V473-M477 HydrophobicContact CG1-CE 4.11Å; V473-M477 HydrophobicContact CG1-CG 4.48Å; V473-M477 HydrophobicContact CG1-SD 4.34Å; V473-M477 WeakPolarHBondContact O-CB 3.42Å; V473-M477 WeakPolarHBondContact O-CG 3.17Å; V473-M477 PolarHBondContact O-N 3.43Å; G474-M477 PolarHBondContact O-N 3.27Å; M477-C479 VanDerWaalsContact C-N 3.29Å; M477-C479 PolarHBondContact O-N 2.94Å; M477-T480 WeakPolarHBondContact CA-OG1 3.33Å; M477-T480 PolarHBondContact O-N 2.95Å; M477-T480 PolarHBondContact O-OG1 3.47Å; M477-S481 PolarHBondContact O-N 3.2Å; M477-S481 PolarHBondContact O-OG 3.02Å; M477-L508 HydrophobicContact CG-CD1 3.71Å; M477-L508 HydrophobicContact CG-CD2 4.4Å; M477-L508 HydrophobicContact CG-CG 4.18Å; M477-L508 HydrophobicContact SD-CD1 4.04Å
478	A	80.7	Confident	79.7	Confident	15 Å²	15	41.9 Å²	41.9	12%	0.124	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-34.5	175.4	0	0	0	0	0	112.3	G474 A476 K482 L489 W499	G474-A478 WeakPolarHBondContact O-CB 3.36Å; G474-A478 PolarHBondContact O-N 3.31Å; A476-A478 PolarHBondContact O-N 2.77Å; A478-K482 VanDerWaalsContact O-CB 3.22Å; A478-K482 WeakPolarHBondContact O-CB 3.4Å; A478-K482 PolarHBondContact O-N 3.41Å; A478-L489 HydrophobicContact CB-CD2 4.12Å; A478-W499 HydrophobicContact CB-CH2 3.87Å; A478-W499 HydrophobicContact CB-CZ2 4.2Å
479	C	78.9	Confident	78.9	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-66.3	-48.4	170.5	-80.5	0	0	0	0	112.5	M475 A476 M477 S481 K482 Q483 W499 C501	M475-C479 PolarHBondContact O-N 2.75Å; A476-C479 WeakPolarHBondContact O-CB 3.5Å; A476-C479 PolarHBondContact O-N 3.03Å; A476-C479 VanDerWaalsContact O-N 3.15Å; M477-C479 VanDerWaalsContact C-N 3.29Å; M477-C479 PolarHBondContact O-N 2.94Å; C479-S481 VanDerWaalsContact C-N 3.33Å; C479-S481 PolarHBondContact O-N 3.13Å; C479-K482 PolarHBondContact O-N 3.03Å; C479-Q483 WeakPolarHBondContact O-CB 3.29Å; C479-Q483 PolarHBondContact O-N 3.22Å; C479-W499 VanDerWaalsContact SG-CZ3 3.52Å; C479-C501 WeakPolarHBondContact CA-SG 3.5Å; C479-C501 HydrophobicContact CB-CB 3.69Å; C479-C501 WeakPolarHBondContact CB-SG 3.13Å; C479-C501 WeakPolarHBondContact SG-CB 3.44Å; C479-C501 CovalentContact SG-SG 2.04Å; C479-C501 PolarHBondContact SG-SG 3.3Å
480	T	78.1	Confident	77.7	Confident	19 Å²	19	45.1 Å²	45.1	12%	0.117	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-37.6	178.9	50.3	0	0	0	0	112.3	A476 M477 Q483 K484	A476-T480 PolarHBondContact O-N 2.99Å; A476-T480 PolarHBondContact O-OG1 3.2Å; M477-T480 WeakPolarHBondContact CA-OG1 3.33Å; M477-T480 PolarHBondContact O-N 2.95Å; M477-T480 PolarHBondContact O-OG1 3.47Å; T480-Q483 PolarHBondContact O-N 3.15Å; T480-K484 PolarHBondContact O-N 2.94Å; T480-K484 VanDerWaalsContact O-N 3.09Å
481	S	78.7	Confident	76.4	Confident	57 Å²	57	45.9 Å²	45.9	40%	0.399	27%	0.265	S	S	.	.	H	α-helix	trans	-67.2	-42.8	174.8	-61.7	0	0	0	0	112.2	M477 C479 Q483 K484 D485 T488	M477-S481 PolarHBondContact O-N 3.2Å; M477-S481 PolarHBondContact O-OG 3.02Å; C479-S481 VanDerWaalsContact C-N 3.33Å; C479-S481 PolarHBondContact O-N 3.13Å; S481-Q483 PolarHBondContact O-N 3.14Å; S481-K484 PolarHBondContact O-N 3.29Å; S481-D485 PolarHBondContact O-N 3.26Å; S481-T488 VanDerWaalsContact C-OG1 3.25Å; S481-T488 PolarHBondContact O-OG1 3.22Å
482	K	73.6	Confident	75.5	Confident	40 Å²	40	51.8 Å²	51.8	17%	0.174	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-22.7	175.3	-172.1	-178.5	-179	-174.1	0	112.8	A478 C479 D485 L486 T488 W499	A478-K482 VanDerWaalsContact O-CB 3.22Å; A478-K482 WeakPolarHBondContact O-CB 3.4Å; A478-K482 PolarHBondContact O-N 3.41Å; C479-K482 PolarHBondContact O-N 3.03Å; K482-D485 WeakPolarHBondContact CA-O 3.17Å; K482-D485 CarbonylContact O-C 3.54Å; K482-L486 VanDerWaalsContact O-CA 3.31Å; K482-L486 WeakPolarHBondContact O-CA 3.43Å; K482-L486 PolarHBondContact O-N 2.94Å; K482-T488 WeakPolarHBondContact CA-OG1 3.46Å; K482-T488 PolarHBondContact N-OG1 3.03Å; K482-W499 HydrophobicContact CD-CZ2 4.42Å; K482-W499 PolarHBondContact NZ-O 3.01Å
483	Q	71.1	Confident	74.6	Confident	64 Å²	64	53.6 Å²	53.6	30%	0.299	30%	0.304	S	S	.	.	H	α-helix	trans	-84.2	-35.4	178.2	-171.7	166.1	-27.2	0	0	112.3	C479 T480 S481 T503 D506	C479-Q483 WeakPolarHBondContact O-CB 3.29Å; C479-Q483 PolarHBondContact O-N 3.22Å; T480-Q483 PolarHBondContact O-N 3.15Å; S481-Q483 PolarHBondContact O-N 3.14Å; Q483-T503 PolarHBondContact NE2-O 3.49Å; Q483-T503 PolarHBondContact OE1-O 3.02Å; Q483-D506 PolarHBondContact NE2-OD1 3.32Å
484	K	72.1	Confident	73.7	Confident	120 Å²	120	53.7 Å²	53.7	52%	0.522	31%	0.306	S	S	.	.	H	α-helix	trans	-76.2	-41.8	172.1	-67.7	-176.6	-179.1	177.3	0	112.4	T480 S481 D506 D507	T480-K484 PolarHBondContact O-N 2.94Å; T480-K484 VanDerWaalsContact O-N 3.09Å; S481-K484 PolarHBondContact O-N 3.29Å; K484-D506 WeakPolarHBondContact CE-O 3.45Å; K484-D506 PolarHBondContact NZ-O 3.09Å; K484-D507 IonicContact NZ-OD1 3.62Å; K484-D507 PolarHBondContact NZ-OD1 3.14Å
485	D	69.9	Low	72.5	Confident	104 Å²	104	56.8 Å²	56.8	56%	0.556	31%	0.313	S	S	*	.			trans	-131.4	104	174.7	-89	-49.1	0	0	0	110.2	S481 K482 C487 T488	S481-D485 PolarHBondContact O-N 3.26Å; K482-D485 WeakPolarHBondContact CA-O 3.17Å; K482-D485 CarbonylContact O-C 3.54Å; D485-C487 PolarHBondContact O-N 3.39Å; D485-T488 HydrophobicContact CB-CG2 3.54Å; D485-T488 PolarHBondContact O-N 2.89Å; D485-T488 PolarHBondContact O-OG1 3.26Å
486	L	66.4	Low	71.6	Confident	71 Å²	71	56.3 Å²	56.3	37%	0.372	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.6	179.3	-72.5	83.8	0	0	0	113.6	T93 K482	T93-L486 HydrophobicContact CG2-CD2 4.08Å; K482-L486 VanDerWaalsContact O-CA 3.31Å; K482-L486 WeakPolarHBondContact O-CA 3.43Å; K482-L486 PolarHBondContact O-N 2.94Å
487	C	69.5	Low	71.1	Confident	20 Å²	20	56.8 Å²	56.8	14%	0.135	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	0.9	179.2	-69.1	0	0	0	0	114.8	C95 K107 N109 D485	C95-C487 HydrophobicContact CB-CB 3.94Å; C95-C487 WeakPolarHBondContact CB-SG 3.45Å; C95-C487 WeakPolarHBondContact SG-CB 3.42Å; C95-C487 CovalentContact SG-SG 2.04Å; C95-C487 PolarHBondContact SG-SG 3.07Å; K107-C487 HydrophobicContact CB-CB 4.43Å; K107-C487 HydrophobicContact CD-CB 3.75Å; K107-C487 PolarHBondContact NZ-O 3.08Å; N109-C487 PolarHBondContact OD1-SG 2.85Å; D485-C487 PolarHBondContact O-N 3.39Å
488	T	65.2	Low	70.5	Confident	49 Å²	49	53 Å²	53	30%	0.301	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	156.9	173.1	53.2	0	0	0	0	111.8	S481 K482 D485 S490	S481-T488 VanDerWaalsContact C-OG1 3.25Å; S481-T488 PolarHBondContact O-OG1 3.22Å; K482-T488 WeakPolarHBondContact CA-OG1 3.46Å; K482-T488 PolarHBondContact N-OG1 3.03Å; D485-T488 HydrophobicContact CB-CG2 3.54Å; D485-T488 PolarHBondContact O-N 2.89Å; D485-T488 PolarHBondContact O-OG1 3.26Å; T488-S490 PolarHBondContact O-N 3.08Å
489	L	69.8	Low	70.1	Confident	58 Å²	58	52.7 Å²	52.7	30%	0.304	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	-2.7	-169.4	-85	74.5	0	0	0	116.7	A478 S491 I492 L493	A478-L489 HydrophobicContact CB-CD2 4.12Å; L489-S491 PolarHBondContact O-N 2.9Å; L489-I492 PolarHBondContact O-N 2.97Å; L489-L493 HydrophobicContact CB-CD1 4.22Å; L489-L493 HydrophobicContact CB-CG 4.46Å; L489-L493 HydrophobicContact CD2-CD1 3.89Å; L489-L493 HydrophobicContact CD2-CG 4.25Å; L489-L493 PolarHBondContact O-N 3.46Å
490	S	65.8	Low	69.5	Low	53 Å²	53	58.5 Å²	58.5	37%	0.371	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-7.7	-179.5	96.3	0	0	0	0	115.2	K107 T488	K107-S490 PolarHBondContact NZ-OG 3.34Å; T488-S490 PolarHBondContact O-N 3.08Å
491	S	65	Low	69.1	Low	111 Å²	111	59.1 Å²	59.1	78%	0.776	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-0.5	175.3	51.2	0	0	0	0	113.7	L489	L489-S491 PolarHBondContact O-N 2.9Å
492	I	70.3	Confident	68.3	Low	134 Å²	134	57.2 Å²	57.2	69%	0.687	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	-38.8	-175.5	-59.8	174.1	0	0	0	110.7	L489	L489-I492 PolarHBondContact O-N 2.97Å
493	L	69.1	Low	67.6	Low	38 Å²	38	56.1 Å²	56.1	20%	0.199	30%	0.299	C	S	.	.	S	Bend	trans	-93	131.8	171.9	-69.7	174.7	0	0	0	110	L80 L489	L80-L493 HydrophobicContact CD1-CD2 3.75Å; L489-L493 HydrophobicContact CB-CD1 4.22Å; L489-L493 HydrophobicContact CB-CG 4.46Å; L489-L493 HydrophobicContact CD2-CD1 3.89Å; L489-L493 HydrophobicContact CD2-CG 4.25Å; L489-L493 PolarHBondContact O-N 3.46Å
494	P	67.3	Low	67	Low	43 Å²	43	58.7 Å²	58.7	28%	0.279	33%	0.325	S	S	.	.			trans	-54.6	143.2	167.1	-25.4	32.5	0	0	0	112.2	N428 N496 F497	N428-P494 HydrophobicContact CB-CB 4.26Å; P494-N496 PolarHBondContact O-N 3.18Å; P494-F497 HydrophobicContact CB-CD2 4.12Å; P494-F497 HydrophobicContact CG-CD2 4.11Å; P494-F497 HydrophobicContact CG-CE2 4.27Å; P494-F497 PolarHBondContact O-N 3.21Å
495	E	61.7	Low	66.2	Low	93 Å²	93	53.9 Å²	53.9	44%	0.435	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-24.6	-177.3	-60.4	179.2	153.1	0	0	113.7	F497	E495-F497 PolarHBondContact O-N 3.27Å
496	N	65.2	Low	65.7	Low	6 Å²	6	53.2 Å²	53.2	3%	0.032	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-5.3	178.9	-51.7	0.3	0	0	0	114.2	W122 S424 N425 S429 P494 F498	W122-N496 HydrophobicContact CZ2-CB 3.85Å; W122-N496 WeakPolarHBondContact CZ2-O 3.31Å; W122-N496 PolarHBondContact NE1-O 3.09Å; S424-N496 WeakPolarHBondContact CB-OD1 3.4Å; N425-N496 PolarHBondContact O-ND2 3.09Å; N425-N496 VanDerWaalsContact O-ND2 3.1Å; S429-N496 PolarHBondContact OG-ND2 2.92Å; P494-N496 PolarHBondContact O-N 3.18Å; N496-F498 VanDerWaalsContact O-CE2 3.31Å; N496-F498 WeakPolarHBondContact O-CE2 3.44Å; N496-F498 PolarHBondContact O-N 3.28Å
497	F	71.6	Confident	65.9	Low	12 Å²	12	54.1 Å²	54.1	5%	0.053	31%	0.31	C	S	.	.			trans	-93	95.7	-171.2	-93	-69	0	0	0	115.5	L80 M81 W122 T432 P494 E495	L80-F497 HydrophobicContact CB-CD1 3.77Å; L80-F497 HydrophobicContact CB-CE1 3.68Å; M81-F497 HydrophobicContact CG-CE1 3.9Å; M81-F497 HydrophobicContact CG-CZ 3.95Å; W122-F497 HydrophobicContact CH2-CD1 4.3Å; W122-F497 HydrophobicContact CH2-CD2 4.29Å; W122-F497 AromaticContact CH2-CE1 3.67Å; W122-F497 HydrophobicContact CH2-CE1 3.67Å; W122-F497 AromaticContact CH2-CE2 3.68Å; W122-F497 HydrophobicContact CH2-CE2 3.68Å; W122-F497 AromaticContact CH2-CZ 3.32Å; W122-F497 HydrophobicContact CH2-CZ 3.32Å; W122-F497 HydrophobicContact CZ2-CD1 4.33Å; W122-F497 HydrophobicContact CZ2-CE1 4.12Å; W122-F497 HydrophobicContact CZ2-CE2 4.33Å; W122-F497 HydrophobicContact CZ2-CZ 4.11Å; W122-F497 AromaticContact CZ3-CE1 3.98Å; W122-F497 HydrophobicContact CZ3-CE1 3.98Å; W122-F497 HydrophobicContact CZ3-CE2 4.47Å; W122-F497 AromaticContact CZ3-CZ 3.72Å; W122-F497 HydrophobicContact CZ3-CZ 3.72Å; T432-F497 HydrophobicContact CG2-CE2 3.82Å; T432-F497 HydrophobicContact CG2-CZ 3.58Å; P494-F497 HydrophobicContact CB-CD2 4.12Å; P494-F497 HydrophobicContact CG-CD2 4.11Å; P494-F497 HydrophobicContact CG-CE2 4.27Å; P494-F497 PolarHBondContact O-N 3.21Å; E495-F497 PolarHBondContact O-N 3.27Å
498	F	70.6	Confident	66.1	Low	6 Å²	6	56 Å²	56	3%	0.026	32%	0.319	C	S	.	.			trans	-88.5	118.4	175.4	-40.5	-58.7	0	0	0	111	S84 W87 F92 I114 M331 N496	S84-F498 WeakPolarHBondContact CA-O 3.33Å; S84-F498 WeakPolarHBondContact CB-O 3.21Å; S84-F498 PolarHBondContact N-O 2.78Å; W87-F498 HydrophobicContact CB-CB 3.98Å; W87-F498 HydrophobicContact CD2-CB 4.06Å; W87-F498 HydrophobicContact CG-CB 3.6Å; F92-F498 AromaticContact CD1-CD1 3.84Å; F92-F498 HydrophobicContact CD1-CD1 3.84Å; F92-F498 HydrophobicContact CD1-CE1 4.17Å; F92-F498 HydrophobicContact CE1-CD1 4.06Å; F92-F498 HydrophobicContact CE1-CE1 4.43Å; F92-F498 HydrophobicContact CG-CD1 4.19Å; I114-F498 HydrophobicContact CD1-CB 4.11Å; I114-F498 HydrophobicContact CD1-CD1 3.6Å; I114-F498 HydrophobicContact CD1-CD2 3.77Å; I114-F498 HydrophobicContact CD1-CE1 3.95Å; I114-F498 HydrophobicContact CD1-CE2 4.1Å; I114-F498 HydrophobicContact CD1-CG 3.5Å; I114-F498 HydrophobicContact CD1-CZ 4.19Å; I114-F498 HydrophobicContact CG1-CD1 4.46Å; I114-F498 HydrophobicContact CG1-CE1 4.33Å; I114-F498 HydrophobicContact CG1-CE2 4.41Å; I114-F498 HydrophobicContact CG1-CZ 4.31Å; I114-F498 HydrophobicContact CG2-CE2 4.26Å; M331-F498 HydrophobicContact SD-CE1 4.37Å; M331-F498 HydrophobicContact SD-CZ 3.81Å; N496-F498 VanDerWaalsContact O-CE2 3.31Å; N496-F498 WeakPolarHBondContact O-CE2 3.44Å; N496-F498 PolarHBondContact O-N 3.28Å
499	W	71.5	Confident	66.7	Low	8 Å²	8	58.8 Å²	58.8	3%	0.03	33%	0.331	C	S	.	.			trans	-145.4	141.7	179	72.4	-68.4	0	0	0	112.2	L80 A185 M475 A478 C479 K482	L80-W499 HydrophobicContact CD2-CB 3.86Å; L80-W499 HydrophobicContact CD2-CD2 3.73Å; L80-W499 HydrophobicContact CD2-CE3 4.08Å; L80-W499 HydrophobicContact CD2-CG 3.65Å; A185-W499 HydrophobicContact CB-CE3 4.08Å; A185-W499 HydrophobicContact CB-CZ3 4.43Å; M475-W499 HydrophobicContact CE-CE3 3.9Å; M475-W499 HydrophobicContact CE-CH2 4.19Å; M475-W499 HydrophobicContact CE-CZ3 3.55Å; M475-W499 HydrophobicContact SD-CH2 4.4Å; M475-W499 HydrophobicContact SD-CZ3 4.28Å; A478-W499 HydrophobicContact CB-CH2 3.87Å; A478-W499 HydrophobicContact CB-CZ2 4.2Å; C479-W499 VanDerWaalsContact SG-CZ3 3.52Å; K482-W499 HydrophobicContact CD-CZ2 4.42Å; K482-W499 PolarHBondContact NZ-O 3.01Å
500	Y	66.7	Low	66.9	Low	123 Å²	123	59 Å²	59	48%	0.482	33%	0.332	S	S	.	.			trans	-102	129.4	-170.5	176.1	-114.8	0	0	0	112	W87 P502	W87-Y500 HydrophobicContact CZ2-CD2 4.44Å; Y500-P502 HydrophobicContact CD1-CB 4.38Å; Y500-P502 HydrophobicContact CE1-CB 3.75Å
501	C	70.4	Confident	67.5	Low	31 Å²	31	57.2 Å²	57.2	21%	0.209	32%	0.318	C	S	.	.			trans	-107.1	110.1	177.5	-71.1	0	0	0	0	109.9	C479 T503	C479-C501 WeakPolarHBondContact CA-SG 3.5Å; C479-C501 HydrophobicContact CB-CB 3.69Å; C479-C501 WeakPolarHBondContact CB-SG 3.13Å; C479-C501 WeakPolarHBondContact SG-CB 3.44Å; C479-C501 CovalentContact SG-SG 2.04Å; C479-C501 PolarHBondContact SG-SG 3.3Å; C501-T503 VanDerWaalsContact C-N 3.31Å; C501-T503 PolarHBondContact O-N 3.31Å
502	P	62	Low	68.2	Low	18 Å²	18	56.2 Å²	56.2	12%	0.117	30%	0.3	C	S	.	.			trans	-92.4	24.1	-176	37.5	-37.4	0	0	0	113.8	R187 Y500	R187-P502 HydrophobicContact CG-CG 4.1Å; Y500-P502 HydrophobicContact CD1-CB 4.38Å; Y500-P502 HydrophobicContact CE1-CB 3.75Å
503	T	59.3	Low	68.7	Low	17 Å²	17	58.4 Å²	58.4	10%	0.104	30%	0.299	C	S	.	.			trans	-96.4	115.7	-179.9	41.3	0	0	0	0	110.1	Q483 C501	Q483-T503 PolarHBondContact NE2-O 3.49Å; Q483-T503 PolarHBondContact OE1-O 3.02Å; C501-T503 VanDerWaalsContact C-N 3.31Å; C501-T503 PolarHBondContact O-N 3.31Å
504	S	56.9	Low	69.1	Low	118 Å²	118	59.2 Å²	59.2	83%	0.825	30%	0.302	S	S	*	.			trans	-100.9	35.6	-177.8	64.3	0	0	0	0	113
505	G	56.6	Low	69.6	Low	19 Å²	19	61.7 Å²	61.7	20%	0.196	32%	0.318	C	S	.	.	S	Bend	trans	-152.2	139.2	179.8	0	0	0	0	0	109.5	D507	G505-D507 PolarHBondContact O-N 3.46Å
506	D	59.4	Low	70.4	Confident	89 Å²	89	58.3 Å²	58.3	48%	0.476	30%	0.303	S	S	.	.	S	Bend	trans	-83.9	-11.4	-161.1	-55.8	-48.2	0	0	0	113.9	Q483 K484	Q483-D506 PolarHBondContact NE2-OD1 3.32Å; K484-D506 WeakPolarHBondContact CE-O 3.45Å; K484-D506 PolarHBondContact NZ-O 3.09Å
507	D	69.6	Low	71.1	Confident	90 Å²	90	58.2 Å²	58.2	48%	0.481	30%	0.303	S	S	.	.	S	Bend	trans	-121.5	148.9	-176.8	-79.9	-27.4	0	0	0	114.7	K484 G505 I509 D510	K484-D507 IonicContact NZ-OD1 3.62Å; K484-D507 PolarHBondContact NZ-OD1 3.14Å; G505-D507 PolarHBondContact O-N 3.46Å; D507-I509 PolarHBondContact O-N 2.97Å; D507-D510 PolarHBondContact O-N 3.44Å; D507-D510 VanDerWaalsContact O-N 3.1Å
508	L	73.8	Confident	71.8	Confident	59 Å²	59	65.7 Å²	65.7	31%	0.309	33%	0.331	S	S	.	.	H	α-helix	trans	-53.5	-25.6	179.7	-112.3	174.2	0	0	0	114.2	M477 F511 F512	M477-L508 HydrophobicContact CG-CD1 3.71Å; M477-L508 HydrophobicContact CG-CD2 4.4Å; M477-L508 HydrophobicContact CG-CG 4.18Å; M477-L508 HydrophobicContact SD-CD1 4.04Å; L508-F511 WeakPolarHBondContact O-CB 3.37Å; L508-F511 PolarHBondContact O-N 3.46Å; L508-F512 HydrophobicContact CD2-CE2 4.11Å; L508-F512 VanDerWaalsContact O-CD2 3.3Å; L508-F512 WeakPolarHBondContact O-CD2 3.47Å; L508-F512 PolarHBondContact O-N 3.07Å
509	I	77.5	Confident	72.4	Confident	109 Å²	109	66.3 Å²	66.3	56%	0.559	34%	0.337	S	S	*	.	H	α-helix	trans	-66.4	-38.7	-179.1	-63	174.3	0	0	0	110.9	D507 F511 F512 R513	D507-I509 PolarHBondContact O-N 2.97Å; I509-F511 VanDerWaalsContact C-N 3.33Å; I509-F511 PolarHBondContact O-N 2.85Å; I509-F512 PolarHBondContact O-N 2.81Å; I509-F512 VanDerWaalsContact O-N 3.17Å; I509-R513 PolarHBondContact O-N 2.95Å; I509-R513 VanDerWaalsContact O-N 3.16Å
510	D	74.5	Confident	73	Confident	62 Å²	62	66.1 Å²	66.1	33%	0.332	34%	0.336	S	S	.	.	H	α-helix	trans	-74.2	-25.9	-179.2	-70.1	-35.4	0	0	0	112.4	D507 F512 R513 Q514	D507-D510 PolarHBondContact O-N 3.44Å; D507-D510 VanDerWaalsContact O-N 3.1Å; D510-F512 VanDerWaalsContact C-N 3.32Å; D510-F512 PolarHBondContact O-N 3.04Å; D510-R513 PolarHBondContact O-N 3.28Å; D510-R513 WeakPolarHBondContact OD1-CD 3.34Å; D510-R513 IonicContact OD1-CZ 3.67Å; D510-R513 IonicContact OD1-NE 3.83Å; D510-R513 IonicContact OD1-NH1 2.74Å; D510-R513 PolarHBondContact OD1-NH1 3.04Å; D510-Q514 PolarHBondContact O-N 3.42Å
511	F	77.8	Confident	74	Confident	15 Å²	15	63.7 Å²	63.7	7%	0.066	33%	0.331	C	S	.	.	H	α-helix	trans	-60	-41.6	167.3	176.3	-103.6	0	0	0	111.8	V186 V472 A476 L508 I509 R513 Q514 T517	V186-F511 HydrophobicContact CG1-CE2 3.86Å; V186-F511 HydrophobicContact CG1-CZ 4.34Å; V472-F511 HydrophobicContact CG1-CE1 4.19Å; V472-F511 HydrophobicContact CG1-CZ 3.67Å; A476-F511 HydrophobicContact CB-CD1 4.35Å; A476-F511 HydrophobicContact CB-CD2 4.32Å; A476-F511 HydrophobicContact CB-CE1 4.37Å; A476-F511 HydrophobicContact CB-CE2 4.34Å; A476-F511 HydrophobicContact CB-CG 4.33Å; A476-F511 HydrophobicContact CB-CZ 4.36Å; L508-F511 WeakPolarHBondContact O-CB 3.37Å; L508-F511 PolarHBondContact O-N 3.46Å; I509-F511 VanDerWaalsContact C-N 3.33Å; I509-F511 PolarHBondContact O-N 2.85Å; F511-R513 VanDerWaalsContact C-N 3.31Å; F511-R513 PolarHBondContact O-N 3Å; F511-Q514 PolarHBondContact O-N 3.16Å; F511-T517 HydrophobicContact CD1-CG2 4.14Å; F511-T517 HydrophobicContact CE1-CG2 3.65Å; F511-T517 HydrophobicContact CZ-CG2 3.88Å; F511-T517 WeakPolarHBondContact O-CB 3.5Å; F511-T517 PolarHBondContact O-OG1 3.28Å
512	F	80.5	Confident	74.9	Confident	91 Å²	91	63.9 Å²	63.9	40%	0.399	33%	0.334	S	S	.	.	H	α-helix	trans	-74.1	-17.5	175.5	-73.1	-69.5	0	0	0	114.2	L508 I509 D510 T517 W518	L508-F512 HydrophobicContact CD2-CE2 4.11Å; L508-F512 VanDerWaalsContact O-CD2 3.3Å; L508-F512 WeakPolarHBondContact O-CD2 3.47Å; L508-F512 PolarHBondContact O-N 3.07Å; I509-F512 PolarHBondContact O-N 2.81Å; I509-F512 VanDerWaalsContact O-N 3.17Å; D510-F512 VanDerWaalsContact C-N 3.32Å; D510-F512 PolarHBondContact O-N 3.04Å; F512-T517 HydrophobicContact CD1-CG2 4.19Å; F512-W518 PolarHBondContact O-NE1 3.18Å
513	R	80.2	Confident	76.2	Confident	179 Å²	179	63.2 Å²	63.2	68%	0.675	33%	0.33	S	S	*	.	H	α-helix	trans	-80.4	-19.2	172.5	-73.7	165.4	165.8	171.2	-4.2	113.6	I509 D510 F511	I509-R513 PolarHBondContact O-N 2.95Å; I509-R513 VanDerWaalsContact O-N 3.16Å; D510-R513 PolarHBondContact O-N 3.28Å; D510-R513 WeakPolarHBondContact OD1-CD 3.34Å; D510-R513 IonicContact OD1-CZ 3.67Å; D510-R513 IonicContact OD1-NE 3.83Å; D510-R513 IonicContact OD1-NH1 2.74Å; D510-R513 PolarHBondContact OD1-NH1 3.04Å; F511-R513 VanDerWaalsContact C-N 3.31Å; F511-R513 PolarHBondContact O-N 3Å
514	Q	77.3	Confident	77.6	Confident	55 Å²	55	64.2 Å²	64.2	26%	0.257	33%	0.334	S	S	.	.	S	Bend	trans	-67.2	134.3	179.2	-69.2	-174.1	14.6	0	0	111.7	D510 F511 L516 T517	D510-Q514 PolarHBondContact O-N 3.42Å; F511-Q514 PolarHBondContact O-N 3.16Å; Q514-L516 PolarHBondContact O-N 2.89Å; Q514-T517 WeakPolarHBondContact O-CB 3.36Å; Q514-T517 PolarHBondContact O-N 3.46Å; Q514-T517 PolarHBondContact O-OG1 3.42Å
515	P	79.3	Confident	79.2	Confident	96 Å²	96	63.9 Å²	63.9	62%	0.623	32%	0.318	S	S	*	.	H	α-helix	trans	-65.2	-26.2	-178.1	25.4	-34.4	0	0	0	113	T517 W518 A519	P515-T517 PolarHBondContact O-N 2.94Å; P515-W518 PolarHBondContact O-N 2.91Å; P515-A519 PolarHBondContact O-N 3.28Å; P515-A519 VanDerWaalsContact O-N 3.09Å
516	L	77.4	Confident	80.8	Confident	22 Å²	22	63 Å²	63	12%	0.115	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-33.6	173.4	-176.5	61.7	0	0	0	112.2	R187 I237 Q514 A519 W520 W523	R187-L516 HydrophobicContact CB-CD2 4.41Å; R187-L516 HydrophobicContact CG-CD2 3.86Å; I237-L516 HydrophobicContact CD1-CD1 4.23Å; I237-L516 HydrophobicContact CG1-CD1 4.09Å; I237-L516 HydrophobicContact CG2-CD1 4.21Å; Q514-L516 PolarHBondContact O-N 2.89Å; L516-A519 PolarHBondContact O-N 2.88Å; L516-W520 WeakPolarHBondContact O-CB 3.48Å; L516-W520 PolarHBondContact O-N 2.72Å; L516-W523 HydrophobicContact CD1-CH2 4.21Å; L516-W523 HydrophobicContact CD1-CZ3 4.41Å
517	T	81	Confident	82.2	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-71.4	-35.9	-179.2	-44.3	0	0	0	0	111.2	F511 F512 Q514 P515 W520 L521	F511-T517 HydrophobicContact CD1-CG2 4.14Å; F511-T517 HydrophobicContact CE1-CG2 3.65Å; F511-T517 HydrophobicContact CZ-CG2 3.88Å; F511-T517 WeakPolarHBondContact O-CB 3.5Å; F511-T517 PolarHBondContact O-OG1 3.28Å; F512-T517 HydrophobicContact CD1-CG2 4.19Å; Q514-T517 WeakPolarHBondContact O-CB 3.36Å; Q514-T517 PolarHBondContact O-N 3.46Å; Q514-T517 PolarHBondContact O-OG1 3.42Å; P515-T517 PolarHBondContact O-N 2.94Å; T517-W520 HydrophobicContact CG2-CE3 4.09Å; T517-W520 HydrophobicContact CG2-CZ3 4.47Å; T517-W520 PolarHBondContact O-N 2.92Å; T517-L521 WeakPolarHBondContact O-CG 3.25Å; T517-L521 PolarHBondContact O-N 3.17Å
518	W	84.8	Confident	83.1	Confident	170 Å²	170	58.7 Å²	58.7	64%	0.644	28%	0.282	S	S	*	.	H	α-helix	trans	-70.7	-40.1	172.8	-71.1	87.4	0	0	0	112.5	F512 P515 W520 L521 A522	F512-W518 PolarHBondContact O-NE1 3.18Å; P515-W518 PolarHBondContact O-N 2.91Å; W518-W520 VanDerWaalsContact C-N 3.29Å; W518-W520 PolarHBondContact O-N 3.42Å; W518-L521 PolarHBondContact O-N 3.03Å; W518-A522 PolarHBondContact O-N 3.5Å; W518-A522 VanDerWaalsContact O-N 3.1Å
519	A	83.1	Confident	83.8	Confident	18 Å²	18	58.2 Å²	58.2	15%	0.149	28%	0.276	C	S	.	.	H	α-helix	trans	-60.3	-40.3	171.2	0	0	0	0	0	111.8	L233 P515 L516 A522 W523	L233-A519 HydrophobicContact CD2-CB 3.98Å; P515-A519 PolarHBondContact O-N 3.28Å; P515-A519 VanDerWaalsContact O-N 3.09Å; L516-A519 PolarHBondContact O-N 2.88Å; A519-A522 WeakPolarHBondContact O-CB 3.39Å; A519-A522 PolarHBondContact O-N 3.35Å; A519-W523 HydrophobicContact CB-CH2 4.35Å; A519-W523 HydrophobicContact CB-CZ2 4.21Å; A519-W523 VanDerWaalsContact O-CG 3.32Å; A519-W523 PolarHBondContact O-N 2.95Å
520	W	85.5	Confident	84.2	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.015	25%	0.25	C	C	.	.	H	α-helix	trans	-64.4	-43.2	175.5	167.6	68.7	0	0	0	113.7	C190 S193 P469 V472 L516 T517 W518 A522 W523 I524	C190-W520 HydrophobicContact CB-CB 4.25Å; C190-W520 HydrophobicContact CB-CG 4.12Å; S193-W520 VanDerWaalsContact OG-CD1 3.31Å; S193-W520 PolarHBondContact OG-NE1 2.96Å; P469-W520 HydrophobicContact CB-CH2 4.12Å; P469-W520 HydrophobicContact CB-CZ2 4.26Å; V472-W520 HydrophobicContact CB-CH2 3.85Å; V472-W520 HydrophobicContact CB-CZ2 3.53Å; V472-W520 HydrophobicContact CG1-CD2 4.4Å; V472-W520 HydrophobicContact CG1-CE3 4.39Å; V472-W520 HydrophobicContact CG1-CH2 3.72Å; V472-W520 HydrophobicContact CG1-CZ2 3.72Å; V472-W520 HydrophobicContact CG1-CZ3 4.07Å; V472-W520 HydrophobicContact CG2-CH2 4.35Å; V472-W520 HydrophobicContact CG2-CZ2 3.54Å; L516-W520 WeakPolarHBondContact O-CB 3.48Å; L516-W520 PolarHBondContact O-N 2.72Å; T517-W520 HydrophobicContact CG2-CE3 4.09Å; T517-W520 HydrophobicContact CG2-CZ3 4.47Å; T517-W520 PolarHBondContact O-N 2.92Å; W518-W520 VanDerWaalsContact C-N 3.29Å; W518-W520 PolarHBondContact O-N 3.42Å; W520-A522 VanDerWaalsContact C-N 3.28Å; W520-A522 PolarHBondContact O-N 3.17Å; W520-W523 HydrophobicContact CB-CE3 4.19Å; W520-W523 HydrophobicContact CB-CZ3 4.5Å; W520-W523 PolarHBondContact O-N 3.27Å; W520-W523 VanDerWaalsContact O-N 3.15Å; W520-I524 HydrophobicContact CD2-CD1 4.32Å; W520-I524 VanDerWaalsContact CE2-CD1 3.4Å; W520-I524 HydrophobicContact CH2-CD1 4.1Å; W520-I524 HydrophobicContact CZ2-CD1 3.29Å; W520-I524 PolarHBondContact O-N 3.43Å
521	L	88.3	Confident	84.9	Confident	73 Å²	73	50.2 Å²	50.2	38%	0.382	23%	0.234	S	C	.	.	H	α-helix	trans	-59.6	-39.5	173.3	-73	171.4	0	0	0	111.7	T517 W518 I524 F525	T517-L521 WeakPolarHBondContact O-CG 3.25Å; T517-L521 PolarHBondContact O-N 3.17Å; W518-L521 PolarHBondContact O-N 3.03Å; L521-I524 PolarHBondContact O-N 3.19Å; L521-F525 PolarHBondContact O-N 3.33Å
522	A	88.3	Confident	85.3	Confident	34 Å²	34	52.6 Å²	52.6	28%	0.281	25%	0.248	S	C	.	.	H	α-helix	trans	-64.2	-43.2	173.3	0	0	0	0	0	112.2	I226 W518 A519 W520 I524 F525 S526	I226-A522 HydrophobicContact CD1-CB 4.37Å; I226-A522 HydrophobicContact CG1-CB 4.45Å; I226-A522 HydrophobicContact CG2-CB 4.05Å; I226-A522 WeakPolarHBondContact CG2-O 3.42Å; W518-A522 PolarHBondContact O-N 3.5Å; W518-A522 VanDerWaalsContact O-N 3.1Å; A519-A522 WeakPolarHBondContact O-CB 3.39Å; A519-A522 PolarHBondContact O-N 3.35Å; W520-A522 VanDerWaalsContact C-N 3.28Å; W520-A522 PolarHBondContact O-N 3.17Å; A522-I524 VanDerWaalsContact C-N 3.35Å; A522-I524 PolarHBondContact O-N 3.23Å; A522-F525 PolarHBondContact O-N 3.4Å; A522-S526 PolarHBondContact O-N 2.83Å
523	W	89.1	Confident	85.3	Confident	4 Å²	4	50 Å²	50	2%	0.015	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-41.9	175.2	-62.9	-34	0	0	0	112.4	C190 C194 I226 A229 P230 I237 L516 A519 W520 S526 Q527	C190-W523 HydrophobicContact CB-CZ3 4.48Å; C194-W523 HydrophobicContact CB-CD2 4.16Å; C194-W523 HydrophobicContact CB-CG 4.24Å; I226-W523 PolarHBondContact O-NE1 3.17Å; A229-W523 HydrophobicContact CB-CZ2 4.49Å; P230-W523 HydrophobicContact CG-CZ2 4.3Å; I237-W523 HydrophobicContact CD1-CH2 4.32Å; L516-W523 HydrophobicContact CD1-CH2 4.21Å; L516-W523 HydrophobicContact CD1-CZ3 4.41Å; A519-W523 HydrophobicContact CB-CH2 4.35Å; A519-W523 HydrophobicContact CB-CZ2 4.21Å; A519-W523 VanDerWaalsContact O-CG 3.32Å; A519-W523 PolarHBondContact O-N 2.95Å; W520-W523 HydrophobicContact CB-CE3 4.19Å; W520-W523 HydrophobicContact CB-CZ3 4.5Å; W520-W523 PolarHBondContact O-N 3.27Å; W520-W523 VanDerWaalsContact O-N 3.15Å; W523-S526 PolarHBondContact O-N 3.39Å; W523-Q527 WeakPolarHBondContact O-CB 3.5Å; W523-Q527 PolarHBondContact O-N 3.03Å
524	I	89	Confident	85.5	Confident	39 Å²	39	41.5 Å²	41.5	20%	0.2	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-44.5	174.1	-75.6	-175.5	0	0	0	111.6	Q468 P469 W520 L521 A522 S526 Q527 F528	Q468-I524 HydrophobicContact CG-CD1 4.5Å; P469-I524 HydrophobicContact CB-CD1 4.43Å; W520-I524 HydrophobicContact CD2-CD1 4.32Å; W520-I524 VanDerWaalsContact CE2-CD1 3.4Å; W520-I524 HydrophobicContact CH2-CD1 4.1Å; W520-I524 HydrophobicContact CZ2-CD1 3.29Å; W520-I524 PolarHBondContact O-N 3.43Å; L521-I524 PolarHBondContact O-N 3.19Å; A522-I524 VanDerWaalsContact C-N 3.35Å; A522-I524 PolarHBondContact O-N 3.23Å; I524-S526 VanDerWaalsContact C-N 3.29Å; I524-S526 PolarHBondContact O-N 2.68Å; I524-Q527 PolarHBondContact O-N 3.04Å; I524-F528 WeakPolarHBondContact O-CB 3.21Å; I524-F528 PolarHBondContact O-N 2.92Å
525	F	90	Very high	85.8	Confident	111 Å²	111	41.5 Å²	41.5	49%	0.487	20%	0.202	S	C	.	.	H	α-helix	trans	-59.3	-41.3	176.3	-179.8	-95.9	0	0	0	111.9	L521 A522 F528 W529	L521-F525 PolarHBondContact O-N 3.33Å; A522-F525 PolarHBondContact O-N 3.4Å; F525-F528 PolarHBondContact O-N 3.3Å; F525-W529 PolarHBondContact O-N 3.4Å
526	S	90.4	Very high	85.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-40.8	176.3	176.9	0	0	0	0	113.3	C223 Q227 A522 W523 I524 F528 W529 T530	C223-S526 PolarHBondContact O-OG 2.99Å; Q227-S526 VanDerWaalsContact CG-OG 3.31Å; Q227-S526 WeakPolarHBondContact CG-OG 3.44Å; Q227-S526 PolarHBondContact NE2-OG 2.65Å; A522-S526 PolarHBondContact O-N 2.83Å; W523-S526 PolarHBondContact O-N 3.39Å; I524-S526 VanDerWaalsContact C-N 3.29Å; I524-S526 PolarHBondContact O-N 2.68Å; S526-F528 VanDerWaalsContact C-N 3.32Å; S526-F528 PolarHBondContact O-N 3.5Å; S526-W529 PolarHBondContact O-N 3.09Å; S526-T530 WeakPolarHBondContact O-CB 3.24Å; S526-T530 WeakPolarHBondContact O-CG2 3.26Å; S526-T530 PolarHBondContact O-N 3.05Å; S526-T530 PolarHBondContact O-OG1 2.89Å
527	Q	89.1	Confident	85.1	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-40.8	172.3	178.2	170.2	-63.1	0	0	111	S193 Q468 W523 I524 T530 T531 Y565	S193-Q527 PolarHBondContact O-OE1 3.25Å; Q468-Q527 VanDerWaalsContact OE1-NE2 3.1Å; W523-Q527 WeakPolarHBondContact O-CB 3.5Å; W523-Q527 PolarHBondContact O-N 3.03Å; I524-Q527 PolarHBondContact O-N 3.04Å; Q527-T530 PolarHBondContact O-OG1 2.66Å; Q527-T531 WeakPolarHBondContact O-CB 3.21Å; Q527-T531 VanDerWaalsContact O-CG2 3.27Å; Q527-T531 WeakPolarHBondContact O-CG2 3.45Å; Q527-T531 PolarHBondContact O-N 2.93Å; Q527-T531 VanDerWaalsContact O-N 3.16Å; Q527-T531 PolarHBondContact O-OG1 2.97Å; Q527-Y565 WeakPolarHBondContact CG-OH 3.27Å
528	F	88.5	Confident	84.2	Confident	80 Å²	80	50 Å²	50	35%	0.351	24%	0.235	S	C	.	.	H	α-helix	trans	-65	-44.5	175.6	-176.8	-92	0	0	0	112.4	T465 I524 F525 S526 T531 L532 W535	T465-F528 HydrophobicContact CG2-CD2 4.28Å; I524-F528 WeakPolarHBondContact O-CB 3.21Å; I524-F528 PolarHBondContact O-N 2.92Å; F525-F528 PolarHBondContact O-N 3.3Å; S526-F528 VanDerWaalsContact C-N 3.32Å; S526-F528 PolarHBondContact O-N 3.5Å; F528-T531 CarbonylContact O-C 3.58Å; F528-T531 PolarHBondContact O-N 3.36Å; F528-T531 PolarHBondContact O-OG1 3.03Å; F528-L532 HydrophobicContact CE1-CD1 4.06Å; F528-L532 HydrophobicContact CZ-CD1 4.5Å; F528-L532 PolarHBondContact O-N 2.72Å; F528-L532 VanDerWaalsContact O-N 3.13Å; F528-W535 AromaticContact CE2-CE2 3.67Å; F528-W535 AromaticContact CE2-CZ2 3.75Å; F528-W535 HydrophobicContact CE2-CZ2 3.75Å; F528-W535 AromaticContact CE2-NE1 3.54Å
529	W	88.5	Confident	83.1	Confident	50 Å²	50	43.4 Å²	43.4	19%	0.189	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-44.8	179.1	-177.6	-101.2	0	0	0	112.9	L216 V219 D220 C223 F525 S526 T531 L532	L216-W529 HydrophobicContact CD2-CH2 3.85Å; L216-W529 HydrophobicContact CD2-CZ2 3.98Å; V219-W529 HydrophobicContact CB-CH2 4.33Å; V219-W529 HydrophobicContact CB-CZ2 3.75Å; V219-W529 HydrophobicContact CG1-CD2 3.64Å; V219-W529 HydrophobicContact CG1-CE3 4.11Å; V219-W529 HydrophobicContact CG1-CG 4.07Å; V219-W529 HydrophobicContact CG1-CH2 4.14Å; V219-W529 HydrophobicContact CG1-CZ2 3.67Å; V219-W529 HydrophobicContact CG1-CZ3 4.34Å; V219-W529 HydrophobicContact CG2-CZ2 4.47Å; D220-W529 PolarHBondContact OD1-NE1 3.19Å; C223-W529 VanDerWaalsContact SG-CD1 3.58Å; F525-W529 PolarHBondContact O-N 3.4Å; S526-W529 PolarHBondContact O-N 3.09Å; W529-T531 PolarHBondContact O-N 3.01Å; W529-L532 HydrophobicContact CE3-CD2 4.16Å; W529-L532 HydrophobicContact CZ3-CD2 4.05Å; W529-L532 VanDerWaalsContact O-CB 3.24Å; W529-L532 WeakPolarHBondContact O-CB 3.4Å; W529-L532 PolarHBondContact O-N 2.82Å
530	T	85.8	Confident	82.1	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-67.3	-24	178	50.3	0	0	0	0	113.4	A200 Y264 S526 Q527	A200-T530 HydrophobicContact CB-CG2 3.9Å; Y264-T530 PolarHBondContact OH-O 2.87Å; S526-T530 WeakPolarHBondContact O-CB 3.24Å; S526-T530 WeakPolarHBondContact O-CG2 3.26Å; S526-T530 PolarHBondContact O-N 3.05Å; S526-T530 PolarHBondContact O-OG1 2.89Å; Q527-T530 PolarHBondContact O-OG1 2.66Å
531	T	88.2	Confident	81.2	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	8.9	176.6	61.7	0	0	0	0	113.4	Q527 F528 W529 H533 V534 L564 Y565	Q527-T531 WeakPolarHBondContact O-CB 3.21Å; Q527-T531 VanDerWaalsContact O-CG2 3.27Å; Q527-T531 WeakPolarHBondContact O-CG2 3.45Å; Q527-T531 PolarHBondContact O-N 2.93Å; Q527-T531 VanDerWaalsContact O-N 3.16Å; Q527-T531 PolarHBondContact O-OG1 2.97Å; F528-T531 CarbonylContact O-C 3.58Å; F528-T531 PolarHBondContact O-N 3.36Å; F528-T531 PolarHBondContact O-OG1 3.03Å; W529-T531 PolarHBondContact O-N 3.01Å; T531-H533 PolarHBondContact O-N 3.29Å; T531-V534 WeakPolarHBondContact O-CB 3.44Å; T531-V534 VanDerWaalsContact O-CG2 3.32Å; T531-V534 WeakPolarHBondContact O-CG2 3.44Å; T531-V534 PolarHBondContact O-N 2.97Å; T531-L564 HydrophobicContact CG2-CB 3.92Å; T531-Y565 HydrophobicContact CG2-CD1 3.79Å; T531-Y565 HydrophobicContact CG2-CE1 3.76Å
532	L	86.3	Confident	80.2	Confident	65 Å²	65	45.3 Å²	45.3	34%	0.34	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-55.9	-25.1	-174.4	-169.5	68.7	0	0	0	114.4	F528 W529 V534 W535	F528-L532 HydrophobicContact CE1-CD1 4.06Å; F528-L532 HydrophobicContact CZ-CD1 4.5Å; F528-L532 PolarHBondContact O-N 2.72Å; F528-L532 VanDerWaalsContact O-N 3.13Å; W529-L532 HydrophobicContact CE3-CD2 4.16Å; W529-L532 HydrophobicContact CZ3-CD2 4.05Å; W529-L532 VanDerWaalsContact O-CB 3.24Å; W529-L532 WeakPolarHBondContact O-CB 3.4Å; W529-L532 PolarHBondContact O-N 2.82Å; L532-V534 PolarHBondContact O-N 3.11Å; L532-W535 PolarHBondContact O-N 3.28Å; L532-W535 VanDerWaalsContact O-N 3.15Å
533	H	81.7	Confident	79	Confident	37 Å²	37	43.9 Å²	43.9	17%	0.171	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-63.9	-27.7	174.6	66.1	-80.6	0	0	0	113.3	T531 W535 Q536 Q567 R569	T531-H533 PolarHBondContact O-N 3.29Å; H533-W535 PolarHBondContact O-N 3.39Å; H533-Q536 CarbonylContact O-C 3.59Å; H533-Q536 PolarHBondContact O-N 3.01Å; H533-Q567 PolarHBondContact NE2-O 2.98Å; H533-R569 HydrophobicContact CB-CG 4.07Å
534	V	84.4	Confident	78	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-60.2	-23	174.5	175.5	0	0	0	0	111.9	Q456 F460 A461 T531 L532 L564 Q567	Q456-V534 PolarHBondContact NE2-O 3.29Å; F460-V534 HydrophobicContact CD1-CG1 3.84Å; F460-V534 HydrophobicContact CE1-CG1 3.59Å; A461-V534 HydrophobicContact CB-CG1 3.72Å; T531-V534 WeakPolarHBondContact O-CB 3.44Å; T531-V534 VanDerWaalsContact O-CG2 3.32Å; T531-V534 WeakPolarHBondContact O-CG2 3.44Å; T531-V534 PolarHBondContact O-N 2.97Å; L532-V534 PolarHBondContact O-N 3.11Å; V534-L564 HydrophobicContact CG1-CD2 4.14Å; V534-Q567 HydrophobicContact CG2-CB 4.38Å
535	W	83	Confident	77.1	Confident	54 Å²	54	46.9 Å²	46.9	21%	0.205	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-89.2	-10.9	177.8	-64.4	85	0	0	0	113.6	R457 A461 L462 T465 F528 L532 H533 P537	R457-W535 PolarHBondContact NE-O 3.26Å; R457-W535 PolarHBondContact NH2-O 3.35Å; A461-W535 HydrophobicContact CB-CD2 3.98Å; A461-W535 HydrophobicContact CB-CE3 4.23Å; A461-W535 HydrophobicContact CB-CH2 4.24Å; A461-W535 HydrophobicContact CB-CZ2 3.96Å; A461-W535 HydrophobicContact CB-CZ3 4.36Å; L462-W535 HydrophobicContact CB-CH2 3.76Å; L462-W535 HydrophobicContact CB-CZ3 4.3Å; L462-W535 HydrophobicContact CD1-CH2 4.34Å; L462-W535 HydrophobicContact CG-CH2 4.18Å; T465-W535 HydrophobicContact CG2-CZ2 4.09Å; F528-W535 AromaticContact CE2-CE2 3.67Å; F528-W535 AromaticContact CE2-CZ2 3.75Å; F528-W535 HydrophobicContact CE2-CZ2 3.75Å; F528-W535 AromaticContact CE2-NE1 3.54Å; L532-W535 PolarHBondContact O-N 3.28Å; L532-W535 VanDerWaalsContact O-N 3.15Å; H533-W535 PolarHBondContact O-N 3.39Å; W535-P537 VanDerWaalsContact C-CD 3.44Å
536	Q	75.5	Confident	76.1	Confident	136 Å²	136	44.1 Å²	44.1	64%	0.636	21%	0.213	S	C	*	.	S	Bend	trans	-131.1	53.2	179.3	-57.3	-167.4	6.1	0	0	113.4	H533 K538	H533-Q536 CarbonylContact O-C 3.59Å; H533-Q536 PolarHBondContact O-N 3.01Å; Q536-K538 PolarHBondContact O-N 3.07Å
537	P	67.4	Low	75.1	Confident	49 Å²	49	49.4 Å²	49.4	32%	0.318	23%	0.233	S	C	.	.			trans	-64	134.5	-178.6	27.4	-35.9	0	0	0	112.7	Q456 W535	Q456-P537 HydrophobicContact CB-CG 4.34Å; Q456-P537 HydrophobicContact CG-CG 4.37Å; W535-P537 VanDerWaalsContact C-CD 3.44Å
538	K	62.5	Low	74.5	Confident	115 Å²	115	49.1 Å²	49.1	50%	0.5	23%	0.231	S	C	.	.			trans	-105.4	28.9	171.6	-61.9	175	-169.3	167.3	0	111.9	Q536 D571	Q536-K538 PolarHBondContact O-N 3.07Å; K538-D571 IonicContact NZ-OD1 2.69Å; K538-D571 PolarHBondContact NZ-OD1 3.41Å
539	C	61.3	Low	74.2	Confident	31 Å²	31	45.4 Å²	45.4	21%	0.209	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-66.3	143.5	-176	-56.8	0	0	0	0	112.4	K454 L548	K454-C539 WeakPolarHBondContact CE-O 3.27Å; K454-C539 PolarHBondContact NZ-O 3.14Å; C539-L548 HydrophobicContact CB-CD2 4.37Å
540	E	61.4	Low	73.6	Confident	54 Å²	54	43.4 Å²	43.4	25%	0.252	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-59.8	153.1	165.7	-61.8	155	155.1	0	0	110.1	L542 R547 Q572	E540-L542 PolarHBondContact O-N 3.47Å; E540-R547 IonicContact OE1-NH1 3.61Å; E540-R547 PolarHBondContact OE1-NH1 3.1Å; E540-R547 IonicContact OE2-CZ 3.5Å; E540-R547 IonicContact OE2-NH1 2.62Å; E540-R547 PolarHBondContact OE2-NH1 2.8Å; E540-Q572 PolarHBondContact OE1-NE2 3.22Å
541	R	67.6	Low	73.2	Confident	67 Å²	67	44.3 Å²	44.3	25%	0.253	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	137.8	171.2	-69.6	177.4	-177.9	121.7	0	108.6	K454 A543 D674 D815 A1404	K454-R541 HydrophobicContact CD-CG 4.41Å; R541-A543 VanDerWaalsContact C-N 3.27Å; R541-A543 PolarHBondContact O-N 3.11Å; R541-A543 VanDerWaalsContact O-N 3.17Å; R541-D674 IonicContact NH1-OD1 2.75Å; R541-D674 IonicContact NH1-OD2 2.66Å; R541-D674 IonicContact NH2-OD2 3.41Å; R541-D815 VanDerWaalsContact CD-OD2 3.27Å; R541-D815 WeakPolarHBondContact CD-OD2 3.46Å; R541-D815 IonicContact CZ-OD2 2.77Å; R541-D815 IonicContact NE-OD2 3.76Å; R541-D815 IonicContact NH1-OD1 3.31Å; R541-D815 IonicContact NH1-OD2 2.94Å; R541-D815 PolarHBondContact NH1-OD2 2.97Å; R541-A1404 HydrophobicContact CB-CB 4.39Å
542	L	66.6	Low	72.2	Confident	14 Å²	14	45.1 Å²	45.1	7%	0.073	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	28.8	176.6	-64.5	-178.2	0	0	0	116.7	K452 E540 N544 K819 A1400 H1401 A1404	K452-L542 PolarHBondContact O-N 2.85Å; K452-L542 VanDerWaalsContact O-N 3.15Å; E540-L542 PolarHBondContact O-N 3.47Å; L542-N544 PolarHBondContact O-N 3.04Å; L542-K819 HydrophobicContact CB-CD 4.28Å; L542-K819 WeakPolarHBondContact O-CE 3.29Å; L542-A1400 HydrophobicContact CD2-CB 3.92Å; L542-H1401 HydrophobicContact CD1-CB 3.7Å; L542-A1404 HydrophobicContact CD2-CB 4.31Å; L542-A1404 HydrophobicContact CG-CB 4.29Å
543	A	63.6	Low	71.7	Confident	5 Å²	5	43.3 Å²	43.3	4%	0.041	21%	0.207	C	C	.	.			trans	-49.9	141	179.6	0	0	0	0	0	112.9	K452 R541 R547 L548	K452-A543 WeakPolarHBondContact CE-O 3.2Å; R541-A543 VanDerWaalsContact C-N 3.27Å; R541-A543 PolarHBondContact O-N 3.11Å; R541-A543 VanDerWaalsContact O-N 3.17Å; A543-R547 HydrophobicContact CB-CB 4.41Å; A543-L548 HydrophobicContact CB-CD2 3.89Å; A543-L548 HydrophobicContact CB-CG 4.04Å; A543-L548 WeakPolarHBondContact O-CD1 3.26Å
544	N	66.2	Low	71.8	Confident	81 Å²	81	42.1 Å²	42.1	43%	0.433	20%	0.201	S	C	.	.			trans	-62.2	148.8	178.3	-76.8	-25.6	0	0	0	110.8	L542 D546 R547 L548	L542-N544 PolarHBondContact O-N 3.04Å; N544-D546 PolarHBondContact O-N 3.32Å; N544-D546 VanDerWaalsContact O-N 3.11Å; N544-R547 WeakPolarHBondContact O-CA 3.21Å; N544-R547 WeakPolarHBondContact O-CB 3.37Å; N544-R547 PolarHBondContact O-N 3.34Å; N544-L548 PolarHBondContact O-N 3.43Å
545	T	70.7	Confident	71.5	Confident	25 Å²	25	42.5 Å²	42.5	15%	0.153	20%	0.204	C	C	.	.	H	α-helix	trans	-52.2	-41.6	-174.5	-37.8	0	0	0	0	112.2	K448 R547 L548 F549	K448-T545 HydrophobicContact CD-CG2 3.95Å; K448-T545 HydrophobicContact CG-CG2 4.21Å; T545-R547 PolarHBondContact O-N 3.36Å; T545-L548 PolarHBondContact O-N 3.06Å; T545-F549 HydrophobicContact CG2-CD2 4.36Å; T545-F549 PolarHBondContact O-N 3.49Å
546	D	68.8	Low	71.1	Confident	53 Å²	53	40 Å²	40	28%	0.283	20%	0.195	S	C	.	.	H	α-helix	trans	-66.1	-15	178.8	-44.4	-6.4	0	0	0	114.1	R144 R285 N544 F549 W568	R144-D546 IonicContact CZ-OD2 2.88Å; R144-D546 VanDerWaalsContact NH1-CG 3.34Å; R144-D546 IonicContact NH1-OD1 2.69Å; R144-D546 PolarHBondContact NH1-OD1 3.4Å; R144-D546 VanDerWaalsContact NH1-OD1 3.12Å; R144-D546 IonicContact NH1-OD2 2.8Å; R144-D546 PolarHBondContact NH1-OD2 3.07Å; R144-D546 IonicContact NH2-OD2 3.92Å; R144-D546 PolarHBondContact NH2-OD2 2.68Å; R285-D546 PolarHBondContact NE-O 3.21Å; R285-D546 PolarHBondContact NH2-O 2.93Å; N544-D546 PolarHBondContact O-N 3.32Å; N544-D546 VanDerWaalsContact O-N 3.11Å; D546-F549 CarbonylContact C-O 3.55Å; D546-W568 PolarHBondContact O-NE1 3.28Å
547	R	71	Confident	71.3	Confident	111 Å²	111	33.8 Å²	33.8	42%	0.419	17%	0.166	S	C	.	.	H	α-helix	trans	-96.2	-12.8	170.7	-77.8	-169.1	178.4	-172.9	-1.3	113	E540 A543 N544 T545	E540-R547 IonicContact OE1-NH1 3.61Å; E540-R547 PolarHBondContact OE1-NH1 3.1Å; E540-R547 IonicContact OE2-CZ 3.5Å; E540-R547 IonicContact OE2-NH1 2.62Å; E540-R547 PolarHBondContact OE2-NH1 2.8Å; A543-R547 HydrophobicContact CB-CB 4.41Å; N544-R547 WeakPolarHBondContact O-CA 3.21Å; N544-R547 WeakPolarHBondContact O-CB 3.37Å; N544-R547 PolarHBondContact O-N 3.34Å; T545-R547 PolarHBondContact O-N 3.36Å
548	L	75.3	Confident	72.2	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-95.1	-42.8	178.4	-68.2	172.8	0	0	0	111.6	C451 K452 C539 A543 N544 T545 Q567 W568	C451-L548 HydrophobicContact CB-CD1 4.11Å; C451-L548 HydrophobicContact CB-CD2 4.12Å; K452-L548 HydrophobicContact CB-CD1 4.48Å; K452-L548 HydrophobicContact CG-CD1 3.5Å; C539-L548 HydrophobicContact CB-CD2 4.37Å; A543-L548 HydrophobicContact CB-CD2 3.89Å; A543-L548 HydrophobicContact CB-CG 4.04Å; A543-L548 WeakPolarHBondContact O-CD1 3.26Å; N544-L548 PolarHBondContact O-N 3.43Å; T545-L548 PolarHBondContact O-N 3.06Å; L548-Q567 WeakPolarHBondContact O-CA 3.38Å; L548-W568 PolarHBondContact O-N 3.41Å
549	F	82.7	Confident	73.3	Confident	1 Å²	1	26.1 Å²	26.1	0%	0.004	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-119.6	147.5	175.1	-56.5	-75.3	0	0	0	110.4	K448 F460 T545 D546 L551 L563 N566 Q567 W568	K448-F549 HydrophobicContact CB-CE2 4.15Å; F460-F549 HydrophobicContact CE2-CE1 4.4Å; F460-F549 HydrophobicContact CE2-CZ 4.39Å; F460-F549 HydrophobicContact CZ-CE1 4.18Å; T545-F549 HydrophobicContact CG2-CD2 4.36Å; T545-F549 PolarHBondContact O-N 3.49Å; D546-F549 CarbonylContact C-O 3.55Å; F549-L551 WeakPolarHBondContact CB-O 3.44Å; F549-L563 HydrophobicContact CE1-CD2 4.06Å; F549-L563 HydrophobicContact CZ-CD2 4.17Å; F549-N566 WeakPolarHBondContact CA-O 3.46Å; F549-Q567 HydrophobicContact CD1-CB 4.32Å; F549-Q567 HydrophobicContact CE1-CB 4.27Å; F549-W568 PolarHBondContact O-NE1 3.37Å
550	V	76.7	Confident	74.7	Confident	8 Å²	8	24.6 Å²	24.6	5%	0.048	12%	0.118	C	C	.	.	S	Bend	trans	-78.4	-49.6	-178.2	-176.5	0	0	0	0	110.8	E262 N263 R288 N566 W568	E262-V550 HydrophobicContact CB-CG1 3.54Å; E262-V550 HydrophobicContact CG-CG1 4.43Å; E262-V550 WeakPolarHBondContact OE2-CG1 3.31Å; N263-V550 HydrophobicContact CB-CG2 3.82Å; R288-V550 PolarHBondContact NH1-O 3.38Å; V550-N566 WeakPolarHBondContact CB-OD1 3.18Å; V550-N566 PolarHBondContact N-O 3.5Å; V550-N566 PolarHBondContact N-OD1 3.26Å; V550-W568 HydrophobicContact CG1-CZ2 4.38Å; V550-W568 HydrophobicContact CG2-CD2 3.95Å; V550-W568 HydrophobicContact CG2-CG 4.01Å; V550-W568 HydrophobicContact CG2-CZ2 4.12Å
551	L	76.7	Confident	76	Confident	21 Å²	21	22 Å²	22	11%	0.11	11%	0.106	C	C	.	.	S	Bend	trans	-88.6	136.6	166.8	-50.5	-177.9	0	0	0	108.8	A259 Y292 F549 W553 N566	A259-L551 HydrophobicContact CB-CD1 4.46Å; Y292-L551 WeakPolarHBondContact OH-CD2 3.42Å; F549-L551 WeakPolarHBondContact CB-O 3.44Å; L551-W553 PolarHBondContact O-N 3.26Å; L551-W553 VanDerWaalsContact O-N 3.07Å; L551-N566 PolarHBondContact N-OD1 3.24Å; L551-N566 PolarHBondContact O-ND2 2.96Å
552	P	65.9	Low	77	Confident	19 Å²	19	19.1 Å²	19.1	12%	0.123	10%	0.096	C	C	.	.	S	Bend	trans	-73.7	0.1	-171.1	28.3	-36.3	0	0	0	114.9	K140 Y444	K140-P552 PolarHBondContact NZ-O 3.21Å; Y444-P552 PolarHBondContact OH-O 3.04Å
553	W	76.9	Confident	78.1	Confident	27 Å²	27	18.5 Å²	18.5	10%	0.102	9%	0.092	C	C	.	.	S	Bend	trans	-147.3	170.6	-167.9	-73.4	120.3	0	0	0	113.6	V136 C137 K140 Y444 L551 N566	V136-W553 HydrophobicContact CG1-CH2 3.51Å; V136-W553 HydrophobicContact CG1-CZ2 3.78Å; V136-W553 HydrophobicContact CG1-CZ3 4.39Å; V136-W553 WeakPolarHBondContact O-CZ2 3.48Å; C137-W553 VanDerWaalsContact CA-NE1 3.28Å; C137-W553 VanDerWaalsContact CB-CD1 3.42Å; C137-W553 HydrophobicContact CB-CG 4.12Å; K140-W553 HydrophobicContact CB-CZ2 3.79Å; K140-W553 VanDerWaalsContact CD-CE2 3.47Å; K140-W553 HydrophobicContact CD-CH2 3.67Å; K140-W553 HydrophobicContact CD-CZ2 3Å; K140-W553 HydrophobicContact CG-CZ2 4.1Å; K140-W553 VanDerWaalsContact NZ-CZ2 3.31Å; Y444-W553 HydrophobicContact CD1-CE3 4.18Å; Y444-W553 AromaticContact CD1-CZ3 3.93Å; Y444-W553 HydrophobicContact CD1-CZ3 3.93Å; Y444-W553 HydrophobicContact CD2-CE3 4.44Å; Y444-W553 AromaticContact CE1-CE3 3.69Å; Y444-W553 HydrophobicContact CE1-CE3 3.69Å; Y444-W553 AromaticContact CE1-CZ3 3.48Å; Y444-W553 HydrophobicContact CE1-CZ3 3.48Å; Y444-W553 VanDerWaalsContact CE1-CZ3 3.48Å; Y444-W553 AromaticContact CE2-CE3 3.96Å; Y444-W553 HydrophobicContact CE2-CE3 3.96Å; Y444-W553 AromaticContact CZ-CE3 3.55Å; Y444-W553 AromaticContact CZ-CZ3 3.83Å; L551-W553 PolarHBondContact O-N 3.26Å; L551-W553 VanDerWaalsContact O-N 3.07Å; W553-N566 PolarHBondContact O-ND2 3.34Å
554	Y	82.7	Confident	79.3	Confident	11 Å²	11	18.3 Å²	18.3	4%	0.043	9%	0.09	C	C	.	.			trans	-107	164.5	179.7	67.4	-80.6	0	0	0	110.3	P133 A440 F441 Y444 V559	P133-Y554 HydrophobicContact CB-CE2 4.16Å; P133-Y554 HydrophobicContact CG-CE2 4Å; A440-Y554 HydrophobicContact CB-CE2 3.73Å; F441-Y554 PolarHBondContact N-OH 2.88Å; Y444-Y554 VanDerWaalsContact CB-CD1 3.4Å; Y444-Y554 HydrophobicContact CD1-CD1 4.25Å; Y444-Y554 HydrophobicContact CD1-CE1 4.41Å; Y444-Y554 AromaticContact CD2-CD1 3.59Å; Y444-Y554 HydrophobicContact CD2-CD1 3.59Å; Y444-Y554 HydrophobicContact CD2-CE1 4.5Å; Y444-Y554 HydrophobicContact CD2-CG 4.28Å; Y444-Y554 HydrophobicContact CE2-CD1 4.42Å; Y444-Y554 AromaticContact CG-CD1 3.48Å; Y444-Y554 HydrophobicContact CG-CD1 3.48Å; Y444-Y554 VanDerWaalsContact CG-CD1 3.48Å; Y444-Y554 AromaticContact CG-CE1 3.99Å; Y444-Y554 HydrophobicContact CG-CE1 3.99Å; Y444-Y554 HydrophobicContact CG-CG 4.37Å; Y554-V559 HydrophobicContact CD2-CG1 4.42Å; Y554-V559 HydrophobicContact CD2-CG2 4.33Å
555	S	79.4	Confident	80.4	Confident	8 Å²	8	14.4 Å²	14.4	6%	0.056	7%	0.07	C	C	.	.			trans	-97.5	132.3	166.9	176.3	0	0	0	0	110.1	Y168 I557 L558 V559 S562	Y168-S555 WeakPolarHBondContact OH-CB 3.22Å; Y168-S555 PolarHBondContact OH-OG 3.18Å; Y168-S555 VanDerWaalsContact OH-OG 3.07Å; S555-I557 PolarHBondContact O-N 3.22Å; S555-I557 VanDerWaalsContact O-N 3.15Å; S555-L558 CarbonylContact O-C 3.57Å; S555-L558 PolarHBondContact O-N 3.12Å; S555-V559 WeakPolarHBondContact O-CA 3.06Å; S555-V559 WeakPolarHBondContact O-CG2 3.45Å; S555-V559 PolarHBondContact O-N 2.9Å; S555-S562 PolarHBondContact N-OG 3.33Å; S555-S562 VanDerWaalsContact N-OG 3.08Å
556	G	73.4	Confident	81.1	Confident	2 Å²	2	13.5 Å²	13.5	2%	0.021	6%	0.064	C	C	.	.	S	Bend	trans	-62.3	-20	-177.5	0	0	0	0	0	114.8	Q436 V559	Q436-G556 PolarHBondContact NE2-O 3.48Å; G556-V559 WeakPolarHBondContact O-CG2 3.33Å
557	I	81.2	Confident	81.9	Confident	6 Å²	6	11.1 Å²	11.1	3%	0.031	5%	0.051	C	C	.	.	S	Bend	trans	-92.5	-49.8	-179.1	-56.4	167.1	0	0	0	110.7	F78 V130 V172 T176 S555 V559	F78-I557 HydrophobicContact CD1-CB 4.37Å; F78-I557 HydrophobicContact CD1-CG1 4.19Å; F78-I557 HydrophobicContact CD1-CG2 3.89Å; F78-I557 HydrophobicContact CD2-CG1 4.34Å; F78-I557 HydrophobicContact CE1-CB 4.14Å; F78-I557 HydrophobicContact CE1-CD1 4.22Å; F78-I557 HydrophobicContact CE1-CG1 3.67Å; F78-I557 HydrophobicContact CE1-CG2 3.63Å; F78-I557 HydrophobicContact CE2-CD1 4.49Å; F78-I557 HydrophobicContact CE2-CG1 3.82Å; F78-I557 HydrophobicContact CZ-CB 4.43Å; F78-I557 HydrophobicContact CZ-CD1 3.86Å; F78-I557 HydrophobicContact CZ-CG1 3.48Å; F78-I557 VanDerWaalsContact CZ-CG1 3.48Å; F78-I557 HydrophobicContact CZ-CG2 4.33Å; V130-I557 HydrophobicContact CB-CD1 4.42Å; V130-I557 HydrophobicContact CG1-CD1 3.9Å; V130-I557 HydrophobicContact CG2-CD1 3.62Å; V130-I557 HydrophobicContact CG2-CG1 3.96Å; V172-I557 HydrophobicContact CG1-CD1 3.37Å; T176-I557 WeakPolarHBondContact OG1-CD1 3.4Å; S555-I557 PolarHBondContact O-N 3.22Å; S555-I557 VanDerWaalsContact O-N 3.15Å; I557-V559 PolarHBondContact O-N 3.21Å
558	L	85.2	Confident	82.2	Confident	1 Å²	1	8.4 Å²	8.4	1%	0.005	4%	0.041	C	C	.	.	S	Bend	trans	-104	49.4	-173.1	-66.7	175.7	0	0	0	109.4	T192 T195 I256 S555 E560 Q561 S562	T192-L558 HydrophobicContact CG2-CD2 3.72Å; T195-L558 HydrophobicContact CG2-CD1 4.24Å; I256-L558 HydrophobicContact CD1-CD1 4.34Å; I256-L558 HydrophobicContact CG2-CD1 3.62Å; S555-L558 CarbonylContact O-C 3.57Å; S555-L558 PolarHBondContact O-N 3.12Å; L558-E560 PolarHBondContact O-N 3.02Å; L558-Q561 HydrophobicContact CB-CB 4.3Å; L558-Q561 PolarHBondContact O-N 3.33Å; L558-S562 WeakPolarHBondContact O-CA 3.35Å; L558-S562 WeakPolarHBondContact O-CB 3.4Å; L558-S562 PolarHBondContact O-N 3.01Å; L558-S562 PolarHBondContact O-OG 3.37Å
559	V	87.1	Confident	82	Confident	1 Å²	1	11.7 Å²	11.7	1%	0.006	5%	0.053	C	C	.	.	H	α-helix	trans	-56.6	-51.6	-171.4	-174.4	0	0	0	0	111	A440 V443 Y554 S555 G556 I557 S562 L563	A440-V559 HydrophobicContact CB-CG2 4.04Å; V443-V559 HydrophobicContact CB-CG1 3.95Å; V443-V559 HydrophobicContact CG1-CG1 3.76Å; V443-V559 HydrophobicContact CG2-CG1 4.38Å; Y554-V559 HydrophobicContact CD2-CG1 4.42Å; Y554-V559 HydrophobicContact CD2-CG2 4.33Å; S555-V559 WeakPolarHBondContact O-CA 3.06Å; S555-V559 WeakPolarHBondContact O-CG2 3.45Å; S555-V559 PolarHBondContact O-N 2.9Å; G556-V559 WeakPolarHBondContact O-CG2 3.33Å; I557-V559 PolarHBondContact O-N 3.21Å; V559-S562 PolarHBondContact O-OG 3.05Å; V559-L563 HydrophobicContact CG1-CD1 4.01Å; V559-L563 WeakPolarHBondContact O-CB 3.22Å; V559-L563 VanDerWaalsContact O-CG 3.24Å; V559-L563 WeakPolarHBondContact O-CG 3.41Å; V559-L563 PolarHBondContact O-N 2.92Å
560	E	89.3	Confident	80.9	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-65.3	-50.1	178.6	68.8	-159.1	-156.9	0	0	113	K75 L464 V467 Q468 L558 S562 L563 L564	K75-E560 WeakPolarHBondContact CD-OE2 3.31Å; K75-E560 VanDerWaalsContact NZ-CD 3.31Å; K75-E560 IonicContact NZ-OE1 3.99Å; K75-E560 PolarHBondContact NZ-OE1 2.89Å; K75-E560 IonicContact NZ-OE2 2.63Å; L464-E560 HydrophobicContact CB-CB 4.49Å; L464-E560 HydrophobicContact CD2-CB 4.07Å; V467-E560 WeakPolarHBondContact CG1-OE2 3.32Å; Q468-E560 WeakPolarHBondContact CB-OE1 3.27Å; Q468-E560 VanDerWaalsContact CD-OE1 3.29Å; Q468-E560 PolarHBondContact OE1-OE1 3.13Å; L558-E560 PolarHBondContact O-N 3.02Å; E560-S562 PolarHBondContact O-N 3.29Å; E560-L563 PolarHBondContact O-N 3.06Å; E560-L564 WeakPolarHBondContact O-CB 3.48Å; E560-L564 WeakPolarHBondContact O-CG 3.32Å; E560-L564 PolarHBondContact O-N 2.96Å
561	Q	89.2	Confident	79.6	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.8	-44.9	179.1	-73.8	75.9	28.3	0	0	111	L558 L563 L564 Y565	L558-Q561 HydrophobicContact CB-CB 4.3Å; L558-Q561 PolarHBondContact O-N 3.33Å; Q561-L563 VanDerWaalsContact C-N 3.3Å; Q561-L563 PolarHBondContact O-N 2.82Å; Q561-L564 PolarHBondContact O-N 3.1Å; Q561-Y565 HydrophobicContact CB-CD2 4.08Å; Q561-Y565 HydrophobicContact CB-CE2 4.04Å; Q561-Y565 HydrophobicContact CG-CE2 4.17Å; Q561-Y565 WeakPolarHBondContact O-CD2 3.49Å; Q561-Y565 PolarHBondContact O-N 2.86Å
562	S	88.9	Confident	78.1	Confident	6 Å²	6	23.6 Å²	23.6	4%	0.042	11%	0.113	C	C	.	.	H	α-helix	trans	-69.6	-23.8	-180	70.4	0	0	0	0	113.3	S555 L558 V559 E560 N566	S555-S562 PolarHBondContact N-OG 3.33Å; S555-S562 VanDerWaalsContact N-OG 3.08Å; L558-S562 WeakPolarHBondContact O-CA 3.35Å; L558-S562 WeakPolarHBondContact O-CB 3.4Å; L558-S562 PolarHBondContact O-N 3.01Å; L558-S562 PolarHBondContact O-OG 3.37Å; V559-S562 PolarHBondContact O-OG 3.05Å; E560-S562 PolarHBondContact O-N 3.29Å; S562-N566 WeakPolarHBondContact O-CB 3.39Å
563	L	89	Confident	77	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-79.6	-42.7	170.8	-77.2	170.3	0	0	0	112.1	V443 Y444 A447 F460 L464 F549 V559 E560 Q561 Q567	V443-L563 HydrophobicContact CG1-CD1 3.66Å; Y444-L563 HydrophobicContact CD2-CD2 4.19Å; A447-L563 HydrophobicContact CB-CD1 4.01Å; A447-L563 HydrophobicContact CB-CD2 4.2Å; F460-L563 HydrophobicContact CE2-CB 4.02Å; F460-L563 HydrophobicContact CZ-CB 4.24Å; L464-L563 HydrophobicContact CD1-CB 3.84Å; L464-L563 HydrophobicContact CD1-CD1 4.11Å; F549-L563 HydrophobicContact CE1-CD2 4.06Å; F549-L563 HydrophobicContact CZ-CD2 4.17Å; V559-L563 HydrophobicContact CG1-CD1 4.01Å; V559-L563 WeakPolarHBondContact O-CB 3.22Å; V559-L563 VanDerWaalsContact O-CG 3.24Å; V559-L563 WeakPolarHBondContact O-CG 3.41Å; V559-L563 PolarHBondContact O-N 2.92Å; E560-L563 PolarHBondContact O-N 3.06Å; Q561-L563 VanDerWaalsContact C-N 3.3Å; Q561-L563 PolarHBondContact O-N 2.82Å; L563-Q567 PolarHBondContact O-N 3.3Å
564	L	89.5	Confident	75.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.6	-51.2	-178.2	-70.6	171	0	0	0	112.7	F460 L464 T531 V534 E560 Q561 N566	F460-L564 HydrophobicContact CE1-CD2 4.37Å; L464-L564 HydrophobicContact CB-CD1 4.21Å; L464-L564 HydrophobicContact CB-CD2 4.14Å; L464-L564 HydrophobicContact CB-CG 4.19Å; L464-L564 HydrophobicContact CD1-CD2 4.3Å; L464-L564 HydrophobicContact CD1-CG 4.3Å; T531-L564 HydrophobicContact CG2-CB 3.92Å; V534-L564 HydrophobicContact CG1-CD2 4.14Å; E560-L564 WeakPolarHBondContact O-CB 3.48Å; E560-L564 WeakPolarHBondContact O-CG 3.32Å; E560-L564 PolarHBondContact O-N 2.96Å; Q561-L564 PolarHBondContact O-N 3.1Å; L564-N566 VanDerWaalsContact C-N 3.28Å; L564-N566 PolarHBondContact O-N 3.23Å
565	Y	88.4	Confident	73.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-19	-178	-65.8	-56.4	0	0	0	113.7	G196 P199 W260 N263 Q527 T531 Q561	G196-Y565 WeakPolarHBondContact CA-OH 3.25Å; P199-Y565 HydrophobicContact CB-CD1 4.16Å; P199-Y565 HydrophobicContact CB-CE1 4.37Å; P199-Y565 HydrophobicContact CG-CD1 4.15Å; P199-Y565 HydrophobicContact CG-CG 4.46Å; W260-Y565 HydrophobicContact CD2-CD2 4.11Å; W260-Y565 HydrophobicContact CD2-CG 4.18Å; W260-Y565 AromaticContact CE3-CD2 3.9Å; W260-Y565 HydrophobicContact CE3-CD2 3.9Å; W260-Y565 HydrophobicContact CE3-CG 4.22Å; W260-Y565 HydrophobicContact CG-CG 4.49Å; W260-Y565 HydrophobicContact CH2-CD2 4.12Å; W260-Y565 HydrophobicContact CZ2-CD2 4.31Å; W260-Y565 AromaticContact CZ3-CD2 3.9Å; W260-Y565 HydrophobicContact CZ3-CD2 3.9Å; W260-Y565 HydrophobicContact CZ3-CE2 4.42Å; N263-Y565 PolarHBondContact ND2-O 3.02Å; Q527-Y565 WeakPolarHBondContact CG-OH 3.27Å; T531-Y565 HydrophobicContact CG2-CD1 3.79Å; T531-Y565 HydrophobicContact CG2-CE1 3.76Å; Q561-Y565 HydrophobicContact CB-CD2 4.08Å; Q561-Y565 HydrophobicContact CB-CE2 4.04Å; Q561-Y565 HydrophobicContact CG-CE2 4.17Å; Q561-Y565 WeakPolarHBondContact O-CD2 3.49Å; Q561-Y565 PolarHBondContact O-N 2.86Å
566	N	86.9	Confident	71.5	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.027	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-10.7	-178.1	-173.6	21.9	0	0	0	113.7	F549 V550 L551 W553 S562 L564 W568	F549-N566 WeakPolarHBondContact CA-O 3.46Å; V550-N566 WeakPolarHBondContact CB-OD1 3.18Å; V550-N566 PolarHBondContact N-O 3.5Å; V550-N566 PolarHBondContact N-OD1 3.26Å; L551-N566 PolarHBondContact N-OD1 3.24Å; L551-N566 PolarHBondContact O-ND2 2.96Å; W553-N566 PolarHBondContact O-ND2 3.34Å; S562-N566 WeakPolarHBondContact O-CB 3.39Å; L564-N566 VanDerWaalsContact C-N 3.28Å; L564-N566 PolarHBondContact O-N 3.23Å; N566-W568 PolarHBondContact O-N 2.87Å
567	Q	84.8	Confident	70	Confident	3 Å²	3	48.5 Å²	48.5	1%	0.014	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-72.6	125.9	179.4	175.4	162.3	49.2	0	0	111.8	N263 F460 H533 V534 L548 F549 L563 R569	N263-Q567 PolarHBondContact ND2-O 2.79Å; N263-Q567 PolarHBondContact OD1-O 2.77Å; F460-Q567 VanDerWaalsContact CE1-OE1 3.3Å; H533-Q567 PolarHBondContact NE2-O 2.98Å; V534-Q567 HydrophobicContact CG2-CB 4.38Å; L548-Q567 WeakPolarHBondContact O-CA 3.38Å; F549-Q567 HydrophobicContact CD1-CB 4.32Å; F549-Q567 HydrophobicContact CE1-CB 4.27Å; L563-Q567 PolarHBondContact O-N 3.3Å; Q567-R569 PolarHBondContact O-N 3.02Å
568	W	76.3	Confident	68.1	Low	54 Å²	54	54.8 Å²	54.8	21%	0.205	26%	0.259	C	S	.	.			trans	-48.9	128.5	-178.2	-93.3	93.4	0	0	0	113.7	N263 R285 D546 L548 F549 V550 N566 D570	N263-W568 VanDerWaalsContact OD1-CA 3.3Å; N263-W568 WeakPolarHBondContact OD1-CA 3.32Å; R285-W568 VanDerWaalsContact NH1-CH2 3.35Å; R285-W568 VanDerWaalsContact NH2-CZ2 3.29Å; D546-W568 PolarHBondContact O-NE1 3.28Å; L548-W568 PolarHBondContact O-N 3.41Å; F549-W568 PolarHBondContact O-NE1 3.37Å; V550-W568 HydrophobicContact CG1-CZ2 4.38Å; V550-W568 HydrophobicContact CG2-CD2 3.95Å; V550-W568 HydrophobicContact CG2-CG 4.01Å; V550-W568 HydrophobicContact CG2-CZ2 4.12Å; N566-W568 PolarHBondContact O-N 2.87Å; W568-D570 VanDerWaalsContact C-N 3.29Å; W568-D570 HydrophobicContact CE3-CB 3.86Å; W568-D570 HydrophobicContact CZ3-CB 4.48Å; W568-D570 PolarHBondContact O-N 2.87Å
569	R	71.4	Confident	66.1	Low	72 Å²	72	58.5 Å²	58.5	27%	0.272	28%	0.281	S	S	.	.			trans	-85.5	9.6	177.1	-153.5	172.2	-167.3	-135.9	3.2	114.2	S206 N263 H533 Q567	S206-R569 PolarHBondContact OG-NH1 3.1Å; N263-R569 PolarHBondContact OD1-N 3.44Å; H533-R569 HydrophobicContact CB-CG 4.07Å; Q567-R569 PolarHBondContact O-N 3.02Å
570	D	59.5	Low	64.2	Low	109 Å²	109	59.8 Å²	59.8	58%	0.583	29%	0.288	S	S	*	.			trans	-70.2	141.9	-159.9	-144.1	-14.1	0	0	0	114.4	W568	W568-D570 VanDerWaalsContact C-N 3.29Å; W568-D570 HydrophobicContact CE3-CB 3.86Å; W568-D570 HydrophobicContact CZ3-CB 4.48Å; W568-D570 PolarHBondContact O-N 2.87Å
571	D	49.3	Very low	62	Low	58 Å²	58	66.4 Å²	66.4	31%	0.31	32%	0.323	S	S	.	.			trans	-127.6	71.7	-162.5	-162.6	34.5	0	0	0	108.9	K208 K538	K208-D571 IonicContact NZ-OD2 3.7Å; K208-D571 PolarHBondContact NZ-OD2 3.06Å; K538-D571 IonicContact NZ-OD1 2.69Å; K538-D571 PolarHBondContact NZ-OD1 3.41Å
572	Q	46.1	Very low	59.9	Low	113 Å²	113	69.6 Å²	69.6	53%	0.528	34%	0.337	S	S	.	.			trans	-49.6	143.2	178.8	-85.1	-168	-3.6	0	0	110.9	E540 K574	E540-Q572 PolarHBondContact OE1-NE2 3.22Å; Q572-K574 PolarHBondContact O-N 3.26Å
573	Q	42.8	Very low	57.4	Low	159 Å²	159	75 Å²	75	74%	0.743	36%	0.362	S	S	*	.			trans	-63.4	105.3	173.4	-93.6	155.2	-101.2	0	0	109.3	I575	Q573-I575 PolarHBondContact O-N 3.39Å; Q573-I575 VanDerWaalsContact O-N 3.13Å
574	K	41.7	Very low	54.8	Low	173 Å²	173	77.2 Å²	77.2	75%	0.752	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-53.7	119.2	158	-79.8	-166.3	171.2	-166.2	0	107.5	Q572 K576	Q572-K574 PolarHBondContact O-N 3.26Å; K574-K576 PolarHBondContact O-N 3.41Å
575	I	41.8	Very low	52.3	Low	82 Å²	82	81.3 Å²	81.3	42%	0.421	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-59.4	118.3	158.2	-58.1	174.6	0	0	0	105.4	Q573 I580 P623 C626	Q573-I575 PolarHBondContact O-N 3.39Å; Q573-I575 VanDerWaalsContact O-N 3.13Å; I575-I580 HydrophobicContact CG2-CD1 4.09Å; I575-I580 HydrophobicContact CG2-CG1 4.4Å; I575-P623 HydrophobicContact CG2-CB 4.3Å; I575-C626 HydrophobicContact CD1-CB 4.41Å
576	K	39	Very low	49.9	Very low	115 Å²	115	88.3 Å²	88.3	50%	0.5	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-81.5	139.2	176.7	-84.1	179.6	146.2	-149.1	0	108.7	K574 E578 V579	K574-K576 PolarHBondContact O-N 3.41Å; K576-E578 HydrophobicContact CB-CB 4.32Å; K576-E578 WeakPolarHBondContact CD-OE2 3.1Å; K576-E578 WeakPolarHBondContact CE-OE2 3.26Å; K576-E578 IonicContact NZ-OE1 3.96Å; K576-E578 IonicContact NZ-OE2 2.55Å; K576-E578 PolarHBondContact NZ-OE2 3.03Å; K576-E578 PolarHBondContact O-N 3.37Å; K576-V579 HydrophobicContact CB-CG2 4.07Å; K576-V579 PolarHBondContact O-N 3.43Å
577	T	41.9	Very low	47.6	Very low	61 Å²	61	95.9 Å²	95.9	37%	0.374	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-55.2	-34.8	171.6	-22.6	0	0	0	0	111.8	V579 I580 V671	T577-V579 PolarHBondContact O-N 3.12Å; T577-I580 PolarHBondContact O-N 3.41Å; T577-V671 HydrophobicContact CG2-CG2 3.75Å; T577-V671 VanDerWaalsContact OG1-CG2 3.31Å; T577-V671 WeakPolarHBondContact OG1-CG2 3.23Å
578	E	42.2	Very low	45.1	Very low	138 Å²	138	101.7 Å²	101.7	65%	0.645	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-61.8	1.3	177.8	-56.3	164.1	-170.8	0	0	115.2	K576	K576-E578 HydrophobicContact CB-CB 4.32Å; K576-E578 WeakPolarHBondContact CD-OE2 3.1Å; K576-E578 WeakPolarHBondContact CE-OE2 3.26Å; K576-E578 IonicContact NZ-OE1 3.96Å; K576-E578 IonicContact NZ-OE2 2.55Å; K576-E578 PolarHBondContact NZ-OE2 3.03Å; K576-E578 PolarHBondContact O-N 3.37Å
579	V	43	Very low	43	Very low	79 Å²	79	100.4 Å²	100.4	48%	0.479	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-127.9	14.8	176.6	-148.2	0	0	0	0	111.3	K576 T577 P623	K576-V579 HydrophobicContact CB-CG2 4.07Å; K576-V579 PolarHBondContact O-N 3.43Å; T577-V579 PolarHBondContact O-N 3.12Å; V579-P623 HydrophobicContact CB-CG 3.95Å; V579-P623 HydrophobicContact CG1-CG 3.75Å; V579-P623 WeakPolarHBondContact O-CG 3.42Å
580	I	48.1	Very low	41.2	Very low	28 Å²	28	103.2 Å²	103.2	14%	0.144	53%	0.532	C	S	.	.	S	Bend	trans	-117.5	73.1	169.4	-46.4	177.9	0	0	0	106.3	I575 T577 F582	I575-I580 HydrophobicContact CG2-CD1 4.09Å; I575-I580 HydrophobicContact CG2-CG1 4.4Å; T577-I580 PolarHBondContact O-N 3.41Å; I580-F582 HydrophobicContact CB-CE2 4.13Å; I580-F582 HydrophobicContact CG2-CD2 4.09Å; I580-F582 HydrophobicContact CG2-CE1 4.24Å; I580-F582 HydrophobicContact CG2-CE2 3.42Å; I580-F582 VanDerWaalsContact CG2-CE2 3.42Å; I580-F582 HydrophobicContact CG2-CZ 3.52Å; I580-F582 VanDerWaalsContact O-CD2 3.23Å; I580-F582 WeakPolarHBondContact O-CD2 3.23Å; I580-F582 PolarHBondContact O-N 3.42Å
581	D	42.4	Very low	39.9	Very low	138 Å²	138	100.3 Å²	100.3	74%	0.738	52%	0.521	S	S	*	.			trans	-69.6	102.2	-178.9	-77.3	-39.9	0	0	0	110.6	E583	D581-E583 VanDerWaalsContact C-N 3.3Å
582	F	44.7	Very low	39.1	Very low	68 Å²	68	100.4 Å²	100.4	30%	0.298	52%	0.52	S	S	.	.			trans	-87	1.1	170	-68.1	-73.4	0	0	0	112.8	I580 A584 Y593 Q665	I580-F582 HydrophobicContact CB-CE2 4.13Å; I580-F582 HydrophobicContact CG2-CD2 4.09Å; I580-F582 HydrophobicContact CG2-CE1 4.24Å; I580-F582 HydrophobicContact CG2-CE2 3.42Å; I580-F582 VanDerWaalsContact CG2-CE2 3.42Å; I580-F582 HydrophobicContact CG2-CZ 3.52Å; I580-F582 VanDerWaalsContact O-CD2 3.23Å; I580-F582 WeakPolarHBondContact O-CD2 3.23Å; I580-F582 PolarHBondContact O-N 3.42Å; F582-A584 PolarHBondContact O-N 3.09Å; F582-Y593 AromaticContact CD1-CE1 3.91Å; F582-Y593 HydrophobicContact CD1-CE1 3.91Å; F582-Y593 HydrophobicContact CE1-CE1 4.25Å; F582-Q665 HydrophobicContact CE2-CG 3.9Å; F582-Q665 HydrophobicContact CZ-CG 4.02Å
583	E	36.6	Very low	38.7	Very low	119 Å²	119	97.6 Å²	97.6	56%	0.556	51%	0.505	S	S	*	.			trans	-99.1	61.3	-170.9	-67.2	-177.1	-163.6	0	0	112.1	D581 K669	D581-E583 VanDerWaalsContact C-N 3.3Å; E583-K669 IonicContact OE1-NZ 3.86Å; E583-K669 PolarHBondContact OE1-NZ 2.89Å
584	A	34.6	Very low	38.6	Very low	48 Å²	48	93.6 Å²	93.6	40%	0.397	49%	0.487	S	S	.	.	S	Bend	trans	-117.4	144.8	163.8	0	0	0	0	0	109	F582 I592	F582-A584 PolarHBondContact O-N 3.09Å; A584-I592 HydrophobicContact CB-CD1 3.49Å; A584-I592 VanDerWaalsContact CB-CD1 3.49Å
585	D	36.6	Very low	38.6	Very low	86 Å²	86	87.7 Å²	87.7	46%	0.46	47%	0.465	S	S	.	.			trans	-72.7	148.4	-142.5	-53.4	-84.2	0	0	0	116	D587 N588 A589 R1538	D585-D587 PolarHBondContact O-N 3.41Å; D585-D587 VanDerWaalsContact O-N 3.09Å; D585-N588 PolarHBondContact O-N 2.8Å; D585-N588 VanDerWaalsContact O-N 3.09Å; D585-A589 PolarHBondContact O-N 2.93Å; D585-R1538 IonicContact OD1-CZ 3.87Å; D585-R1538 IonicContact OD1-NH1 2.66Å; D585-R1538 PolarHBondContact OD1-NH1 3.38Å; D585-R1538 IonicContact OD1-NH2 2.66Å; D585-R1538 PolarHBondContact OD1-NH2 3.28Å
586	E	38.6	Very low	38.8	Very low	146 Å²	146	84.5 Å²	84.5	68%	0.682	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.9	-168.5	-79.9	-158	120.7	0	0	114.1	A589 K1486	E586-A589 WeakPolarHBondContact O-CB 3.23Å; E586-A589 PolarHBondContact O-N 3.4Å; E586-K1486 IonicContact OE1-NZ 2.69Å; E586-K1486 PolarHBondContact OE1-NZ 3.26Å; E586-K1486 VanDerWaalsContact OE1-NZ 3.08Å
587	D	37.4	Very low	38.7	Very low	165 Å²	165	80 Å²	80	88%	0.882	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-75.6	-20.8	179.7	-59.2	-49.2	0	0	0	113.6	D585	D585-D587 PolarHBondContact O-N 3.41Å; D585-D587 VanDerWaalsContact O-N 3.09Å
588	N	33.6	Very low	38.4	Very low	124 Å²	124	79.2 Å²	79.2	66%	0.663	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-101.1	0.6	168.3	-86.2	-38.5	0	0	0	112.7	D585 V590 S591	D585-N588 PolarHBondContact O-N 2.8Å; D585-N588 VanDerWaalsContact O-N 3.09Å; N588-V590 PolarHBondContact O-N 3.48Å; N588-S591 PolarHBondContact O-N 3.4Å
589	A	31.4	Very low	38.4	Very low	27 Å²	27	74.7 Å²	74.7	22%	0.223	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	8.3	-169.6	0	0	0	0	0	115.5	D585 E586	D585-A589 PolarHBondContact O-N 2.93Å; E586-A589 WeakPolarHBondContact O-CB 3.23Å; E586-A589 PolarHBondContact O-N 3.4Å
590	V	34	Very low	38.3	Very low	132 Å²	132	73 Å²	73	80%	0.8	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-38.8	160.8	-178.1	0	0	0	0	110.3	N588	N588-V590 PolarHBondContact O-N 3.48Å
591	S	31.8	Very low	37.7	Very low	48 Å²	48	74.2 Å²	74.2	34%	0.336	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-34.3	-174.5	178.9	0	0	0	0	114.3	N588 Y593 A601	N588-S591 PolarHBondContact O-N 3.4Å; S591-Y593 PolarHBondContact O-N 2.83Å; S591-A601 WeakPolarHBondContact OG-CB 3.37Å
592	I	31.9	Very low	37.5	Very low	60 Å²	60	78.3 Å²	78.3	31%	0.308	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-19.4	-161.8	-56.4	-176	0	0	0	113.4	A584	A584-I592 HydrophobicContact CB-CD1 3.49Å; A584-I592 VanDerWaalsContact CB-CD1 3.49Å
593	Y	38.7	Very low	37.1	Very low	54 Å²	54	83.7 Å²	83.7	21%	0.212	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-1.2	-179.7	-78.8	-80.3	0	0	0	114.9	F582 S591 T595 K666	F582-Y593 AromaticContact CD1-CE1 3.91Å; F582-Y593 HydrophobicContact CD1-CE1 3.91Å; F582-Y593 HydrophobicContact CE1-CE1 4.25Å; S591-Y593 PolarHBondContact O-N 2.83Å; Y593-T595 VanDerWaalsContact C-N 3.29Å; Y593-T595 PolarHBondContact O-N 3.4Å; Y593-K666 HydrophobicContact CE1-CD 3.83Å; Y593-K666 VanDerWaalsContact CZ-NZ 3.27Å; Y593-K666 WeakPolarHBondContact OH-CD 3.35Å; Y593-K666 WeakPolarHBondContact OH-CE 3.41Å
594	E	39.8	Very low	36.9	Very low	75 Å²	75	87.1 Å²	87.1	35%	0.35	45%	0.454	S	S	.	.			trans	-83.5	57.2	170.6	-55.2	-161.9	130.5	0	0	111.2	I596 S597 S598 K746	E594-I596 CarbonylContact O-C 3.47Å; E594-I596 PolarHBondContact O-N 3.45Å; E594-S597 CarbonylContact O-C 3.53Å; E594-S597 WeakPolarHBondContact O-CA 3.42Å; E594-S597 PolarHBondContact O-N 2.91Å; E594-S597 WeakPolarHBondContact OE2-CB 3.27Å; E594-S598 WeakPolarHBondContact O-CB 3.23Å; E594-S598 PolarHBondContact O-N 3.17Å; E594-K746 WeakPolarHBondContact OE1-CE 3.5Å; E594-K746 IonicContact OE1-NZ 3.48Å; E594-K746 PolarHBondContact OE1-NZ 3Å; E594-K746 IonicContact OE2-NZ 3.08Å
595	T	42.3	Very low	36.6	Very low	49 Å²	49	92 Å²	92	30%	0.301	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	9	-166.2	43.4	0	0	0	0	117.3	Y593 S598 K629 E677	Y593-T595 VanDerWaalsContact C-N 3.29Å; Y593-T595 PolarHBondContact O-N 3.4Å; T595-S598 WeakPolarHBondContact CA-OG 3.27Å; T595-K629 PolarHBondContact O-NZ 3.49Å; T595-E677 WeakPolarHBondContact CB-OE1 3.29Å; T595-E677 PolarHBondContact OG1-OE1 3Å
596	I	46.9	Very low	36.1	Very low	14 Å²	14	92.4 Å²	92.4	7%	0.072	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-38.6	156.4	-69	164.6	0	0	0	111.4	E594 Y600 Y631 E679	E594-I596 CarbonylContact O-C 3.47Å; E594-I596 PolarHBondContact O-N 3.45Å; I596-Y600 WeakPolarHBondContact O-CE2 3.48Å; I596-Y631 HydrophobicContact CD1-CE1 3.92Å; I596-Y631 HydrophobicContact CG2-CE1 4.02Å; I596-Y631 VanDerWaalsContact CG2-OH 3.31Å; I596-Y631 WeakPolarHBondContact CG2-OH 3.26Å; I596-E679 HydrophobicContact CD1-CB 3.75Å; I596-E679 WeakPolarHBondContact CG2-OE2 3.34Å
597	S	35.2	Very low	35.6	Very low	22 Å²	22	95 Å²	95	15%	0.154	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-15.4	176.5	-52	0	0	0	0	115.3	E594 V599 Y600 A601	E594-S597 CarbonylContact O-C 3.53Å; E594-S597 WeakPolarHBondContact O-CA 3.42Å; E594-S597 PolarHBondContact O-N 2.91Å; E594-S597 WeakPolarHBondContact OE2-CB 3.27Å; S597-V599 PolarHBondContact O-N 2.77Å; S597-V599 VanDerWaalsContact O-N 3.17Å; S597-Y600 WeakPolarHBondContact O-CA 3.27Å; S597-Y600 VanDerWaalsContact O-CB 3.29Å; S597-Y600 WeakPolarHBondContact O-CB 3.39Å; S597-Y600 PolarHBondContact O-N 3.21Å; S597-A601 PolarHBondContact O-N 3.31Å
598	S	37.6	Very low	35.1	Very low	43 Å²	43	91.3 Å²	91.3	30%	0.301	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-2.9	-175.5	81.6	0	0	0	0	114	E594 T595 Y600	E594-S598 WeakPolarHBondContact O-CB 3.23Å; E594-S598 PolarHBondContact O-N 3.17Å; T595-S598 WeakPolarHBondContact CA-OG 3.27Å; S598-Y600 VanDerWaalsContact C-N 3.33Å
599	V	42	Very low	34.9	Very low	43 Å²	43	92.3 Å²	92.3	26%	0.261	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-37.7	160.7	174.6	0	0	0	0	109.9	S597 K780 I781	S597-V599 PolarHBondContact O-N 2.77Å; S597-V599 VanDerWaalsContact O-N 3.17Å; V599-K780 WeakPolarHBondContact CG1-O 3.33Å; V599-I781 HydrophobicContact CG1-CG1 3.8Å
600	Y	40.3	Very low	34.7	Very low	44 Å²	44	98 Å²	98	17%	0.173	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-88.4	-29.6	-164.9	-41.1	-32.1	0	0	0	112.5	I596 S597 S598 R602 R776 K780	I596-Y600 WeakPolarHBondContact O-CE2 3.48Å; S597-Y600 WeakPolarHBondContact O-CA 3.27Å; S597-Y600 VanDerWaalsContact O-CB 3.29Å; S597-Y600 WeakPolarHBondContact O-CB 3.39Å; S597-Y600 PolarHBondContact O-N 3.21Å; S598-Y600 VanDerWaalsContact C-N 3.33Å; Y600-R602 PolarHBondContact O-N 3.31Å; Y600-R776 WeakPolarHBondContact OH-CA 3.47Å; Y600-R776 VanDerWaalsContact OH-CB 3.31Å; Y600-R776 WeakPolarHBondContact OH-CB 3.18Å; Y600-R776 PolarHBondContact OH-O 3.17Å; Y600-K780 HydrophobicContact CD1-CB 3.52Å; Y600-K780 HydrophobicContact CD1-CD 3.27Å; Y600-K780 HydrophobicContact CD1-CG 4.05Å; Y600-K780 HydrophobicContact CD2-CD 3.94Å; Y600-K780 HydrophobicContact CE1-CB 3.36Å; Y600-K780 HydrophobicContact CE1-CD 3.6Å; Y600-K780 HydrophobicContact CE1-CG 4.09Å; Y600-K780 HydrophobicContact CE2-CD 4.23Å; Y600-K780 HydrophobicContact CG-CD 3.48Å; Y600-K780 VanDerWaalsContact CG-CD 3.48Å
601	A	36.4	Very low	34.3	Very low	53 Å²	53	101.5 Å²	101.5	44%	0.438	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-65.6	-7.8	-178.5	0	0	0	0	0	115.1	S591 S597 Q603	S591-A601 WeakPolarHBondContact OG-CB 3.37Å; S597-A601 PolarHBondContact O-N 3.31Å; A601-Q603 VanDerWaalsContact C-N 3.33Å; A601-Q603 PolarHBondContact O-N 2.7Å
602	R	37.8	Very low	34	Very low	225 Å²	225	104.7 Å²	104.7	85%	0.849	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-82.2	-2.9	-168.8	-140.7	178.7	-160.6	177.1	7.7	115.5	Y600	Y600-R602 PolarHBondContact O-N 3.31Å
603	Q	35.2	Very low	33.8	Very low	180 Å²	180	107.1 Å²	107.1	84%	0.841	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-102.6	-2.9	-171.2	-156.3	161.5	-12.7	0	0	114.3	A601 L605	A601-Q603 VanDerWaalsContact C-N 3.33Å; A601-Q603 PolarHBondContact O-N 2.7Å; Q603-L605 PolarHBondContact O-N 2.63Å
604	K	32.2	Very low	33.3	Very low	192 Å²	192	113.7 Å²	113.7	84%	0.835	59%	0.593	S	S	*	*	S	Bend	trans	-93.2	27.3	178	-82.4	-174.2	173.5	175.5	0	114.8
605	L	29.2	Very low	32.7	Very low	151 Å²	151	118.4 Å²	118.4	79%	0.791	62%	0.615	S	S	*	*	S	Bend	trans	-128.8	125.4	175.3	-144.5	77.3	0	0	0	112.9	Q603	Q603-L605 PolarHBondContact O-N 2.63Å
606	S	26.8	Very low	32.1	Very low	93 Å²	93	121.6 Å²	121.6	65%	0.65	64%	0.64	S	S	*	*			trans	49.4	93.2	169.2	59.3	0	0	0	0	117.4	S608	S606-S608 PolarHBondContact O-N 3.49Å; S606-S608 VanDerWaalsContact O-N 3.14Å
607	H	27.4	Very low	31.6	Very low	202 Å²	202	131.2 Å²	131.2	94%	0.935	68%	0.681	S	S	*	*	S	Bend	trans	-82.8	51.4	156.8	-150.7	-62.5	0	0	0	110.6
608	S	26.1	Very low	31.6	Very low	87 Å²	87	138.3 Å²	138.3	61%	0.608	71%	0.712	S	S	*	*			trans	-145.4	148.6	-173.5	-47.7	0	0	0	0	112.4	S606	S606-S608 PolarHBondContact O-N 3.49Å; S606-S608 VanDerWaalsContact O-N 3.14Å
609	D	28.9	Very low	32	Very low	145 Å²	145	141.4 Å²	141.4	78%	0.775	72%	0.721	S	S	*	*			trans	66	103.2	160.9	-62.7	-19.5	0	0	0	122.7
610	I	28.1	Very low	32.5	Very low	147 Å²	147	145.5 Å²	145.5	75%	0.754	75%	0.747	S	S	*	*				79.2	97.4	128.5	-58.1	168.8	0	0	0	118.9	S612	I610-S612 PolarHBondContact O-N 2.95Å
611	K	25.9	Very low	33.3	Very low	205 Å²	205	146 Å²	146	89%	0.891	75%	0.754	S	S	*	*			trans	-15	109.2	139.3	-57.1	167	-179.3	173.9	0	116.3
612	S	25.7	Very low	34.6	Very low	114 Å²	114	147.7 Å²	147.7	80%	0.797	76%	0.756	S	S	*	*				173.7	108.2	126.2	57.6	0	0	0	0	112.8	I610	I610-S612 PolarHBondContact O-N 2.95Å
613	S	27.9	Very low	35.8	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	73%	0.725	S	S	*	*			trans	167.1	60.8	152.5	178.8	0	0	0	0	111.9	Q615	S613-Q615 PolarHBondContact O-N 3.28Å; S613-Q615 VanDerWaalsContact O-N 3.09Å
614	E	26.9	Very low	37.3	Very low	191 Å²	191	132.1 Å²	132.1	89%	0.893	70%	0.703	S	S	*	*			trans	-83	76.6	175.2	-69.4	-169.4	131.4	0	0	112.4
615	Q	27.3	Very low	39.1	Very low	174 Å²	174	123.4 Å²	123.4	81%	0.813	67%	0.666	S	S	*	*	S	Bend	trans	-162.2	139.2	161.1	-111.1	142.1	78.8	0	0	112.7	S613	S613-Q615 PolarHBondContact O-N 3.28Å; S613-Q615 VanDerWaalsContact O-N 3.09Å
616	S	29.6	Very low	41.2	Very low	117 Å²	117	118.8 Å²	118.8	82%	0.818	65%	0.645	S	S	*	*			trans	55.4	60.3	170	57.5	0	0	0	0	118.5
617	K	36.2	Very low	43.8	Very low	216 Å²	216	115.6 Å²	115.6	94%	0.939	62%	0.621	S	S	*	*			trans	-95.6	76.5	149.7	-76.6	-176.4	178.4	174.4	0	110.2
618	E	36.6	Very low	46.6	Very low	171 Å²	171	106.3 Å²	106.3	80%	0.799	58%	0.578	S	S	*	*			trans	-71.5	150.6	165	-74.6	-167.2	131	0	0	110.5	T620	E618-T620 PolarHBondContact O-N 3.47Å
619	E	46.2	Very low	49.7	Very low	108 Å²	108	103.3 Å²	103.3	51%	0.505	56%	0.555	S	S	.	*			trans	-66.2	82.3	-173.6	-63.6	-177.1	129.6	0	0	113.3	V621 G783 I784 R785	E619-V621 PolarHBondContact O-N 3.05Å; E619-G783 WeakPolarHBondContact OE1-CA 3.49Å; E619-I784 PolarHBondContact OE1-N 3.28Å; E619-R785 VanDerWaalsContact OE2-CB 3.25Å; E619-R785 WeakPolarHBondContact OE2-CB 3.47Å
620	T	51.8	Low	52.7	Low	129 Å²	129	96.5 Å²	96.5	79%	0.791	52%	0.518	S	S	*	.			trans	-73.2	91.7	171.2	56.2	0	0	0	0	110.7	E618 N622	E618-T620 PolarHBondContact O-N 3.47Å; T620-N622 PolarHBondContact O-N 3.43Å
621	V	56.4	Low	55.9	Low	55 Å²	55	90 Å²	90	33%	0.333	48%	0.484	S	S	.	.			trans	-50	125.7	172.7	178.5	0	0	0	0	110.3	E619 D625 I789	E619-V621 PolarHBondContact O-N 3.05Å; V621-D625 HydrophobicContact CG1-CB 4.26Å; V621-I789 HydrophobicContact CB-CD1 4.4Å; V621-I789 HydrophobicContact CG1-CD1 3.75Å; V621-I789 HydrophobicContact CG2-CD1 3.77Å
622	N	64.4	Low	59.2	Low	87 Å²	87	80.2 Å²	80.2	47%	0.465	44%	0.442	S	S	.	.			trans	-77.6	141.3	178	-104.9	-24.3	0	0	0	109.7	T620 A624 D625	T620-N622 PolarHBondContact O-N 3.43Å; N622-A624 PolarHBondContact O-N 3.48Å; N622-A624 VanDerWaalsContact O-N 3.17Å; N622-D625 WeakPolarHBondContact CB-OD2 3.42Å; N622-D625 PolarHBondContact N-OD2 2.93Å; N622-D625 WeakPolarHBondContact O-CB 3.29Å; N622-D625 PolarHBondContact O-N 2.94Å
623	P	62.7	Low	62.5	Low	33 Å²	33	74.9 Å²	74.9	21%	0.214	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-64.8	-21.3	177.5	28.2	-35.7	0	0	0	112.8	I575 V579 D625 C626	I575-P623 HydrophobicContact CG2-CB 4.3Å; V579-P623 HydrophobicContact CB-CG 3.95Å; V579-P623 HydrophobicContact CG1-CG 3.75Å; V579-P623 WeakPolarHBondContact O-CG 3.42Å; P623-D625 PolarHBondContact O-N 3Å; P623-C626 WeakPolarHBondContact O-CB 3.03Å; P623-C626 PolarHBondContact O-N 2.92Å
624	A	66.4	Low	65.6	Low	46 Å²	46	69.5 Å²	69.5	38%	0.38	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-62.7	-28	169.5	0	0	0	0	0	112.9	N622 C626 I627	N622-A624 PolarHBondContact O-N 3.48Å; N622-A624 VanDerWaalsContact O-N 3.17Å; A624-C626 PolarHBondContact O-N 3.43Å; A624-I627 HydrophobicContact CB-CD1 4.24Å; A624-I627 VanDerWaalsContact O-CB 3.29Å; A624-I627 WeakPolarHBondContact O-CB 3.44Å; A624-I627 WeakPolarHBondContact O-CG1 3.42Å; A624-I627 PolarHBondContact O-N 2.9Å
625	D	70.5	Confident	68.5	Low	8 Å²	8	61.1 Å²	61.1	4%	0.043	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-68.8	-14.8	178.5	-53.6	-28.5	0	0	0	112.2	V621 N622 P623 R786 I789 I790	V621-D625 HydrophobicContact CG1-CB 4.26Å; N622-D625 WeakPolarHBondContact CB-OD2 3.42Å; N622-D625 PolarHBondContact N-OD2 2.93Å; N622-D625 WeakPolarHBondContact O-CB 3.29Å; N622-D625 PolarHBondContact O-N 2.94Å; P623-D625 PolarHBondContact O-N 3Å; D625-R786 VanDerWaalsContact CG-NE 3.27Å; D625-R786 IonicContact OD1-CZ 3.66Å; D625-R786 IonicContact OD1-NE 2.76Å; D625-R786 PolarHBondContact OD1-NE 2.69Å; D625-R786 VanDerWaalsContact OD1-NE 3.09Å; D625-R786 IonicContact OD1-NH2 3.25Å; D625-R786 PolarHBondContact OD1-NH2 3.09Å; D625-R786 WeakPolarHBondContact OD2-CG 3.3Å; D625-R786 IonicContact OD2-CZ 2.6Å; D625-R786 IonicContact OD2-NE 2.61Å; D625-R786 PolarHBondContact OD2-NE 2.98Å; D625-R786 IonicContact OD2-NH2 3.43Å; D625-I789 HydrophobicContact CB-CG2 4.36Å; D625-I790 HydrophobicContact CB-CD1 4.19Å; D625-I790 HydrophobicContact CB-CG1 3.79Å
626	C	74.4	Confident	71.4	Confident	54 Å²	54	52.9 Å²	52.9	37%	0.365	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-92.1	0.8	173.1	-64.5	0	0	0	0	113.6	I575 P623 A624	I575-C626 HydrophobicContact CD1-CB 4.41Å; P623-C626 WeakPolarHBondContact O-CB 3.03Å; P623-C626 PolarHBondContact O-N 2.92Å; A624-C626 PolarHBondContact O-N 3.43Å
627	I	80.8	Confident	73.9	Confident	26 Å²	26	50.4 Å²	50.4	13%	0.133	26%	0.263	C	S	.	.	S	Bend	trans	-70.8	141.6	174.8	-66.5	173.9	0	0	0	109.3	A624 K629 Y675 E677	A624-I627 HydrophobicContact CB-CD1 4.24Å; A624-I627 VanDerWaalsContact O-CB 3.29Å; A624-I627 WeakPolarHBondContact O-CB 3.44Å; A624-I627 WeakPolarHBondContact O-CG1 3.42Å; A624-I627 PolarHBondContact O-N 2.9Å; I627-K629 PolarHBondContact O-N 3.35Å; I627-Y675 HydrophobicContact CD1-CE1 4.48Å; I627-Y675 HydrophobicContact CG2-CD1 3.85Å; I627-Y675 HydrophobicContact CG2-CE1 3.82Å; I627-E677 HydrophobicContact CG2-CG 3.94Å
628	T	86.8	Confident	76	Confident	7 Å²	7	42 Å²	42	4%	0.043	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	121.6	177.9	-60.3	0	0	0	0	110.5	Y676 E677 N793 Y795 V814 K818	T628-Y676 CarbonylContact O-C 3.55Å; T628-Y676 VanDerWaalsContact O-CA 3.22Å; T628-Y676 WeakPolarHBondContact O-CA 3.26Å; T628-E677 PolarHBondContact O-N 3.39Å; T628-N793 WeakPolarHBondContact CA-O 3.37Å; T628-Y795 HydrophobicContact CG2-CD2 3.8Å; T628-Y795 HydrophobicContact CG2-CE2 3.84Å; T628-V814 HydrophobicContact CG2-CG1 4.07Å; T628-K818 WeakPolarHBondContact OG1-CE 3.35Å; T628-K818 PolarHBondContact OG1-NZ 3.03Å
629	K	90.3	Very high	78.2	Confident	25 Å²	25	34.6 Å²	34.6	11%	0.109	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	135.1	174.1	-65.8	179.1	-178.5	-71.9	0	110.1	T595 I627 E677 I790 N793 T794 Y795	T595-K629 PolarHBondContact O-NZ 3.49Å; I627-K629 PolarHBondContact O-N 3.35Å; K629-E677 HydrophobicContact CG-CB 4.38Å; K629-E677 WeakPolarHBondContact CG-OE2 3.3Å; K629-E677 IonicContact NZ-OE2 3.7Å; K629-E677 PolarHBondContact NZ-OE2 2.94Å; K629-I790 HydrophobicContact CD-CG2 4.19Å; K629-N793 PolarHBondContact N-O 3.19Å; K629-N793 VanDerWaalsContact N-O 3.08Å; K629-T794 HydrophobicContact CB-CG2 4.04Å; K629-Y795 PolarHBondContact O-N 2.82Å
630	L	92.9	Very high	80.1	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	109	-177.4	-177	71.8	0	0	0	110.6	L654 Y676 E677 F678 E679 Y795 L797 V810 L872	L630-L654 HydrophobicContact CD2-CD1 4.47Å; L630-Y676 HydrophobicContact CB-CD2 4.1Å; L630-Y676 HydrophobicContact CD2-CD2 3.97Å; L630-Y676 HydrophobicContact CD2-CE2 3.93Å; L630-E677 WeakPolarHBondContact CB-O 3.16Å; L630-E677 PolarHBondContact N-O 3.44Å; L630-F678 HydrophobicContact CD2-CD2 4.04Å; L630-F678 HydrophobicContact CD2-CE2 4.47Å; L630-F678 HydrophobicContact CG-CD2 4.36Å; L630-F678 WeakPolarHBondContact O-CA 3.35Å; L630-E679 PolarHBondContact O-N 3.34Å; L630-E679 VanDerWaalsContact O-N 3.17Å; L630-Y795 WeakPolarHBondContact CA-O 3.49Å; L630-L797 HydrophobicContact CD1-CB 3.98Å; L630-V810 HydrophobicContact CD1-CG1 4.34Å; L630-V810 HydrophobicContact CD2-CG1 3.74Å; L630-L872 HydrophobicContact CD1-CD1 3.55Å
631	Y	94.4	Very high	81.8	Confident	9 Å²	9	28.8 Å²	28.8	4%	0.035	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.2	169.6	-65.2	-69.7	0	0	0	109.8	I596 E679 L772 T794 Y795 I796 L797	I596-Y631 HydrophobicContact CD1-CE1 3.92Å; I596-Y631 HydrophobicContact CG2-CE1 4.02Å; I596-Y631 VanDerWaalsContact CG2-OH 3.31Å; I596-Y631 WeakPolarHBondContact CG2-OH 3.26Å; Y631-E679 WeakPolarHBondContact CA-O 2.99Å; Y631-E679 HydrophobicContact CD1-CB 4.09Å; Y631-E679 HydrophobicContact CE1-CB 4.28Å; Y631-L772 HydrophobicContact CD1-CD1 4.23Å; Y631-L772 HydrophobicContact CD1-CD2 3.92Å; Y631-L772 HydrophobicContact CD2-CD1 4.19Å; Y631-L772 HydrophobicContact CE1-CD2 3.95Å; Y631-L772 HydrophobicContact CG-CD1 3.82Å; Y631-L772 HydrophobicContact CG-CD2 4.26Å; Y631-T794 HydrophobicContact CD2-CG2 3.74Å; Y631-T794 HydrophobicContact CE2-CG2 3.57Å; Y631-Y795 PolarHBondContact N-O 2.94Å; Y631-I796 CarbonylContact O-C 3.58Å; Y631-I796 WeakPolarHBondContact O-CA 3.35Å; Y631-L797 PolarHBondContact O-N 2.72Å
632	A	94.5	Very high	83.1	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.008	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	111.4	170.3	0	0	0	0	0	109.9	F678 E679 A680 H681 L797 L799	A632-F678 HydrophobicContact CB-CE2 3.76Å; A632-F678 HydrophobicContact CB-CZ 4.34Å; A632-E679 PolarHBondContact N-O 2.87Å; A632-A680 HydrophobicContact CB-CB 4.45Å; A632-A680 CarbonylContact O-C 3.15Å; A632-A680 WeakPolarHBondContact O-CA 3.33Å; A632-H681 PolarHBondContact O-N 3.02Å; A632-L797 CarbonylContact C-O 3.55Å; A632-L797 WeakPolarHBondContact CA-O 3.25Å; A632-L797 HydrophobicContact CB-CD2 4.44Å; A632-L799 HydrophobicContact CB-CD1 4.07Å
633	C	94.7	Very high	84.1	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	110.8	-179.8	-65.8	0	0	0	0	110.2	H681 Y768 L772 I796 L797 T798 L799	C633-H681 WeakPolarHBondContact CA-O 3.22Å; C633-Y768 HydrophobicContact CB-CD1 3.75Å; C633-Y768 HydrophobicContact CB-CD2 4.08Å; C633-Y768 HydrophobicContact CB-CE1 3.73Å; C633-Y768 HydrophobicContact CB-CE2 4.14Å; C633-Y768 HydrophobicContact CB-CG 3.96Å; C633-L772 WeakPolarHBondContact SG-CD1 3.33Å; C633-I796 HydrophobicContact CB-CG2 4.08Å; C633-L797 PolarHBondContact N-O 2.72Å; C633-T798 WeakPolarHBondContact O-CA 3.2Å; C633-L799 PolarHBondContact O-N 3.38Å
634	A	93	Very high	85.4	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	145.1	173.3	0	0	0	0	0	111.6	M647 H681 I682 F683 L799	A634-M647 HydrophobicContact CB-SD 3.46Å; A634-M647 WeakPolarHBondContact CB-SD 3.45Å; A634-H681 PolarHBondContact N-O 3.42Å; A634-I682 HydrophobicContact CB-CG1 4.29Å; A634-I682 HydrophobicContact CB-CG2 4.48Å; A634-I682 WeakPolarHBondContact O-CA 3.48Å; A634-F683 PolarHBondContact O-N 3.19Å; A634-L799 WeakPolarHBondContact CA-O 3.29Å; A634-L799 HydrophobicContact CB-CB 4.03Å
635	T	89.5	Confident	86.5	Confident	14 Å²	14	27.6 Å²	27.6	9%	0.086	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.7	167	52.3	0	0	0	0	109.8	F683 K761 L799	T635-F683 HydrophobicContact CG2-CB 4.49Å; T635-K761 HydrophobicContact CG2-CG 4.33Å; T635-L799 PolarHBondContact N-O 2.95Å
636	M	87.6	Confident	87.4	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152	176.7	-63.3	-162.9	-45.3	0	0	111.1	E639 M644 M647 I682 F683 F684 D685 L705	M636-E639 HydrophobicContact CB-CG 4Å; M636-E639 HydrophobicContact CG-CG 4.13Å; M636-E639 HydrophobicContact SD-CG 4.32Å; M636-M644 HydrophobicContact CE-CE 4.29Å; M636-M644 HydrophobicContact SD-CG 4.19Å; M636-M647 HydrophobicContact CE-CE 4.47Å; M636-M647 HydrophobicContact CG-CE 4.34Å; M636-M647 HydrophobicContact CG-SD 4.31Å; M636-M647 HydrophobicContact SD-CE 3.44Å; M636-M647 WeakPolarHBondContact SD-CE 3.47Å; M636-M647 HydrophobicContact SD-SD 4.09Å; M636-I682 HydrophobicContact CB-CG2 4.39Å; M636-I682 HydrophobicContact CE-CG2 3.62Å; M636-I682 HydrophobicContact CG-CG2 3.86Å; M636-I682 HydrophobicContact SD-CG2 4.1Å; M636-F683 PolarHBondContact N-O 2.9Å; M636-F684 HydrophobicContact CB-CD2 4.45Å; M636-F684 HydrophobicContact CE-CD2 3.63Å; M636-F684 HydrophobicContact CE-CE2 3.65Å; M636-D685 PolarHBondContact O-N 2.68Å; M636-L705 HydrophobicContact CE-CD1 3.82Å; M636-L705 HydrophobicContact CE-CD2 3.78Å; M636-L705 HydrophobicContact CE-CG 4.36Å
637	W	80.9	Confident	88.2	Confident	64 Å²	64	25.1 Å²	25.1	24%	0.242	13%	0.128	C	C	.	.	S	Bend	trans	-136.6	-124	170.4	-176.4	37.8	0	0	0	108.1	E639 F684 D685 R1127 E1128	W637-E639 PolarHBondContact O-N 3.38Å; W637-F684 WeakPolarHBondContact O-CZ 3.27Å; W637-D685 HydrophobicContact CB-CB 4.37Å; W637-D685 HydrophobicContact CG-CB 4.4Å; W637-R1127 HydrophobicContact CE3-CB 4.49Å; W637-R1127 HydrophobicContact CZ3-CB 4.04Å; W637-E1128 HydrophobicContact CH2-CB 4.45Å; W637-E1128 HydrophobicContact CH2-CG 3.68Å; W637-E1128 HydrophobicContact CZ3-CG 4.18Å
638	H	81.7	Confident	88.8	Confident	39 Å²	39	24 Å²	24	18%	0.181	12%	0.122	C	C	.	.	S	Bend	trans	-75	57.1	176.9	-60.7	166	0	0	0	113	F701 R1127	H638-F701 HydrophobicContact CB-CD2 4.23Å; H638-F701 HydrophobicContact CB-CE1 4.18Å; H638-F701 HydrophobicContact CB-CE2 3.69Å; H638-F701 HydrophobicContact CB-CZ 3.65Å; H638-F701 AromaticContact CD2-CD2 3.26Å; H638-F701 WeakPolarHBondContact CD2-CD2 3.42Å; H638-F701 AromaticContact CD2-CE2 3.15Å; H638-F701 WeakPolarHBondContact CD2-CE2 3.31Å; H638-F701 AromaticContact CG-CD2 3.91Å; H638-F701 AromaticContact CG-CE2 3.38Å; H638-F701 AromaticContact CG-CZ 3.86Å; H638-F701 AromaticContact NE2-CD2 3.95Å; H638-F701 AromaticContact NE2-CE2 3.74Å; H638-R1127 WeakPolarHBondContact O-CD 3.49Å
639	E	82	Confident	89.1	Confident	16 Å²	16	26.4 Å²	26.4	8%	0.075	13%	0.132	C	C	.	.			trans	-74.6	147.1	175.5	-53.3	-52.7	133.6	0	0	112	M636 W637 E643 M644 F701 Q704 R1127	M636-E639 HydrophobicContact CB-CG 4Å; M636-E639 HydrophobicContact CG-CG 4.13Å; M636-E639 HydrophobicContact SD-CG 4.32Å; W637-E639 PolarHBondContact O-N 3.38Å; E639-E643 HydrophobicContact CB-CB 4.43Å; E639-M644 HydrophobicContact CB-CE 3.88Å; E639-M644 HydrophobicContact CB-CG 3.85Å; E639-F701 WeakPolarHBondContact O-CD1 3.45Å; E639-Q704 PolarHBondContact O-NE2 2.66Å; E639-R1127 IonicContact OE1-CZ 3.67Å; E639-R1127 IonicContact OE1-NH1 2.73Å; E639-R1127 PolarHBondContact OE1-NH1 3.21Å; E639-R1127 IonicContact OE2-CZ 2.69Å; E639-R1127 VanDerWaalsContact OE2-CZ 3.26Å; E639-R1127 IonicContact OE2-NH1 3.65Å; E639-R1127 PolarHBondContact OE2-NH1 3.21Å; E639-R1127 IonicContact OE2-NH2 2.64Å; E639-R1127 PolarHBondContact OE2-NH2 3.31Å
640	T	86	Confident	89.2	Confident	67 Å²	67	25.2 Å²	25.2	41%	0.411	13%	0.127	S	C	.	.			trans	-75.9	160.4	170	70.1	0	0	0	0	111.7	Q642 E643 M644	T640-Q642 PolarHBondContact O-N 3.47Å; T640-E643 WeakPolarHBondContact CA-OE2 3.33Å; T640-E643 WeakPolarHBondContact CB-OE2 3.13Å; T640-E643 VanDerWaalsContact CG2-OE2 3.28Å; T640-E643 WeakPolarHBondContact CG2-OE2 3.42Å; T640-E643 PolarHBondContact N-OE2 2.9Å; T640-E643 PolarHBondContact O-N 2.97Å; T640-E643 VanDerWaalsContact OG1-CD 3.3Å; T640-E643 PolarHBondContact OG1-N 3Å; T640-E643 PolarHBondContact OG1-OE2 3.5Å; T640-M644 WeakPolarHBondContact O-CG 3.35Å; T640-M644 PolarHBondContact O-N 2.9Å
641	S	87.5	Confident	89.2	Confident	49 Å²	49	25.2 Å²	25.2	34%	0.343	13%	0.127	S	C	.	.	H	α-helix	trans	-58	-31	176	58.8	0	0	0	0	113.3	I645	S641-I645 VanDerWaalsContact O-CB 3.27Å; S641-I645 WeakPolarHBondContact O-CB 3.38Å; S641-I645 WeakPolarHBondContact O-CD1 3.32Å; S641-I645 WeakPolarHBondContact O-CG1 3.38Å; S641-I645 PolarHBondContact O-N 3.31Å
642	Q	84.7	Confident	89.1	Confident	137 Å²	137	25 Å²	25	64%	0.64	13%	0.126	S	C	*	.	H	α-helix	trans	-73.1	-37.9	178.9	-62.3	-167.9	28.6	0	0	112.6	T640 C646	T640-Q642 PolarHBondContact O-N 3.47Å; Q642-C646 WeakPolarHBondContact O-CB 3.36Å; Q642-C646 PolarHBondContact O-N 2.81Å; Q642-C646 VanDerWaalsContact O-N 3.07Å
643	E	85.1	Confident	89	Confident	27 Å²	27	27.8 Å²	27.8	13%	0.126	14%	0.137	C	C	.	.	H	α-helix	trans	-67	-49.6	175.1	-69.3	154.8	139.3	0	0	110.2	E639 T640 I645 C646 M647 G801 D802 F930 R1127	E639-E643 HydrophobicContact CB-CB 4.43Å; T640-E643 WeakPolarHBondContact CA-OE2 3.33Å; T640-E643 WeakPolarHBondContact CB-OE2 3.13Å; T640-E643 VanDerWaalsContact CG2-OE2 3.28Å; T640-E643 WeakPolarHBondContact CG2-OE2 3.42Å; T640-E643 PolarHBondContact N-OE2 2.9Å; T640-E643 PolarHBondContact O-N 2.97Å; T640-E643 VanDerWaalsContact OG1-CD 3.3Å; T640-E643 PolarHBondContact OG1-N 3Å; T640-E643 PolarHBondContact OG1-OE2 3.5Å; E643-I645 VanDerWaalsContact C-N 3.34Å; E643-I645 PolarHBondContact O-N 2.87Å; E643-C646 WeakPolarHBondContact O-CA 3.14Å; E643-C646 WeakPolarHBondContact O-CB 3.31Å; E643-C646 PolarHBondContact O-N 3.45Å; E643-M647 PolarHBondContact O-N 3.31Å; E643-G801 CarbonylContact C-O 3.52Å; E643-G801 VanDerWaalsContact C-O 3.31Å; E643-G801 VanDerWaalsContact O-O 3.11Å; E643-D802 HydrophobicContact CB-CB 4.25Å; E643-D802 HydrophobicContact CG-CB 4.09Å; E643-F930 HydrophobicContact CG-CD2 4.36Å; E643-R1127 IonicContact OE1-CZ 3.85Å; E643-R1127 IonicContact OE1-NH2 2.65Å; E643-R1127 PolarHBondContact OE1-NH2 2.59Å; E643-R1127 IonicContact OE2-NH2 3.79Å; E643-R1127 PolarHBondContact OE2-NH2 3.49Å
644	M	89.6	Confident	88.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-55.9	-45	174.8	-67.1	-174.2	177.2	0	0	112.4	M636 E639 T640 C646 L648 F684 F701 Q704 L705 V708	M636-M644 HydrophobicContact CE-CE 4.29Å; M636-M644 HydrophobicContact SD-CG 4.19Å; E639-M644 HydrophobicContact CB-CE 3.88Å; E639-M644 HydrophobicContact CB-CG 3.85Å; T640-M644 WeakPolarHBondContact O-CG 3.35Å; T640-M644 PolarHBondContact O-N 2.9Å; M644-C646 PolarHBondContact O-N 3.19Å; M644-L648 WeakPolarHBondContact O-CB 3.27Å; M644-L648 WeakPolarHBondContact O-CG 3.37Å; M644-L648 PolarHBondContact O-N 3.36Å; M644-F684 HydrophobicContact CE-CE2 3.96Å; M644-F684 HydrophobicContact CE-CZ 4.14Å; M644-F701 HydrophobicContact CE-CB 4.34Å; M644-Q704 HydrophobicContact SD-CG 4.3Å; M644-Q704 PolarHBondContact SD-NE2 3.03Å; M644-L705 HydrophobicContact SD-CB 4.04Å; M644-L705 HydrophobicContact SD-CD1 4.13Å; M644-V708 HydrophobicContact CB-CG1 3.97Å
645	I	90	Very high	88.8	Confident	32 Å²	32	27.8 Å²	27.8	16%	0.164	14%	0.136	C	C	.	.	H	α-helix	trans	-57.9	-37.3	173.7	-77.6	168.7	0	0	0	111.1	S641 E643 K649 V708 V711	S641-I645 VanDerWaalsContact O-CB 3.27Å; S641-I645 WeakPolarHBondContact O-CB 3.38Å; S641-I645 WeakPolarHBondContact O-CD1 3.32Å; S641-I645 WeakPolarHBondContact O-CG1 3.38Å; S641-I645 PolarHBondContact O-N 3.31Å; E643-I645 VanDerWaalsContact C-N 3.34Å; E643-I645 PolarHBondContact O-N 2.87Å; I645-K649 HydrophobicContact CG2-CD 3.84Å; I645-K649 VanDerWaalsContact CG2-CE 3.44Å; I645-K649 WeakPolarHBondContact O-CB 2.68Å; I645-K649 VanDerWaalsContact O-CD 3.3Å; I645-K649 WeakPolarHBondContact O-CD 3.41Å; I645-K649 WeakPolarHBondContact O-CG 3.13Å; I645-K649 PolarHBondContact O-N 3.23Å; I645-K649 VanDerWaalsContact O-N 3.12Å; I645-V708 HydrophobicContact CB-CG1 4.39Å; I645-V708 HydrophobicContact CD1-CG2 4.39Å; I645-V708 HydrophobicContact CG1-CB 4.37Å; I645-V708 HydrophobicContact CG1-CG1 3.54Å; I645-V708 HydrophobicContact CG1-CG2 4.07Å; I645-V711 HydrophobicContact CD1-CG1 4.12Å
646	C	89	Confident	88.8	Confident	9 Å²	9	29.4 Å²	29.4	6%	0.061	14%	0.143	C	C	.	.	H	α-helix	trans	-67.7	-54.1	-177.8	-158.8	0	0	0	0	111.5	Q642 E643 M644 K649 S650 D802 D804 F930	Q642-C646 WeakPolarHBondContact O-CB 3.36Å; Q642-C646 PolarHBondContact O-N 2.81Å; Q642-C646 VanDerWaalsContact O-N 3.07Å; E643-C646 WeakPolarHBondContact O-CA 3.14Å; E643-C646 WeakPolarHBondContact O-CB 3.31Å; E643-C646 PolarHBondContact O-N 3.45Å; M644-C646 PolarHBondContact O-N 3.19Å; C646-K649 WeakPolarHBondContact O-CB 3.32Å; C646-K649 PolarHBondContact O-N 3.08Å; C646-S650 PolarHBondContact O-N 2.57Å; C646-S650 PolarHBondContact O-OG 2.63Å; C646-D802 WeakPolarHBondContact CB-O 3.47Å; C646-D802 PolarHBondContact SG-O 3.35Å; C646-D804 VanDerWaalsContact SG-CB 3.53Å; C646-F930 HydrophobicContact CB-CE2 4.3Å
647	M	91.4	Very high	89	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.5	-46	178.1	-178.4	-160.1	67	0	0	111.9	A634 M636 E643 K649 S650 I651 I682 G801	A634-M647 HydrophobicContact CB-SD 3.46Å; A634-M647 WeakPolarHBondContact CB-SD 3.45Å; M636-M647 HydrophobicContact CE-CE 4.47Å; M636-M647 HydrophobicContact CG-CE 4.34Å; M636-M647 HydrophobicContact CG-SD 4.31Å; M636-M647 HydrophobicContact SD-CE 3.44Å; M636-M647 WeakPolarHBondContact SD-CE 3.47Å; M636-M647 HydrophobicContact SD-SD 4.09Å; E643-M647 PolarHBondContact O-N 3.31Å; M647-K649 VanDerWaalsContact C-N 3.33Å; M647-K649 PolarHBondContact O-N 2.89Å; M647-S650 WeakPolarHBondContact O-CA 3.48Å; M647-S650 WeakPolarHBondContact O-CB 3.41Å; M647-S650 PolarHBondContact O-N 2.72Å; M647-I651 HydrophobicContact CE-CD1 4.31Å; M647-I651 HydrophobicContact CG-CD1 4.28Å; M647-I651 PolarHBondContact O-N 2.7Å; M647-I651 VanDerWaalsContact O-N 3.1Å; M647-I682 HydrophobicContact CE-CD1 3.64Å; M647-I682 HydrophobicContact CE-CG1 4.25Å; M647-G801 WeakPolarHBondContact CB-O 3.45Å
648	L	93.1	Very high	89.4	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-64.3	-36.7	180	-74.8	165.8	0	0	0	112.4	M644 S650 I651 L652 I682 L705 V708 A712 L747	M644-L648 WeakPolarHBondContact O-CB 3.27Å; M644-L648 WeakPolarHBondContact O-CG 3.37Å; M644-L648 PolarHBondContact O-N 3.36Å; L648-S650 PolarHBondContact O-N 2.76Å; L648-I651 PolarHBondContact O-N 3.26Å; L648-L652 WeakPolarHBondContact O-CB 3.21Å; L648-L652 WeakPolarHBondContact O-CD1 3.26Å; L648-L652 WeakPolarHBondContact O-CG 3.32Å; L648-L652 PolarHBondContact O-N 2.81Å; L648-I682 HydrophobicContact CD2-CD1 4.22Å; L648-L705 HydrophobicContact CD1-CD1 3.83Å; L648-V708 HydrophobicContact CD1-CG1 3.71Å; L648-A712 HydrophobicContact CB-CB 3.67Å; L648-L747 HydrophobicContact CD2-CD2 4.16Å
649	K	92	Very high	89.8	Confident	58 Å²	58	24.9 Å²	24.9	25%	0.252	13%	0.125	S	C	.	.	H	α-helix	trans	-58.8	-36.1	170.8	-80.6	166.3	178.4	165.7	0	112	I645 C646 M647 R653 V716	I645-K649 HydrophobicContact CG2-CD 3.84Å; I645-K649 VanDerWaalsContact CG2-CE 3.44Å; I645-K649 WeakPolarHBondContact O-CB 2.68Å; I645-K649 VanDerWaalsContact O-CD 3.3Å; I645-K649 WeakPolarHBondContact O-CD 3.41Å; I645-K649 WeakPolarHBondContact O-CG 3.13Å; I645-K649 PolarHBondContact O-N 3.23Å; I645-K649 VanDerWaalsContact O-N 3.12Å; C646-K649 WeakPolarHBondContact O-CB 3.32Å; C646-K649 PolarHBondContact O-N 3.08Å; M647-K649 VanDerWaalsContact C-N 3.33Å; M647-K649 PolarHBondContact O-N 2.89Å; K649-R653 VanDerWaalsContact O-CD 3.26Å; K649-R653 WeakPolarHBondContact O-CD 3.35Å; K649-R653 WeakPolarHBondContact O-CG 3.29Å; K649-R653 PolarHBondContact O-N 2.65Å; K649-R653 PolarHBondContact O-NE 3.47Å; K649-V716 HydrophobicContact CB-CG2 4.15Å; K649-V716 HydrophobicContact CG-CG2 3.94Å
650	S	92.9	Very high	90.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68.8	-42.5	176.6	-57.1	0	0	0	0	112.3	C646 M647 L648 R653 L654 V803 D804 F805	C646-S650 PolarHBondContact O-N 2.57Å; C646-S650 PolarHBondContact O-OG 2.63Å; M647-S650 WeakPolarHBondContact O-CA 3.48Å; M647-S650 WeakPolarHBondContact O-CB 3.41Å; M647-S650 PolarHBondContact O-N 2.72Å; L648-S650 PolarHBondContact O-N 2.76Å; S650-R653 PolarHBondContact O-N 3.48Å; S650-L654 PolarHBondContact O-N 3.15Å; S650-V803 PolarHBondContact OG-O 2.97Å; S650-D804 WeakPolarHBondContact OG-CA 3.33Å; S650-F805 VanDerWaalsContact CB-CD1 3.48Å; S650-F805 PolarHBondContact OG-N 2.76Å
651	I	93.8	Very high	90.2	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.015	11%	0.107	C	C	.	.	H	α-helix	trans	-63.1	-47.6	176.1	-67.2	170.1	0	0	0	111.2	M647 L648 R653 L654 D655 F678 A680 I682 L741	M647-I651 HydrophobicContact CE-CD1 4.31Å; M647-I651 HydrophobicContact CG-CD1 4.28Å; M647-I651 PolarHBondContact O-N 2.7Å; M647-I651 VanDerWaalsContact O-N 3.1Å; L648-I651 PolarHBondContact O-N 3.26Å; I651-R653 VanDerWaalsContact C-N 3.3Å; I651-R653 PolarHBondContact O-N 3.17Å; I651-L654 WeakPolarHBondContact O-CB 3.39Å; I651-L654 PolarHBondContact O-N 3.01Å; I651-D655 PolarHBondContact O-N 3.25Å; I651-F678 HydrophobicContact CG2-CE1 4.41Å; I651-F678 HydrophobicContact CG2-CZ 4.19Å; I651-A680 HydrophobicContact CG2-CB 3.88Å; I651-I682 HydrophobicContact CD1-CD1 4.42Å; I651-L741 HydrophobicContact CG2-CD1 4.17Å
652	L	92.4	Very high	90	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.016	9%	0.093	C	C	.	.	H	α-helix	trans	-64.4	-30.3	179.8	-76	158.3	0	0	0	113.3	L648 D655 E656 A712 A713 V716 L741	L648-L652 WeakPolarHBondContact O-CB 3.21Å; L648-L652 WeakPolarHBondContact O-CD1 3.26Å; L648-L652 WeakPolarHBondContact O-CG 3.32Å; L648-L652 PolarHBondContact O-N 2.81Å; L652-D655 PolarHBondContact O-N 2.87Å; L652-E656 PolarHBondContact O-N 2.92Å; L652-A712 HydrophobicContact CD1-CB 3.79Å; L652-A713 HydrophobicContact CD1-CB 4.25Å; L652-A713 HydrophobicContact CD2-CB 4.5Å; L652-V716 HydrophobicContact CB-CB 4.3Å; L652-V716 HydrophobicContact CB-CG1 4.35Å; L652-V716 HydrophobicContact CB-CG2 3.9Å; L652-V716 HydrophobicContact CD1-CG2 4.44Å; L652-L741 HydrophobicContact CD2-CD2 4.21Å
653	R	92.9	Very high	90	Very high	61 Å²	61	14.2 Å²	14.2	23%	0.23	6%	0.063	C	C	.	.	H	α-helix	trans	-69.4	-31.7	171.5	-67.5	160.9	-162.6	167.6	5.3	112.5	K649 S650 I651 D657 V716 D804 F805 P807	K649-R653 VanDerWaalsContact O-CD 3.26Å; K649-R653 WeakPolarHBondContact O-CD 3.35Å; K649-R653 WeakPolarHBondContact O-CG 3.29Å; K649-R653 PolarHBondContact O-N 2.65Å; K649-R653 PolarHBondContact O-NE 3.47Å; S650-R653 PolarHBondContact O-N 3.48Å; I651-R653 VanDerWaalsContact C-N 3.3Å; I651-R653 PolarHBondContact O-N 3.17Å; R653-D657 PolarHBondContact O-N 3.21Å; R653-D657 VanDerWaalsContact O-N 3.13Å; R653-V716 HydrophobicContact CG-CG1 4.3Å; R653-V716 HydrophobicContact CG-CG2 4.48Å; R653-D804 IonicContact CZ-OD1 3.5Å; R653-D804 VanDerWaalsContact CZ-OD1 3.28Å; R653-D804 IonicContact NH1-OD1 2.67Å; R653-D804 PolarHBondContact NH1-OD1 2.9Å; R653-D804 IonicContact NH2-OD1 2.91Å; R653-D804 PolarHBondContact NH2-OD1 2.82Å; R653-F805 PolarHBondContact NH1-O 3.12Å; R653-P807 HydrophobicContact CB-CG 4.13Å; R653-P807 WeakPolarHBondContact O-CG 3.32Å
654	L	91.2	Very high	89.9	Confident	0 Å²	0	13 Å²	13	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-71	-40.7	173.1	-78.5	176.6	0	0	0	111.3	L630 S650 I651 E656 D657 Q658 Y676 F678 L797 F805 P807 V810	L630-L654 HydrophobicContact CD2-CD1 4.47Å; S650-L654 PolarHBondContact O-N 3.15Å; I651-L654 WeakPolarHBondContact O-CB 3.39Å; I651-L654 PolarHBondContact O-N 3.01Å; L654-E656 VanDerWaalsContact C-N 3.34Å; L654-E656 PolarHBondContact O-N 3.47Å; L654-D657 PolarHBondContact O-N 2.96Å; L654-Q658 VanDerWaalsContact O-CB 3.31Å; L654-Q658 WeakPolarHBondContact O-CB 3.46Å; L654-Q658 PolarHBondContact O-N 2.96Å; L654-Y676 PolarHBondContact O-OH 2.99Å; L654-F678 HydrophobicContact CB-CD1 4.15Å; L654-F678 HydrophobicContact CB-CE1 3.63Å; L654-F678 HydrophobicContact CB-CE2 4.07Å; L654-F678 HydrophobicContact CB-CZ 3.59Å; L654-F678 HydrophobicContact CD1-CD2 4.33Å; L654-F678 HydrophobicContact CD1-CE2 3.55Å; L654-F678 HydrophobicContact CD1-CZ 3.68Å; L654-F678 HydrophobicContact CG-CE2 4.46Å; L654-F678 HydrophobicContact CG-CZ 4.31Å; L654-L797 HydrophobicContact CD1-CD2 4.37Å; L654-F805 HydrophobicContact CD1-CE2 3.66Å; L654-F805 HydrophobicContact CD1-CZ 3.82Å; L654-F805 HydrophobicContact CD2-CE2 4.46Å; L654-F805 HydrophobicContact CG-CE2 3.93Å; L654-F805 HydrophobicContact CG-CZ 4.46Å; L654-P807 HydrophobicContact CD2-CB 3.98Å; L654-P807 HydrophobicContact CD2-CG 4.15Å; L654-V810 HydrophobicContact CD2-CB 4.34Å; L654-V810 HydrophobicContact CD2-CG2 4.17Å
655	D	92.5	Very high	89.3	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-59.4	-43.2	174.3	179.8	54.7	0	0	0	111.8	I651 L652 C659 F678 L741 G743 N745	I651-D655 PolarHBondContact O-N 3.25Å; L652-D655 PolarHBondContact O-N 2.87Å; D655-C659 WeakPolarHBondContact O-CB 3.39Å; D655-C659 PolarHBondContact O-N 3.17Å; D655-F678 HydrophobicContact CB-CE1 4.38Å; D655-L741 HydrophobicContact CB-CB 4.5Å; D655-L741 HydrophobicContact CB-CD1 3.98Å; D655-L741 WeakPolarHBondContact OD2-CB 3.48Å; D655-G743 WeakPolarHBondContact OD1-CA 3.3Å; D655-G743 PolarHBondContact OD1-N 3.15Å; D655-G743 VanDerWaalsContact OD2-CA 3.3Å; D655-G743 WeakPolarHBondContact OD2-CA 3.28Å; D655-G743 PolarHBondContact OD2-N 3.09Å; D655-N745 WeakPolarHBondContact OD1-CB 3.15Å; D655-N745 PolarHBondContact OD1-ND2 3.21Å
656	E	89.4	Confident	88.7	Confident	48 Å²	48	13.9 Å²	13.9	22%	0.224	6%	0.06	C	C	.	.	H	α-helix	trans	-62	-44.8	172.9	-173	-177.7	-153.4	0	0	112.9	L652 L654 A660 Q1436 L1481	L652-E656 PolarHBondContact O-N 2.92Å; L654-E656 VanDerWaalsContact C-N 3.34Å; L654-E656 PolarHBondContact O-N 3.47Å; E656-A660 WeakPolarHBondContact O-CB 3.27Å; E656-A660 PolarHBondContact O-N 3.02Å; E656-A660 VanDerWaalsContact O-N 3.14Å; E656-Q1436 PolarHBondContact O-NE2 2.89Å; E656-L1481 HydrophobicContact CB-CD1 4.44Å
657	D	90.1	Very high	88.1	Confident	8 Å²	8	14.2 Å²	14.2	4%	0.043	6%	0.06	C	C	.	.	H	α-helix	trans	-65.5	-45.4	178.7	-166.9	77.5	0	0	0	112.1	R653 L654 A660 R661 Y676 P807 H811 K1433	R653-D657 PolarHBondContact O-N 3.21Å; R653-D657 VanDerWaalsContact O-N 3.13Å; L654-D657 PolarHBondContact O-N 2.96Å; D657-A660 PolarHBondContact O-N 3.44Å; D657-R661 WeakPolarHBondContact O-CG 3.49Å; D657-R661 PolarHBondContact O-N 3.5Å; D657-R661 VanDerWaalsContact O-N 3.14Å; D657-R661 IonicContact OD1-NE 2.79Å; D657-R661 IonicContact OD2-CZ 3.87Å; D657-R661 IonicContact OD2-NE 3.76Å; D657-R661 PolarHBondContact OD2-NE 3.2Å; D657-R661 IonicContact OD2-NH2 3.92Å; D657-Y676 PolarHBondContact OD2-OH 3.33Å; D657-P807 HydrophobicContact CB-CB 3.74Å; D657-P807 HydrophobicContact CB-CG 3.77Å; D657-H811 IonicContact OD2-CD2 3.83Å; D657-H811 IonicContact OD2-CE1 3.16Å; D657-H811 IonicContact OD2-NE2 3.68Å; D657-H811 PolarHBondContact OD2-NE2 3.44Å; D657-K1433 WeakPolarHBondContact OD1-CE 3.27Å; D657-K1433 IonicContact OD1-NZ 2.72Å; D657-K1433 PolarHBondContact OD1-NZ 3.49Å
658	Q	91.1	Very high	87.3	Confident	3 Å²	3	14.4 Å²	14.4	1%	0.014	6%	0.061	C	C	.	.	H	α-helix	trans	-65.2	-47.2	-179.9	-162.8	-76.3	-18.6	0	0	110.9	L654 A660 R661 R662 Y675 Y676 F678 N745	L654-Q658 VanDerWaalsContact O-CB 3.31Å; L654-Q658 WeakPolarHBondContact O-CB 3.46Å; L654-Q658 PolarHBondContact O-N 2.96Å; Q658-A660 VanDerWaalsContact C-N 3.29Å; Q658-A660 PolarHBondContact O-N 3.12Å; Q658-R661 PolarHBondContact O-N 3.38Å; Q658-R661 VanDerWaalsContact O-N 3.16Å; Q658-R662 WeakPolarHBondContact O-CB 3.32Å; Q658-R662 PolarHBondContact O-N 3.44Å; Q658-Y675 PolarHBondContact NE2-OH 3.29Å; Q658-Y676 HydrophobicContact CB-CE2 4.07Å; Q658-Y676 HydrophobicContact CG-CD2 4.3Å; Q658-Y676 HydrophobicContact CG-CE2 4.02Å; Q658-Y676 WeakPolarHBondContact CG-O 3.41Å; Q658-Y676 PolarHBondContact NE2-O 3.41Å; Q658-F678 HydrophobicContact CB-CB 4.23Å; Q658-F678 HydrophobicContact CG-CB 3.82Å; Q658-N745 PolarHBondContact OE1-ND2 2.82Å; Q658-N745 VanDerWaalsContact OE1-ND2 3.17Å; Q658-N745 PolarHBondContact OE1-OD1 3.46Å
659	C	89.7	Confident	86.3	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.1	-41.1	178.3	179.1	0	0	0	0	111.5	D655 R662 N663 Q1436 L1481	D655-C659 WeakPolarHBondContact O-CB 3.39Å; D655-C659 PolarHBondContact O-N 3.17Å; C659-R662 PolarHBondContact O-N 2.93Å; C659-R662 PolarHBondContact SG-NH2 2.81Å; C659-R662 VanDerWaalsContact SG-NH2 3.43Å; C659-N663 WeakPolarHBondContact O-CB 3.34Å; C659-N663 PolarHBondContact O-N 2.96Å; C659-N663 PolarHBondContact O-ND2 3.05Å; C659-N663 PolarHBondContact O-OD1 2.96Å; C659-N663 PolarHBondContact SG-ND2 3.36Å; C659-N663 VanDerWaalsContact SG-ND2 3.4Å; C659-Q1436 PolarHBondContact SG-OE1 3.34Å; C659-Q1436 VanDerWaalsContact SG-OE1 3.35Å; C659-L1481 HydrophobicContact CB-CD1 4.21Å; C659-L1481 VanDerWaalsContact SG-CB 3.57Å
660	A	87.6	Confident	85.2	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.3	-46.8	176.4	0	0	0	0	0	111.9	E656 D657 Q658 N663 V664 V1429 A1432 K1433	E656-A660 WeakPolarHBondContact O-CB 3.27Å; E656-A660 PolarHBondContact O-N 3.02Å; E656-A660 VanDerWaalsContact O-N 3.14Å; D657-A660 PolarHBondContact O-N 3.44Å; Q658-A660 VanDerWaalsContact C-N 3.29Å; Q658-A660 PolarHBondContact O-N 3.12Å; A660-N663 PolarHBondContact O-N 3.4Å; A660-V664 WeakPolarHBondContact O-CG2 3.43Å; A660-V664 PolarHBondContact O-N 3.33Å; A660-V1429 HydrophobicContact CB-CG1 4.16Å; A660-A1432 HydrophobicContact CB-CB 4.13Å; A660-K1433 HydrophobicContact CB-CD 4.45Å; A660-K1433 HydrophobicContact CB-CG 3.55Å
661	R	87.4	Confident	83.9	Confident	26 Å²	26	19.4 Å²	19.4	10%	0.098	9%	0.089	C	C	.	.	H	α-helix	trans	-65	-41	179.2	-64.6	173.5	-179.4	-90.2	13.9	112.2	D657 Q658 N663 V664 Q665 D672 D674 Y675 H811 V1429	D657-R661 WeakPolarHBondContact O-CG 3.49Å; D657-R661 PolarHBondContact O-N 3.5Å; D657-R661 VanDerWaalsContact O-N 3.14Å; D657-R661 IonicContact OD1-NE 2.79Å; D657-R661 IonicContact OD2-CZ 3.87Å; D657-R661 IonicContact OD2-NE 3.76Å; D657-R661 PolarHBondContact OD2-NE 3.2Å; D657-R661 IonicContact OD2-NH2 3.92Å; Q658-R661 PolarHBondContact O-N 3.38Å; Q658-R661 VanDerWaalsContact O-N 3.16Å; R661-N663 VanDerWaalsContact C-N 3.35Å; R661-N663 PolarHBondContact O-N 2.92Å; R661-V664 WeakPolarHBondContact O-CB 3.49Å; R661-V664 PolarHBondContact O-N 3.4Å; R661-Q665 PolarHBondContact O-N 2.92Å; R661-D672 WeakPolarHBondContact CG-OD2 3.3Å; R661-D672 IonicContact CZ-OD2 2.67Å; R661-D672 IonicContact NH1-OD1 3.13Å; R661-D672 PolarHBondContact NH1-OD1 3.48Å; R661-D672 IonicContact NH1-OD2 3.57Å; R661-D672 PolarHBondContact NH1-OD2 3.01Å; R661-D674 PolarHBondContact NH1-O 3.39Å; R661-Y675 HydrophobicContact CB-CD2 3.97Å; R661-H811 PolarHBondContact NH2-CD2 3.46Å; R661-H811 PolarHBondContact NH2-CE1 3.07Å; R661-H811 PolarHBondContact NH2-NE2 2.96Å; R661-V1429 HydrophobicContact CG-CG1 3.79Å; R661-V1429 HydrophobicContact CG-CG2 4.03Å
662	R	85.2	Confident	82.7	Confident	18 Å²	18	20.2 Å²	20.2	7%	0.068	9%	0.093	C	C	.	.	H	α-helix	trans	-61.6	-41.7	173.7	-168.7	179.1	59.6	-139.6	-16.5	111.6	Q658 C659 Q665 K666 Y675 G743 N745	Q658-R662 WeakPolarHBondContact O-CB 3.32Å; Q658-R662 PolarHBondContact O-N 3.44Å; C659-R662 PolarHBondContact O-N 2.93Å; C659-R662 PolarHBondContact SG-NH2 2.81Å; C659-R662 VanDerWaalsContact SG-NH2 3.43Å; R662-Q665 PolarHBondContact O-N 3.46Å; R662-K666 VanDerWaalsContact O-CB 3.28Å; R662-K666 WeakPolarHBondContact O-CB 3.48Å; R662-K666 PolarHBondContact O-N 2.96Å; R662-Y675 HydrophobicContact CB-CE2 3.99Å; R662-Y675 HydrophobicContact CG-CE2 4.48Å; R662-G743 PolarHBondContact NH1-O 3.26Å; R662-G743 PolarHBondContact NH2-O 3.17Å; R662-N745 PolarHBondContact NH1-OD1 3.44Å
663	N	84.1	Confident	81.5	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-66.3	-37.4	176.7	-68.8	-16.1	0	0	0	112.1	C659 A660 R661 Y667 Q1436 F1485	C659-N663 WeakPolarHBondContact O-CB 3.34Å; C659-N663 PolarHBondContact O-N 2.96Å; C659-N663 PolarHBondContact O-ND2 3.05Å; C659-N663 PolarHBondContact O-OD1 2.96Å; C659-N663 PolarHBondContact SG-ND2 3.36Å; C659-N663 VanDerWaalsContact SG-ND2 3.4Å; A660-N663 PolarHBondContact O-N 3.4Å; R661-N663 VanDerWaalsContact C-N 3.35Å; R661-N663 PolarHBondContact O-N 2.92Å; N663-Y667 HydrophobicContact CB-CD2 4.02Å; N663-Y667 HydrophobicContact CB-CE2 4.28Å; N663-Y667 WeakPolarHBondContact O-CB 3.48Å; N663-Y667 WeakPolarHBondContact O-CD2 3.29Å; N663-Y667 PolarHBondContact O-N 3.04Å; N663-Q1436 PolarHBondContact ND2-OE1 2.97Å; N663-F1485 HydrophobicContact CB-CD1 4.39Å; N663-F1485 HydrophobicContact CB-CD2 4.13Å; N663-F1485 HydrophobicContact CB-CE2 4.21Å; N663-F1485 HydrophobicContact CB-CG 4.23Å; N663-F1485 HydrophobicContact CB-CZ 4.41Å
664	V	82.8	Confident	80.6	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.006	12%	0.121	C	C	.	.	H	α-helix	trans	-59.1	-50.1	170.3	167	0	0	0	0	111.5	A660 R661 L668 K669 V670 A1428 V1429 A1432	A660-V664 WeakPolarHBondContact O-CG2 3.43Å; A660-V664 PolarHBondContact O-N 3.33Å; R661-V664 WeakPolarHBondContact O-CB 3.49Å; R661-V664 PolarHBondContact O-N 3.4Å; V664-L668 HydrophobicContact CG1-CD1 4.5Å; V664-L668 HydrophobicContact CG2-CD1 4.22Å; V664-L668 WeakPolarHBondContact O-CA 3.37Å; V664-L668 VanDerWaalsContact O-CB 3.28Å; V664-L668 WeakPolarHBondContact O-CB 3.45Å; V664-L668 PolarHBondContact O-N 3.29Å; V664-K669 PolarHBondContact O-N 3.21Å; V664-V670 HydrophobicContact CG1-CB 3.73Å; V664-V670 HydrophobicContact CG1-CG1 4.12Å; V664-V670 HydrophobicContact CG1-CG2 4.46Å; V664-A1428 HydrophobicContact CB-CB 4.42Å; V664-A1428 HydrophobicContact CG1-CB 3.65Å; V664-A1428 HydrophobicContact CG2-CB 3.83Å; V664-A1428 VanDerWaalsContact CG2-O 3.22Å; V664-A1428 WeakPolarHBondContact CG2-O 3.44Å; V664-V1429 HydrophobicContact CG2-CB 4.43Å; V664-V1429 HydrophobicContact CG2-CG2 4.05Å; V664-A1432 HydrophobicContact CG2-CB 3.69Å
665	Q	76.9	Confident	80.2	Confident	8 Å²	8	24.5 Å²	24.5	4%	0.037	13%	0.125	C	C	.	.	H	α-helix	trans	-67.4	-40.5	-175.5	-163.2	169.8	-0.1	0	0	111.7	F582 R661 R662 K669 V670 Y675	F582-Q665 HydrophobicContact CE2-CG 3.9Å; F582-Q665 HydrophobicContact CZ-CG 4.02Å; R661-Q665 PolarHBondContact O-N 2.92Å; R662-Q665 PolarHBondContact O-N 3.46Å; Q665-K669 WeakPolarHBondContact O-CA 3.35Å; Q665-K669 PolarHBondContact O-N 3.43Å; Q665-V670 WeakPolarHBondContact CA-O 3.47Å; Q665-Y675 VanDerWaalsContact OE1-CG 3.24Å
666	K	77.5	Confident	80.1	Confident	42 Å²	42	24.8 Å²	24.8	18%	0.183	13%	0.126	C	C	.	.	H	α-helix	trans	-71.1	-54.8	178	-174.2	172.8	-176.9	168.3	0	113.5	Y593 R662	Y593-K666 HydrophobicContact CE1-CD 3.83Å; Y593-K666 VanDerWaalsContact CZ-NZ 3.27Å; Y593-K666 WeakPolarHBondContact OH-CD 3.35Å; Y593-K666 WeakPolarHBondContact OH-CE 3.41Å; R662-K666 VanDerWaalsContact O-CB 3.28Å; R662-K666 WeakPolarHBondContact O-CB 3.48Å; R662-K666 PolarHBondContact O-N 2.96Å
667	Y	76.3	Confident	80	Confident	16 Å²	16	23 Å²	23	6%	0.063	12%	0.118	C	C	.	.	H	α-helix	trans	-97.7	-19.9	-168.5	-54.9	-68.4	0	0	0	114.5	N663 D1482 F1485 K1486 L1531	N663-Y667 HydrophobicContact CB-CD2 4.02Å; N663-Y667 HydrophobicContact CB-CE2 4.28Å; N663-Y667 WeakPolarHBondContact O-CB 3.48Å; N663-Y667 WeakPolarHBondContact O-CD2 3.29Å; N663-Y667 PolarHBondContact O-N 3.04Å; Y667-D1482 WeakPolarHBondContact CE2-OD1 3.48Å; Y667-D1482 PolarHBondContact OH-OD1 3.39Å; Y667-F1485 AromaticContact CD2-CD1 3.55Å; Y667-F1485 HydrophobicContact CD2-CD1 3.55Å; Y667-F1485 AromaticContact CD2-CE1 3.2Å; Y667-F1485 HydrophobicContact CD2-CE1 3.2Å; Y667-F1485 HydrophobicContact CD2-CZ 4.05Å; Y667-F1485 AromaticContact CE2-CD1 3.71Å; Y667-F1485 HydrophobicContact CE2-CD1 3.71Å; Y667-F1485 AromaticContact CE2-CE1 3.87Å; Y667-F1485 HydrophobicContact CE2-CE1 3.87Å; Y667-F1485 HydrophobicContact CG-CD1 4.32Å; Y667-F1485 AromaticContact CG-CE1 3.64Å; Y667-F1485 HydrophobicContact CG-CE1 3.64Å; Y667-F1485 HydrophobicContact CG-CZ 4.46Å; Y667-K1486 HydrophobicContact CE1-CG 4.47Å; Y667-K1486 WeakPolarHBondContact OH-CE 3.47Å; Y667-L1531 WeakPolarHBondContact O-CD1 3.11Å
668	L	73.9	Confident	80.1	Confident	4 Å²	4	23 Å²	23	2%	0.021	12%	0.117	C	C	.	.	S	Bend	trans	-104.2	-6.4	175.3	-51.8	178.2	0	0	0	112.8	V664 V670 V1424 A1428 F1489 L1524 R1527	V664-L668 HydrophobicContact CG1-CD1 4.5Å; V664-L668 HydrophobicContact CG2-CD1 4.22Å; V664-L668 WeakPolarHBondContact O-CA 3.37Å; V664-L668 VanDerWaalsContact O-CB 3.28Å; V664-L668 WeakPolarHBondContact O-CB 3.45Å; V664-L668 PolarHBondContact O-N 3.29Å; L668-V670 HydrophobicContact CB-CG2 3.96Å; L668-V670 PolarHBondContact O-N 2.84Å; L668-V1424 HydrophobicContact CD1-CG1 4.38Å; L668-A1428 HydrophobicContact CD1-CB 3.96Å; L668-F1489 HydrophobicContact CD2-CE2 3.96Å; L668-L1524 HydrophobicContact CD2-CD2 3.59Å; L668-R1527 PolarHBondContact O-NE 2.95Å; L668-R1527 PolarHBondContact O-NH2 3.16Å
669	K	72.6	Confident	80.2	Confident	96 Å²	96	23.1 Å²	23.1	42%	0.417	12%	0.118	S	C	.	.			trans	49.9	38.8	-175	-65.6	-167.7	172.4	-173.6	0	113	E583 V664 Q665 L1531	E583-K669 IonicContact OE1-NZ 3.86Å; E583-K669 PolarHBondContact OE1-NZ 2.89Å; V664-K669 PolarHBondContact O-N 3.21Å; Q665-K669 WeakPolarHBondContact O-CA 3.35Å; Q665-K669 PolarHBondContact O-N 3.43Å; K669-L1531 HydrophobicContact CD-CD2 4.48Å
670	V	69	Low	80.4	Confident	14 Å²	14	23.1 Å²	23.1	9%	0.085	12%	0.118	C	C	.	.			trans	-99.8	127.3	177.6	174.3	0	0	0	0	109.7	V664 Q665 L668 D672 L1425	V664-V670 HydrophobicContact CG1-CB 3.73Å; V664-V670 HydrophobicContact CG1-CG1 4.12Å; V664-V670 HydrophobicContact CG1-CG2 4.46Å; Q665-V670 WeakPolarHBondContact CA-O 3.47Å; L668-V670 HydrophobicContact CB-CG2 3.96Å; L668-V670 PolarHBondContact O-N 2.84Å; V670-D672 PolarHBondContact O-N 3.38Å; V670-L1425 HydrophobicContact CB-CD2 4.17Å; V670-L1425 HydrophobicContact CG1-CD2 3.61Å; V670-L1425 HydrophobicContact CG2-CD2 3.57Å; V670-L1425 HydrophobicContact CG2-CG 3.82Å
671	V	65.4	Low	80.7	Confident	55 Å²	55	23.1 Å²	23.1	33%	0.333	12%	0.118	S	C	.	.			trans	-78.5	106.2	169.6	-179.1	0	0	0	0	108.9	T577	T577-V671 HydrophobicContact CG2-CG2 3.75Å; T577-V671 VanDerWaalsContact OG1-CG2 3.31Å; T577-V671 WeakPolarHBondContact OG1-CG2 3.23Å
672	D	68.1	Low	81.1	Confident	21 Å²	21	22 Å²	22	11%	0.112	11%	0.113	C	C	.	.			trans	-81.5	116.1	168.5	-179.4	4.5	0	0	0	109.4	R661 V670 D674 Y675	R661-D672 WeakPolarHBondContact CG-OD2 3.3Å; R661-D672 IonicContact CZ-OD2 2.67Å; R661-D672 IonicContact NH1-OD1 3.13Å; R661-D672 PolarHBondContact NH1-OD1 3.48Å; R661-D672 IonicContact NH1-OD2 3.57Å; R661-D672 PolarHBondContact NH1-OD2 3.01Å; V670-D672 PolarHBondContact O-N 3.38Å; D672-D674 PolarHBondContact O-N 3.08Å; D672-D674 WeakPolarHBondContact OD1-CA 3.35Å; D672-D674 PolarHBondContact OD1-N 3.45Å; D672-Y675 WeakPolarHBondContact O-CB 3.18Å; D672-Y675 PolarHBondContact O-N 3.24Å
673	P	67.5	Low	81.4	Confident	100 Å²	100	21.1 Å²	21.1	65%	0.649	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-17.5	177.7	30.6	-36.3	0	0	0	113	K818	P673-K818 PolarHBondContact O-NZ 3.17Å
674	D	74	Confident	81.8	Confident	35 Å²	35	21 Å²	21	19%	0.187	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	15.8	-177.9	-56.6	-11.2	0	0	0	110.4	R541 R661 D672	R541-D674 IonicContact NH1-OD1 2.75Å; R541-D674 IonicContact NH1-OD2 2.66Å; R541-D674 IonicContact NH2-OD2 3.41Å; R661-D674 PolarHBondContact NH1-O 3.39Å; D672-D674 PolarHBondContact O-N 3.08Å; D672-D674 WeakPolarHBondContact OD1-CA 3.35Å; D672-D674 PolarHBondContact OD1-N 3.45Å
675	Y	83.7	Confident	82	Confident	18 Å²	18	21.4 Å²	21.4	7%	0.071	11%	0.112	C	C	.	.			trans	-65.4	146.3	170.9	-178.3	-104	0	0	0	112.2	I627 Q658 R661 R662 Q665 D672 E677	I627-Y675 HydrophobicContact CD1-CE1 4.48Å; I627-Y675 HydrophobicContact CG2-CD1 3.85Å; I627-Y675 HydrophobicContact CG2-CE1 3.82Å; Q658-Y675 PolarHBondContact NE2-OH 3.29Å; R661-Y675 HydrophobicContact CB-CD2 3.97Å; R662-Y675 HydrophobicContact CB-CE2 3.99Å; R662-Y675 HydrophobicContact CG-CE2 4.48Å; Q665-Y675 VanDerWaalsContact OE1-CG 3.24Å; D672-Y675 WeakPolarHBondContact O-CB 3.18Å; D672-Y675 PolarHBondContact O-N 3.24Å; Y675-E677 HydrophobicContact CE1-CG 4.04Å
676	Y	89.4	Confident	82.4	Confident	7 Å²	7	22.5 Å²	22.5	3%	0.027	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	158.6	177	65.9	-74.8	0	0	0	111	T628 L630 L654 D657 Q658 F678 H811	T628-Y676 CarbonylContact O-C 3.55Å; T628-Y676 VanDerWaalsContact O-CA 3.22Å; T628-Y676 WeakPolarHBondContact O-CA 3.26Å; L630-Y676 HydrophobicContact CB-CD2 4.1Å; L630-Y676 HydrophobicContact CD2-CD2 3.97Å; L630-Y676 HydrophobicContact CD2-CE2 3.93Å; L654-Y676 PolarHBondContact O-OH 2.99Å; D657-Y676 PolarHBondContact OD2-OH 3.33Å; Q658-Y676 HydrophobicContact CB-CE2 4.07Å; Q658-Y676 HydrophobicContact CG-CD2 4.3Å; Q658-Y676 HydrophobicContact CG-CE2 4.02Å; Q658-Y676 WeakPolarHBondContact CG-O 3.41Å; Q658-Y676 PolarHBondContact NE2-O 3.41Å; Y676-F678 HydrophobicContact CD2-CB 4.2Å; Y676-F678 HydrophobicContact CE2-CB 3.93Å; Y676-F678 HydrophobicContact CE2-CG 4.36Å; Y676-H811 AromaticContact CD1-CE1 3.62Å; Y676-H811 AromaticContact CE1-CE1 3.33Å; Y676-H811 WeakPolarHBondContact CE1-CE1 3.37Å; Y676-H811 AromaticContact CE1-NE2 3.6Å
677	E	87.4	Confident	82.8	Confident	11 Å²	11	20.5 Å²	20.5	5%	0.051	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	145.2	170.2	-66.7	173.3	168.9	0	0	109.3	T595 I627 T628 K629 L630 Y675	T595-E677 WeakPolarHBondContact CB-OE1 3.29Å; T595-E677 PolarHBondContact OG1-OE1 3Å; I627-E677 HydrophobicContact CG2-CG 3.94Å; T628-E677 PolarHBondContact O-N 3.39Å; K629-E677 HydrophobicContact CG-CB 4.38Å; K629-E677 WeakPolarHBondContact CG-OE2 3.3Å; K629-E677 IonicContact NZ-OE2 3.7Å; K629-E677 PolarHBondContact NZ-OE2 2.94Å; L630-E677 WeakPolarHBondContact CB-O 3.16Å; L630-E677 PolarHBondContact N-O 3.44Å; Y675-E677 HydrophobicContact CE1-CG 4.04Å
678	F	92.5	Very high	83.4	Confident	7 Å²	7	20.1 Å²	20.1	3%	0.031	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.2	-169	-179.8	-125.3	0	0	0	111.9	L630 A632 I651 L654 D655 Q658 Y676 A680 N745	L630-F678 HydrophobicContact CD2-CD2 4.04Å; L630-F678 HydrophobicContact CD2-CE2 4.47Å; L630-F678 HydrophobicContact CG-CD2 4.36Å; L630-F678 WeakPolarHBondContact O-CA 3.35Å; A632-F678 HydrophobicContact CB-CE2 3.76Å; A632-F678 HydrophobicContact CB-CZ 4.34Å; I651-F678 HydrophobicContact CG2-CE1 4.41Å; I651-F678 HydrophobicContact CG2-CZ 4.19Å; L654-F678 HydrophobicContact CB-CD1 4.15Å; L654-F678 HydrophobicContact CB-CE1 3.63Å; L654-F678 HydrophobicContact CB-CE2 4.07Å; L654-F678 HydrophobicContact CB-CZ 3.59Å; L654-F678 HydrophobicContact CD1-CD2 4.33Å; L654-F678 HydrophobicContact CD1-CE2 3.55Å; L654-F678 HydrophobicContact CD1-CZ 3.68Å; L654-F678 HydrophobicContact CG-CE2 4.46Å; L654-F678 HydrophobicContact CG-CZ 4.31Å; D655-F678 HydrophobicContact CB-CE1 4.38Å; Q658-F678 HydrophobicContact CB-CB 4.23Å; Q658-F678 HydrophobicContact CG-CB 3.82Å; Y676-F678 HydrophobicContact CD2-CB 4.2Å; Y676-F678 HydrophobicContact CE2-CB 3.93Å; Y676-F678 HydrophobicContact CE2-CG 4.36Å; F678-A680 HydrophobicContact CZ-CB 4.19Å; F678-N745 HydrophobicContact CD1-CB 4.22Å
679	E	92.4	Very high	83.8	Confident	5 Å²	5	23.5 Å²	23.5	2%	0.023	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	146.1	166.7	-173	174.5	173.7	0	0	108.9	I596 L630 Y631 A632 H681 K746 R776	I596-E679 HydrophobicContact CD1-CB 3.75Å; I596-E679 WeakPolarHBondContact CG2-OE2 3.34Å; L630-E679 PolarHBondContact O-N 3.34Å; L630-E679 VanDerWaalsContact O-N 3.17Å; Y631-E679 WeakPolarHBondContact CA-O 2.99Å; Y631-E679 HydrophobicContact CD1-CB 4.09Å; Y631-E679 HydrophobicContact CE1-CB 4.28Å; A632-E679 PolarHBondContact N-O 2.87Å; E679-H681 IonicContact OE1-CE1 3.26Å; E679-H681 PolarHBondContact OE1-CE1 3.44Å; E679-H681 IonicContact OE1-NE2 3.46Å; E679-H681 PolarHBondContact OE1-NE2 2.64Å; E679-H681 IonicContact OE2-NE2 3.56Å; E679-K746 HydrophobicContact CG-CB 4.14Å; E679-K746 WeakPolarHBondContact CG-O 3.38Å; E679-R776 IonicContact OE1-CZ 3.99Å; E679-R776 IonicContact OE1-NH1 2.77Å; E679-R776 PolarHBondContact OE1-NH1 2.77Å; E679-R776 IonicContact OE1-NH2 3.03Å; E679-R776 PolarHBondContact OE1-NH2 2.71Å; E679-R776 IonicContact OE2-CZ 3.32Å; E679-R776 IonicContact OE2-NH1 2.78Å; E679-R776 PolarHBondContact OE2-NH1 3.12Å; E679-R776 IonicContact OE2-NH2 2.86Å
680	A	94.5	Very high	84.2	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.7	179.5	0	0	0	0	0	110.7	A632 I651 F678 K746 L747 T748	A632-A680 HydrophobicContact CB-CB 4.45Å; A632-A680 CarbonylContact O-C 3.15Å; A632-A680 WeakPolarHBondContact O-CA 3.33Å; I651-A680 HydrophobicContact CG2-CB 3.88Å; F678-A680 HydrophobicContact CZ-CB 4.19Å; A680-K746 PolarHBondContact N-O 2.98Å; A680-L747 HydrophobicContact CB-CD1 3.58Å; A680-L747 CarbonylContact O-C 3.45Å; A680-L747 WeakPolarHBondContact O-CA 3.33Å; A680-T748 PolarHBondContact O-N 2.98Å
681	H	95.1	Very high	84.7	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.8	173.7	-64	-96	0	0	0	109.7	A632 C633 A634 E679 F683 T748 H750 Y771	A632-H681 PolarHBondContact O-N 3.02Å; C633-H681 WeakPolarHBondContact CA-O 3.22Å; A634-H681 PolarHBondContact N-O 3.42Å; E679-H681 IonicContact OE1-CE1 3.26Å; E679-H681 PolarHBondContact OE1-CE1 3.44Å; E679-H681 IonicContact OE1-NE2 3.46Å; E679-H681 PolarHBondContact OE1-NE2 2.64Å; E679-H681 IonicContact OE2-NE2 3.56Å; H681-F683 HydrophobicContact CB-CD2 4.41Å; H681-F683 HydrophobicContact CB-CE2 3.57Å; H681-F683 HydrophobicContact CB-CZ 4.24Å; H681-T748 CarbonylContact C-O 3.5Å; H681-T748 VanDerWaalsContact CA-O 3.24Å; H681-T748 WeakPolarHBondContact CA-O 3.46Å; H681-H750 AromaticContact CG-NE2 3.97Å; H681-H750 AromaticContact ND1-CD2 3.98Å; H681-H750 AromaticContact ND1-NE2 3.05Å; H681-H750 PolarHBondContact ND1-NE2 3.16Å; H681-Y771 AromaticContact CE1-CE1 3.94Å
682	I	94.4	Very high	85.1	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.9	173.1	-54.9	171.5	0	0	0	108	A634 M636 M647 L648 I651 L747 T748 V749 H750	A634-I682 HydrophobicContact CB-CG1 4.29Å; A634-I682 HydrophobicContact CB-CG2 4.48Å; A634-I682 WeakPolarHBondContact O-CA 3.48Å; M636-I682 HydrophobicContact CB-CG2 4.39Å; M636-I682 HydrophobicContact CE-CG2 3.62Å; M636-I682 HydrophobicContact CG-CG2 3.86Å; M636-I682 HydrophobicContact SD-CG2 4.1Å; M647-I682 HydrophobicContact CE-CD1 3.64Å; M647-I682 HydrophobicContact CE-CG1 4.25Å; L648-I682 HydrophobicContact CD2-CD1 4.22Å; I651-I682 HydrophobicContact CD1-CD1 4.42Å; I682-L747 HydrophobicContact CD1-CD1 3.78Å; I682-L747 HydrophobicContact CG1-CD1 3.97Å; I682-T748 PolarHBondContact N-O 2.99Å; I682-V749 HydrophobicContact CB-CG1 4.31Å; I682-V749 HydrophobicContact CB-CG2 4.14Å; I682-V749 HydrophobicContact CD1-CG2 4.13Å; I682-V749 HydrophobicContact CG1-CG2 4.48Å; I682-V749 CarbonylContact O-C 3.46Å; I682-V749 WeakPolarHBondContact O-CA 3.39Å; I682-H750 PolarHBondContact O-N 2.84Å
683	F	92.9	Very high	85.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.7	176.6	-67.9	-94.1	0	0	0	108.5	A634 T635 M636 H681 H750 M767 Y768	A634-F683 PolarHBondContact O-N 3.19Å; T635-F683 HydrophobicContact CG2-CB 4.49Å; M636-F683 PolarHBondContact N-O 2.9Å; H681-F683 HydrophobicContact CB-CD2 4.41Å; H681-F683 HydrophobicContact CB-CE2 3.57Å; H681-F683 HydrophobicContact CB-CZ 4.24Å; F683-H750 HydrophobicContact CD1-CB 3.63Å; F683-H750 AromaticContact CD1-CG 3.88Å; F683-H750 HydrophobicContact CE1-CB 3.69Å; F683-H750 AromaticContact CE1-CD2 3.46Å; F683-H750 VanDerWaalsContact CE1-CD2 3.46Å; F683-H750 WeakPolarHBondContact CE1-CD2 3.28Å; F683-H750 AromaticContact CE1-CG 3.4Å; F683-H750 AromaticContact CE1-ND1 3.8Å; F683-H750 AromaticContact CE1-NE2 3.93Å; F683-H750 AromaticContact CE2-CD2 3.83Å; F683-H750 HydrophobicContact CG-CB 4.35Å; F683-H750 HydrophobicContact CZ-CB 4.43Å; F683-H750 AromaticContact CZ-CD2 3.31Å; F683-H750 WeakPolarHBondContact CZ-CD2 3.26Å; F683-H750 AromaticContact CZ-CE1 3.99Å; F683-H750 AromaticContact CZ-CG 3.77Å; F683-H750 AromaticContact CZ-NE2 3.49Å; F683-H750 WeakPolarHBondContact CZ-NE2 3.41Å; F683-M767 HydrophobicContact CD1-CE 4.34Å; F683-M767 HydrophobicContact CD1-CG 4.25Å; F683-M767 HydrophobicContact CD1-SD 3.68Å; F683-M767 HydrophobicContact CE1-CB 4.47Å; F683-M767 HydrophobicContact CE1-CE 4.15Å; F683-M767 HydrophobicContact CE1-CG 3.98Å; F683-M767 HydrophobicContact CE1-SD 3.86Å; F683-Y768 HydrophobicContact CD2-CD1 4.12Å; F683-Y768 HydrophobicContact CE2-CD1 4.16Å; F683-Y768 HydrophobicContact CE2-CG 4.16Å
684	F	90.7	Very high	85.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	106.6	-176.5	-153	-62.2	0	0	0	109.1	M636 W637 M644 A687 F701 V702 L705 H750 L751 K752	M636-F684 HydrophobicContact CB-CD2 4.45Å; M636-F684 HydrophobicContact CE-CD2 3.63Å; M636-F684 HydrophobicContact CE-CE2 3.65Å; W637-F684 WeakPolarHBondContact O-CZ 3.27Å; M644-F684 HydrophobicContact CE-CE2 3.96Å; M644-F684 HydrophobicContact CE-CZ 4.14Å; F684-A687 HydrophobicContact CB-CB 4.47Å; F684-A687 HydrophobicContact CD1-CB 4.04Å; F684-A687 HydrophobicContact CG-CB 4.5Å; F684-F701 HydrophobicContact CE1-CB 4.28Å; F684-F701 HydrophobicContact CZ-CB 3.66Å; F684-V702 HydrophobicContact CD1-CG2 4.05Å; F684-V702 HydrophobicContact CD2-CG2 4.34Å; F684-V702 HydrophobicContact CE1-CG2 3.95Å; F684-V702 HydrophobicContact CE2-CG2 4.22Å; F684-V702 HydrophobicContact CG-CG2 4.29Å; F684-V702 HydrophobicContact CZ-CG2 4.06Å; F684-L705 HydrophobicContact CD2-CD2 4.14Å; F684-L705 HydrophobicContact CE2-CD2 4.3Å; F684-H750 PolarHBondContact N-O 2.88Å; F684-L751 HydrophobicContact CB-CD2 4.06Å; F684-L751 HydrophobicContact CG-CD2 4.44Å; F684-K752 VanDerWaalsContact O-CB 3.29Å; F684-K752 WeakPolarHBondContact O-CB 3.26Å; F684-K752 WeakPolarHBondContact O-CG 3.48Å; F684-K752 PolarHBondContact O-N 2.9Å
685	D	87.1	Confident	85.7	Confident	9 Å²	9	40.3 Å²	40.3	5%	0.048	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	142.4	173	-89.6	-71.3	0	0	0	110.9	M636 W637 A687 K752 R760 S764	M636-D685 PolarHBondContact O-N 2.68Å; W637-D685 HydrophobicContact CB-CB 4.37Å; W637-D685 HydrophobicContact CG-CB 4.4Å; D685-A687 PolarHBondContact O-N 3.45Å; D685-K752 IonicContact OD1-NZ 3.61Å; D685-K752 PolarHBondContact OD1-NZ 3.49Å; D685-K752 IonicContact OD2-NZ 2.76Å; D685-R760 PolarHBondContact OD1-N 2.71Å; D685-S764 PolarHBondContact OD1-OG 3.04Å; D685-S764 PolarHBondContact OD2-OG 3.21Å
686	D	85.2	Confident	85.4	Confident	30 Å²	30	40.8 Å²	40.8	16%	0.16	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	51.6	-177.8	-154.2	19.5	0	0	0	116.3	F688 N699 K754	D686-F688 VanDerWaalsContact C-N 3.26Å; D686-F688 PolarHBondContact O-N 3.32Å; D686-N699 PolarHBondContact O-ND2 2.79Å; D686-K754 VanDerWaalsContact OD1-CD 3.24Å; D686-K754 WeakPolarHBondContact OD1-CD 3.31Å; D686-K754 WeakPolarHBondContact OD1-CE 3.44Å; D686-K754 VanDerWaalsContact OD1-CG 3.25Å; D686-K754 WeakPolarHBondContact OD1-CG 3.19Å; D686-K754 IonicContact OD1-NZ 3.7Å; D686-K754 PolarHBondContact OD1-NZ 3.13Å; D686-K754 IonicContact OD2-NZ 2.88Å; D686-K754 PolarHBondContact OD2-NZ 2.55Å
687	A	87.5	Confident	85.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.			trans	-73.3	-9.7	-173.7	0	0	0	0	0	115.3	F684 D685 N699 V702 L751 K752	F684-A687 HydrophobicContact CB-CB 4.47Å; F684-A687 HydrophobicContact CD1-CB 4.04Å; F684-A687 HydrophobicContact CG-CB 4.5Å; D685-A687 PolarHBondContact O-N 3.45Å; A687-N699 VanDerWaalsContact O-CB 3.29Å; A687-N699 WeakPolarHBondContact O-CB 3.47Å; A687-N699 PolarHBondContact O-N 3.25Å; A687-V702 HydrophobicContact CB-CG2 3.91Å; A687-L751 HydrophobicContact CB-CB 3.74Å; A687-L751 HydrophobicContact CB-CD2 4.05Å; A687-L751 HydrophobicContact CB-CG 4.42Å; A687-K752 PolarHBondContact N-O 3.42Å
688	F	87.8	Confident	85.1	Confident	8 Å²	8	40.6 Å²	40.6	4%	0.035	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.3	-171.5	-60.9	-89.6	0	0	0	112.4	D686 P696 V697 L698 L751 D753 K754 W1257	D686-F688 VanDerWaalsContact C-N 3.26Å; D686-F688 PolarHBondContact O-N 3.32Å; F688-P696 HydrophobicContact CD1-CB 4.38Å; F688-V697 WeakPolarHBondContact CA-O 3.44Å; F688-L698 HydrophobicContact CD1-CD2 4.27Å; F688-L698 HydrophobicContact CE1-CD2 3.88Å; F688-L698 HydrophobicContact CZ-CD2 4.48Å; F688-L751 HydrophobicContact CE2-CB 3.87Å; F688-L751 HydrophobicContact CZ-CB 4.03Å; F688-L751 HydrophobicContact CZ-CD1 4.39Å; F688-D753 HydrophobicContact CD2-CB 3.84Å; F688-D753 HydrophobicContact CE2-CB 4.13Å; F688-K754 PolarHBondContact O-NZ 3.16Å; F688-W1257 HydrophobicContact CE1-CB 4.22Å; F688-W1257 AromaticContact CE1-CD1 3.98Å; F688-W1257 AromaticContact CE1-CD2 3.86Å; F688-W1257 HydrophobicContact CE1-CD2 3.86Å; F688-W1257 HydrophobicContact CE1-CE3 4.41Å; F688-W1257 AromaticContact CE1-CG 3.77Å; F688-W1257 HydrophobicContact CE1-CG 3.77Å; F688-W1257 HydrophobicContact CZ-CD2 4.42Å
689	E	82.6	Confident	84.8	Confident	75 Å²	75	40.5 Å²	40.5	35%	0.35	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	158.8	166.9	-71.8	166.5	-150.3	0	0	108.9	V697 N699 R700	E689-V697 PolarHBondContact N-O 3.08Å; E689-V697 PolarHBondContact O-N 3.21Å; E689-N699 HydrophobicContact CG-CB 4.02Å; E689-N699 WeakPolarHBondContact OE1-CA 3.39Å; E689-N699 PolarHBondContact OE1-OD1 2.92Å; E689-N699 VanDerWaalsContact OE1-OD1 3.13Å; E689-R700 PolarHBondContact OE1-N 3.43Å; E689-R700 VanDerWaalsContact OE1-N 3.07Å
690	V	80.5	Confident	84.6	Confident	102 Å²	102	48.2 Å²	48.2	62%	0.618	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.8	179	-178.9	0	0	0	0	108.4
691	N	79.7	Confident	84.4	Confident	67 Å²	67	49.4 Å²	49.4	36%	0.358	24%	0.242	S	C	.	.			trans	-71.8	168.1	177.2	-87.4	7.3	0	0	0	112	Y693 S694 E695 V697	N691-Y693 PolarHBondContact O-N 2.91Å; N691-S694 WeakPolarHBondContact O-CA 3.38Å; N691-S694 PolarHBondContact O-N 3.34Å; N691-E695 HydrophobicContact CB-CB 4.5Å; N691-E695 PolarHBondContact N-O 2.81Å; N691-V697 WeakPolarHBondContact ND2-CG2 3.33Å
692	E	75.1	Confident	84.1	Confident	186 Å²	186	49.4 Å²	49.4	87%	0.869	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-27.6	173.7	-60.4	-178	149.5	0	0	113.4	S694	E692-S694 VanDerWaalsContact C-N 3.29Å; E692-S694 PolarHBondContact O-N 3.08Å
693	Y	72.8	Confident	83.8	Confident	172 Å²	172	53.2 Å²	53.2	68%	0.675	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	9.5	176.6	-55.1	-74.5	0	0	0	114.4	N691 E695	N691-Y693 PolarHBondContact O-N 2.91Å; Y693-E695 PolarHBondContact O-N 3.39Å
694	S	74.3	Confident	83.7	Confident	100 Å²	100	55.3 Å²	55.3	70%	0.699	27%	0.266	S	S	*	.	S	Bend	trans	63.5	14.3	-172.2	-50.7	0	0	0	0	115.5	N691 E692	N691-S694 WeakPolarHBondContact O-CA 3.38Å; N691-S694 PolarHBondContact O-N 3.34Å; E692-S694 VanDerWaalsContact C-N 3.29Å; E692-S694 PolarHBondContact O-N 3.08Å
695	E	74.1	Confident	83.7	Confident	48 Å²	48	55.5 Å²	55.5	22%	0.224	27%	0.267	C	S	.	.			trans	-83.8	139.3	179.5	-62	175.9	149.1	0	0	112	N691 Y693 V1256	N691-E695 HydrophobicContact CB-CB 4.5Å; N691-E695 PolarHBondContact N-O 2.81Å; Y693-E695 PolarHBondContact O-N 3.39Å; E695-V1256 HydrophobicContact CG-CG2 4.34Å
696	P	76.9	Confident	83.8	Confident	27 Å²	27	56.4 Å²	56.4	18%	0.175	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	124.1	174.5	30.8	-32.9	0	0	0	111	F688	F688-P696 HydrophobicContact CD1-CB 4.38Å
697	V	83.8	Confident	83.9	Confident	14 Å²	14	61.7 Å²	61.7	9%	0.085	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	153.2	-178.3	171.3	0	0	0	0	110.5	F688 E689 N691 N699	F688-V697 WeakPolarHBondContact CA-O 3.44Å; E689-V697 PolarHBondContact N-O 3.08Å; E689-V697 PolarHBondContact O-N 3.21Å; N691-V697 WeakPolarHBondContact ND2-CG2 3.33Å; V697-N699 PolarHBondContact O-N 3.49Å
698	L	86.2	Confident	84	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	126.2	-175.2	-64.5	-178.4	0	0	0	112.6	F688 V702 R703 L751 W1257 L1263	F688-L698 HydrophobicContact CD1-CD2 4.27Å; F688-L698 HydrophobicContact CE1-CD2 3.88Å; F688-L698 HydrophobicContact CZ-CD2 4.48Å; L698-V702 HydrophobicContact CB-CB 4.45Å; L698-V702 HydrophobicContact CD1-CG1 4.32Å; L698-V702 HydrophobicContact CD2-CG1 4.23Å; L698-R703 HydrophobicContact CB-CG 4.45Å; L698-R703 PolarHBondContact O-NH1 3.25Å; L698-L751 HydrophobicContact CD2-CD1 3.92Å; L698-W1257 HydrophobicContact CD2-CB 4.43Å; L698-W1257 HydrophobicContact CD2-CD2 4.49Å; L698-W1257 HydrophobicContact CD2-CE3 3.9Å; L698-W1257 HydrophobicContact CG-CB 4.34Å; L698-W1257 HydrophobicContact CG-CE3 4.39Å; L698-L1263 HydrophobicContact CD1-CD1 3.57Å; L698-L1263 HydrophobicContact CD1-CG 4.4Å
699	N	87.9	Confident	84.1	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.027	30%	0.298	C	S	.	.			trans	-55.7	145.6	174.5	177.1	-35.3	0	0	0	111.2	D686 A687 E689 V697 F701 V702 R703	D686-N699 PolarHBondContact O-ND2 2.79Å; A687-N699 VanDerWaalsContact O-CB 3.29Å; A687-N699 WeakPolarHBondContact O-CB 3.47Å; A687-N699 PolarHBondContact O-N 3.25Å; E689-N699 HydrophobicContact CG-CB 4.02Å; E689-N699 WeakPolarHBondContact OE1-CA 3.39Å; E689-N699 PolarHBondContact OE1-OD1 2.92Å; E689-N699 VanDerWaalsContact OE1-OD1 3.13Å; V697-N699 PolarHBondContact O-N 3.49Å; N699-F701 PolarHBondContact O-N 3.23Å; N699-F701 WeakPolarHBondContact OD1-CD2 3.45Å; N699-F701 PolarHBondContact OD1-N 2.94Å; N699-V702 HydrophobicContact CB-CG2 4.38Å; N699-V702 PolarHBondContact O-N 3.08Å; N699-R703 PolarHBondContact O-N 2.88Å
700	R	88.1	Confident	84.3	Confident	168 Å²	168	60.9 Å²	60.9	63%	0.634	29%	0.294	S	S	*	.	H	α-helix	trans	-46.8	-35.9	176.3	64.3	176.5	-175.4	-177.6	-4.1	113.8	E689 R703 Q704	E689-R700 PolarHBondContact OE1-N 3.43Å; E689-R700 VanDerWaalsContact OE1-N 3.07Å; R700-R703 PolarHBondContact O-N 2.75Å; R700-Q704 PolarHBondContact O-N 3.08Å
701	F	89	Confident	84.7	Confident	25 Å²	25	60 Å²	60	11%	0.11	29%	0.289	C	S	.	.	H	α-helix	trans	-73.9	-27.9	-179.5	-60.3	-74.8	0	0	0	113	H638 E639 M644 F684 N699 Q704 L705	H638-F701 HydrophobicContact CB-CD2 4.23Å; H638-F701 HydrophobicContact CB-CE1 4.18Å; H638-F701 HydrophobicContact CB-CE2 3.69Å; H638-F701 HydrophobicContact CB-CZ 3.65Å; H638-F701 AromaticContact CD2-CD2 3.26Å; H638-F701 WeakPolarHBondContact CD2-CD2 3.42Å; H638-F701 AromaticContact CD2-CE2 3.15Å; H638-F701 WeakPolarHBondContact CD2-CE2 3.31Å; H638-F701 AromaticContact CG-CD2 3.91Å; H638-F701 AromaticContact CG-CE2 3.38Å; H638-F701 AromaticContact CG-CZ 3.86Å; H638-F701 AromaticContact NE2-CD2 3.95Å; H638-F701 AromaticContact NE2-CE2 3.74Å; E639-F701 WeakPolarHBondContact O-CD1 3.45Å; M644-F701 HydrophobicContact CE-CB 4.34Å; F684-F701 HydrophobicContact CE1-CB 4.28Å; F684-F701 HydrophobicContact CZ-CB 3.66Å; N699-F701 PolarHBondContact O-N 3.23Å; N699-F701 WeakPolarHBondContact OD1-CD2 3.45Å; N699-F701 PolarHBondContact OD1-N 2.94Å; F701-Q704 WeakPolarHBondContact O-CB 3.31Å; F701-Q704 PolarHBondContact O-N 3.36Å; F701-L705 PolarHBondContact O-N 3.36Å; F701-L705 VanDerWaalsContact O-N 3.07Å
702	V	88.8	Confident	85.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-71.4	-41.1	172.1	-176.1	0	0	0	0	110	F684 A687 L698 N699 Q704 L705 L706 L751	F684-V702 HydrophobicContact CD1-CG2 4.05Å; F684-V702 HydrophobicContact CD2-CG2 4.34Å; F684-V702 HydrophobicContact CE1-CG2 3.95Å; F684-V702 HydrophobicContact CE2-CG2 4.22Å; F684-V702 HydrophobicContact CG-CG2 4.29Å; F684-V702 HydrophobicContact CZ-CG2 4.06Å; A687-V702 HydrophobicContact CB-CG2 3.91Å; L698-V702 HydrophobicContact CB-CB 4.45Å; L698-V702 HydrophobicContact CD1-CG1 4.32Å; L698-V702 HydrophobicContact CD2-CG1 4.23Å; N699-V702 HydrophobicContact CB-CG2 4.38Å; N699-V702 PolarHBondContact O-N 3.08Å; V702-Q704 VanDerWaalsContact C-N 3.3Å; V702-Q704 PolarHBondContact O-N 3.08Å; V702-L705 WeakPolarHBondContact O-CB 3.48Å; V702-L705 PolarHBondContact O-N 2.83Å; V702-L705 VanDerWaalsContact O-N 3.14Å; V702-L706 WeakPolarHBondContact O-CG 3.2Å; V702-L706 PolarHBondContact O-N 2.59Å; V702-L706 VanDerWaalsContact O-N 3.12Å; V702-L751 HydrophobicContact CG1-CD1 4.35Å; V702-L751 HydrophobicContact CG1-CD2 3.86Å; V702-L751 HydrophobicContact CG2-CD2 4.17Å
703	R	89.2	Confident	85.7	Confident	81 Å²	81	48 Å²	48	31%	0.306	23%	0.23	S	C	.	.	H	α-helix	trans	-61.6	-37.7	172.6	-65.4	-178.7	177.2	131.9	-5.9	112.1	L698 N699 R700 L706 Q707 D1260	L698-R703 HydrophobicContact CB-CG 4.45Å; L698-R703 PolarHBondContact O-NH1 3.25Å; N699-R703 PolarHBondContact O-N 2.88Å; R700-R703 PolarHBondContact O-N 2.75Å; R703-L706 PolarHBondContact O-N 3.49Å; R703-Q707 WeakPolarHBondContact O-CG 3.4Å; R703-Q707 PolarHBondContact O-N 2.85Å; R703-D1260 IonicContact CZ-OD2 2.7Å; R703-D1260 IonicContact NE-OD2 3.2Å; R703-D1260 PolarHBondContact NE-OD2 3.04Å; R703-D1260 IonicContact NH2-OD2 3.03Å; R703-D1260 PolarHBondContact NH2-OD2 3.29Å
704	Q	89.7	Confident	86.1	Confident	44 Å²	44	40.5 Å²	40.5	21%	0.206	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-42.4	172.2	-173.8	-172.7	-105.8	0	0	111.9	E639 M644 R700 F701 V702 L706 Q707 V708	E639-Q704 PolarHBondContact O-NE2 2.66Å; M644-Q704 HydrophobicContact SD-CG 4.3Å; M644-Q704 PolarHBondContact SD-NE2 3.03Å; R700-Q704 PolarHBondContact O-N 3.08Å; F701-Q704 WeakPolarHBondContact O-CB 3.31Å; F701-Q704 PolarHBondContact O-N 3.36Å; V702-Q704 VanDerWaalsContact C-N 3.3Å; V702-Q704 PolarHBondContact O-N 3.08Å; Q704-L706 PolarHBondContact O-N 2.89Å; Q704-Q707 PolarHBondContact O-N 2.95Å; Q704-V708 HydrophobicContact CG-CG2 4.42Å; Q704-V708 WeakPolarHBondContact O-CB 3.47Å; Q704-V708 VanDerWaalsContact O-CG2 3.31Å; Q704-V708 WeakPolarHBondContact O-CG2 3.43Å; Q704-V708 PolarHBondContact O-N 3.5Å
705	L	90.7	Very high	86.6	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-60.7	-43.2	176.3	-177.9	64.9	0	0	0	112.2	M636 M644 L648 F684 F701 V702 Q707 V708 I709 V749	M636-L705 HydrophobicContact CE-CD1 3.82Å; M636-L705 HydrophobicContact CE-CD2 3.78Å; M636-L705 HydrophobicContact CE-CG 4.36Å; M644-L705 HydrophobicContact SD-CB 4.04Å; M644-L705 HydrophobicContact SD-CD1 4.13Å; L648-L705 HydrophobicContact CD1-CD1 3.83Å; F684-L705 HydrophobicContact CD2-CD2 4.14Å; F684-L705 HydrophobicContact CE2-CD2 4.3Å; F701-L705 PolarHBondContact O-N 3.36Å; F701-L705 VanDerWaalsContact O-N 3.07Å; V702-L705 WeakPolarHBondContact O-CB 3.48Å; V702-L705 PolarHBondContact O-N 2.83Å; V702-L705 VanDerWaalsContact O-N 3.14Å; L705-Q707 VanDerWaalsContact C-N 3.31Å; L705-Q707 PolarHBondContact O-N 3.45Å; L705-V708 PolarHBondContact O-N 2.95Å; L705-I709 PolarHBondContact O-N 3.47Å; L705-V749 HydrophobicContact CD2-CG1 4.1Å; L705-V749 HydrophobicContact CD2-CG2 4.46Å
706	L	89	Confident	87	Confident	28 Å²	28	36.7 Å²	36.7	15%	0.147	19%	0.187	C	C	.	.	H	α-helix	trans	-59.9	-38.7	176.9	-63.7	177.5	0	0	0	112.5	V702 R703 Q704 L737 W739 L1263	V702-L706 WeakPolarHBondContact O-CG 3.2Å; V702-L706 PolarHBondContact O-N 2.59Å; V702-L706 VanDerWaalsContact O-N 3.12Å; R703-L706 PolarHBondContact O-N 3.49Å; Q704-L706 PolarHBondContact O-N 2.89Å; L706-L737 HydrophobicContact CD2-CD1 4.09Å; L706-W739 HydrophobicContact CD2-CH2 3.61Å; L706-W739 HydrophobicContact CD2-CZ2 3.56Å; L706-L1263 HydrophobicContact CD1-CD2 3.78Å; L706-L1263 HydrophobicContact CD1-CG 3.99Å; L706-L1263 HydrophobicContact CD2-CD2 3.93Å
707	Q	87.2	Confident	87.2	Confident	141 Å²	141	36.1 Å²	36.1	66%	0.659	18%	0.182	S	C	*	.	H	α-helix	trans	-73.5	-34.8	176.8	-66.5	171.5	-1.1	0	0	112.5	R703 Q704 L705	R703-Q707 WeakPolarHBondContact O-CG 3.4Å; R703-Q707 PolarHBondContact O-N 2.85Å; Q704-Q707 PolarHBondContact O-N 2.95Å; L705-Q707 VanDerWaalsContact C-N 3.31Å; L705-Q707 PolarHBondContact O-N 3.45Å
708	V	90.5	Very high	86.9	Confident	9 Å²	9	40.4 Å²	40.4	6%	0.055	20%	0.196	C	C	.	.	H	α-helix	trans	-75.3	-28.6	-173.6	155.2	0	0	0	0	113.4	M644 I645 L648 Q704 L705 D710 V711 A712	M644-V708 HydrophobicContact CB-CG1 3.97Å; I645-V708 HydrophobicContact CB-CG1 4.39Å; I645-V708 HydrophobicContact CD1-CG2 4.39Å; I645-V708 HydrophobicContact CG1-CB 4.37Å; I645-V708 HydrophobicContact CG1-CG1 3.54Å; I645-V708 HydrophobicContact CG1-CG2 4.07Å; L648-V708 HydrophobicContact CD1-CG1 3.71Å; Q704-V708 HydrophobicContact CG-CG2 4.42Å; Q704-V708 WeakPolarHBondContact O-CB 3.47Å; Q704-V708 VanDerWaalsContact O-CG2 3.31Å; Q704-V708 WeakPolarHBondContact O-CG2 3.43Å; Q704-V708 PolarHBondContact O-N 3.5Å; L705-V708 PolarHBondContact O-N 2.95Å; V708-D710 PolarHBondContact O-N 3.42Å; V708-V711 WeakPolarHBondContact O-CB 3.35Å; V708-V711 PolarHBondContact O-N 3.2Å; V708-V711 VanDerWaalsContact O-N 3.13Å; V708-A712 PolarHBondContact O-N 3.45Å
709	I	90.2	Very high	86.2	Confident	9 Å²	9	42 Å²	42	5%	0.046	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-41.7	-172.8	-160.2	175.1	0	0	0	113.1	L705 A712 A713 V723 W739 L747	L705-I709 PolarHBondContact O-N 3.47Å; I709-A712 PolarHBondContact O-N 3.05Å; I709-A713 WeakPolarHBondContact O-CB 3.44Å; I709-A713 PolarHBondContact O-N 3.17Å; I709-V723 HydrophobicContact CG1-CG2 4.43Å; I709-W739 HydrophobicContact CD1-CD2 3.77Å; I709-W739 HydrophobicContact CD1-CE3 4.4Å; I709-W739 HydrophobicContact CD1-CG 3.85Å; I709-W739 HydrophobicContact CD1-CZ2 4.31Å; I709-L747 HydrophobicContact CD1-CD2 4.09Å
710	D	87.3	Confident	85.5	Confident	48 Å²	48	49.8 Å²	49.8	26%	0.257	25%	0.246	S	C	.	.	H	α-helix	trans	-65.4	-40.3	175.1	-82.6	-1.7	0	0	0	111.8	V708 A712 A713 G714 R722 V723	V708-D710 PolarHBondContact O-N 3.42Å; D710-A712 VanDerWaalsContact C-N 3.32Å; D710-A712 PolarHBondContact O-N 3Å; D710-A713 PolarHBondContact O-N 3.33Å; D710-G714 PolarHBondContact O-N 3.1Å; D710-R722 WeakPolarHBondContact OD1-CA 3.24Å; D710-R722 WeakPolarHBondContact OD2-CG 3.46Å; D710-V723 PolarHBondContact OD1-N 3.11Å
711	V	88.1	Confident	84.8	Confident	84 Å²	84	42.6 Å²	42.6	51%	0.509	22%	0.22	S	C	.	.	H	α-helix	trans	-64.7	-38	177.1	-178.3	0	0	0	0	110.9	I645 V708 A715	I645-V711 HydrophobicContact CD1-CG1 4.12Å; V708-V711 WeakPolarHBondContact O-CB 3.35Å; V708-V711 PolarHBondContact O-N 3.2Å; V708-V711 VanDerWaalsContact O-N 3.13Å; V711-A715 WeakPolarHBondContact O-CB 3.27Å; V711-A715 PolarHBondContact O-N 3.37Å; V711-A715 VanDerWaalsContact O-N 3.15Å
712	A	88.7	Confident	84.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-46.9	174.6	0	0	0	0	0	111.8	L648 L652 V708 I709 D710 A715 V716	L648-A712 HydrophobicContact CB-CB 3.67Å; L652-A712 HydrophobicContact CD1-CB 3.79Å; V708-A712 PolarHBondContact O-N 3.45Å; I709-A712 PolarHBondContact O-N 3.05Å; D710-A712 VanDerWaalsContact C-N 3.32Å; D710-A712 PolarHBondContact O-N 3Å; A712-A715 PolarHBondContact O-N 3.35Å; A712-V716 PolarHBondContact O-N 3.24Å; A712-V716 VanDerWaalsContact O-N 3.11Å
713	A	86.2	Confident	83.9	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-50.6	177.8	0	0	0	0	0	111.9	L652 I709 D710 A715 V716 H717 V723	L652-A713 HydrophobicContact CD1-CB 4.25Å; L652-A713 HydrophobicContact CD2-CB 4.5Å; I709-A713 WeakPolarHBondContact O-CB 3.44Å; I709-A713 PolarHBondContact O-N 3.17Å; D710-A713 PolarHBondContact O-N 3.33Å; A713-A715 VanDerWaalsContact C-N 3.3Å; A713-A715 PolarHBondContact O-N 3.4Å; A713-V716 PolarHBondContact O-N 3.43Å; A713-H717 PolarHBondContact O-CD2 3.22Å; A713-H717 PolarHBondContact O-N 2.86Å; A713-V723 HydrophobicContact CB-CG2 3.73Å
714	G	82.7	Confident	83.5	Confident	15 Å²	15	53.4 Å²	53.4	16%	0.155	27%	0.265	C	S	.	.	H	α-helix	trans	-64	-33.5	178.9	0	0	0	0	0	113.5	D710 R718 T719	D710-G714 PolarHBondContact O-N 3.1Å; G714-R718 VanDerWaalsContact O-CA 3.26Å; G714-R718 WeakPolarHBondContact O-CA 3.38Å; G714-R718 PolarHBondContact O-N 2.79Å; G714-T719 WeakPolarHBondContact CA-O 2.93Å; G714-T719 PolarHBondContact O-N 3.13Å
715	A	84.1	Confident	83.1	Confident	50 Å²	50	54.6 Å²	54.6	41%	0.413	28%	0.276	S	S	.	.	H	α-helix	trans	-73.2	-26.5	176.5	0	0	0	0	0	114.1	V711 A712 A713	V711-A715 WeakPolarHBondContact O-CB 3.27Å; V711-A715 PolarHBondContact O-N 3.37Å; V711-A715 VanDerWaalsContact O-N 3.15Å; A712-A715 PolarHBondContact O-N 3.35Å; A713-A715 VanDerWaalsContact C-N 3.3Å; A713-A715 PolarHBondContact O-N 3.4Å
716	V	83	Confident	83.1	Confident	19 Å²	19	54.9 Å²	54.9	12%	0.115	28%	0.278	C	S	.	.	H	α-helix	trans	-79.3	-53.6	173.1	174.4	0	0	0	0	110.6	K649 L652 R653 A712 A713 R718	K649-V716 HydrophobicContact CB-CG2 4.15Å; K649-V716 HydrophobicContact CG-CG2 3.94Å; L652-V716 HydrophobicContact CB-CB 4.3Å; L652-V716 HydrophobicContact CB-CG1 4.35Å; L652-V716 HydrophobicContact CB-CG2 3.9Å; L652-V716 HydrophobicContact CD1-CG2 4.44Å; R653-V716 HydrophobicContact CG-CG1 4.3Å; R653-V716 HydrophobicContact CG-CG2 4.48Å; A712-V716 PolarHBondContact O-N 3.24Å; A712-V716 VanDerWaalsContact O-N 3.11Å; A713-V716 PolarHBondContact O-N 3.43Å; V716-R718 VanDerWaalsContact C-N 3.28Å; V716-R718 PolarHBondContact O-N 2.83Å
717	H	81.8	Confident	83	Confident	15 Å²	15	56.1 Å²	56.1	7%	0.069	28%	0.283	C	S	.	.	H	α-helix	trans	-78.9	-9.3	-175.4	-57.3	-50.5	0	0	0	114.1	A713 T719	A713-H717 PolarHBondContact O-CD2 3.22Å; A713-H717 PolarHBondContact O-N 2.86Å; H717-T719 VanDerWaalsContact C-N 3.32Å; H717-T719 PolarHBondContact O-N 3.27Å
718	R	75.6	Confident	83.1	Confident	104 Å²	104	49.6 Å²	49.6	39%	0.392	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	41.8	178.3	-67.8	179.9	-84.9	-179.2	-6.6	113.1	G714 V716	G714-R718 VanDerWaalsContact O-CA 3.26Å; G714-R718 WeakPolarHBondContact O-CA 3.38Å; G714-R718 PolarHBondContact O-N 2.79Å; V716-R718 VanDerWaalsContact C-N 3.28Å; V716-R718 PolarHBondContact O-N 2.83Å
719	T	73.3	Confident	83	Confident	34 Å²	34	49.4 Å²	49.4	21%	0.209	25%	0.252	C	S	.	.	S	Bend	trans	-144	147.3	176.2	47.1	0	0	0	0	108.3	G714 H717 M721 K1439	G714-T719 WeakPolarHBondContact CA-O 2.93Å; G714-T719 PolarHBondContact O-N 3.13Å; H717-T719 VanDerWaalsContact C-N 3.32Å; H717-T719 PolarHBondContact O-N 3.27Å; T719-M721 PolarHBondContact O-N 3.36Å; T719-M721 VanDerWaalsContact O-N 3.15Å; T719-K1439 HydrophobicContact CG2-CB 3.89Å; T719-K1439 HydrophobicContact CG2-CG 4.34Å
720	I	71.9	Confident	82.7	Confident	168 Å²	168	51 Å²	51	86%	0.862	26%	0.263	S	S	*	.			trans	-64.2	119.8	165.2	-58.6	175.6	0	0	0	106.6
721	M	73.1	Confident	82.8	Confident	17 Å²	17	49.3 Å²	49.3	8%	0.084	25%	0.254	C	S	.	.			trans	-138.9	135.1	-175.7	-176.1	170.9	-167.8	0	0	108.3	T719 P742 I1438 E1479	T719-M721 PolarHBondContact O-N 3.36Å; T719-M721 VanDerWaalsContact O-N 3.15Å; M721-P742 HydrophobicContact CE-CB 3.9Å; M721-P742 HydrophobicContact CE-CG 3.63Å; M721-P742 HydrophobicContact SD-CG 4.05Å; M721-I1438 HydrophobicContact CE-CD1 3.81Å; M721-I1438 HydrophobicContact SD-CD1 3.81Å; M721-E1479 WeakPolarHBondContact CE-O 3.5Å
722	R	78.1	Confident	82.7	Confident	206 Å²	206	46 Å²	46	78%	0.777	23%	0.234	S	C	*	.	P	Polyproline II helix	trans	-102	131.1	163.2	-63.3	-166.4	170.9	172.5	-3.2	108.5	D710	D710-R722 WeakPolarHBondContact OD1-CA 3.24Å; D710-R722 WeakPolarHBondContact OD2-CG 3.46Å
723	V	81.3	Confident	82.7	Confident	17 Å²	17	46 Å²	46	10%	0.103	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-70.9	155.8	167.5	-170.2	0	0	0	0	107.5	I709 D710 A713	I709-V723 HydrophobicContact CG1-CG2 4.43Å; D710-V723 PolarHBondContact OD1-N 3.11Å; A713-V723 HydrophobicContact CB-CG2 3.73Å
724	K	81.6	Confident	82.7	Confident	110 Å²	110	46.2 Å²	46.2	48%	0.478	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-59.7	147.5	169.8	-71.4	-174.3	174.6	-173.6	0	110	W739 E1479	K724-W739 VanDerWaalsContact O-CD1 3.27Å; K724-E1479 WeakPolarHBondContact CE-OE2 3.37Å; K724-E1479 IonicContact NZ-OE2 3.67Å
725	P	81.9	Confident	83.1	Confident	69 Å²	69	45.5 Å²	45.5	45%	0.448	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-58.6	149.8	169.2	29.2	-35.5	0	0	0	109.4	S1265	P725-S1265 WeakPolarHBondContact CG-O 3.46Å
726	P	88.7	Confident	83.4	Confident	9 Å²	9	43.9 Å²	43.9	6%	0.058	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-68.4	161.8	-178.3	28.7	-34.1	0	0	0	112.1	L737 V738 W739 L1263 A1266 Q1267	P726-L737 HydrophobicContact CB-CB 4.17Å; P726-L737 HydrophobicContact CG-CD2 4.43Å; P726-V738 CarbonylContact C-O 3.42Å; P726-V738 WeakPolarHBondContact CA-O 3.41Å; P726-V738 WeakPolarHBondContact CB-O 3.4Å; P726-W739 HydrophobicContact CB-CD2 3.88Å; P726-W739 HydrophobicContact CB-CE3 4.29Å; P726-W739 HydrophobicContact CB-CG 4.28Å; P726-W739 HydrophobicContact CB-CH2 4.46Å; P726-W739 HydrophobicContact CB-CZ2 4.05Å; P726-W739 HydrophobicContact CG-CH2 4.4Å; P726-W739 HydrophobicContact CG-CZ2 3.85Å; P726-L1263 HydrophobicContact CG-CD2 4.1Å; P726-A1266 HydrophobicContact CG-CB 4.4Å; P726-A1266 WeakPolarHBondContact O-CA 3.22Å; P726-A1266 WeakPolarHBondContact O-CB 3.46Å; P726-Q1267 PolarHBondContact O-N 2.93Å
727	E	88.6	Confident	83.9	Confident	55 Å²	55	43 Å²	43	26%	0.257	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	135.8	152.7	-66.5	118.8	-175.9	0	0	108.9	L737 V738 Q1267	E727-L737 CarbonylContact O-C 3.41Å; E727-L737 WeakPolarHBondContact O-CA 3.41Å; E727-V738 HydrophobicContact CB-CB 4.31Å; E727-V738 PolarHBondContact N-O 3.49Å; E727-V738 PolarHBondContact O-N 2.7Å; E727-Q1267 CarbonylContact C-O 3.57Å; E727-Q1267 WeakPolarHBondContact CA-O 3.15Å; E727-Q1267 HydrophobicContact CG-CB 4.34Å
728	I	89	Confident	84.3	Confident	4 Å²	4	43 Å²	43	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.3	179.6	-57.7	170.5	0	0	0	109.6	R736 L737 W1257 M1258 L1263 A1266 Q1267 R1268 E1269	I728-R736 WeakPolarHBondContact CA-O 3.29Å; I728-L737 HydrophobicContact CB-CD2 4.43Å; I728-L737 HydrophobicContact CG1-CD2 3.74Å; I728-L737 HydrophobicContact CG2-CD2 4.29Å; I728-W1257 HydrophobicContact CG2-CH2 3.54Å; I728-W1257 HydrophobicContact CG2-CZ2 4.46Å; I728-W1257 HydrophobicContact CG2-CZ3 3.74Å; I728-M1258 HydrophobicContact CG2-CG 3.92Å; I728-M1258 HydrophobicContact CG2-SD 3.87Å; I728-L1263 HydrophobicContact CD1-CB 3.85Å; I728-L1263 HydrophobicContact CD1-CD1 3.89Å; I728-L1263 HydrophobicContact CD1-CD2 4.16Å; I728-L1263 HydrophobicContact CD1-CG 4.19Å; I728-A1266 HydrophobicContact CD1-CB 3.32Å; I728-A1266 HydrophobicContact CG1-CB 3.67Å; I728-Q1267 PolarHBondContact N-O 3.29Å; I728-R1268 WeakPolarHBondContact O-CA 3.39Å; I728-E1269 PolarHBondContact O-N 3.3Å
729	C	87	Confident	85	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.034	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.6	171.9	-173.6	0	0	0	0	110.3	R736 E1269 L1271	C729-R736 HydrophobicContact CB-CB 4.3Å; C729-R736 PolarHBondContact N-O 3.02Å; C729-R736 PolarHBondContact O-N 3.46Å; C729-E1269 WeakPolarHBondContact CA-O 3.44Å; C729-E1269 WeakPolarHBondContact CB-O 3.19Å; C729-E1269 PolarHBondContact SG-O 2.96Å; C729-E1269 VanDerWaalsContact SG-O 3.33Å; C729-L1271 VanDerWaalsContact SG-CD1 3.59Å; C729-L1271 PolarHBondContact SG-N 2.99Å
730	C	85.1	Confident	85.8	Confident	42 Å²	42	39.2 Å²	39.2	28%	0.284	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	151.6	163.4	-87.1	0	0	0	0	110	N1255 W1257 M1258	C730-N1255 PolarHBondContact SG-OD1 3.22Å; C730-W1257 VanDerWaalsContact SG-CZ2 3.57Å; C730-M1258 VanDerWaalsContact SG-CE 3.52Å; C730-M1258 VanDerWaalsContact SG-SD 3.61Å
731	T	88.3	Confident	86.6	Confident	12 Å²	12	31.3 Å²	31.3	7%	0.074	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	157.7	-177.3	61.2	0	0	0	0	111.8	Y733 G734 G735 R736 L1271	T731-Y733 HydrophobicContact CG2-CE1 3.86Å; T731-Y733 HydrophobicContact CG2-CE2 4.36Å; T731-Y733 PolarHBondContact O-N 3.31Å; T731-Y733 VanDerWaalsContact OG1-CD2 3.3Å; T731-Y733 WeakPolarHBondContact OG1-CD2 3.16Å; T731-Y733 WeakPolarHBondContact OG1-CE1 3.44Å; T731-Y733 VanDerWaalsContact OG1-CE2 3.23Å; T731-Y733 WeakPolarHBondContact OG1-CE2 3.37Å; T731-Y733 VanDerWaalsContact OG1-CZ 3.31Å; T731-G734 PolarHBondContact N-O 3.16Å; T731-G734 VanDerWaalsContact N-O 3.12Å; T731-G734 PolarHBondContact O-N 3.15Å; T731-G734 PolarHBondContact OG1-N 3.4Å; T731-G734 PolarHBondContact OG1-O 3.33Å; T731-G735 PolarHBondContact OG1-N 3.14Å; T731-R736 HydrophobicContact CG2-CB 3.97Å; T731-L1271 HydrophobicContact CG2-CD1 4.23Å
732	P	86.4	Confident	87.2	Confident	14 Å²	14	30.6 Å²	30.6	9%	0.091	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-12	176	-28.9	36.9	0	0	0	115.8	E1276 W1279 R1283	P732-E1276 HydrophobicContact CG-CG 3.89Å; P732-W1279 HydrophobicContact CB-CB 4.2Å; P732-W1279 HydrophobicContact CG-CB 3.98Å; P732-R1283 WeakPolarHBondContact O-CD 3.17Å; P732-R1283 PolarHBondContact O-NH1 3.43Å; P732-R1283 VanDerWaalsContact O-NH1 3.12Å
733	Y	88.7	Confident	87.5	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.008	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-1.6	-179.2	62	-105.4	0	0	0	115.4	T731 G735 R736 H750 D753 I757 M767 W1279	T731-Y733 HydrophobicContact CG2-CE1 3.86Å; T731-Y733 HydrophobicContact CG2-CE2 4.36Å; T731-Y733 PolarHBondContact O-N 3.31Å; T731-Y733 VanDerWaalsContact OG1-CD2 3.3Å; T731-Y733 WeakPolarHBondContact OG1-CD2 3.16Å; T731-Y733 WeakPolarHBondContact OG1-CE1 3.44Å; T731-Y733 VanDerWaalsContact OG1-CE2 3.23Å; T731-Y733 WeakPolarHBondContact OG1-CE2 3.37Å; T731-Y733 VanDerWaalsContact OG1-CZ 3.31Å; Y733-G735 VanDerWaalsContact CE2-O 3.28Å; Y733-G735 WeakPolarHBondContact CE2-O 3.35Å; Y733-R736 PolarHBondContact OH-NE 3.16Å; Y733-R736 PolarHBondContact OH-NH2 2.8Å; Y733-H750 HydrophobicContact CE2-CB 4.03Å; Y733-H750 AromaticContact CZ-ND1 3.69Å; Y733-H750 PolarHBondContact OH-ND1 3.39Å; Y733-D753 PolarHBondContact O-N 2.94Å; Y733-I757 HydrophobicContact CG-CD1 4.35Å; Y733-M767 HydrophobicContact CD1-CE 3.59Å; Y733-M767 HydrophobicContact CD2-CE 3.57Å; Y733-M767 HydrophobicContact CE1-CE 3.74Å; Y733-M767 HydrophobicContact CE2-CE 3.72Å; Y733-M767 HydrophobicContact CG-CE 3.52Å; Y733-W1279 AromaticContact CD1-CD2 3.79Å; Y733-W1279 HydrophobicContact CD1-CD2 3.79Å; Y733-W1279 AromaticContact CD1-CE3 3.87Å; Y733-W1279 HydrophobicContact CD1-CE3 3.87Å; Y733-W1279 HydrophobicContact CD1-CG 4.14Å; Y733-W1279 HydrophobicContact CD1-CZ3 4.33Å; Y733-W1279 AromaticContact CE1-CD2 3.77Å; Y733-W1279 HydrophobicContact CE1-CD2 3.77Å; Y733-W1279 AromaticContact CE1-CE2 3.67Å; Y733-W1279 HydrophobicContact CE1-CE3 4.14Å; Y733-W1279 HydrophobicContact CE1-CG 4.2Å; Y733-W1279 HydrophobicContact CE1-CH2 4.3Å; Y733-W1279 AromaticContact CE1-CZ2 3.95Å; Y733-W1279 HydrophobicContact CE1-CZ2 3.95Å; Y733-W1279 HydrophobicContact CE1-CZ3 4.4Å
734	G	87.6	Confident	87.7	Confident	3 Å²	3	24.8 Å²	24.8	3%	0.031	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137.1	-109.3	-169.9	0	0	0	0	0	111	T731	T731-G734 PolarHBondContact N-O 3.16Å; T731-G734 VanDerWaalsContact N-O 3.12Å; T731-G734 PolarHBondContact O-N 3.15Å; T731-G734 PolarHBondContact OG1-N 3.4Å; T731-G734 PolarHBondContact OG1-O 3.33Å
735	G	89.6	Confident	88.2	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	169.4	-179.3	0	0	0	0	0	114.5	T731 Y733 L751	T731-G735 PolarHBondContact OG1-N 3.14Å; Y733-G735 VanDerWaalsContact CE2-O 3.28Å; Y733-G735 WeakPolarHBondContact CE2-O 3.35Å; G735-L751 PolarHBondContact N-O 3.39Å; G735-L751 PolarHBondContact O-N 2.86Å
736	R	91.7	Very high	88.6	Confident	16 Å²	16	19.5 Å²	19.5	6%	0.06	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	138.1	175.6	-177.7	178	-62.4	-179.1	3.4	110.2	I728 C729 T731 Y733 V738 T748 V749 E1275	I728-R736 WeakPolarHBondContact CA-O 3.29Å; C729-R736 HydrophobicContact CB-CB 4.3Å; C729-R736 PolarHBondContact N-O 3.02Å; C729-R736 PolarHBondContact O-N 3.46Å; T731-R736 HydrophobicContact CG2-CB 3.97Å; Y733-R736 PolarHBondContact OH-NE 3.16Å; Y733-R736 PolarHBondContact OH-NH2 2.8Å; R736-V738 HydrophobicContact CG-CG2 3.91Å; R736-T748 HydrophobicContact CG-CG2 3.77Å; R736-V749 WeakPolarHBondContact CA-O 3.19Å; R736-E1275 IonicContact CZ-OE1 2.85Å; R736-E1275 IonicContact NH1-OE1 2.9Å; R736-E1275 PolarHBondContact NH1-OE1 3.47Å; R736-E1275 IonicContact NH1-OE2 3.2Å; R736-E1275 PolarHBondContact NH1-OE2 2.85Å; R736-E1275 IonicContact NH2-OE1 3.41Å; R736-E1275 PolarHBondContact NH2-OE1 3.33Å
737	L	92.1	Very high	88.8	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.7	169	-52.9	176.9	0	0	0	108	L706 P726 E727 I728 W739 V749 L751 W1257 L1263	L706-L737 HydrophobicContact CD2-CD1 4.09Å; P726-L737 HydrophobicContact CB-CB 4.17Å; P726-L737 HydrophobicContact CG-CD2 4.43Å; E727-L737 CarbonylContact O-C 3.41Å; E727-L737 WeakPolarHBondContact O-CA 3.41Å; I728-L737 HydrophobicContact CB-CD2 4.43Å; I728-L737 HydrophobicContact CG1-CD2 3.74Å; I728-L737 HydrophobicContact CG2-CD2 4.29Å; L737-W739 HydrophobicContact CB-CE3 4.16Å; L737-W739 HydrophobicContact CB-CH2 3.9Å; L737-W739 HydrophobicContact CB-CZ3 3.49Å; L737-W739 VanDerWaalsContact CB-CZ3 3.49Å; L737-W739 HydrophobicContact CD1-CH2 3.64Å; L737-W739 HydrophobicContact CD1-CZ3 3.99Å; L737-W739 HydrophobicContact CG-CH2 4.42Å; L737-W739 HydrophobicContact CG-CZ3 4.4Å; L737-V749 HydrophobicContact CB-CB 4.35Å; L737-V749 PolarHBondContact N-O 2.86Å; L737-V749 PolarHBondContact O-N 3.41Å; L737-L751 HydrophobicContact CD1-CD1 4.08Å; L737-L751 HydrophobicContact CG-CD1 4.04Å; L737-L751 HydrophobicContact CG-CG 4.46Å; L737-W1257 HydrophobicContact CD2-CZ3 4.32Å; L737-L1263 HydrophobicContact CD2-CD1 4.23Å; L737-L1263 HydrophobicContact CD2-CD2 4.41Å
738	V	91.7	Very high	89.1	Confident	15 Å²	15	16.8 Å²	16.8	9%	0.091	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.1	177.6	-173.4	0	0	0	0	109.2	P726 E727 R736 K746 T748	P726-V738 CarbonylContact C-O 3.42Å; P726-V738 WeakPolarHBondContact CA-O 3.41Å; P726-V738 WeakPolarHBondContact CB-O 3.4Å; E727-V738 HydrophobicContact CB-CB 4.31Å; E727-V738 PolarHBondContact N-O 3.49Å; E727-V738 PolarHBondContact O-N 2.7Å; R736-V738 HydrophobicContact CG-CG2 3.91Å; V738-K746 HydrophobicContact CG1-CD 4.46Å; V738-T748 HydrophobicContact CG2-CG2 4.3Å
739	W	90	Very high	89.3	Confident	10 Å²	10	16.6 Å²	16.6	4%	0.038	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.7	171.7	-79.9	-86	0	0	0	110.9	L706 I709 K724 P726 L737 L747 V749	L706-W739 HydrophobicContact CD2-CH2 3.61Å; L706-W739 HydrophobicContact CD2-CZ2 3.56Å; I709-W739 HydrophobicContact CD1-CD2 3.77Å; I709-W739 HydrophobicContact CD1-CE3 4.4Å; I709-W739 HydrophobicContact CD1-CG 3.85Å; I709-W739 HydrophobicContact CD1-CZ2 4.31Å; K724-W739 VanDerWaalsContact O-CD1 3.27Å; P726-W739 HydrophobicContact CB-CD2 3.88Å; P726-W739 HydrophobicContact CB-CE3 4.29Å; P726-W739 HydrophobicContact CB-CG 4.28Å; P726-W739 HydrophobicContact CB-CH2 4.46Å; P726-W739 HydrophobicContact CB-CZ2 4.05Å; P726-W739 HydrophobicContact CG-CH2 4.4Å; P726-W739 HydrophobicContact CG-CZ2 3.85Å; L737-W739 HydrophobicContact CB-CE3 4.16Å; L737-W739 HydrophobicContact CB-CH2 3.9Å; L737-W739 HydrophobicContact CB-CZ3 3.49Å; L737-W739 VanDerWaalsContact CB-CZ3 3.49Å; L737-W739 HydrophobicContact CD1-CH2 3.64Å; L737-W739 HydrophobicContact CD1-CZ3 3.99Å; L737-W739 HydrophobicContact CG-CH2 4.42Å; L737-W739 HydrophobicContact CG-CZ3 4.4Å; W739-L747 HydrophobicContact CB-CB 4.19Å; W739-L747 PolarHBondContact N-O 3.4Å; W739-L747 PolarHBondContact O-N 2.69Å; W739-V749 HydrophobicContact CE3-CG2 3.97Å; W739-V749 HydrophobicContact CZ3-CB 4.06Å; W739-V749 HydrophobicContact CZ3-CG2 3.5Å
740	T	89.2	Confident	89.6	Confident	49 Å²	49	16.4 Å²	16.4	30%	0.301	9%	0.086	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	111.8	159.1	-66.5	0	0	0	0	108.9
741	L	89	Confident	90	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.01	7%	0.072	C	C	.	.			trans	-70.4	164.5	179.1	-64.3	-178.2	0	0	0	112.3	I651 L652 D655 G743 K744 N745 L747	I651-L741 HydrophobicContact CG2-CD1 4.17Å; L652-L741 HydrophobicContact CD2-CD2 4.21Å; D655-L741 HydrophobicContact CB-CB 4.5Å; D655-L741 HydrophobicContact CB-CD1 3.98Å; D655-L741 WeakPolarHBondContact OD2-CB 3.48Å; L741-G743 PolarHBondContact O-N 2.67Å; L741-G743 VanDerWaalsContact O-N 3.12Å; L741-K744 WeakPolarHBondContact O-CA 3.4Å; L741-K744 PolarHBondContact O-N 3.23Å; L741-N745 WeakPolarHBondContact CB-O 3.4Å; L741-N745 PolarHBondContact N-O 3.02Å; L741-L747 HydrophobicContact CD1-CB 4.14Å; L741-L747 HydrophobicContact CD2-CB 3.99Å; L741-L747 HydrophobicContact CD2-CD2 3.98Å; L741-L747 HydrophobicContact CG-CB 3.97Å
742	P	86	Confident	90.1	Very high	3 Å²	3	13.9 Å²	13.9	2%	0.019	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-33.6	179.2	-30.6	39.3	0	0	0	114.5	M721 K744 T1480 L1481	M721-P742 HydrophobicContact CE-CB 3.9Å; M721-P742 HydrophobicContact CE-CG 3.63Å; M721-P742 HydrophobicContact SD-CG 4.05Å; P742-K744 VanDerWaalsContact C-N 3.3Å; P742-K744 PolarHBondContact O-N 2.98Å; P742-T1480 CarbonylContact O-C 3.57Å; P742-T1480 VanDerWaalsContact O-CA 3.28Å; P742-T1480 WeakPolarHBondContact O-CA 3.48Å; P742-T1480 WeakPolarHBondContact O-CB 3.4Å; P742-L1481 HydrophobicContact CB-CD1 4.34Å; P742-L1481 HydrophobicContact CB-CG 4.02Å; P742-L1481 PolarHBondContact O-N 3.26Å
743	G	84.5	Confident	90.1	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	17.2	173.5	0	0	0	0	0	115	D655 R662 L741 N745	D655-G743 WeakPolarHBondContact OD1-CA 3.3Å; D655-G743 PolarHBondContact OD1-N 3.15Å; D655-G743 VanDerWaalsContact OD2-CA 3.3Å; D655-G743 WeakPolarHBondContact OD2-CA 3.28Å; D655-G743 PolarHBondContact OD2-N 3.09Å; R662-G743 PolarHBondContact NH1-O 3.26Å; R662-G743 PolarHBondContact NH2-O 3.17Å; L741-G743 PolarHBondContact O-N 2.67Å; L741-G743 VanDerWaalsContact O-N 3.12Å; G743-N745 PolarHBondContact O-N 3Å; G743-N745 VanDerWaalsContact O-N 3.15Å; G743-N745 PolarHBondContact O-ND2 3.22Å
744	K	85.8	Confident	89.9	Confident	101 Å²	101	18.2 Å²	18.2	44%	0.439	9%	0.087	S	C	.	.	S	Bend	trans	61.3	11.9	178.7	-60.6	-179.8	167.8	-179.7	0	115.7	L741 P742 D1482	L741-K744 WeakPolarHBondContact O-CA 3.4Å; L741-K744 PolarHBondContact O-N 3.23Å; P742-K744 VanDerWaalsContact C-N 3.3Å; P742-K744 PolarHBondContact O-N 2.98Å; K744-D1482 HydrophobicContact CD-CB 4.27Å; K744-D1482 IonicContact NZ-OD2 3.56Å; K744-D1482 PolarHBondContact NZ-OD2 2.95Å
745	N	90.6	Very high	89.6	Confident	13 Å²	13	21.6 Å²	21.6	7%	0.07	12%	0.115	C	C	.	.			trans	-85.7	149.6	171.5	-59.3	-56.4	0	0	0	109.7	D655 Q658 R662 F678 L741 G743	D655-N745 WeakPolarHBondContact OD1-CB 3.15Å; D655-N745 PolarHBondContact OD1-ND2 3.21Å; Q658-N745 PolarHBondContact OE1-ND2 2.82Å; Q658-N745 VanDerWaalsContact OE1-ND2 3.17Å; Q658-N745 PolarHBondContact OE1-OD1 3.46Å; R662-N745 PolarHBondContact NH1-OD1 3.44Å; F678-N745 HydrophobicContact CD1-CB 4.22Å; L741-N745 WeakPolarHBondContact CB-O 3.4Å; L741-N745 PolarHBondContact N-O 3.02Å; G743-N745 PolarHBondContact O-N 3Å; G743-N745 VanDerWaalsContact O-N 3.15Å; G743-N745 PolarHBondContact O-ND2 3.22Å
746	K	90.8	Very high	89.4	Confident	55 Å²	55	24.8 Å²	24.8	24%	0.239	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	140	-178.5	-66.8	-174	180	178.3	0	111.3	E594 E679 A680 V738	E594-K746 WeakPolarHBondContact OE1-CE 3.5Å; E594-K746 IonicContact OE1-NZ 3.48Å; E594-K746 PolarHBondContact OE1-NZ 3Å; E594-K746 IonicContact OE2-NZ 3.08Å; E679-K746 HydrophobicContact CG-CB 4.14Å; E679-K746 WeakPolarHBondContact CG-O 3.38Å; A680-K746 PolarHBondContact N-O 2.98Å; V738-K746 HydrophobicContact CG1-CD 4.46Å
747	L	93.5	Very high	89.1	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	105.7	168.9	169.7	63.2	0	0	0	108.2	L648 A680 I682 I709 W739 L741	L648-L747 HydrophobicContact CD2-CD2 4.16Å; A680-L747 HydrophobicContact CB-CD1 3.58Å; A680-L747 CarbonylContact O-C 3.45Å; A680-L747 WeakPolarHBondContact O-CA 3.33Å; I682-L747 HydrophobicContact CD1-CD1 3.78Å; I682-L747 HydrophobicContact CG1-CD1 3.97Å; I709-L747 HydrophobicContact CD1-CD2 4.09Å; W739-L747 HydrophobicContact CB-CB 4.19Å; W739-L747 PolarHBondContact N-O 3.4Å; W739-L747 PolarHBondContact O-N 2.69Å; L741-L747 HydrophobicContact CD1-CB 4.14Å; L741-L747 HydrophobicContact CD2-CB 3.99Å; L741-L747 HydrophobicContact CD2-CD2 3.98Å; L741-L747 HydrophobicContact CG-CB 3.97Å
748	T	93.8	Very high	88.7	Confident	4 Å²	4	26 Å²	26	3%	0.025	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.9	-179.6	-54.7	0	0	0	0	110.2	A680 H681 I682 R736 V738 H750	A680-T748 PolarHBondContact O-N 2.98Å; H681-T748 CarbonylContact C-O 3.5Å; H681-T748 VanDerWaalsContact CA-O 3.24Å; H681-T748 WeakPolarHBondContact CA-O 3.46Å; I682-T748 PolarHBondContact N-O 2.99Å; R736-T748 HydrophobicContact CG-CG2 3.77Å; V738-T748 HydrophobicContact CG2-CG2 4.3Å; T748-H750 WeakPolarHBondContact CG2-NE2 3.44Å
749	V	94	Very high	88	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117	172.5	-173.6	0	0	0	0	109	I682 L705 R736 L737 W739 L751	I682-V749 HydrophobicContact CB-CG1 4.31Å; I682-V749 HydrophobicContact CB-CG2 4.14Å; I682-V749 HydrophobicContact CD1-CG2 4.13Å; I682-V749 HydrophobicContact CG1-CG2 4.48Å; I682-V749 CarbonylContact O-C 3.46Å; I682-V749 WeakPolarHBondContact O-CA 3.39Å; L705-V749 HydrophobicContact CD2-CG1 4.1Å; L705-V749 HydrophobicContact CD2-CG2 4.46Å; R736-V749 WeakPolarHBondContact CA-O 3.19Å; L737-V749 HydrophobicContact CB-CB 4.35Å; L737-V749 PolarHBondContact N-O 2.86Å; L737-V749 PolarHBondContact O-N 3.41Å; W739-V749 HydrophobicContact CE3-CG2 3.97Å; W739-V749 HydrophobicContact CZ3-CB 4.06Å; W739-V749 HydrophobicContact CZ3-CG2 3.5Å; V749-L751 HydrophobicContact CG1-CD2 3.98Å
750	H	93.7	Very high	87.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	108.7	177.4	-58	-103	0	0	0	108.4	H681 I682 F683 F684 Y733 T748 M767 Y771	H681-H750 AromaticContact CG-NE2 3.97Å; H681-H750 AromaticContact ND1-CD2 3.98Å; H681-H750 AromaticContact ND1-NE2 3.05Å; H681-H750 PolarHBondContact ND1-NE2 3.16Å; I682-H750 PolarHBondContact O-N 2.84Å; F683-H750 HydrophobicContact CD1-CB 3.63Å; F683-H750 AromaticContact CD1-CG 3.88Å; F683-H750 HydrophobicContact CE1-CB 3.69Å; F683-H750 AromaticContact CE1-CD2 3.46Å; F683-H750 VanDerWaalsContact CE1-CD2 3.46Å; F683-H750 WeakPolarHBondContact CE1-CD2 3.28Å; F683-H750 AromaticContact CE1-CG 3.4Å; F683-H750 AromaticContact CE1-ND1 3.8Å; F683-H750 AromaticContact CE1-NE2 3.93Å; F683-H750 AromaticContact CE2-CD2 3.83Å; F683-H750 HydrophobicContact CG-CB 4.35Å; F683-H750 HydrophobicContact CZ-CB 4.43Å; F683-H750 AromaticContact CZ-CD2 3.31Å; F683-H750 WeakPolarHBondContact CZ-CD2 3.26Å; F683-H750 AromaticContact CZ-CE1 3.99Å; F683-H750 AromaticContact CZ-CG 3.77Å; F683-H750 AromaticContact CZ-NE2 3.49Å; F683-H750 WeakPolarHBondContact CZ-NE2 3.41Å; F684-H750 PolarHBondContact N-O 2.88Å; Y733-H750 HydrophobicContact CE2-CB 4.03Å; Y733-H750 AromaticContact CZ-ND1 3.69Å; Y733-H750 PolarHBondContact OH-ND1 3.39Å; T748-H750 WeakPolarHBondContact CG2-NE2 3.44Å; H750-M767 HydrophobicContact CB-CE 4.44Å; H750-Y771 AromaticContact CE1-CE1 3.98Å
751	L	92.3	Very high	87.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	110.5	177.8	-57.4	-179.2	0	0	0	109	F684 A687 F688 L698 V702 G735 L737 V749 W1257	F684-L751 HydrophobicContact CB-CD2 4.06Å; F684-L751 HydrophobicContact CG-CD2 4.44Å; A687-L751 HydrophobicContact CB-CB 3.74Å; A687-L751 HydrophobicContact CB-CD2 4.05Å; A687-L751 HydrophobicContact CB-CG 4.42Å; F688-L751 HydrophobicContact CE2-CB 3.87Å; F688-L751 HydrophobicContact CZ-CB 4.03Å; F688-L751 HydrophobicContact CZ-CD1 4.39Å; L698-L751 HydrophobicContact CD2-CD1 3.92Å; V702-L751 HydrophobicContact CG1-CD1 4.35Å; V702-L751 HydrophobicContact CG1-CD2 3.86Å; V702-L751 HydrophobicContact CG2-CD2 4.17Å; G735-L751 PolarHBondContact N-O 3.39Å; G735-L751 PolarHBondContact O-N 2.86Å; L737-L751 HydrophobicContact CD1-CD1 4.08Å; L737-L751 HydrophobicContact CG-CD1 4.04Å; L737-L751 HydrophobicContact CG-CG 4.46Å; V749-L751 HydrophobicContact CG1-CD2 3.98Å; L751-W1257 HydrophobicContact CD1-CZ3 4.19Å
752	K	90.9	Very high	87	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.009	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	128.5	-179.7	-58.7	175	67.1	-160.3	0	111	F684 D685 A687 R758 S764 M767	F684-K752 VanDerWaalsContact O-CB 3.29Å; F684-K752 WeakPolarHBondContact O-CB 3.26Å; F684-K752 WeakPolarHBondContact O-CG 3.48Å; F684-K752 PolarHBondContact O-N 2.9Å; D685-K752 IonicContact OD1-NZ 3.61Å; D685-K752 PolarHBondContact OD1-NZ 3.49Å; D685-K752 IonicContact OD2-NZ 2.76Å; A687-K752 PolarHBondContact N-O 3.42Å; K752-R758 PolarHBondContact NZ-O 2.83Å; K752-S764 WeakPolarHBondContact CD-OG 3.44Å; K752-S764 PolarHBondContact NZ-OG 3.1Å; K752-M767 HydrophobicContact CD-SD 4.17Å; K752-M767 HydrophobicContact CG-SD 4.15Å
753	D	87.6	Confident	87.1	Confident	18 Å²	18	31 Å²	31	10%	0.096	15%	0.152	C	C	.	.			trans	-89.1	122.8	169.7	179.6	-8.1	0	0	0	110	F688 Y733 A755 K756 I757	F688-D753 HydrophobicContact CD2-CB 3.84Å; F688-D753 HydrophobicContact CE2-CB 4.13Å; Y733-D753 PolarHBondContact O-N 2.94Å; D753-A755 PolarHBondContact O-N 3.26Å; D753-A755 WeakPolarHBondContact OD1-CB 3.47Å; D753-A755 PolarHBondContact OD1-N 3.08Å; D753-K756 HydrophobicContact CB-CB 4.12Å; D753-K756 HydrophobicContact CB-CD 3.98Å; D753-K756 HydrophobicContact CB-CG 4.14Å; D753-K756 PolarHBondContact O-N 3.36Å; D753-K756 VanDerWaalsContact OD2-CD 3.23Å; D753-K756 WeakPolarHBondContact OD2-CD 3.36Å; D753-K756 WeakPolarHBondContact OD2-CE 3.12Å; D753-K756 WeakPolarHBondContact OD2-CG 3.4Å; D753-K756 IonicContact OD2-NZ 3.63Å; D753-K756 PolarHBondContact OD2-NZ 2.82Å; D753-I757 PolarHBondContact O-N 3.02Å
754	K	83.4	Confident	87.4	Confident	89 Å²	89	31 Å²	31	39%	0.387	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.9	179.3	56.5	166.2	163.2	-84.2	0	113.6	D686 F688 V759	D686-K754 VanDerWaalsContact OD1-CD 3.24Å; D686-K754 WeakPolarHBondContact OD1-CD 3.31Å; D686-K754 WeakPolarHBondContact OD1-CE 3.44Å; D686-K754 VanDerWaalsContact OD1-CG 3.25Å; D686-K754 WeakPolarHBondContact OD1-CG 3.19Å; D686-K754 IonicContact OD1-NZ 3.7Å; D686-K754 PolarHBondContact OD1-NZ 3.13Å; D686-K754 IonicContact OD2-NZ 2.88Å; D686-K754 PolarHBondContact OD2-NZ 2.55Å; F688-K754 PolarHBondContact O-NZ 3.16Å; K754-V759 HydrophobicContact CB-CG2 4.06Å
755	A	82.1	Confident	87.6	Confident	74 Å²	74	26.3 Å²	26.3	61%	0.612	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-15.9	174.7	0	0	0	0	0	113.1	D753	D753-A755 PolarHBondContact O-N 3.26Å; D753-A755 WeakPolarHBondContact OD1-CB 3.47Å; D753-A755 PolarHBondContact OD1-N 3.08Å
756	K	84.3	Confident	87.6	Confident	67 Å²	67	25.7 Å²	25.7	29%	0.291	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-25.4	-174.9	-62.8	174.9	-173.6	149.4	0	114.2	D753 P1289	D753-K756 HydrophobicContact CB-CB 4.12Å; D753-K756 HydrophobicContact CB-CD 3.98Å; D753-K756 HydrophobicContact CB-CG 4.14Å; D753-K756 PolarHBondContact O-N 3.36Å; D753-K756 VanDerWaalsContact OD2-CD 3.23Å; D753-K756 WeakPolarHBondContact OD2-CD 3.36Å; D753-K756 WeakPolarHBondContact OD2-CE 3.12Å; D753-K756 WeakPolarHBondContact OD2-CG 3.4Å; D753-K756 IonicContact OD2-NZ 3.63Å; D753-K756 PolarHBondContact OD2-NZ 2.82Å; K756-P1289 WeakPolarHBondContact O-CD 2.95Å
757	I	86.4	Confident	87.7	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.015	12%	0.118	C	C	.	.	S	Bend	trans	-139.6	145.5	179.7	-78.1	-159.4	0	0	0	113	Y733 D753 V759 M767 L1287	Y733-I757 HydrophobicContact CG-CD1 4.35Å; D753-I757 PolarHBondContact O-N 3.02Å; I757-V759 PolarHBondContact O-N 2.68Å; I757-M767 HydrophobicContact CD1-CE 4.34Å; I757-M767 HydrophobicContact CD1-SD 4.32Å; I757-L1287 CarbonylContact C-O 3.59Å; I757-L1287 VanDerWaalsContact CA-O 3.31Å; I757-L1287 WeakPolarHBondContact CA-O 3.28Å; I757-L1287 HydrophobicContact CD1-CB 3.78Å; I757-L1287 HydrophobicContact CD1-CD1 3.77Å; I757-L1287 HydrophobicContact CD1-CG 4.42Å; I757-L1287 HydrophobicContact CG1-CB 4.01Å; I757-L1287 HydrophobicContact CG2-CB 4.25Å
758	R	83.1	Confident	87.6	Confident	37 Å²	37	23.1 Å²	23.1	14%	0.14	12%	0.117	C	C	.	.			trans	-48.7	122.8	169.5	-69.6	169.8	-167.1	-169.1	2.4	112.7	K752 W763 Y1286 L1287 Y1288	K752-R758 PolarHBondContact NZ-O 2.83Å; R758-W763 HydrophobicContact CB-CB 3.88Å; R758-W763 HydrophobicContact CB-CD2 4.05Å; R758-W763 HydrophobicContact CB-CG 3.58Å; R758-W763 HydrophobicContact CG-CD2 4.48Å; R758-W763 HydrophobicContact CG-CG 4.48Å; R758-W763 WeakPolarHBondContact O-CB 3.45Å; R758-Y1286 PolarHBondContact NE-O 2.71Å; R758-Y1286 PolarHBondContact NH1-O 3.2Å; R758-L1287 WeakPolarHBondContact CG-O 3.18Å; R758-L1287 PolarHBondContact N-O 2.87Å; R758-Y1288 PolarHBondContact NE-O 3.01Å; R758-Y1288 PolarHBondContact NH2-O 3.35Å
759	V	76.3	Confident	87.4	Confident	67 Å²	67	23 Å²	23	41%	0.406	12%	0.117	S	C	.	.			trans	-72.5	163.2	174.1	-159.4	0	0	0	0	110.6	K754 I757	K754-V759 HydrophobicContact CB-CG2 4.06Å; I757-V759 PolarHBondContact O-N 2.68Å
760	R	77.5	Confident	87.3	Confident	81 Å²	81	24.6 Å²	24.6	31%	0.306	12%	0.123	S	C	.	.	S	Bend	trans	95.5	144.5	179.6	-56.9	171.8	168.8	176.7	-3.5	114.6	D685 R762 W763 S764 D901 V1122	D685-R760 PolarHBondContact OD1-N 2.71Å; R760-R762 VanDerWaalsContact C-N 3.26Å; R760-R762 PolarHBondContact O-N 3.41Å; R760-R762 VanDerWaalsContact O-N 3.09Å; R760-W763 PolarHBondContact O-N 3.38Å; R760-S764 PolarHBondContact O-N 3.34Å; R760-D901 IonicContact CZ-OD2 3.95Å; R760-D901 IonicContact NH1-OD2 3.67Å; R760-D901 PolarHBondContact NH1-OD2 3.4Å; R760-V1122 PolarHBondContact NH2-O 2.88Å
761	K	82.7	Confident	87.2	Confident	21 Å²	21	24.8 Å²	24.8	9%	0.091	12%	0.124	C	C	.	.	H	α-helix	trans	-43.6	-44.6	179.5	174.7	168.9	164.7	-176	0	113.5	T635 W763 S764 Q765 D800 E904 D905 W1124	T635-K761 HydrophobicContact CG2-CG 4.33Å; K761-W763 PolarHBondContact O-N 3.08Å; K761-S764 CarbonylContact O-C 3.52Å; K761-S764 WeakPolarHBondContact O-CA 3.32Å; K761-S764 WeakPolarHBondContact O-CB 3.29Å; K761-S764 PolarHBondContact O-N 3.32Å; K761-Q765 HydrophobicContact CG-CG 4.45Å; K761-Q765 WeakPolarHBondContact O-CG 3.18Å; K761-Q765 PolarHBondContact O-N 3.12Å; K761-D800 WeakPolarHBondContact CE-OD1 3.46Å; K761-D800 IonicContact NZ-OD1 3.93Å; K761-D800 PolarHBondContact NZ-OD1 3.44Å; K761-D800 IonicContact NZ-OD2 3.26Å; K761-D800 PolarHBondContact NZ-OD2 2.83Å; K761-E904 HydrophobicContact CG-CG 4.42Å; K761-E904 IonicContact NZ-OE1 2.59Å; K761-D905 WeakPolarHBondContact CE-OD1 3.31Å; K761-D905 IonicContact NZ-OD1 2.92Å; K761-D905 IonicContact NZ-OD2 3.81Å; K761-D905 PolarHBondContact NZ-OD2 2.97Å; K761-W1124 HydrophobicContact CB-CH2 3.87Å; K761-W1124 HydrophobicContact CB-CZ2 4.24Å; K761-W1124 HydrophobicContact CD-CH2 4.07Å
762	R	87.9	Confident	87	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.015	12%	0.124	C	C	.	.	H	α-helix	trans	-54.9	-47.9	178.2	177.7	177.8	174.9	-144	-5.5	113.4	R760 S764 Q765 V766 Y887 T889 D901 E904	R760-R762 VanDerWaalsContact C-N 3.26Å; R760-R762 PolarHBondContact O-N 3.41Å; R760-R762 VanDerWaalsContact O-N 3.09Å; R762-S764 VanDerWaalsContact C-N 3.32Å; R762-Q765 WeakPolarHBondContact O-CB 3.05Å; R762-Q765 PolarHBondContact O-N 3.42Å; R762-Q765 VanDerWaalsContact O-N 3.12Å; R762-V766 WeakPolarHBondContact O-CG2 3.42Å; R762-V766 PolarHBondContact O-N 3.31Å; R762-Y887 HydrophobicContact CG-CE1 4.24Å; R762-Y887 PolarHBondContact NE-O 2.7Å; R762-Y887 PolarHBondContact NH2-O 3.47Å; R762-T889 PolarHBondContact NH2-O 2.83Å; R762-D901 WeakPolarHBondContact CD-OD1 3.12Å; R762-D901 IonicContact CZ-OD1 3.65Å; R762-D901 IonicContact NE-OD1 3.7Å; R762-D901 IonicContact NH1-OD1 2.71Å; R762-D901 PolarHBondContact NH1-OD1 2.81Å; R762-E904 HydrophobicContact CB-CB 4.11Å
763	W	88.7	Confident	86.8	Confident	11 Å²	11	24.8 Å²	24.8	4%	0.042	12%	0.124	C	C	.	.	H	α-helix	trans	-73.1	-29	-179.3	-64.5	105.9	0	0	0	111.7	R758 R760 K761 Q765 V766 M767 A888 Y1286 L1287	R758-W763 HydrophobicContact CB-CB 3.88Å; R758-W763 HydrophobicContact CB-CD2 4.05Å; R758-W763 HydrophobicContact CB-CG 3.58Å; R758-W763 HydrophobicContact CG-CD2 4.48Å; R758-W763 HydrophobicContact CG-CG 4.48Å; R758-W763 WeakPolarHBondContact O-CB 3.45Å; R760-W763 PolarHBondContact O-N 3.38Å; K761-W763 PolarHBondContact O-N 3.08Å; W763-Q765 VanDerWaalsContact C-N 3.34Å; W763-V766 HydrophobicContact CE3-CB 4.33Å; W763-V766 HydrophobicContact CE3-CG1 4.49Å; W763-V766 HydrophobicContact CE3-CG2 4.15Å; W763-V766 HydrophobicContact CZ3-CG2 4.38Å; W763-V766 PolarHBondContact O-N 2.92Å; W763-M767 VanDerWaalsContact O-CB 3.28Å; W763-M767 WeakPolarHBondContact O-CB 3.41Å; W763-M767 PolarHBondContact O-N 3.04Å; W763-A888 WeakPolarHBondContact CH2-O 3.38Å; W763-Y1286 WeakPolarHBondContact CZ3-O 3.23Å; W763-L1287 HydrophobicContact CE3-CD2 3.92Å
764	S	89.9	Confident	86.6	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66	-32.9	167.3	-56.5	0	0	0	0	112.5	D685 K752 R760 K761 R762 Y768	D685-S764 PolarHBondContact OD1-OG 3.04Å; D685-S764 PolarHBondContact OD2-OG 3.21Å; K752-S764 WeakPolarHBondContact CD-OG 3.44Å; K752-S764 PolarHBondContact NZ-OG 3.1Å; R760-S764 PolarHBondContact O-N 3.34Å; K761-S764 CarbonylContact O-C 3.52Å; K761-S764 WeakPolarHBondContact O-CA 3.32Å; K761-S764 WeakPolarHBondContact O-CB 3.29Å; K761-S764 PolarHBondContact O-N 3.32Å; R762-S764 VanDerWaalsContact C-N 3.32Å; S764-Y768 VanDerWaalsContact O-CD1 3.3Å; S764-Y768 WeakPolarHBondContact O-CD1 3.31Å; S764-Y768 PolarHBondContact O-N 3.34Å
765	Q	90.8	Very high	86.7	Confident	4 Å²	4	20.8 Å²	20.8	2%	0.019	11%	0.111	C	C	.	.	H	α-helix	trans	-68.5	-47.7	170.3	-67.8	-170.9	10.6	0	0	112.3	K761 R762 W763 M767 Y768 M769 Y887 D905	K761-Q765 HydrophobicContact CG-CG 4.45Å; K761-Q765 WeakPolarHBondContact O-CG 3.18Å; K761-Q765 PolarHBondContact O-N 3.12Å; R762-Q765 WeakPolarHBondContact O-CB 3.05Å; R762-Q765 PolarHBondContact O-N 3.42Å; R762-Q765 VanDerWaalsContact O-N 3.12Å; W763-Q765 VanDerWaalsContact C-N 3.34Å; Q765-M767 VanDerWaalsContact C-N 3.28Å; Q765-M767 PolarHBondContact O-N 3.25Å; Q765-Y768 HydrophobicContact CB-CE1 4Å; Q765-Y768 HydrophobicContact CG-CE1 3.78Å; Q765-Y768 PolarHBondContact O-N 2.93Å; Q765-M769 HydrophobicContact CB-CE 4.2Å; Q765-M769 WeakPolarHBondContact O-CB 3.45Å; Q765-M769 VanDerWaalsContact O-CG 3.28Å; Q765-M769 WeakPolarHBondContact O-CG 3.3Å; Q765-M769 PolarHBondContact O-N 2.87Å; Q765-Y887 HydrophobicContact CB-CE1 4.09Å; Q765-Y887 PolarHBondContact OE1-OH 3.5Å; Q765-D905 PolarHBondContact NE2-OD1 3.06Å
766	V	90.9	Very high	86.8	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-55.3	-45.7	174.1	175.9	0	0	0	0	110.6	R762 W763 Y768 M769 Y770 Y887 A888 L1287	R762-V766 WeakPolarHBondContact O-CG2 3.42Å; R762-V766 PolarHBondContact O-N 3.31Å; W763-V766 HydrophobicContact CE3-CB 4.33Å; W763-V766 HydrophobicContact CE3-CG1 4.49Å; W763-V766 HydrophobicContact CE3-CG2 4.15Å; W763-V766 HydrophobicContact CZ3-CG2 4.38Å; W763-V766 PolarHBondContact O-N 2.92Å; V766-Y768 PolarHBondContact O-N 3.14Å; V766-M769 PolarHBondContact O-N 3.12Å; V766-Y770 HydrophobicContact CG1-CD2 3.71Å; V766-Y770 HydrophobicContact CG1-CE2 3.92Å; V766-Y770 WeakPolarHBondContact O-CD2 3.21Å; V766-Y770 PolarHBondContact O-N 3.16Å; V766-Y887 HydrophobicContact CG2-CD1 3.74Å; V766-Y887 HydrophobicContact CG2-CE1 3.75Å; V766-A888 HydrophobicContact CG1-CB 4.04Å; V766-A888 HydrophobicContact CG2-CB 4.33Å; V766-L1287 HydrophobicContact CB-CD2 4.32Å; V766-L1287 HydrophobicContact CG1-CD2 3.94Å
767	M	91.3	Very high	86.7	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-56.6	-49.6	179.9	-170	-176.6	176.5	0	0	112.5	F683 Y733 H750 K752 I757 W763 Q765 Y771 W1279 L1287	F683-M767 HydrophobicContact CD1-CE 4.34Å; F683-M767 HydrophobicContact CD1-CG 4.25Å; F683-M767 HydrophobicContact CD1-SD 3.68Å; F683-M767 HydrophobicContact CE1-CB 4.47Å; F683-M767 HydrophobicContact CE1-CE 4.15Å; F683-M767 HydrophobicContact CE1-CG 3.98Å; F683-M767 HydrophobicContact CE1-SD 3.86Å; Y733-M767 HydrophobicContact CD1-CE 3.59Å; Y733-M767 HydrophobicContact CD2-CE 3.57Å; Y733-M767 HydrophobicContact CE1-CE 3.74Å; Y733-M767 HydrophobicContact CE2-CE 3.72Å; Y733-M767 HydrophobicContact CG-CE 3.52Å; H750-M767 HydrophobicContact CB-CE 4.44Å; K752-M767 HydrophobicContact CD-SD 4.17Å; K752-M767 HydrophobicContact CG-SD 4.15Å; I757-M767 HydrophobicContact CD1-CE 4.34Å; I757-M767 HydrophobicContact CD1-SD 4.32Å; W763-M767 VanDerWaalsContact O-CB 3.28Å; W763-M767 WeakPolarHBondContact O-CB 3.41Å; W763-M767 PolarHBondContact O-N 3.04Å; Q765-M767 VanDerWaalsContact C-N 3.28Å; Q765-M767 PolarHBondContact O-N 3.25Å; M767-Y771 WeakPolarHBondContact O-CB 3.48Å; M767-Y771 PolarHBondContact O-N 2.94Å; M767-W1279 HydrophobicContact CE-CE3 4.33Å; M767-W1279 HydrophobicContact CE-CH2 3.71Å; M767-W1279 HydrophobicContact CE-CZ3 3.61Å; M767-W1279 HydrophobicContact CG-CH2 3.87Å; M767-W1279 HydrophobicContact CG-CZ3 3.58Å; M767-W1279 HydrophobicContact SD-CZ3 4.48Å; M767-L1287 HydrophobicContact CB-CD1 4.03Å; M767-L1287 HydrophobicContact CG-CD1 3.96Å
768	Y	91.7	Very high	86.4	Confident	2 Å²	2	18.6 Å²	18.6	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-72.4	-34.3	179	77.2	-123.2	0	0	0	112.8	C633 F683 S764 Q765 V766 Y771 L772 I796 T798	C633-Y768 HydrophobicContact CB-CD1 3.75Å; C633-Y768 HydrophobicContact CB-CD2 4.08Å; C633-Y768 HydrophobicContact CB-CE1 3.73Å; C633-Y768 HydrophobicContact CB-CE2 4.14Å; C633-Y768 HydrophobicContact CB-CG 3.96Å; F683-Y768 HydrophobicContact CD2-CD1 4.12Å; F683-Y768 HydrophobicContact CE2-CD1 4.16Å; F683-Y768 HydrophobicContact CE2-CG 4.16Å; S764-Y768 VanDerWaalsContact O-CD1 3.3Å; S764-Y768 WeakPolarHBondContact O-CD1 3.31Å; S764-Y768 PolarHBondContact O-N 3.34Å; Q765-Y768 HydrophobicContact CB-CE1 4Å; Q765-Y768 HydrophobicContact CG-CE1 3.78Å; Q765-Y768 PolarHBondContact O-N 2.93Å; V766-Y768 PolarHBondContact O-N 3.14Å; Y768-Y771 PolarHBondContact O-N 2.95Å; Y768-L772 VanDerWaalsContact O-CB 3.32Å; Y768-L772 WeakPolarHBondContact O-CB 3.47Å; Y768-L772 VanDerWaalsContact O-CG 3.28Å; Y768-L772 WeakPolarHBondContact O-CG 3.4Å; Y768-L772 PolarHBondContact O-N 3.06Å; Y768-I796 HydrophobicContact CD2-CD1 4.4Å; Y768-I796 HydrophobicContact CD2-CG2 4.37Å; Y768-I796 HydrophobicContact CE2-CD1 4.35Å; Y768-I796 HydrophobicContact CE2-CG2 3.84Å; Y768-T798 VanDerWaalsContact OH-CG2 3.25Å; Y768-T798 WeakPolarHBondContact OH-CG2 3.35Å
769	M	91	Very high	86.1	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-64.6	-48	178.8	-71.8	179.7	-164.4	0	0	110.8	Q765 V766 Y771 L773 L878 L884 Y887 L908	Q765-M769 HydrophobicContact CB-CE 4.2Å; Q765-M769 WeakPolarHBondContact O-CB 3.45Å; Q765-M769 VanDerWaalsContact O-CG 3.28Å; Q765-M769 WeakPolarHBondContact O-CG 3.3Å; Q765-M769 PolarHBondContact O-N 2.87Å; V766-M769 PolarHBondContact O-N 3.12Å; M769-Y771 PolarHBondContact O-N 3.18Å; M769-L773 HydrophobicContact CB-CD1 4.26Å; M769-L773 WeakPolarHBondContact O-CB 3.2Å; M769-L773 WeakPolarHBondContact O-CG 3.31Å; M769-L773 PolarHBondContact O-N 3.16Å; M769-L878 HydrophobicContact CE-CD2 4.46Å; M769-L878 HydrophobicContact SD-CD2 4.42Å; M769-L884 HydrophobicContact CB-CD1 3.61Å; M769-L884 HydrophobicContact CB-CD2 4.2Å; M769-L884 HydrophobicContact CG-CD1 4.35Å; M769-L884 HydrophobicContact SD-CD1 3.87Å; M769-Y887 HydrophobicContact SD-CD1 4.49Å; M769-L908 HydrophobicContact CE-CD1 4.34Å; M769-L908 HydrophobicContact CE-CD2 3.69Å
770	Y	90.7	Very high	86.1	Confident	36 Å²	36	20.9 Å²	20.9	14%	0.141	10%	0.096	C	C	.	.	I	π-helix	trans	-65.6	-37.5	177.2	-86.4	-86.7	0	0	0	112.8	V766 G774 Y775 L884 A888 F1278 L1282 Y1286	V766-Y770 HydrophobicContact CG1-CD2 3.71Å; V766-Y770 HydrophobicContact CG1-CE2 3.92Å; V766-Y770 WeakPolarHBondContact O-CD2 3.21Å; V766-Y770 PolarHBondContact O-N 3.16Å; Y770-G774 WeakPolarHBondContact O-CA 3.34Å; Y770-G774 PolarHBondContact O-N 3.15Å; Y770-Y775 PolarHBondContact O-N 2.98Å; Y770-L884 HydrophobicContact CD1-CD2 4.37Å; Y770-L884 HydrophobicContact CD2-CD1 3.89Å; Y770-L884 HydrophobicContact CD2-CD2 3.95Å; Y770-L884 HydrophobicContact CD2-CG 4.03Å; Y770-L884 HydrophobicContact CE1-CD2 4.28Å; Y770-L884 HydrophobicContact CE2-CD1 3.64Å; Y770-L884 HydrophobicContact CE2-CD2 3.85Å; Y770-L884 HydrophobicContact CE2-CG 3.52Å; Y770-L884 HydrophobicContact CG-CD2 4.22Å; Y770-A888 HydrophobicContact CE2-CB 4.09Å; Y770-F1278 WeakPolarHBondContact O-CZ 3.33Å; Y770-L1282 HydrophobicContact CD1-CD1 3.74Å; Y770-L1282 HydrophobicContact CD2-CD1 4.1Å; Y770-L1282 HydrophobicContact CE1-CD1 4.48Å; Y770-L1282 HydrophobicContact CG-CD1 3.51Å; Y770-Y1286 HydrophobicContact CE1-CE2 4.32Å
771	Y	91	Very high	86.1	Confident	4 Å²	4	17.3 Å²	17.3	2%	0.016	8%	0.084	C	C	.	.	I	π-helix	trans	-67.6	-48.1	177.6	179.8	-122.5	0	0	0	113.4	H681 H750 M767 Y768 M769 Y775 R776 E1275 F1278 W1279	H681-Y771 AromaticContact CE1-CE1 3.94Å; H750-Y771 AromaticContact CE1-CE1 3.98Å; M767-Y771 WeakPolarHBondContact O-CB 3.48Å; M767-Y771 PolarHBondContact O-N 2.94Å; Y768-Y771 PolarHBondContact O-N 2.95Å; M769-Y771 PolarHBondContact O-N 3.18Å; Y771-Y775 HydrophobicContact CD2-CD1 4.16Å; Y771-Y775 AromaticContact CE2-CD1 3.79Å; Y771-Y775 HydrophobicContact CE2-CD1 3.79Å; Y771-Y775 HydrophobicContact CE2-CE1 4.38Å; Y771-R776 HydrophobicContact CE2-CG 4.4Å; Y771-R776 VanDerWaalsContact CZ-NE 3.31Å; Y771-R776 PolarHBondContact O-N 3.18Å; Y771-R776 PolarHBondContact OH-NE 3Å; Y771-R776 VanDerWaalsContact OH-NE 3.17Å; Y771-R776 PolarHBondContact OH-NH2 3.32Å; Y771-E1275 VanDerWaalsContact CE2-CD 3.48Å; Y771-E1275 HydrophobicContact CE2-CG 4.04Å; Y771-E1275 VanDerWaalsContact CE2-OE1 3.31Å; Y771-E1275 WeakPolarHBondContact CE2-OE1 3.22Å; Y771-E1275 PolarHBondContact OH-OE1 2.83Å; Y771-E1275 PolarHBondContact OH-OE2 3.07Å; Y771-F1278 HydrophobicContact CD2-CE1 4.17Å; Y771-W1279 HydrophobicContact CD1-CZ2 4.15Å; Y771-W1279 AromaticContact CD2-CE2 3.92Å; Y771-W1279 HydrophobicContact CD2-CH2 4.06Å; Y771-W1279 AromaticContact CD2-CZ2 3.34Å; Y771-W1279 HydrophobicContact CD2-CZ2 3.34Å; Y771-W1279 AromaticContact CE2-CZ2 3.88Å; Y771-W1279 HydrophobicContact CE2-CZ2 3.88Å; Y771-W1279 AromaticContact CG-CH2 3.83Å; Y771-W1279 HydrophobicContact CG-CH2 3.83Å; Y771-W1279 AromaticContact CG-CZ2 3.5Å; Y771-W1279 HydrophobicContact CG-CZ2 3.5Å; Y771-W1279 VanDerWaalsContact CG-CZ2 3.5Å
772	L	89.4	Confident	85.6	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	I	π-helix	trans	-77.8	-28.7	-176.1	-62.4	-179.2	0	0	0	113.3	Y631 C633 Y768 L777 I796	Y631-L772 HydrophobicContact CD1-CD1 4.23Å; Y631-L772 HydrophobicContact CD1-CD2 3.92Å; Y631-L772 HydrophobicContact CD2-CD1 4.19Å; Y631-L772 HydrophobicContact CE1-CD2 3.95Å; Y631-L772 HydrophobicContact CG-CD1 3.82Å; Y631-L772 HydrophobicContact CG-CD2 4.26Å; C633-L772 WeakPolarHBondContact SG-CD1 3.33Å; Y768-L772 VanDerWaalsContact O-CB 3.32Å; Y768-L772 WeakPolarHBondContact O-CB 3.47Å; Y768-L772 VanDerWaalsContact O-CG 3.28Å; Y768-L772 WeakPolarHBondContact O-CG 3.4Å; Y768-L772 PolarHBondContact O-N 3.06Å; L772-L777 WeakPolarHBondContact O-CB 3.49Å; L772-I796 HydrophobicContact CD1-CD1 4.24Å
773	L	86.8	Confident	85	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.01	13%	0.127	C	C	.	.	I	π-helix	trans	-104.2	-41.2	-175.1	-52.7	176.7	0	0	0	112.6	M769 L777 M778 I796 S875 L878 M879	M769-L773 HydrophobicContact CB-CD1 4.26Å; M769-L773 WeakPolarHBondContact O-CB 3.2Å; M769-L773 WeakPolarHBondContact O-CG 3.31Å; M769-L773 PolarHBondContact O-N 3.16Å; L773-L777 HydrophobicContact CD2-CD2 4.13Å; L773-L777 WeakPolarHBondContact O-CB 3.42Å; L773-M778 VanDerWaalsContact O-CG 3.29Å; L773-M778 WeakPolarHBondContact O-CG 3.43Å; L773-M778 PolarHBondContact O-N 2.96Å; L773-I796 HydrophobicContact CD1-CD1 4.31Å; L773-I796 HydrophobicContact CD2-CD1 4.07Å; L773-I796 HydrophobicContact CG-CD1 4.23Å; L773-S875 VanDerWaalsContact CD2-CB 3.44Å; L773-S875 VanDerWaalsContact CD2-OG 3.22Å; L773-S875 WeakPolarHBondContact CD2-OG 3.41Å; L773-L878 HydrophobicContact CD1-CB 3.7Å; L773-L878 HydrophobicContact CD1-CD1 4.1Å; L773-M879 HydrophobicContact CB-CG 3.77Å; L773-M879 HydrophobicContact CB-SD 3.8Å; L773-M879 HydrophobicContact CD1-CG 3.95Å; L773-M879 HydrophobicContact CD2-CG 4.38Å; L773-M879 HydrophobicContact CD2-SD 4.44Å; L773-M879 HydrophobicContact CG-CG 4.26Å
774	G	83.5	Confident	84.6	Confident	20 Å²	20	29.9 Å²	29.9	21%	0.206	16%	0.158	C	C	.	.	I	π-helix	trans	-72.1	-84.6	173.2	0	0	0	0	0	110.5	Y770 R776 M778 E779	Y770-G774 WeakPolarHBondContact O-CA 3.34Å; Y770-G774 PolarHBondContact O-N 3.15Å; G774-R776 PolarHBondContact O-N 2.91Å; G774-M778 CarbonylContact O-C 3.56Å; G774-M778 WeakPolarHBondContact O-CA 3.4Å; G774-M778 WeakPolarHBondContact O-CB 3.49Å; G774-M778 PolarHBondContact O-N 3.24Å; G774-E779 PolarHBondContact O-N 2.82Å
775	Y	85.5	Confident	83.9	Confident	3 Å²	3	37 Å²	37	1%	0.012	19%	0.185	C	C	.	.	I	π-helix	trans	-54.7	-59.9	-173.7	-174.5	-107.7	0	0	0	113.3	Y770 Y771 L777 E779 K780 D1274 E1275 F1278	Y770-Y775 PolarHBondContact O-N 2.98Å; Y771-Y775 HydrophobicContact CD2-CD1 4.16Å; Y771-Y775 AromaticContact CE2-CD1 3.79Å; Y771-Y775 HydrophobicContact CE2-CD1 3.79Å; Y771-Y775 HydrophobicContact CE2-CE1 4.38Å; Y775-L777 VanDerWaalsContact C-N 3.32Å; Y775-L777 PolarHBondContact O-N 3.27Å; Y775-E779 WeakPolarHBondContact CD2-OE2 3.17Å; Y775-E779 VanDerWaalsContact O-CB 3.24Å; Y775-E779 WeakPolarHBondContact O-CB 3.42Å; Y775-E779 PolarHBondContact O-N 3.35Å; Y775-K780 HydrophobicContact CE1-CD 4.28Å; Y775-K780 PolarHBondContact O-N 3.02Å; Y775-K780 VanDerWaalsContact O-N 3.12Å; Y775-K780 WeakPolarHBondContact OH-CE 3.49Å; Y775-K780 PolarHBondContact OH-NZ 2.83Å; Y775-D1274 HydrophobicContact CE2-CB 4.24Å; Y775-D1274 WeakPolarHBondContact CE2-O 3.45Å; Y775-E1275 HydrophobicContact CD1-CG 3.99Å; Y775-E1275 HydrophobicContact CE1-CB 3.87Å; Y775-E1275 HydrophobicContact CE1-CG 3.47Å; Y775-E1275 VanDerWaalsContact CE1-CG 3.47Å; Y775-E1275 HydrophobicContact CE2-CB 4.18Å; Y775-E1275 HydrophobicContact CE2-CG 4.28Å; Y775-E1275 VanDerWaalsContact CZ-CA 3.48Å; Y775-E1275 WeakPolarHBondContact OH-CA 3.47Å; Y775-E1275 VanDerWaalsContact OH-CB 3.27Å; Y775-E1275 WeakPolarHBondContact OH-CB 3.3Å; Y775-E1275 PolarHBondContact OH-N 2.66Å; Y775-E1275 VanDerWaalsContact OH-N 3.1Å; Y775-F1278 HydrophobicContact CD2-CB 3.66Å; Y775-F1278 HydrophobicContact CD2-CD1 4.16Å; Y775-F1278 HydrophobicContact CD2-CD2 4.02Å; Y775-F1278 AromaticContact CD2-CG 3.65Å; Y775-F1278 HydrophobicContact CD2-CG 3.65Å; Y775-F1278 HydrophobicContact CE2-CB 4.08Å; Y775-F1278 HydrophobicContact CG-CB 4.43Å; Y775-F1278 HydrophobicContact CG-CD1 4.09Å; Y775-F1278 HydrophobicContact CG-CD2 4.34Å; Y775-F1278 HydrophobicContact CG-CG 4Å
776	R	84	Confident	83.4	Confident	18 Å²	18	40.3 Å²	40.3	7%	0.068	20%	0.197	C	C	.	.	I	π-helix	trans	-70.5	-19.7	-172	-76.5	-172.2	172.4	-157.6	-0.2	115.9	Y600 E679 Y771 G774	Y600-R776 WeakPolarHBondContact OH-CA 3.47Å; Y600-R776 VanDerWaalsContact OH-CB 3.31Å; Y600-R776 WeakPolarHBondContact OH-CB 3.18Å; Y600-R776 PolarHBondContact OH-O 3.17Å; E679-R776 IonicContact OE1-CZ 3.99Å; E679-R776 IonicContact OE1-NH1 2.77Å; E679-R776 PolarHBondContact OE1-NH1 2.77Å; E679-R776 IonicContact OE1-NH2 3.03Å; E679-R776 PolarHBondContact OE1-NH2 2.71Å; E679-R776 IonicContact OE2-CZ 3.32Å; E679-R776 IonicContact OE2-NH1 2.78Å; E679-R776 PolarHBondContact OE2-NH1 3.12Å; E679-R776 IonicContact OE2-NH2 2.86Å; Y771-R776 HydrophobicContact CE2-CG 4.4Å; Y771-R776 VanDerWaalsContact CZ-NE 3.31Å; Y771-R776 PolarHBondContact O-N 3.18Å; Y771-R776 PolarHBondContact OH-NE 3Å; Y771-R776 VanDerWaalsContact OH-NE 3.17Å; Y771-R776 PolarHBondContact OH-NH2 3.32Å; G774-R776 PolarHBondContact O-N 2.91Å
777	L	82.3	Confident	83	Confident	7 Å²	7	42.7 Å²	42.7	4%	0.037	21%	0.207	C	C	.	.	I	π-helix	trans	-125.8	-41.7	-170	-179.9	75.5	0	0	0	113.6	L772 L773 Y775 I781 I790 A791 M879	L772-L777 WeakPolarHBondContact O-CB 3.49Å; L773-L777 HydrophobicContact CD2-CD2 4.13Å; L773-L777 WeakPolarHBondContact O-CB 3.42Å; Y775-L777 VanDerWaalsContact C-N 3.32Å; Y775-L777 PolarHBondContact O-N 3.27Å; L777-I781 HydrophobicContact CD1-CD1 3.91Å; L777-I790 HydrophobicContact CD1-CB 4.06Å; L777-I790 HydrophobicContact CD1-CG2 3.49Å; L777-I790 VanDerWaalsContact CD1-CG2 3.49Å; L777-A791 HydrophobicContact CD2-CB 4.16Å; L777-M879 HydrophobicContact CD2-CE 3.7Å; L777-M879 HydrophobicContact CD2-SD 3.83Å
778	M	78.6	Confident	82.6	Confident	72 Å²	72	48.2 Å²	48.2	36%	0.355	23%	0.233	S	C	.	.	I	π-helix	trans	-87.3	-29.4	174.8	-69.8	-59.4	96.1	0	0	113.5	L773 G774 K787 M879	L773-M778 VanDerWaalsContact O-CG 3.29Å; L773-M778 WeakPolarHBondContact O-CG 3.43Å; L773-M778 PolarHBondContact O-N 2.96Å; G774-M778 CarbonylContact O-C 3.56Å; G774-M778 WeakPolarHBondContact O-CA 3.4Å; G774-M778 WeakPolarHBondContact O-CB 3.49Å; G774-M778 PolarHBondContact O-N 3.24Å; M778-K787 HydrophobicContact CE-CB 3.78Å; M778-K787 HydrophobicContact CE-CD 4.08Å; M778-K787 HydrophobicContact CE-CG 4.02Å; M778-K787 WeakPolarHBondContact O-CE 3.31Å; M778-K787 PolarHBondContact O-NZ 2.88Å; M778-K787 HydrophobicContact SD-CD 4.16Å; M778-M879 HydrophobicContact CE-CE 3.64Å; M778-M879 HydrophobicContact CE-SD 3.73Å; M778-M879 HydrophobicContact CG-SD 3.9Å; M778-M879 HydrophobicContact SD-CE 4.44Å; M778-M879 HydrophobicContact SD-SD 4.12Å
779	E	77.7	Confident	82	Confident	107 Å²	107	49.7 Å²	49.7	50%	0.5	24%	0.241	S	C	.	.	I	π-helix	trans	-90.8	-62.9	-176.8	-153.2	169	161.4	0	0	111.1	G774 Y775 I781	G774-E779 PolarHBondContact O-N 2.82Å; Y775-E779 WeakPolarHBondContact CD2-OE2 3.17Å; Y775-E779 VanDerWaalsContact O-CB 3.24Å; Y775-E779 WeakPolarHBondContact O-CB 3.42Å; Y775-E779 PolarHBondContact O-N 3.35Å; E779-I781 PolarHBondContact O-N 2.93Å
780	K	76.8	Confident	81.7	Confident	45 Å²	45	49.9 Å²	49.9	20%	0.196	24%	0.242	C	C	.	.	S	Bend	trans	-72.6	9	-173.8	-69	-152	175.5	-175.6	0	117.7	V599 Y600 Y775 E1272	V599-K780 WeakPolarHBondContact CG1-O 3.33Å; Y600-K780 HydrophobicContact CD1-CB 3.52Å; Y600-K780 HydrophobicContact CD1-CD 3.27Å; Y600-K780 HydrophobicContact CD1-CG 4.05Å; Y600-K780 HydrophobicContact CD2-CD 3.94Å; Y600-K780 HydrophobicContact CE1-CB 3.36Å; Y600-K780 HydrophobicContact CE1-CD 3.6Å; Y600-K780 HydrophobicContact CE1-CG 4.09Å; Y600-K780 HydrophobicContact CE2-CD 4.23Å; Y600-K780 HydrophobicContact CG-CD 3.48Å; Y600-K780 VanDerWaalsContact CG-CD 3.48Å; Y775-K780 HydrophobicContact CE1-CD 4.28Å; Y775-K780 PolarHBondContact O-N 3.02Å; Y775-K780 VanDerWaalsContact O-N 3.12Å; Y775-K780 WeakPolarHBondContact OH-CE 3.49Å; Y775-K780 PolarHBondContact OH-NZ 2.83Å; K780-E1272 IonicContact NZ-OE2 2.9Å; K780-E1272 PolarHBondContact NZ-OE2 2.72Å
781	I	76.7	Confident	81.5	Confident	7 Å²	7	48.3 Å²	48.3	4%	0.036	24%	0.236	C	C	.	.			trans	-120.6	139.1	179.2	-67.4	174.1	0	0	0	109.2	V599 L777 E779 R786 K787 I790	V599-I781 HydrophobicContact CG1-CG1 3.8Å; L777-I781 HydrophobicContact CD1-CD1 3.91Å; E779-I781 PolarHBondContact O-N 2.93Å; I781-R786 HydrophobicContact CG2-CG 4.47Å; I781-K787 HydrophobicContact CB-CG 4.37Å; I781-K787 HydrophobicContact CG2-CG 4.02Å; I781-K787 WeakPolarHBondContact O-CE 3.46Å; I781-K787 PolarHBondContact O-NZ 2.81Å; I781-I790 HydrophobicContact CD1-CD1 3.93Å; I781-I790 HydrophobicContact CG2-CD1 4.46Å
782	D	71.8	Confident	81.2	Confident	140 Å²	140	50 Å²	50	75%	0.749	25%	0.245	S	C	*	.			trans	-97.4	151.1	170.7	-70.6	-51.1	0	0	0	113.1
783	G	75.6	Confident	81.1	Confident	27 Å²	27	51.8 Å²	51.8	28%	0.278	25%	0.254	S	S	.	.			trans	89.6	120.9	177.3	0	0	0	0	0	113.5	E619 R785 R786 K787	E619-G783 WeakPolarHBondContact OE1-CA 3.49Å; G783-R785 PolarHBondContact O-N 2.99Å; G783-R786 WeakPolarHBondContact O-CB 3.47Å; G783-R786 PolarHBondContact O-N 3.23Å; G783-K787 WeakPolarHBondContact O-CG 3.25Å; G783-K787 PolarHBondContact O-N 3.23Å
784	I	81	Confident	81.3	Confident	132 Å²	132	51.9 Å²	51.9	68%	0.677	25%	0.254	S	S	*	.	H	α-helix	trans	-62.7	-48.2	-176.3	-61.9	171.7	0	0	0	109.8	E619 R786 K787 E788	E619-I784 PolarHBondContact OE1-N 3.28Å; I784-R786 PolarHBondContact O-N 3.07Å; I784-K787 WeakPolarHBondContact O-CB 3.35Å; I784-K787 PolarHBondContact O-N 3.15Å; I784-E788 PolarHBondContact O-N 3.22Å; I784-E788 VanDerWaalsContact O-N 3.12Å
785	R	74.9	Confident	81.8	Confident	151 Å²	151	51 Å²	51	57%	0.57	25%	0.245	S	C	*	.	H	α-helix	trans	-65.7	-26.7	-179.4	-163.3	176.4	-162.4	157.2	9.1	112.8	E619 G783 I789	E619-R785 VanDerWaalsContact OE2-CB 3.25Å; E619-R785 WeakPolarHBondContact OE2-CB 3.47Å; G783-R785 PolarHBondContact O-N 2.99Å; R785-I789 HydrophobicContact CG-CD1 4.44Å; R785-I789 WeakPolarHBondContact O-CG1 3.28Å; R785-I789 PolarHBondContact O-N 3.46Å
786	R	80	Confident	82.3	Confident	73 Å²	73	50.9 Å²	50.9	28%	0.275	25%	0.245	S	C	.	.	H	α-helix	trans	-73.9	-43.7	176.2	-163.4	173.8	-174	-136.2	-11.4	111	D625 I781 G783 I784 E788 I789 I790	D625-R786 VanDerWaalsContact CG-NE 3.27Å; D625-R786 IonicContact OD1-CZ 3.66Å; D625-R786 IonicContact OD1-NE 2.76Å; D625-R786 PolarHBondContact OD1-NE 2.69Å; D625-R786 VanDerWaalsContact OD1-NE 3.09Å; D625-R786 IonicContact OD1-NH2 3.25Å; D625-R786 PolarHBondContact OD1-NH2 3.09Å; D625-R786 WeakPolarHBondContact OD2-CG 3.3Å; D625-R786 IonicContact OD2-CZ 2.6Å; D625-R786 IonicContact OD2-NE 2.61Å; D625-R786 PolarHBondContact OD2-NE 2.98Å; D625-R786 IonicContact OD2-NH2 3.43Å; I781-R786 HydrophobicContact CG2-CG 4.47Å; G783-R786 WeakPolarHBondContact O-CB 3.47Å; G783-R786 PolarHBondContact O-N 3.23Å; I784-R786 PolarHBondContact O-N 3.07Å; R786-E788 PolarHBondContact O-N 3.32Å; R786-I789 PolarHBondContact O-N 2.94Å; R786-I790 HydrophobicContact CG-CD1 3.97Å; R786-I790 WeakPolarHBondContact O-CG1 3.37Å; R786-I790 PolarHBondContact O-N 3.48Å
787	K	82.9	Confident	82.8	Confident	49 Å²	49	50 Å²	50	21%	0.213	24%	0.241	C	C	.	.	H	α-helix	trans	-54.6	-49.1	171.8	-72.6	176.5	-173.8	-179.3	0	111.8	M778 I781 G783 I784 I789 I790 A791	M778-K787 HydrophobicContact CE-CB 3.78Å; M778-K787 HydrophobicContact CE-CD 4.08Å; M778-K787 HydrophobicContact CE-CG 4.02Å; M778-K787 WeakPolarHBondContact O-CE 3.31Å; M778-K787 PolarHBondContact O-NZ 2.88Å; M778-K787 HydrophobicContact SD-CD 4.16Å; I781-K787 HydrophobicContact CB-CG 4.37Å; I781-K787 HydrophobicContact CG2-CG 4.02Å; I781-K787 WeakPolarHBondContact O-CE 3.46Å; I781-K787 PolarHBondContact O-NZ 2.81Å; G783-K787 WeakPolarHBondContact O-CG 3.25Å; G783-K787 PolarHBondContact O-N 3.23Å; I784-K787 WeakPolarHBondContact O-CB 3.35Å; I784-K787 PolarHBondContact O-N 3.15Å; K787-I789 PolarHBondContact O-N 3.08Å; K787-I790 PolarHBondContact O-N 3.48Å; K787-A791 WeakPolarHBondContact O-CB 3.35Å; K787-A791 PolarHBondContact O-N 2.63Å
788	E	82.9	Confident	83.3	Confident	116 Å²	116	50 Å²	50	54%	0.542	24%	0.241	S	C	.	.	H	α-helix	trans	-55.4	-49.5	177.6	-69.8	179.6	162.4	0	0	112.6	I784 R786 A791 E792	I784-E788 PolarHBondContact O-N 3.22Å; I784-E788 VanDerWaalsContact O-N 3.12Å; R786-E788 PolarHBondContact O-N 3.32Å; E788-A791 PolarHBondContact O-N 3.31Å; E788-E792 PolarHBondContact O-N 3.1Å
789	I	78.9	Confident	83.9	Confident	33 Å²	33	46.7 Å²	46.7	17%	0.169	23%	0.225	C	C	.	.	H	α-helix	trans	-68.5	-40.3	-175.7	-67.9	170.9	0	0	0	111.5	V621 D625 R785 R786 K787 E792 N793	V621-I789 HydrophobicContact CB-CD1 4.4Å; V621-I789 HydrophobicContact CG1-CD1 3.75Å; V621-I789 HydrophobicContact CG2-CD1 3.77Å; D625-I789 HydrophobicContact CB-CG2 4.36Å; R785-I789 HydrophobicContact CG-CD1 4.44Å; R785-I789 WeakPolarHBondContact O-CG1 3.28Å; R785-I789 PolarHBondContact O-N 3.46Å; R786-I789 PolarHBondContact O-N 2.94Å; K787-I789 PolarHBondContact O-N 3.08Å; I789-E792 PolarHBondContact O-N 3.19Å; I789-N793 PolarHBondContact O-N 3.11Å; I789-N793 PolarHBondContact O-ND2 3.47Å
790	I	84.6	Confident	84.4	Confident	6 Å²	6	43.3 Å²	43.3	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	-69.2	-39.7	176.2	-60.9	170.9	0	0	0	109.9	D625 K629 L777 I781 R786 K787 E792 N793 T794	D625-I790 HydrophobicContact CB-CD1 4.19Å; D625-I790 HydrophobicContact CB-CG1 3.79Å; K629-I790 HydrophobicContact CD-CG2 4.19Å; L777-I790 HydrophobicContact CD1-CB 4.06Å; L777-I790 HydrophobicContact CD1-CG2 3.49Å; L777-I790 VanDerWaalsContact CD1-CG2 3.49Å; I781-I790 HydrophobicContact CD1-CD1 3.93Å; I781-I790 HydrophobicContact CG2-CD1 4.46Å; R786-I790 HydrophobicContact CG-CD1 3.97Å; R786-I790 WeakPolarHBondContact O-CG1 3.37Å; R786-I790 PolarHBondContact O-N 3.48Å; K787-I790 PolarHBondContact O-N 3.48Å; I790-E792 VanDerWaalsContact C-N 3.32Å; I790-E792 PolarHBondContact O-N 2.87Å; I790-N793 CarbonylContact O-C 3.58Å; I790-N793 PolarHBondContact O-N 2.86Å; I790-T794 VanDerWaalsContact O-CB 3.31Å; I790-T794 WeakPolarHBondContact O-CB 3.32Å; I790-T794 PolarHBondContact O-N 3.13Å; I790-T794 PolarHBondContact O-OG1 3.09Å
791	A	86.9	Confident	84.7	Confident	3 Å²	3	41.3 Å²	41.3	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-33	176	0	0	0	0	0	113.7	L777 K787 E788 S875 A876 M879	L777-A791 HydrophobicContact CD2-CB 4.16Å; K787-A791 WeakPolarHBondContact O-CB 3.35Å; K787-A791 PolarHBondContact O-N 2.63Å; E788-A791 PolarHBondContact O-N 3.31Å; A791-S875 WeakPolarHBondContact O-CB 3.46Å; A791-A876 HydrophobicContact CB-CB 3.92Å; A791-A876 WeakPolarHBondContact O-CB 3.37Å; A791-A876 PolarHBondContact O-N 2.85Å; A791-M879 HydrophobicContact CB-CE 3.35Å
792	E	85	Confident	85.1	Confident	40 Å²	40	41.6 Å²	41.6	19%	0.187	20%	0.204	C	C	.	.	H	α-helix	trans	-71.5	-31.1	174.1	-80	-170.3	114.8	0	0	113.2	E788 I789 I790 Y795 R821 R874 A876	E788-E792 PolarHBondContact O-N 3.1Å; I789-E792 PolarHBondContact O-N 3.19Å; I790-E792 VanDerWaalsContact C-N 3.32Å; I790-E792 PolarHBondContact O-N 2.87Å; E792-Y795 PolarHBondContact O-OH 2.83Å; E792-R821 IonicContact OE1-CZ 3.86Å; E792-R821 IonicContact OE1-NE 2.69Å; E792-R821 PolarHBondContact OE1-NE 3.22Å; E792-R821 IonicContact OE1-NH2 2.76Å; E792-R821 PolarHBondContact OE1-NH2 3.47Å; E792-R821 IonicContact OE2-CZ 2.65Å; E792-R821 IonicContact OE2-NE 2.92Å; E792-R821 IonicContact OE2-NH2 3.28Å; E792-R821 PolarHBondContact OE2-NH2 2.74Å; E792-R874 PolarHBondContact O-NH1 3.43Å; E792-A876 HydrophobicContact CG-CB 4.27Å
793	N	87	Confident	85.9	Confident	37 Å²	37	35 Å²	35	20%	0.198	17%	0.169	C	C	.	.	H	α-helix	trans	-98.4	-4.6	-177.2	-66.2	-61.6	0	0	0	114.1	T628 K629 I789 I790 Y795	T628-N793 WeakPolarHBondContact CA-O 3.37Å; K629-N793 PolarHBondContact N-O 3.19Å; K629-N793 VanDerWaalsContact N-O 3.08Å; I789-N793 PolarHBondContact O-N 3.11Å; I789-N793 PolarHBondContact O-ND2 3.47Å; I790-N793 CarbonylContact O-C 3.58Å; I790-N793 PolarHBondContact O-N 2.86Å; N793-Y795 WeakPolarHBondContact O-CD2 3.27Å; N793-Y795 WeakPolarHBondContact O-CE2 3.36Å
794	T	91.1	Very high	86.6	Confident	3 Å²	3	35 Å²	35	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	134	174.3	-55.8	0	0	0	0	110.5	K629 Y631 I790 S875	K629-T794 HydrophobicContact CB-CG2 4.04Å; Y631-T794 HydrophobicContact CD2-CG2 3.74Å; Y631-T794 HydrophobicContact CE2-CG2 3.57Å; I790-T794 VanDerWaalsContact O-CB 3.31Å; I790-T794 WeakPolarHBondContact O-CB 3.32Å; I790-T794 PolarHBondContact O-N 3.13Å; I790-T794 PolarHBondContact O-OG1 3.09Å; T794-S875 WeakPolarHBondContact CB-OG 3.28Å; T794-S875 WeakPolarHBondContact CG2-OG 3.45Å; T794-S875 PolarHBondContact O-N 3.28Å; T794-S875 PolarHBondContact O-OG 3.35Å
795	Y	94.3	Very high	87.1	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.008	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.5	179.1	-54.2	-78.7	0	0	0	111.4	T628 K629 L630 Y631 E792 N793 M817 L872 F873 R874	T628-Y795 HydrophobicContact CG2-CD2 3.8Å; T628-Y795 HydrophobicContact CG2-CE2 3.84Å; K629-Y795 PolarHBondContact O-N 2.82Å; L630-Y795 WeakPolarHBondContact CA-O 3.49Å; Y631-Y795 PolarHBondContact N-O 2.94Å; E792-Y795 PolarHBondContact O-OH 2.83Å; N793-Y795 WeakPolarHBondContact O-CD2 3.27Å; N793-Y795 WeakPolarHBondContact O-CE2 3.36Å; Y795-M817 HydrophobicContact CD1-CB 4.19Å; Y795-M817 HydrophobicContact CD1-CE 3.66Å; Y795-M817 HydrophobicContact CD1-CG 4.3Å; Y795-M817 HydrophobicContact CE1-CB 3.57Å; Y795-M817 HydrophobicContact CE1-CE 3.8Å; Y795-M817 HydrophobicContact CE1-CG 4.12Å; Y795-L872 HydrophobicContact CG-CG 4.46Å; Y795-F873 CarbonylContact C-O 3.55Å; Y795-F873 WeakPolarHBondContact CA-O 3.41Å; Y795-F873 WeakPolarHBondContact CB-O 3.45Å; Y795-R874 HydrophobicContact CD1-CB 4.17Å; Y795-R874 HydrophobicContact CD1-CG 4.36Å; Y795-R874 HydrophobicContact CE1-CB 4.17Å; Y795-R874 HydrophobicContact CE1-CG 4.04Å; Y795-R874 PolarHBondContact OH-NH1 3.47Å
796	I	94.4	Very high	87.8	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	117.6	173	-59.4	-180	0	0	0	108.2	Y631 C633 Y768 L772 L773 T798 L872 F873 L878	Y631-I796 CarbonylContact O-C 3.58Å; Y631-I796 WeakPolarHBondContact O-CA 3.35Å; C633-I796 HydrophobicContact CB-CG2 4.08Å; Y768-I796 HydrophobicContact CD2-CD1 4.4Å; Y768-I796 HydrophobicContact CD2-CG2 4.37Å; Y768-I796 HydrophobicContact CE2-CD1 4.35Å; Y768-I796 HydrophobicContact CE2-CG2 3.84Å; L772-I796 HydrophobicContact CD1-CD1 4.24Å; L773-I796 HydrophobicContact CD1-CD1 4.31Å; L773-I796 HydrophobicContact CD2-CD1 4.07Å; L773-I796 HydrophobicContact CG-CD1 4.23Å; I796-T798 HydrophobicContact CG2-CG2 4.46Å; I796-L872 CarbonylContact O-C 3.36Å; I796-L872 WeakPolarHBondContact O-CA 3.37Å; I796-F873 PolarHBondContact N-O 3.14Å; I796-F873 PolarHBondContact O-N 2.66Å; I796-L878 HydrophobicContact CD1-CD1 4.03Å
797	L	95.1	Very high	88.2	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	107.8	171.8	175.7	65.1	0	0	0	108.3	L630 Y631 A632 C633 L654 L799 F805 V810 F870 S871 L872	L630-L797 HydrophobicContact CD1-CB 3.98Å; Y631-L797 PolarHBondContact O-N 2.72Å; A632-L797 CarbonylContact C-O 3.55Å; A632-L797 WeakPolarHBondContact CA-O 3.25Å; A632-L797 HydrophobicContact CB-CD2 4.44Å; C633-L797 PolarHBondContact N-O 2.72Å; L654-L797 HydrophobicContact CD1-CD2 4.37Å; L797-L799 HydrophobicContact CD1-CD2 4.34Å; L797-L799 HydrophobicContact CD2-CD2 4.18Å; L797-L799 HydrophobicContact CG-CD2 3.93Å; L797-L799 HydrophobicContact CG-CG 4.25Å; L797-F805 HydrophobicContact CD2-CE2 4.44Å; L797-F805 HydrophobicContact CD2-CZ 4.13Å; L797-V810 HydrophobicContact CD2-CG1 4.39Å; L797-V810 HydrophobicContact CD2-CG2 3.9Å; L797-F870 HydrophobicContact CD1-CD2 4.03Å; L797-F870 HydrophobicContact CD1-CE2 3.95Å; L797-F870 HydrophobicContact CD2-CE2 4.44Å; L797-S871 CarbonylContact C-O 3.06Å; L797-S871 WeakPolarHBondContact CA-O 3.13Å; L797-L872 HydrophobicContact CB-CD1 3.89Å; L797-L872 HydrophobicContact CD1-CD1 4.41Å
798	T	93	Very high	88.3	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.031	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	138.7	174.2	65.7	0	0	0	0	110	C633 Y768 I796 G868 S871 F873	C633-T798 WeakPolarHBondContact O-CA 3.2Å; Y768-T798 VanDerWaalsContact OH-CG2 3.25Å; Y768-T798 WeakPolarHBondContact OH-CG2 3.35Å; I796-T798 HydrophobicContact CG2-CG2 4.46Å; T798-G868 CarbonylContact C-O 3.57Å; T798-G868 VanDerWaalsContact CB-O 3.31Å; T798-G868 WeakPolarHBondContact CB-O 3.07Å; T798-G868 PolarHBondContact OG1-O 3.4Å; T798-S871 PolarHBondContact N-O 2.9Å; T798-S871 PolarHBondContact O-N 3.44Å; T798-S871 PolarHBondContact OG1-O 2.86Å; T798-F873 HydrophobicContact CG2-CD2 3.74Å; T798-F873 HydrophobicContact CG2-CE2 3.69Å
799	L	91.8	Very high	88.5	Confident	3 Å²	3	19.6 Å²	19.6	2%	0.016	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.3	-179.8	-57.8	175.3	0	0	0	110.1	A632 C633 A634 T635 L797 V803 F805 G868 F870	A632-L799 HydrophobicContact CB-CD1 4.07Å; C633-L799 PolarHBondContact O-N 3.38Å; A634-L799 WeakPolarHBondContact CA-O 3.29Å; A634-L799 HydrophobicContact CB-CB 4.03Å; T635-L799 PolarHBondContact N-O 2.95Å; L797-L799 HydrophobicContact CD1-CD2 4.34Å; L797-L799 HydrophobicContact CD2-CD2 4.18Å; L797-L799 HydrophobicContact CG-CD2 3.93Å; L797-L799 HydrophobicContact CG-CG 4.25Å; L799-V803 HydrophobicContact CB-CG1 4.15Å; L799-V803 HydrophobicContact CD2-CG1 3.94Å; L799-F805 HydrophobicContact CD1-CE1 3.86Å; L799-F805 HydrophobicContact CD1-CZ 4.17Å; L799-F805 HydrophobicContact CD2-CD1 4.07Å; L799-F805 HydrophobicContact CD2-CE1 3.43Å; L799-F805 VanDerWaalsContact CD2-CE1 3.43Å; L799-F805 HydrophobicContact CD2-CZ 4.11Å; L799-F805 HydrophobicContact CG-CE1 4.31Å; L799-G868 PolarHBondContact N-O 2.8Å; L799-F870 HydrophobicContact CD2-CD2 3.88Å; L799-F870 HydrophobicContact CD2-CE2 4.48Å
800	D	87.1	Confident	89.1	Confident	36 Å²	36	18.1 Å²	18.1	19%	0.193	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	161.9	165.1	-71.1	-42.1	0	0	0	108.9	K761 D802 V803 C869	K761-D800 WeakPolarHBondContact CE-OD1 3.46Å; K761-D800 IonicContact NZ-OD1 3.93Å; K761-D800 PolarHBondContact NZ-OD1 3.44Å; K761-D800 IonicContact NZ-OD2 3.26Å; K761-D800 PolarHBondContact NZ-OD2 2.83Å; D800-D802 PolarHBondContact O-N 3.5Å; D800-V803 WeakPolarHBondContact O-CG1 3.49Å; D800-C869 HydrophobicContact CB-CB 3.95Å; D800-C869 WeakPolarHBondContact OD2-CA 3.26Å; D800-C869 WeakPolarHBondContact OD2-CB 3.47Å; D800-C869 PolarHBondContact OD2-N 3.46Å
801	G	83.2	Confident	89.3	Confident	3 Å²	3	19.3 Å²	19.3	3%	0.031	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-3.6	-166.1	0	0	0	0	0	117.4	E643 M647	E643-G801 CarbonylContact C-O 3.52Å; E643-G801 VanDerWaalsContact C-O 3.31Å; E643-G801 VanDerWaalsContact O-O 3.11Å; M647-G801 WeakPolarHBondContact CB-O 3.45Å
802	D	85	Confident	89.2	Confident	14 Å²	14	20.5 Å²	20.5	8%	0.075	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-6.9	-166.4	70.9	-60.7	0	0	0	114.6	E643 C646 D800 T929 F930	E643-D802 HydrophobicContact CB-CB 4.25Å; E643-D802 HydrophobicContact CG-CB 4.09Å; C646-D802 WeakPolarHBondContact CB-O 3.47Å; C646-D802 PolarHBondContact SG-O 3.35Å; D800-D802 PolarHBondContact O-N 3.5Å; D802-T929 WeakPolarHBondContact OD2-CA 3.4Å; D802-T929 WeakPolarHBondContact OD2-CB 3.45Å; D802-T929 PolarHBondContact OD2-OG1 2.98Å; D802-F930 HydrophobicContact CB-CB 4.38Å; D802-F930 HydrophobicContact CB-CD2 4.18Å; D802-F930 PolarHBondContact OD2-N 3.4Å
803	V	89.1	Confident	89.4	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.101	C	C	.	.			trans	-80.7	129.2	-157.5	68.1	0	0	0	0	116.1	S650 L799 D800 F805 M830 A927 L928	S650-V803 PolarHBondContact OG-O 2.97Å; L799-V803 HydrophobicContact CB-CG1 4.15Å; L799-V803 HydrophobicContact CD2-CG1 3.94Å; D800-V803 WeakPolarHBondContact O-CG1 3.49Å; V803-F805 HydrophobicContact CG1-CD1 4.08Å; V803-F805 HydrophobicContact CG1-CE1 4.24Å; V803-F805 HydrophobicContact CG2-CD1 4.24Å; V803-M830 HydrophobicContact CG2-CE 4.09Å; V803-A927 HydrophobicContact CG2-CB 4.09Å; V803-L928 WeakPolarHBondContact CA-O 3.06Å; V803-L928 WeakPolarHBondContact CG2-O 3.26Å
804	D	89.9	Confident	89.5	Confident	28 Å²	28	17.3 Å²	17.3	15%	0.15	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	110.2	174.9	-154.1	-17.3	0	0	0	110.2	C646 S650 R653 R833 A927 L928	C646-D804 VanDerWaalsContact SG-CB 3.53Å; S650-D804 WeakPolarHBondContact OG-CA 3.33Å; R653-D804 IonicContact CZ-OD1 3.5Å; R653-D804 VanDerWaalsContact CZ-OD1 3.28Å; R653-D804 IonicContact NH1-OD1 2.67Å; R653-D804 PolarHBondContact NH1-OD1 2.9Å; R653-D804 IonicContact NH2-OD1 2.91Å; R653-D804 PolarHBondContact NH2-OD1 2.82Å; D804-R833 IonicContact OD2-NH1 3.52Å; D804-R833 PolarHBondContact OD2-NH1 3.17Å; D804-A927 WeakPolarHBondContact O-CA 3.17Å; D804-L928 HydrophobicContact CB-CB 3.94Å; D804-L928 HydrophobicContact CB-CD1 4.11Å; D804-L928 HydrophobicContact CB-CG 4.12Å; D804-L928 PolarHBondContact N-O 3.41Å; D804-L928 PolarHBondContact O-N 2.91Å
805	F	92.2	Very high	89.1	Confident	3 Å²	3	18.7 Å²	18.7	1%	0.013	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	169.7	177.2	71.8	-96.5	0	0	0	113.5	S650 R653 L654 L797 L799 V803 V810 F870 A927	S650-F805 VanDerWaalsContact CB-CD1 3.48Å; S650-F805 PolarHBondContact OG-N 2.76Å; R653-F805 PolarHBondContact NH1-O 3.12Å; L654-F805 HydrophobicContact CD1-CE2 3.66Å; L654-F805 HydrophobicContact CD1-CZ 3.82Å; L654-F805 HydrophobicContact CD2-CE2 4.46Å; L654-F805 HydrophobicContact CG-CE2 3.93Å; L654-F805 HydrophobicContact CG-CZ 4.46Å; L797-F805 HydrophobicContact CD2-CE2 4.44Å; L797-F805 HydrophobicContact CD2-CZ 4.13Å; L799-F805 HydrophobicContact CD1-CE1 3.86Å; L799-F805 HydrophobicContact CD1-CZ 4.17Å; L799-F805 HydrophobicContact CD2-CD1 4.07Å; L799-F805 HydrophobicContact CD2-CE1 3.43Å; L799-F805 VanDerWaalsContact CD2-CE1 3.43Å; L799-F805 HydrophobicContact CD2-CZ 4.11Å; L799-F805 HydrophobicContact CG-CE1 4.31Å; V803-F805 HydrophobicContact CG1-CD1 4.08Å; V803-F805 HydrophobicContact CG1-CE1 4.24Å; V803-F805 HydrophobicContact CG2-CD1 4.24Å; F805-V810 HydrophobicContact CD2-CG2 3.81Å; F805-V810 HydrophobicContact CE2-CG2 3.6Å; F805-F870 HydrophobicContact CB-CD2 4.33Å; F805-F870 HydrophobicContact CB-CE2 3.85Å; F805-F870 HydrophobicContact CB-CZ 4.07Å; F805-F870 AromaticContact CD1-CD2 3.93Å; F805-F870 HydrophobicContact CD1-CD2 3.93Å; F805-F870 AromaticContact CD1-CE2 3.74Å; F805-F870 HydrophobicContact CD1-CE2 3.74Å; F805-F870 AromaticContact CD2-CE2 3.64Å; F805-F870 HydrophobicContact CD2-CE2 3.64Å; F805-F870 HydrophobicContact CD2-CZ 4.09Å; F805-F870 HydrophobicContact CE1-CD2 4.41Å; F805-F870 HydrophobicContact CE1-CE2 4.19Å; F805-F870 HydrophobicContact CE2-CE2 4.1Å; F805-F870 HydrophobicContact CG-CD2 4.05Å; F805-F870 AromaticContact CG-CE2 3.45Å; F805-F870 HydrophobicContact CG-CE2 3.45Å; F805-F870 VanDerWaalsContact CG-CE2 3.45Å; F805-F870 HydrophobicContact CG-CZ 4.06Å; F805-F870 HydrophobicContact CZ-CE2 4.36Å; F805-A927 HydrophobicContact CB-CB 3.82Å
806	K	88.9	Confident	88.6	Confident	105 Å²	105	19.1 Å²	19.1	46%	0.457	10%	0.104	S	C	.	.			trans	-118.4	151.3	-179.4	-64.6	169.1	-170.8	157.6	0	110.5	S808 S809	K806-S808 WeakPolarHBondContact CB-OG 3.32Å; K806-S808 PolarHBondContact O-N 2.95Å; K806-S808 VanDerWaalsContact O-N 3.14Å; K806-S809 WeakPolarHBondContact O-CB 3.45Å; K806-S809 PolarHBondContact O-N 2.74Å
807	P	88.5	Confident	88.2	Confident	17 Å²	17	19.1 Å²	19.1	11%	0.11	10%	0.104	C	C	.	.	H	α-helix	trans	-51.3	-38.6	173.7	-28.3	35.1	0	0	0	113.1	R653 L654 D657 S809 V810 H811	R653-P807 HydrophobicContact CB-CG 4.13Å; R653-P807 WeakPolarHBondContact O-CG 3.32Å; L654-P807 HydrophobicContact CD2-CB 3.98Å; L654-P807 HydrophobicContact CD2-CG 4.15Å; D657-P807 HydrophobicContact CB-CB 3.74Å; D657-P807 HydrophobicContact CB-CG 3.77Å; P807-S809 PolarHBondContact O-N 3.46Å; P807-V810 PolarHBondContact O-N 2.77Å; P807-V810 VanDerWaalsContact O-N 3.07Å; P807-H811 PolarHBondContact O-CD2 3.28Å; P807-H811 PolarHBondContact O-N 3.26Å
808	S	85	Confident	87.5	Confident	66 Å²	66	22.2 Å²	22.2	46%	0.462	12%	0.117	S	C	.	.	H	α-helix	trans	-54.4	-35.2	176	55.4	0	0	0	0	114	K806 L812	K806-S808 WeakPolarHBondContact CB-OG 3.32Å; K806-S808 PolarHBondContact O-N 2.95Å; K806-S808 VanDerWaalsContact O-N 3.14Å; S808-L812 WeakPolarHBondContact O-CG 3.22Å; S808-L812 PolarHBondContact O-N 3.14Å
809	S	88.5	Confident	86.6	Confident	6 Å²	6	24 Å²	24	4%	0.042	13%	0.125	C	C	.	.	H	α-helix	trans	-70.1	-43.2	177.8	-52.4	0	0	0	0	110.6	K806 P807 L812 L813 S925 D926	K806-S809 WeakPolarHBondContact O-CB 3.45Å; K806-S809 PolarHBondContact O-N 2.74Å; P807-S809 PolarHBondContact O-N 3.46Å; S809-L812 PolarHBondContact O-N 3.04Å; S809-L813 PolarHBondContact O-N 3.07Å; S809-S925 VanDerWaalsContact C-OG 3.22Å; S809-S925 WeakPolarHBondContact CA-OG 3.49Å; S809-S925 WeakPolarHBondContact CB-OG 3.27Å; S809-S925 PolarHBondContact O-OG 3.05Å; S809-D926 VanDerWaalsContact CB-O 3.32Å; S809-D926 WeakPolarHBondContact CB-O 3.14Å; S809-D926 PolarHBondContact OG-N 3.47Å; S809-D926 PolarHBondContact OG-O 3.5Å
810	V	91.1	Very high	85.8	Confident	3 Å²	3	25.9 Å²	25.9	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-42.9	175.7	-178.6	0	0	0	0	111	L630 L654 L797 F805 P807 L812 L813 V814 F870	L630-V810 HydrophobicContact CD1-CG1 4.34Å; L630-V810 HydrophobicContact CD2-CG1 3.74Å; L654-V810 HydrophobicContact CD2-CB 4.34Å; L654-V810 HydrophobicContact CD2-CG2 4.17Å; L797-V810 HydrophobicContact CD2-CG1 4.39Å; L797-V810 HydrophobicContact CD2-CG2 3.9Å; F805-V810 HydrophobicContact CD2-CG2 3.81Å; F805-V810 HydrophobicContact CE2-CG2 3.6Å; P807-V810 PolarHBondContact O-N 2.77Å; P807-V810 VanDerWaalsContact O-N 3.07Å; V810-L812 VanDerWaalsContact C-N 3.26Å; V810-L812 PolarHBondContact O-N 3.05Å; V810-L813 WeakPolarHBondContact O-CB 3.34Å; V810-L813 PolarHBondContact O-N 3.48Å; V810-V814 HydrophobicContact CG1-CG2 4.29Å; V810-V814 WeakPolarHBondContact O-CG2 3.5Å; V810-V814 PolarHBondContact O-N 3.05Å; V810-F870 HydrophobicContact CG2-CE2 3.89Å; V810-F870 HydrophobicContact CG2-CZ 3.8Å
811	H	87.6	Confident	85.4	Confident	30 Å²	30	31.9 Å²	31.9	14%	0.139	16%	0.155	C	C	.	.	H	α-helix	trans	-56	-39	174.3	-76.3	-60.9	0	0	0	112.7	D657 R661 Y676 P807 V814 D815	D657-H811 IonicContact OD2-CD2 3.83Å; D657-H811 IonicContact OD2-CE1 3.16Å; D657-H811 IonicContact OD2-NE2 3.68Å; D657-H811 PolarHBondContact OD2-NE2 3.44Å; R661-H811 PolarHBondContact NH2-CD2 3.46Å; R661-H811 PolarHBondContact NH2-CE1 3.07Å; R661-H811 PolarHBondContact NH2-NE2 2.96Å; Y676-H811 AromaticContact CD1-CE1 3.62Å; Y676-H811 AromaticContact CE1-CE1 3.33Å; Y676-H811 WeakPolarHBondContact CE1-CE1 3.37Å; Y676-H811 AromaticContact CE1-NE2 3.6Å; P807-H811 PolarHBondContact O-CD2 3.28Å; P807-H811 PolarHBondContact O-N 3.26Å; H811-V814 PolarHBondContact O-N 3.13Å; H811-D815 PolarHBondContact O-N 3.23Å
812	L	85.2	Confident	85.4	Confident	29 Å²	29	38 Å²	38	15%	0.152	18%	0.177	C	C	.	.	H	α-helix	trans	-72.7	-22.6	176.6	-68.3	165.8	0	0	0	113.9	S808 S809 V810 C922 A924	S808-L812 WeakPolarHBondContact O-CG 3.22Å; S808-L812 PolarHBondContact O-N 3.14Å; S809-L812 PolarHBondContact O-N 3.04Å; V810-L812 VanDerWaalsContact C-N 3.26Å; V810-L812 PolarHBondContact O-N 3.05Å; L812-C922 PolarHBondContact O-SG 2.91Å; L812-A924 HydrophobicContact CD1-CB 4.22Å; L812-A924 WeakPolarHBondContact CD1-O 3.43Å
813	L	89.9	Confident	85.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-77.7	-43.6	168.5	-63.5	175.4	0	0	0	110.7	S809 V810 D815 L816 M817 A826 F870 L872 C922 S925	S809-L813 PolarHBondContact O-N 3.07Å; V810-L813 WeakPolarHBondContact O-CB 3.34Å; V810-L813 PolarHBondContact O-N 3.48Å; L813-D815 PolarHBondContact O-N 3.28Å; L813-L816 WeakPolarHBondContact O-CB 3.44Å; L813-L816 PolarHBondContact O-N 3Å; L813-L816 VanDerWaalsContact O-N 3.16Å; L813-M817 WeakPolarHBondContact O-CG 3.26Å; L813-M817 PolarHBondContact O-N 3.38Å; L813-A826 HydrophobicContact CD2-CB 4.17Å; L813-F870 HydrophobicContact CD1-CD1 4.21Å; L813-F870 HydrophobicContact CD1-CE1 3.76Å; L813-F870 HydrophobicContact CD1-CZ 4.01Å; L813-L872 HydrophobicContact CB-CB 4.17Å; L813-L872 HydrophobicContact CB-CD2 3.67Å; L813-L872 HydrophobicContact CD1-CB 4.16Å; L813-C922 HydrophobicContact CD2-CB 3.69Å; L813-S925 WeakPolarHBondContact CG-OG 3.49Å
814	V	89	Confident	85.6	Confident	9 Å²	9	37.3 Å²	37.3	6%	0.055	17%	0.173	C	C	.	.	H	α-helix	trans	-62.2	-42.5	178	171.4	0	0	0	0	111.5	T628 V810 H811 L816 M817 K818 L872	T628-V814 HydrophobicContact CG2-CG1 4.07Å; V810-V814 HydrophobicContact CG1-CG2 4.29Å; V810-V814 WeakPolarHBondContact O-CG2 3.5Å; V810-V814 PolarHBondContact O-N 3.05Å; H811-V814 PolarHBondContact O-N 3.13Å; V814-L816 VanDerWaalsContact C-N 3.29Å; V814-L816 PolarHBondContact O-N 3.35Å; V814-M817 PolarHBondContact O-N 3.2Å; V814-K818 HydrophobicContact CG1-CD 3.9Å; V814-K818 HydrophobicContact CG1-CG 4.23Å; V814-K818 WeakPolarHBondContact O-CB 3.42Å; V814-K818 WeakPolarHBondContact O-CG 3.36Å; V814-K818 PolarHBondContact O-N 3.22Å; V814-L872 HydrophobicContact CG2-CD2 3.76Å
815	D	82.7	Confident	85.8	Confident	32 Å²	32	36 Å²	36	17%	0.171	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-37.3	174.3	-102.3	10.9	0	0	0	112.1	R541 H811 L813 K819	R541-D815 VanDerWaalsContact CD-OD2 3.27Å; R541-D815 WeakPolarHBondContact CD-OD2 3.46Å; R541-D815 IonicContact CZ-OD2 2.77Å; R541-D815 IonicContact NE-OD2 3.76Å; R541-D815 IonicContact NH1-OD1 3.31Å; R541-D815 IonicContact NH1-OD2 2.94Å; R541-D815 PolarHBondContact NH1-OD2 2.97Å; H811-D815 PolarHBondContact O-N 3.23Å; L813-D815 PolarHBondContact O-N 3.28Å; D815-K819 WeakPolarHBondContact O-CB 3.26Å; D815-K819 PolarHBondContact O-N 3.29Å
816	L	83	Confident	85.8	Confident	12 Å²	12	35.9 Å²	35.9	6%	0.063	17%	0.165	C	C	.	.	H	α-helix	trans	-69.9	-40	176.5	-168.5	62.9	0	0	0	111.8	L813 V814 K819 L823 A826 E920 C922	L813-L816 WeakPolarHBondContact O-CB 3.44Å; L813-L816 PolarHBondContact O-N 3Å; L813-L816 VanDerWaalsContact O-N 3.16Å; V814-L816 VanDerWaalsContact C-N 3.29Å; V814-L816 PolarHBondContact O-N 3.35Å; L816-K819 HydrophobicContact CD1-CD 4.46Å; L816-K819 PolarHBondContact O-N 2.8Å; L816-L823 HydrophobicContact CD2-CD2 4.46Å; L816-L823 HydrophobicContact CG-CD2 3.92Å; L816-A826 HydrophobicContact CD2-CB 4.25Å; L816-E920 HydrophobicContact CD2-CB 4.04Å; L816-C922 HydrophobicContact CD2-CB 3.83Å
817	M	86.4	Confident	85.9	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.2	-41.8	175.4	-67	-66.1	-92.6	0	0	112.7	Y795 L813 V814 K819 N820 L823 A826 L872 R874	Y795-M817 HydrophobicContact CD1-CB 4.19Å; Y795-M817 HydrophobicContact CD1-CE 3.66Å; Y795-M817 HydrophobicContact CD1-CG 4.3Å; Y795-M817 HydrophobicContact CE1-CB 3.57Å; Y795-M817 HydrophobicContact CE1-CE 3.8Å; Y795-M817 HydrophobicContact CE1-CG 4.12Å; L813-M817 WeakPolarHBondContact O-CG 3.26Å; L813-M817 PolarHBondContact O-N 3.38Å; V814-M817 PolarHBondContact O-N 3.2Å; M817-K819 VanDerWaalsContact C-N 3.29Å; M817-K819 PolarHBondContact O-N 2.91Å; M817-N820 PolarHBondContact O-N 3.08Å; M817-L823 HydrophobicContact CG-CD2 4.49Å; M817-L823 HydrophobicContact SD-CB 4.03Å; M817-L823 HydrophobicContact SD-CD2 3.6Å; M817-L823 HydrophobicContact SD-CG 3.52Å; M817-L823 VanDerWaalsContact SD-CG 3.52Å; M817-A826 HydrophobicContact CG-CB 4.03Å; M817-A826 HydrophobicContact SD-CB 3.73Å; M817-L872 WeakPolarHBondContact CE-O 3.46Å; M817-L872 HydrophobicContact CG-CD2 3.83Å; M817-L872 HydrophobicContact CG-CG 4.34Å; M817-R874 HydrophobicContact CE-CB 3.81Å; M817-R874 PolarHBondContact O-NH2 2.69Å
818	K	81.6	Confident	85.9	Confident	66 Å²	66	30 Å²	30	29%	0.287	14%	0.138	S	C	.	.	H	α-helix	trans	-60.6	-37.3	175.7	-77.1	175.7	175.3	176.4	0	111.8	T628 P673 V814 N820	T628-K818 WeakPolarHBondContact OG1-CE 3.35Å; T628-K818 PolarHBondContact OG1-NZ 3.03Å; P673-K818 PolarHBondContact O-NZ 3.17Å; V814-K818 HydrophobicContact CG1-CD 3.9Å; V814-K818 HydrophobicContact CG1-CG 4.23Å; V814-K818 WeakPolarHBondContact O-CB 3.42Å; V814-K818 WeakPolarHBondContact O-CG 3.36Å; V814-K818 PolarHBondContact O-N 3.22Å; K818-N820 VanDerWaalsContact C-N 3.35Å; K818-N820 PolarHBondContact O-N 3.42Å
819	K	72.6	Confident	85.9	Confident	43 Å²	43	27.6 Å²	27.6	19%	0.187	12%	0.119	C	C	.	.	H	α-helix	trans	-63.8	-30.4	-179.9	173.7	-173.8	164.5	-158.1	0	114.4	L542 D815 L816 M817	L542-K819 HydrophobicContact CB-CD 4.28Å; L542-K819 WeakPolarHBondContact O-CE 3.29Å; D815-K819 WeakPolarHBondContact O-CB 3.26Å; D815-K819 PolarHBondContact O-N 3.29Å; L816-K819 HydrophobicContact CD1-CD 4.46Å; L816-K819 PolarHBondContact O-N 2.8Å; M817-K819 VanDerWaalsContact C-N 3.29Å; M817-K819 PolarHBondContact O-N 2.91Å
820	N	74.7	Confident	86	Confident	41 Å²	41	27.5 Å²	27.5	22%	0.219	12%	0.118	C	C	.	.			trans	-136.5	101.7	-173	179.5	12.2	0	0	0	111.7	M817 K818 R822 L823 R874 E920	M817-N820 PolarHBondContact O-N 3.08Å; K818-N820 VanDerWaalsContact C-N 3.35Å; K818-N820 PolarHBondContact O-N 3.42Å; N820-R822 PolarHBondContact O-N 3.17Å; N820-R822 VanDerWaalsContact O-N 3.12Å; N820-R822 PolarHBondContact OD1-N 3.01Å; N820-L823 HydrophobicContact CB-CB 4Å; N820-L823 WeakPolarHBondContact O-CB 3.27Å; N820-L823 PolarHBondContact O-N 3.44Å; N820-R874 PolarHBondContact O-NH2 3.5Å; N820-E920 PolarHBondContact ND2-OE1 2.89Å; N820-E920 VanDerWaalsContact ND2-OE1 3.16Å
821	R	79.8	Confident	85.8	Confident	163 Å²	163	29.6 Å²	29.6	62%	0.615	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.5	179.7	-72.5	168.7	74.6	162.6	-2.4	114.3	E792 R874	E792-R821 IonicContact OE1-CZ 3.86Å; E792-R821 IonicContact OE1-NE 2.69Å; E792-R821 PolarHBondContact OE1-NE 3.22Å; E792-R821 IonicContact OE1-NH2 2.76Å; E792-R821 PolarHBondContact OE1-NH2 3.47Å; E792-R821 IonicContact OE2-CZ 2.65Å; E792-R821 IonicContact OE2-NE 2.92Å; E792-R821 IonicContact OE2-NH2 3.28Å; E792-R821 PolarHBondContact OE2-NH2 2.74Å; R821-R874 PolarHBondContact O-NE 3.24Å
822	R	82.6	Confident	85.8	Confident	131 Å²	131	28.7 Å²	28.7	49%	0.494	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	3.4	172.4	-75.8	-163.9	-177.6	170.4	1.7	114.4	N820 G824 R918 D968	N820-R822 PolarHBondContact O-N 3.17Å; N820-R822 VanDerWaalsContact O-N 3.12Å; N820-R822 PolarHBondContact OD1-N 3.01Å; R822-G824 PolarHBondContact O-N 2.65Å; R822-R918 PolarHBondContact O-N 3.44Å; R822-D968 IonicContact CZ-OD2 3.95Å; R822-D968 IonicContact NH1-OD2 3.42Å; R822-D968 PolarHBondContact NH1-OD2 3.36Å; R822-D968 IonicContact NH2-OD2 2.72Å
823	L	88.4	Confident	85.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	111.7	169.7	-166.3	57.4	0	0	0	108	L816 M817 N820 A825 A826 R874 R918 E920	L816-L823 HydrophobicContact CD2-CD2 4.46Å; L816-L823 HydrophobicContact CG-CD2 3.92Å; M817-L823 HydrophobicContact CG-CD2 4.49Å; M817-L823 HydrophobicContact SD-CB 4.03Å; M817-L823 HydrophobicContact SD-CD2 3.6Å; M817-L823 HydrophobicContact SD-CG 3.52Å; M817-L823 VanDerWaalsContact SD-CG 3.52Å; N820-L823 HydrophobicContact CB-CB 4Å; N820-L823 WeakPolarHBondContact O-CB 3.27Å; N820-L823 PolarHBondContact O-N 3.44Å; L823-A825 VanDerWaalsContact CD1-O 3.27Å; L823-A825 WeakPolarHBondContact CD1-O 3.42Å; L823-A826 HydrophobicContact CD2-CB 4.2Å; L823-R874 PolarHBondContact O-NE 3.48Å; L823-R874 PolarHBondContact O-NH2 2.81Å; L823-R874 VanDerWaalsContact O-NH2 3.14Å; L823-R918 HydrophobicContact CD1-CB 4.05Å; L823-R918 HydrophobicContact CD1-CG 4.44Å; L823-R918 WeakPolarHBondContact CD1-O 3.33Å; L823-E920 HydrophobicContact CD1-CB 3.69Å; L823-E920 HydrophobicContact CD1-CG 3.42Å; L823-E920 VanDerWaalsContact CD1-CG 3.42Å; L823-E920 HydrophobicContact CD2-CB 4.15Å; L823-E920 HydrophobicContact CD2-CG 4.3Å
824	G	90.7	Very high	85.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-33.2	179.8	0	0	0	0	0	112.2	R822 F873 R874 R918	R822-G824 PolarHBondContact O-N 2.65Å; G824-F873 CarbonylContact O-C 3.58Å; G824-F873 WeakPolarHBondContact O-CA 3.41Å; G824-R874 PolarHBondContact O-N 3.31Å; G824-R918 PolarHBondContact N-O 3.29Å
825	A	93.7	Very high	85.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	152.3	172.1	0	0	0	0	0	113.2	L823 A866 L872 F873 R918 V919 E920	L823-A825 VanDerWaalsContact CD1-O 3.27Å; L823-A825 WeakPolarHBondContact CD1-O 3.42Å; A825-A866 HydrophobicContact CB-CB 4.32Å; A825-L872 CarbonylContact C-O 3.54Å; A825-L872 VanDerWaalsContact CA-O 3.25Å; A825-L872 WeakPolarHBondContact CA-O 3.46Å; A825-F873 HydrophobicContact CB-CD1 3.55Å; A825-F873 HydrophobicContact CB-CE1 3.69Å; A825-F873 HydrophobicContact CB-CG 4.07Å; A825-F873 HydrophobicContact CB-CZ 4.32Å; A825-R918 PolarHBondContact N-O 2.97Å; A825-V919 HydrophobicContact CB-CG1 4.23Å; A825-V919 HydrophobicContact CB-CG2 4.23Å; A825-V919 WeakPolarHBondContact O-CA 3.28Å; A825-E920 PolarHBondContact O-N 2.78Å
826	A	92	Very high	85.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	130.3	171.4	0	0	0	0	0	110.5	L813 L816 M817 L823 L872 E920	L813-A826 HydrophobicContact CD2-CB 4.17Å; L816-A826 HydrophobicContact CD2-CB 4.25Å; M817-A826 HydrophobicContact CG-CB 4.03Å; M817-A826 HydrophobicContact SD-CB 3.73Å; L823-A826 HydrophobicContact CD2-CB 4.2Å; A826-L872 PolarHBondContact N-O 3.02Å; A826-L872 PolarHBondContact O-N 3.13Å; A826-E920 WeakPolarHBondContact CA-O 3.29Å
827	C	91.5	Very high	85.6	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	148.7	179.9	63	0	0	0	0	113.4	A866 S871 E920 C922	C827-A866 HydrophobicContact CB-CB 3.98Å; C827-S871 VanDerWaalsContact CB-OG 3.28Å; C827-S871 WeakPolarHBondContact CB-OG 3.41Å; C827-E920 PolarHBondContact N-O 3.18Å; C827-C922 PolarHBondContact O-N 2.83Å
828	G	87.2	Confident	85.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	179.3	175.9	0	0	0	0	0	114.4	F870 S925	G828-F870 PolarHBondContact N-O 3.42Å; G828-S925 CarbonylContact C-O 3.56Å; G828-S925 WeakPolarHBondContact CA-O 3.27Å
829	R	86.7	Confident	86.1	Confident	14 Å²	14	42.6 Å²	42.6	5%	0.053	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	120.8	170.1	-174.7	169.8	64.3	155.9	-0.8	109.1	H831 Y921 S925 D926 A927 E1090	R829-H831 PolarHBondContact NE-NE2 3.03Å; R829-Y921 HydrophobicContact CB-CE2 3.98Å; R829-Y921 WeakPolarHBondContact CD-OH 3.47Å; R829-Y921 WeakPolarHBondContact CG-OH 3.45Å; R829-S925 PolarHBondContact N-O 3.02Å; R829-D926 IonicContact CZ-OD1 3.84Å; R829-D926 IonicContact CZ-OD2 2.76Å; R829-D926 IonicContact NE-OD1 3.22Å; R829-D926 PolarHBondContact NE-OD1 3.35Å; R829-D926 VanDerWaalsContact NH2-CG 3.26Å; R829-D926 IonicContact NH2-OD1 2.87Å; R829-D926 PolarHBondContact NH2-OD1 3.24Å; R829-D926 IonicContact NH2-OD2 3.71Å; R829-D926 PolarHBondContact NH2-OD2 3Å; R829-A927 PolarHBondContact O-N 3.3Å; R829-E1090 VanDerWaalsContact CD-OE1 3.28Å; R829-E1090 WeakPolarHBondContact CD-OE1 3.41Å; R829-E1090 IonicContact CZ-OE1 2.69Å; R829-E1090 IonicContact NE-OE1 3.72Å; R829-E1090 PolarHBondContact NE-OE1 3.23Å; R829-E1090 IonicContact NH1-OE1 3.35Å; R829-E1090 PolarHBondContact NH1-OE1 3.05Å; R829-E1090 IonicContact NH1-OE2 2.78Å; R829-E1090 PolarHBondContact NH1-OE2 3.03Å
830	M	88.5	Confident	87	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.025	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.7	-178.5	-59.3	-49.8	-59.5	0	0	111.4	V803 Y846 H850 C869 F870 A927 T929	V803-M830 HydrophobicContact CG2-CE 4.09Å; M830-Y846 HydrophobicContact CB-CD1 4.45Å; M830-Y846 HydrophobicContact CB-CE1 4.39Å; M830-H850 PolarHBondContact O-CE1 3.48Å; M830-H850 VanDerWaalsContact O-CE1 3.32Å; M830-C869 HydrophobicContact CE-CB 4.23Å; M830-F870 HydrophobicContact CE-CB 4.22Å; M830-F870 HydrophobicContact SD-CB 3.56Å; M830-F870 VanDerWaalsContact SD-CB 3.56Å; M830-F870 HydrophobicContact SD-CG 4.49Å; M830-A927 WeakPolarHBondContact CA-O 3.38Å; M830-A927 HydrophobicContact CE-CB 3.83Å; M830-A927 HydrophobicContact SD-CB 3.87Å; M830-T929 HydrophobicContact CB-CG2 4.23Å; M830-T929 HydrophobicContact CE-CG2 3.7Å
831	H	87.2	Confident	87.8	Confident	46 Å²	46	45.2 Å²	45.2	21%	0.213	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.3	176.5	-61.5	-93.8	0	0	0	110.4	R829 R833 D926 A927 L928 T929 E1090	R829-H831 PolarHBondContact NE-NE2 3.03Å; H831-R833 PolarHBondContact O-N 2.89Å; H831-D926 IonicContact CD2-OD1 3.31Å; H831-D926 IonicContact CE1-OD1 2.71Å; H831-D926 IonicContact NE2-OD1 3.91Å; H831-D926 PolarHBondContact NE2-OD1 3.17Å; H831-A927 PolarHBondContact CD2-O 3.05Å; H831-A927 PolarHBondContact N-O 3.45Å; H831-L928 HydrophobicContact CB-CD2 3.73Å; H831-L928 WeakPolarHBondContact O-CA 3.38Å; H831-T929 PolarHBondContact O-N 3.19Å; H831-T929 VanDerWaalsContact O-N 3.09Å; H831-E1090 IonicContact CE1-OE1 3.67Å; H831-E1090 PolarHBondContact CE1-OE1 3.34Å; H831-E1090 VanDerWaalsContact CE1-OE1 3.26Å; H831-E1090 IonicContact ND1-OE1 3.7Å
832	P	88.7	Confident	88.4	Confident	12 Å²	12	37.5 Å²	37.5	8%	0.078	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	127.6	179.8	26.4	-30.6	0	0	0	111.9	Q842 K843 Y846 A931	P832-Q842 HydrophobicContact CG-CB 4.42Å; P832-K843 HydrophobicContact CG-CB 4.46Å; P832-K843 HydrophobicContact CG-CG 3.82Å; P832-K843 WeakPolarHBondContact O-CE 3.41Å; P832-Y846 HydrophobicContact CG-CD1 4.18Å; P832-Y846 HydrophobicContact CG-CG 4.14Å; P832-A931 HydrophobicContact CB-CB 3.62Å
833	R	84.4	Confident	88.8	Confident	106 Å²	106	34.5 Å²	34.5	40%	0.4	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.3	-180	-171.6	179.4	-171.5	155.7	2.2	109.6	D804 H831 T929 F930 A931	D804-R833 IonicContact OD2-NH1 3.52Å; D804-R833 PolarHBondContact OD2-NH1 3.17Å; H831-R833 PolarHBondContact O-N 2.89Å; R833-T929 WeakPolarHBondContact CB-O 3.42Å; R833-T929 PolarHBondContact N-O 2.92Å; R833-F930 HydrophobicContact CG-CD1 4.39Å; R833-F930 HydrophobicContact CG-CE1 4.17Å; R833-F930 HydrophobicContact CG-CZ 4.47Å; R833-A931 PolarHBondContact O-N 3.48Å
834	G	84	Confident	89	Confident	22 Å²	22	34.6 Å²	34.6	23%	0.227	17%	0.172	C	C	.	.			trans	148.9	-174.5	-178.6	0	0	0	0	0	111.8	E933	G834-E933 WeakPolarHBondContact CA-OE1 3.49Å
835	K	83.4	Confident	89.1	Confident	166 Å²	166	36.7 Å²	36.7	72%	0.722	18%	0.182	S	C	*	.			trans	-119.8	171.5	178.8	-64.6	175.3	-179	174	0	111.5	I839 E933	K835-I839 WeakPolarHBondContact O-CG1 3.19Å; K835-E933 VanDerWaalsContact N-CD 3.3Å; K835-E933 PolarHBondContact N-OE1 3.38Å
836	G	86.5	Confident	88.9	Confident	37 Å²	37	38.7 Å²	38.7	38%	0.381	19%	0.19	S	C	.	.	S	Bend	trans	79.5	173.1	176.5	0	0	0	0	0	115.3	I839 W840	G836-I839 PolarHBondContact O-N 2.97Å; G836-W840 VanDerWaalsContact O-CD1 3.24Å; G836-W840 PolarHBondContact O-N 2.85Å
837	P	86.9	Confident	88.9	Confident	90 Å²	90	38.9 Å²	38.9	58%	0.584	19%	0.191	S	C	*	.	H	α-helix	trans	-71.2	-29.9	-171.7	27.6	-34.6	0	0	0	113.6	I839 W840 Y841 L1099	P837-I839 PolarHBondContact O-N 2.88Å; P837-W840 WeakPolarHBondContact O-CA 3.47Å; P837-W840 WeakPolarHBondContact O-CB 3.2Å; P837-W840 PolarHBondContact O-N 3.34Å; P837-Y841 PolarHBondContact O-N 2.87Å; P837-L1099 HydrophobicContact CB-CD2 3.83Å; P837-L1099 VanDerWaalsContact O-CD2 3.26Å; P837-L1099 WeakPolarHBondContact O-CD2 3.36Å
838	M	89.5	Confident	88.8	Confident	19 Å²	19	40 Å²	40	9%	0.094	20%	0.197	C	C	.	.	H	α-helix	trans	-65.5	-30.1	178.2	-165.8	52.9	79.4	0	0	112	Q842 E933 F935 F938 M1107	M838-Q842 WeakPolarHBondContact O-CB 3.41Å; M838-Q842 VanDerWaalsContact O-CG 3.32Å; M838-Q842 WeakPolarHBondContact O-CG 3.26Å; M838-Q842 PolarHBondContact O-N 2.91Å; M838-Q842 VanDerWaalsContact O-N 3.09Å; M838-Q842 PolarHBondContact O-NE2 2.81Å; M838-E933 WeakPolarHBondContact CB-O 3.35Å; M838-F935 HydrophobicContact CE-CB 4.17Å; M838-F935 HydrophobicContact CE-CD2 3.62Å; M838-F935 HydrophobicContact CE-CE2 4.41Å; M838-F935 HydrophobicContact CE-CG 4.15Å; M838-F938 HydrophobicContact CE-CB 4.31Å; M838-F938 HydrophobicContact CE-CD1 3.99Å; M838-F938 HydrophobicContact CE-CG 4.21Å; M838-F938 HydrophobicContact CG-CB 3.9Å; M838-F938 HydrophobicContact CG-CD2 4.12Å; M838-F938 HydrophobicContact CG-CG 3.96Å; M838-F938 HydrophobicContact SD-CB 4.1Å; M838-F938 HydrophobicContact SD-CD1 3.73Å; M838-F938 HydrophobicContact SD-CD2 3.93Å; M838-F938 HydrophobicContact SD-CE1 4.12Å; M838-F938 HydrophobicContact SD-CE2 4.27Å; M838-F938 HydrophobicContact SD-CG 3.64Å; M838-F938 HydrophobicContact SD-CZ 4.37Å; M838-M1107 HydrophobicContact CE-CE 3.87Å; M838-M1107 HydrophobicContact SD-CE 4.13Å
839	I	89.8	Confident	88.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-74.7	-29.8	172.7	-58	-66.5	0	0	0	111.6	K835 G836 P837 K843 A931 E933	K835-I839 WeakPolarHBondContact O-CG1 3.19Å; G836-I839 PolarHBondContact O-N 2.97Å; P837-I839 PolarHBondContact O-N 2.88Å; I839-K843 HydrophobicContact CG2-CD 4.22Å; I839-K843 HydrophobicContact CG2-CG 4.46Å; I839-K843 WeakPolarHBondContact O-CB 3.12Å; I839-K843 VanDerWaalsContact O-CG 3.23Å; I839-K843 WeakPolarHBondContact O-CG 3.47Å; I839-K843 PolarHBondContact O-N 2.79Å; I839-A931 HydrophobicContact CD1-CB 3.61Å; I839-A931 VanDerWaalsContact CD1-O 3.3Å; I839-A931 WeakPolarHBondContact CD1-O 3.15Å; I839-E933 HydrophobicContact CD1-CG 4.1Å; I839-E933 HydrophobicContact CG1-CG 3.99Å
840	W	90.7	Very high	89	Confident	130 Å²	130	41 Å²	41	49%	0.492	21%	0.208	S	C	.	.	H	α-helix	trans	-65.9	-48.9	172.8	-76.7	42.7	0	0	0	110.3	G836 P837 Q842 K843 F844 P1096 L1099	G836-W840 VanDerWaalsContact O-CD1 3.24Å; G836-W840 PolarHBondContact O-N 2.85Å; P837-W840 WeakPolarHBondContact O-CA 3.47Å; P837-W840 WeakPolarHBondContact O-CB 3.2Å; P837-W840 PolarHBondContact O-N 3.34Å; W840-Q842 PolarHBondContact O-N 3.05Å; W840-K843 PolarHBondContact O-N 3.29Å; W840-F844 PolarHBondContact O-N 2.75Å; W840-P1096 HydrophobicContact CB-CB 3.96Å; W840-P1096 HydrophobicContact CB-CG 4.3Å; W840-P1096 HydrophobicContact CD2-CG 4.24Å; W840-P1096 HydrophobicContact CE3-CB 4.38Å; W840-P1096 HydrophobicContact CE3-CG 4.1Å; W840-P1096 HydrophobicContact CG-CG 4.35Å; W840-P1096 VanDerWaalsContact O-CB 3.23Å; W840-P1096 WeakPolarHBondContact O-CB 3.48Å; W840-L1099 HydrophobicContact CB-CD2 4.09Å
841	Y	92	Very high	89	Confident	9 Å²	9	40.9 Å²	40.9	4%	0.035	21%	0.207	C	C	.	.	H	α-helix	trans	-52.4	-53.5	173	179.8	-87.9	0	0	0	111.6	P837 K843 F844 E845 F938 Y1100 A1103 M1107	P837-Y841 PolarHBondContact O-N 2.87Å; Y841-K843 VanDerWaalsContact C-N 3.33Å; Y841-K843 PolarHBondContact O-N 3.22Å; Y841-F844 PolarHBondContact O-N 2.93Å; Y841-E845 HydrophobicContact CE1-CB 4.22Å; Y841-E845 HydrophobicContact CE1-CG 4.42Å; Y841-E845 WeakPolarHBondContact O-CB 3.33Å; Y841-E845 PolarHBondContact O-N 2.95Å; Y841-F938 HydrophobicContact CD1-CE2 4.47Å; Y841-F938 HydrophobicContact CD1-CZ 4.1Å; Y841-F938 AromaticContact CE1-CZ 3.91Å; Y841-F938 HydrophobicContact CE1-CZ 3.91Å; Y841-Y1100 AromaticContact CD2-CD2 3.69Å; Y841-Y1100 HydrophobicContact CD2-CD2 3.69Å; Y841-Y1100 HydrophobicContact CD2-CG 4.24Å; Y841-Y1100 HydrophobicContact CE1-CD2 4.17Å; Y841-Y1100 HydrophobicContact CE1-CE2 4.19Å; Y841-Y1100 AromaticContact CE2-CD2 3.14Å; Y841-Y1100 HydrophobicContact CE2-CD2 3.14Å; Y841-Y1100 AromaticContact CE2-CE2 3.68Å; Y841-Y1100 HydrophobicContact CE2-CE2 3.68Å; Y841-Y1100 AromaticContact CE2-CG 3.78Å; Y841-Y1100 HydrophobicContact CE2-CG 3.78Å; Y841-Y1100 HydrophobicContact CG-CD2 4.37Å; Y841-Y1100 AromaticContact CZ-CD2 3.4Å; Y841-Y1100 AromaticContact CZ-CE2 3.43Å; Y841-Y1100 VanDerWaalsContact CZ-CE2 3.43Å; Y841-Y1100 WeakPolarHBondContact OH-CE2 3.23Å; Y841-A1103 HydrophobicContact CD2-CB 3.88Å; Y841-A1103 HydrophobicContact CE2-CB 3.84Å; Y841-M1107 HydrophobicContact CD2-CG 4.5Å; Y841-M1107 HydrophobicContact CE1-CG 4.24Å; Y841-M1107 HydrophobicContact CE2-CB 4.31Å; Y841-M1107 HydrophobicContact CE2-CG 3.7Å; Y841-M1107 VanDerWaalsContact OH-CB 3.3Å; Y841-M1107 WeakPolarHBondContact OH-CB 3.36Å
842	Q	92.4	Very high	89.2	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-32.5	-178.3	-74.4	173.6	100.1	0	0	113.7	P832 M838 W840 Y846 P932 F938	P832-Q842 HydrophobicContact CG-CB 4.42Å; M838-Q842 WeakPolarHBondContact O-CB 3.41Å; M838-Q842 VanDerWaalsContact O-CG 3.32Å; M838-Q842 WeakPolarHBondContact O-CG 3.26Å; M838-Q842 PolarHBondContact O-N 2.91Å; M838-Q842 VanDerWaalsContact O-N 3.09Å; M838-Q842 PolarHBondContact O-NE2 2.81Å; W840-Q842 PolarHBondContact O-N 3.05Å; Q842-Y846 VanDerWaalsContact O-CB 3.31Å; Q842-Y846 WeakPolarHBondContact O-CB 3.36Å; Q842-Y846 WeakPolarHBondContact O-CD2 3.41Å; Q842-Y846 PolarHBondContact O-N 3.08Å; Q842-P932 PolarHBondContact NE2-O 2.95Å; Q842-F938 HydrophobicContact CG-CD2 3.97Å; Q842-F938 HydrophobicContact CG-CE2 3.56Å
843	K	91.5	Very high	89.1	Confident	68 Å²	68	42 Å²	42	30%	0.296	21%	0.211	S	C	.	.	H	α-helix	trans	-62	-42.9	175.4	-82.5	170.5	179.5	169	0	112.5	P832 I839 W840 Y841 A847	P832-K843 HydrophobicContact CG-CB 4.46Å; P832-K843 HydrophobicContact CG-CG 3.82Å; P832-K843 WeakPolarHBondContact O-CE 3.41Å; I839-K843 HydrophobicContact CG2-CD 4.22Å; I839-K843 HydrophobicContact CG2-CG 4.46Å; I839-K843 WeakPolarHBondContact O-CB 3.12Å; I839-K843 VanDerWaalsContact O-CG 3.23Å; I839-K843 WeakPolarHBondContact O-CG 3.47Å; I839-K843 PolarHBondContact O-N 2.79Å; W840-K843 PolarHBondContact O-N 3.29Å; Y841-K843 VanDerWaalsContact C-N 3.33Å; Y841-K843 PolarHBondContact O-N 3.22Å; K843-A847 VanDerWaalsContact O-CB 3.31Å; K843-A847 WeakPolarHBondContact O-CB 3.46Å; K843-A847 PolarHBondContact O-N 2.98Å
844	F	92.9	Very high	89.3	Confident	3 Å²	3	38.5 Å²	38.5	1%	0.013	20%	0.199	C	C	.	.	H	α-helix	trans	-76	-38.9	177.9	-176.9	-107	0	0	0	111.9	W840 Y841 A847 I848 F1080 C1093 I1094 P1096 G1097 Y1100 F1101	W840-F844 PolarHBondContact O-N 2.75Å; Y841-F844 PolarHBondContact O-N 2.93Å; F844-A847 WeakPolarHBondContact O-CB 3.12Å; F844-A847 PolarHBondContact O-N 2.84Å; F844-I848 HydrophobicContact CD1-CD1 3.92Å; F844-I848 HydrophobicContact CD2-CD1 4.49Å; F844-I848 HydrophobicContact CE1-CD1 3.34Å; F844-I848 HydrophobicContact CE1-CG1 4.36Å; F844-I848 HydrophobicContact CE2-CD1 3.97Å; F844-I848 HydrophobicContact CE2-CG1 4.41Å; F844-I848 HydrophobicContact CZ-CD1 3.39Å; F844-I848 HydrophobicContact CZ-CG1 4.3Å; F844-I848 PolarHBondContact O-N 2.83Å; F844-F1080 HydrophobicContact CZ-CD2 4.11Å; F844-F1080 HydrophobicContact CZ-CE2 4.39Å; F844-C1093 WeakPolarHBondContact CD2-O 3.46Å; F844-I1094 HydrophobicContact CE2-CG1 4.41Å; F844-P1096 HydrophobicContact CB-CB 4.33Å; F844-G1097 VanDerWaalsContact CG-CA 3.5Å; F844-Y1100 AromaticContact CD1-CD1 3.77Å; F844-Y1100 HydrophobicContact CD1-CD1 3.77Å; F844-Y1100 AromaticContact CD1-CD2 3.76Å; F844-Y1100 HydrophobicContact CD1-CD2 3.76Å; F844-Y1100 HydrophobicContact CD1-CE1 4.43Å; F844-Y1100 HydrophobicContact CD1-CE2 4.44Å; F844-Y1100 AromaticContact CD1-CG 3.38Å; F844-Y1100 HydrophobicContact CD1-CG 3.38Å; F844-Y1100 AromaticContact CE1-CD1 3.6Å; F844-Y1100 HydrophobicContact CE1-CD1 3.6Å; F844-Y1100 HydrophobicContact CE1-CD2 4.44Å; F844-Y1100 HydrophobicContact CE1-CE1 4.23Å; F844-Y1100 AromaticContact CE1-CG 3.72Å; F844-Y1100 HydrophobicContact CE1-CG 3.72Å; F844-F1101 HydrophobicContact CE1-CE2 4.48Å; F844-F1101 HydrophobicContact CZ-CE2 4.22Å
845	E	91.4	Very high	89.5	Confident	43 Å²	43	37.4 Å²	37.4	20%	0.201	19%	0.188	C	C	.	.	H	α-helix	trans	-58.8	-50.4	174.5	-174.1	-168.8	-155.5	0	0	112.1	Y841 A847 I848 G849 R942 Y1100	Y841-E845 HydrophobicContact CE1-CB 4.22Å; Y841-E845 HydrophobicContact CE1-CG 4.42Å; Y841-E845 WeakPolarHBondContact O-CB 3.33Å; Y841-E845 PolarHBondContact O-N 2.95Å; E845-A847 VanDerWaalsContact C-N 3.31Å; E845-A847 PolarHBondContact O-N 3.19Å; E845-I848 PolarHBondContact O-N 2.75Å; E845-G849 PolarHBondContact O-N 3.39Å; E845-R942 VanDerWaalsContact CD-NH1 3.34Å; E845-R942 IonicContact OE1-CZ 2.71Å; E845-R942 IonicContact OE1-NH1 3.82Å; E845-R942 PolarHBondContact OE1-NH1 3.02Å; E845-R942 IonicContact OE1-NH2 3.69Å; E845-R942 IonicContact OE2-CZ 3.21Å; E845-R942 IonicContact OE2-NH1 3.9Å; E845-R942 PolarHBondContact OE2-NH1 3.45Å; E845-R942 IonicContact OE2-NH2 2.79Å; E845-R942 PolarHBondContact OE2-NH2 3.31Å; E845-Y1100 HydrophobicContact CB-CD2 4.26Å; E845-Y1100 HydrophobicContact CB-CE2 3.83Å; E845-Y1100 HydrophobicContact CG-CE2 4.08Å
846	Y	90.4	Very high	89.8	Confident	43 Å²	43	29.5 Å²	29.5	17%	0.169	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-39.7	177.7	-85.5	-134.3	0	0	0	110.9	M830 P832 Q842 H850 W945	M830-Y846 HydrophobicContact CB-CD1 4.45Å; M830-Y846 HydrophobicContact CB-CE1 4.39Å; P832-Y846 HydrophobicContact CG-CD1 4.18Å; P832-Y846 HydrophobicContact CG-CG 4.14Å; Q842-Y846 VanDerWaalsContact O-CB 3.31Å; Q842-Y846 WeakPolarHBondContact O-CB 3.36Å; Q842-Y846 WeakPolarHBondContact O-CD2 3.41Å; Q842-Y846 PolarHBondContact O-N 3.08Å; Y846-H850 VanDerWaalsContact O-CB 3.22Å; Y846-H850 WeakPolarHBondContact O-CB 3.16Å; Y846-H850 PolarHBondContact O-CD2 3.35Å; Y846-H850 PolarHBondContact O-N 3.19Å; Y846-H850 PolarHBondContact O-ND1 2.85Å; Y846-W945 WeakPolarHBondContact OH-CH2 3.41Å
847	A	90.4	Very high	89.9	Confident	4 Å²	4	28 Å²	28	3%	0.033	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-54.5	175.1	0	0	0	0	0	111.5	K843 F844 E845 G849 H850 W851 C1093	K843-A847 VanDerWaalsContact O-CB 3.31Å; K843-A847 WeakPolarHBondContact O-CB 3.46Å; K843-A847 PolarHBondContact O-N 2.98Å; F844-A847 WeakPolarHBondContact O-CB 3.12Å; F844-A847 PolarHBondContact O-N 2.84Å; E845-A847 VanDerWaalsContact C-N 3.31Å; E845-A847 PolarHBondContact O-N 3.19Å; A847-G849 PolarHBondContact O-N 3.45Å; A847-H850 PolarHBondContact O-N 3.44Å; A847-H850 VanDerWaalsContact O-N 3.16Å; A847-W851 HydrophobicContact CB-CD2 4.3Å; A847-W851 HydrophobicContact CB-CH2 4.16Å; A847-W851 HydrophobicContact CB-CZ2 3.85Å; A847-W851 WeakPolarHBondContact O-CB 3.34Å; A847-W851 VanDerWaalsContact O-CD1 3.31Å; A847-W851 PolarHBondContact O-N 2.76Å; A847-C1093 HydrophobicContact CB-CB 4.15Å
848	I	90	Very high	89.8	Confident	24 Å²	24	24.4 Å²	24.4	12%	0.123	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-44.4	178.1	-74.2	-176.6	0	0	0	111.9	F844 E845 H850 W851 F852 F1080	F844-I848 HydrophobicContact CD1-CD1 3.92Å; F844-I848 HydrophobicContact CD2-CD1 4.49Å; F844-I848 HydrophobicContact CE1-CD1 3.34Å; F844-I848 HydrophobicContact CE1-CG1 4.36Å; F844-I848 HydrophobicContact CE2-CD1 3.97Å; F844-I848 HydrophobicContact CE2-CG1 4.41Å; F844-I848 HydrophobicContact CZ-CD1 3.39Å; F844-I848 HydrophobicContact CZ-CG1 4.3Å; F844-I848 PolarHBondContact O-N 2.83Å; E845-I848 PolarHBondContact O-N 2.75Å; I848-H850 PolarHBondContact O-N 3.28Å; I848-W851 HydrophobicContact CG1-CE3 4.42Å; I848-W851 PolarHBondContact O-N 2.9Å; I848-F852 HydrophobicContact CG2-CD2 4.13Å; I848-F852 PolarHBondContact O-N 2.94Å; I848-F1080 HydrophobicContact CD1-CD2 3.89Å; I848-F1080 HydrophobicContact CD1-CE1 4.2Å; I848-F1080 HydrophobicContact CD1-CE2 3.51Å; I848-F1080 HydrophobicContact CD1-CG 4.39Å; I848-F1080 HydrophobicContact CD1-CZ 3.69Å
849	G	88.9	Confident	89.5	Confident	22 Å²	22	26 Å²	26	23%	0.227	12%	0.12	C	C	.	.	I	π-helix	trans	-60.9	-31	177.3	0	0	0	0	0	113.2	E845 A847 Q853 K854	E845-G849 PolarHBondContact O-N 3.39Å; A847-G849 PolarHBondContact O-N 3.45Å; G849-Q853 PolarHBondContact O-N 3.09Å; G849-K854 PolarHBondContact O-N 2.9Å
850	H	88.9	Confident	89	Confident	13 Å²	13	28.7 Å²	28.7	6%	0.06	13%	0.132	C	C	.	.	I	π-helix	trans	-85.2	-35.2	176.2	-68.8	169.9	0	0	0	113.5	M830 Y846 A847 I848 K854	M830-H850 PolarHBondContact O-CE1 3.48Å; M830-H850 VanDerWaalsContact O-CE1 3.32Å; Y846-H850 VanDerWaalsContact O-CB 3.22Å; Y846-H850 WeakPolarHBondContact O-CB 3.16Å; Y846-H850 PolarHBondContact O-CD2 3.35Å; Y846-H850 PolarHBondContact O-N 3.19Å; Y846-H850 PolarHBondContact O-ND1 2.85Å; A847-H850 PolarHBondContact O-N 3.44Å; A847-H850 VanDerWaalsContact O-N 3.16Å; I848-H850 PolarHBondContact O-N 3.28Å; H850-K854 PolarHBondContact CD2-NZ 3.17Å; H850-K854 PolarHBondContact NE2-NZ 2.84Å
851	W	89.4	Confident	88.5	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.008	11%	0.11	C	C	.	.	I	π-helix	trans	-73.7	-47.3	178.7	-63.4	-13.2	0	0	0	111.8	A847 I848 A855 A1083 A1084 H1087 E1090 M1391	A847-W851 HydrophobicContact CB-CD2 4.3Å; A847-W851 HydrophobicContact CB-CH2 4.16Å; A847-W851 HydrophobicContact CB-CZ2 3.85Å; A847-W851 WeakPolarHBondContact O-CB 3.34Å; A847-W851 VanDerWaalsContact O-CD1 3.31Å; A847-W851 PolarHBondContact O-N 2.76Å; I848-W851 HydrophobicContact CG1-CE3 4.42Å; I848-W851 PolarHBondContact O-N 2.9Å; W851-A855 WeakPolarHBondContact O-CB 3.43Å; W851-A1083 HydrophobicContact CD2-CB 4.24Å; W851-A1083 HydrophobicContact CE3-CB 3.7Å; W851-A1083 HydrophobicContact CZ3-CB 4.26Å; W851-A1084 HydrophobicContact CH2-CB 3.59Å; W851-A1084 HydrophobicContact CZ2-CB 4.37Å; W851-A1084 HydrophobicContact CZ3-CB 3.98Å; W851-H1087 AromaticContact CD1-CD2 3.64Å; W851-H1087 AromaticContact CD1-CE1 3.52Å; W851-H1087 AromaticContact CD1-CG 3.68Å; W851-H1087 AromaticContact CD1-ND1 3.6Å; W851-H1087 AromaticContact CD1-NE2 3.61Å; W851-H1087 AromaticContact CE2-CG 3.99Å; W851-H1087 AromaticContact CG-CE1 3.97Å; W851-H1087 HydrophobicContact CZ2-CB 4.13Å; W851-H1087 AromaticContact NE1-CD2 3.56Å; W851-H1087 AromaticContact NE1-CG 3.35Å; W851-H1087 AromaticContact NE1-ND1 3.65Å; W851-E1090 HydrophobicContact CZ2-CB 3.79Å; W851-E1090 PolarHBondContact NE1-OE2 3.33Å; W851-M1391 HydrophobicContact CB-CG 4.44Å; W851-M1391 VanDerWaalsContact O-CB 3.25Å; W851-M1391 WeakPolarHBondContact O-CB 3.34Å; W851-M1391 WeakPolarHBondContact O-CG 3.34Å
852	F	90.6	Very high	88.2	Confident	3 Å²	3	22.2 Å²	22.2	1%	0.013	11%	0.108	C	C	.	.	I	π-helix	trans	-99.4	-69	-174.9	-68.1	-90.9	0	0	0	111.7	I848 A855 T856 F1080 A1083 L1384 Q1387 F1388	I848-F852 HydrophobicContact CG2-CD2 4.13Å; I848-F852 PolarHBondContact O-N 2.94Å; F852-A855 PolarHBondContact O-N 2.85Å; F852-T856 VanDerWaalsContact O-CB 3.32Å; F852-T856 WeakPolarHBondContact O-CB 3.45Å; F852-T856 PolarHBondContact O-N 3.41Å; F852-T856 PolarHBondContact O-OG1 3.09Å; F852-F1080 AromaticContact CE2-CD1 3.66Å; F852-F1080 HydrophobicContact CE2-CD1 3.66Å; F852-F1080 AromaticContact CE2-CE1 3.94Å; F852-F1080 HydrophobicContact CE2-CE1 3.94Å; F852-F1080 AromaticContact CZ-CD1 3.66Å; F852-F1080 HydrophobicContact CZ-CD1 3.66Å; F852-F1080 HydrophobicContact CZ-CE1 4.05Å; F852-A1083 HydrophobicContact CE2-CB 3.76Å; F852-A1083 HydrophobicContact CZ-CB 3.81Å; F852-L1384 HydrophobicContact CE1-CD1 4.29Å; F852-Q1387 HydrophobicContact CB-CB 4.28Å; F852-Q1387 HydrophobicContact CD1-CB 3.98Å; F852-F1388 HydrophobicContact CE1-CB 4.12Å; F852-F1388 HydrophobicContact CE1-CD2 4.02Å; F852-F1388 HydrophobicContact CZ-CD2 4.4Å
853	Q	88	Confident	88.1	Confident	77 Å²	77	22.2 Å²	22.2	36%	0.36	11%	0.108	S	C	.	.	I	π-helix	trans	-62.8	-59.9	-169	-176.9	177.6	-14	0	0	113.2	G849 A855 T856 E857	G849-Q853 PolarHBondContact O-N 3.09Å; Q853-A855 VanDerWaalsContact C-N 3.26Å; Q853-A855 PolarHBondContact O-N 2.72Å; Q853-T856 WeakPolarHBondContact O-CB 3.36Å; Q853-T856 PolarHBondContact O-N 2.84Å; Q853-E857 HydrophobicContact CG-CG 4.43Å; Q853-E857 WeakPolarHBondContact CG-OE1 3.32Å; Q853-E857 PolarHBondContact NE2-OE1 3.38Å; Q853-E857 WeakPolarHBondContact O-CG 3.38Å; Q853-E857 PolarHBondContact O-N 3.15Å
854	K	88.4	Confident	87.9	Confident	33 Å²	33	19.4 Å²	19.4	14%	0.143	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-33.8	-178.6	-72.6	-169	-175.4	167	0	112.7	G849 H850 H858 V863 Y921	G849-K854 PolarHBondContact O-N 2.9Å; H850-K854 PolarHBondContact CD2-NZ 3.17Å; H850-K854 PolarHBondContact NE2-NZ 2.84Å; K854-H858 WeakPolarHBondContact O-CB 3.24Å; K854-H858 PolarHBondContact O-N 3.32Å; K854-V863 HydrophobicContact CG-CG1 4.49Å; K854-Y921 HydrophobicContact CB-CD1 3.76Å; K854-Y921 HydrophobicContact CB-CE1 4.08Å; K854-Y921 HydrophobicContact CB-CG 4.29Å; K854-Y921 HydrophobicContact CD-CD1 4.46Å; K854-Y921 HydrophobicContact CD-CD2 4.37Å; K854-Y921 HydrophobicContact CD-CG 4.34Å
855	A	87.6	Confident	87.6	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.9	-43.7	174.2	0	0	0	0	0	111.6	W851 F852 Q853 H858 M859 H1394	W851-A855 WeakPolarHBondContact O-CB 3.43Å; F852-A855 PolarHBondContact O-N 2.85Å; Q853-A855 VanDerWaalsContact C-N 3.26Å; Q853-A855 PolarHBondContact O-N 2.72Å; A855-H858 PolarHBondContact O-N 3.35Å; A855-M859 WeakPolarHBondContact O-CB 3.44Å; A855-M859 VanDerWaalsContact O-CG 3.29Å; A855-M859 WeakPolarHBondContact O-CG 3.43Å; A855-M859 PolarHBondContact O-N 3.02Å; A855-H1394 HydrophobicContact CB-CB 3.76Å; A855-H1394 WeakPolarHBondContact CB-ND1 3.41Å
856	T	89.4	Confident	87.2	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.7	-49.5	178.4	-55.6	0	0	0	0	111.5	F852 Q853 H858 M859 F860 Y977 Q1387 A1390	F852-T856 VanDerWaalsContact O-CB 3.32Å; F852-T856 WeakPolarHBondContact O-CB 3.45Å; F852-T856 PolarHBondContact O-N 3.41Å; F852-T856 PolarHBondContact O-OG1 3.09Å; Q853-T856 WeakPolarHBondContact O-CB 3.36Å; Q853-T856 PolarHBondContact O-N 2.84Å; T856-H858 VanDerWaalsContact C-N 3.32Å; T856-H858 PolarHBondContact O-N 3.08Å; T856-M859 PolarHBondContact O-N 3.01Å; T856-F860 HydrophobicContact CG2-CD2 3.63Å; T856-F860 HydrophobicContact CG2-CE2 3.91Å; T856-F860 WeakPolarHBondContact O-CD2 3.39Å; T856-F860 PolarHBondContact O-N 3.34Å; T856-Y977 HydrophobicContact CG2-CE1 4.16Å; T856-Y977 HydrophobicContact CG2-CE2 3.94Å; T856-Q1387 HydrophobicContact CG2-CG 3.93Å; T856-Q1387 VanDerWaalsContact OG1-CA 3.23Å; T856-Q1387 WeakPolarHBondContact OG1-CA 3.39Å; T856-Q1387 WeakPolarHBondContact OG1-CB 3.48Å; T856-Q1387 WeakPolarHBondContact OG1-CG 3.38Å; T856-A1390 HydrophobicContact CG2-CB 4.24Å
857	E	88.4	Confident	86.6	Confident	6 Å²	6	17.8 Å²	17.8	3%	0.028	10%	0.095	C	C	.	.	H	α-helix	trans	-54.4	-48.9	173.7	-72	-176.2	-160	0	0	111.2	Q853 M859 G861 C862 V863 L864	Q853-E857 HydrophobicContact CG-CG 4.43Å; Q853-E857 WeakPolarHBondContact CG-OE1 3.32Å; Q853-E857 PolarHBondContact NE2-OE1 3.38Å; Q853-E857 WeakPolarHBondContact O-CG 3.38Å; Q853-E857 PolarHBondContact O-N 3.15Å; E857-M859 PolarHBondContact O-N 2.87Å; E857-G861 CarbonylContact O-C 3.31Å; E857-G861 PolarHBondContact O-N 3.06Å; E857-G861 VanDerWaalsContact O-N 3.09Å; E857-C862 CarbonylContact C-O 3.53Å; E857-C862 WeakPolarHBondContact CB-O 3.36Å; E857-C862 CarbonylContact O-C 3.55Å; E857-C862 PolarHBondContact O-N 3.12Å; E857-C862 VanDerWaalsContact O-O 3.07Å; E857-V863 WeakPolarHBondContact OE2-CA 3.48Å; E857-L864 PolarHBondContact OE2-N 3.34Å
858	H	86	Confident	85.6	Confident	13 Å²	13	17.7 Å²	17.7	6%	0.06	10%	0.095	C	C	.	.	H	α-helix	trans	-64.7	-33.6	179	-175.9	-159.7	0	0	0	113.7	K854 A855 T856 V863 R918 E920 Y921 H1394	K854-H858 WeakPolarHBondContact O-CB 3.24Å; K854-H858 PolarHBondContact O-N 3.32Å; A855-H858 PolarHBondContact O-N 3.35Å; T856-H858 VanDerWaalsContact C-N 3.32Å; T856-H858 PolarHBondContact O-N 3.08Å; H858-V863 HydrophobicContact CB-CG2 3.95Å; H858-R918 PolarHBondContact O-NH2 3.25Å; H858-E920 IonicContact NE2-OE2 2.7Å; H858-Y921 PolarHBondContact CE1-O 2.92Å; H858-Y921 PolarHBondContact ND1-O 3.46Å; H858-H1394 AromaticContact CE1-NE2 3.86Å; H858-H1394 AromaticContact ND1-CD2 3.25Å; H858-H1394 PolarHBondContact ND1-CD2 2.86Å; H858-H1394 VanDerWaalsContact ND1-CD2 3.25Å; H858-H1394 AromaticContact ND1-NE2 3Å; H858-H1394 PolarHBondContact ND1-NE2 3.24Å
859	M	82.3	Confident	85.2	Confident	54 Å²	54	17.1 Å²	17.1	27%	0.266	9%	0.093	S	C	.	.	H	α-helix	trans	-81.8	-41.4	-180	-67.9	-61	84.7	0	0	113.8	A855 T856 E857 A1390 L1393 H1394	A855-M859 WeakPolarHBondContact O-CB 3.44Å; A855-M859 VanDerWaalsContact O-CG 3.29Å; A855-M859 WeakPolarHBondContact O-CG 3.43Å; A855-M859 PolarHBondContact O-N 3.02Å; T856-M859 PolarHBondContact O-N 3.01Å; E857-M859 PolarHBondContact O-N 2.87Å; M859-A1390 HydrophobicContact CB-CB 4.13Å; M859-A1390 HydrophobicContact CG-CB 4.38Å; M859-L1393 HydrophobicContact CG-CB 4.49Å; M859-L1393 HydrophobicContact SD-CB 4.32Å; M859-H1394 HydrophobicContact CG-CB 3.81Å; M859-H1394 HydrophobicContact SD-CB 4.08Å
860	F	79.5	Confident	85.3	Confident	55 Å²	55	16.1 Å²	16.1	24%	0.241	8%	0.082	C	C	.	.	H	α-helix	trans	-81.1	-22.2	-179.2	-75.5	-74.4	0	0	0	114.2	T856 Y974 L1386 A1390	T856-F860 HydrophobicContact CG2-CD2 3.63Å; T856-F860 HydrophobicContact CG2-CE2 3.91Å; T856-F860 WeakPolarHBondContact O-CD2 3.39Å; T856-F860 PolarHBondContact O-N 3.34Å; F860-Y974 HydrophobicContact CB-CD2 4.09Å; F860-L1386 HydrophobicContact CE1-CD1 4.1Å; F860-L1386 HydrophobicContact CE2-CD1 3.94Å; F860-L1386 HydrophobicContact CE2-CD2 4.22Å; F860-L1386 HydrophobicContact CE2-CG 3.69Å; F860-L1386 HydrophobicContact CZ-CD1 3.37Å; F860-L1386 HydrophobicContact CZ-CD2 4.36Å; F860-L1386 HydrophobicContact CZ-CG 3.69Å; F860-A1390 HydrophobicContact CD2-CB 4.36Å; F860-A1390 HydrophobicContact CE2-CB 3.84Å
861	G	80.1	Confident	85.5	Confident	3 Å²	3	15.5 Å²	15.5	3%	0.031	8%	0.079	C	C	.	.	S	Bend	trans	-166.1	-84.8	176.9	0	0	0	0	0	113.6	E857 R918 S969	E857-G861 CarbonylContact O-C 3.31Å; E857-G861 PolarHBondContact O-N 3.06Å; E857-G861 VanDerWaalsContact O-N 3.09Å; G861-R918 VanDerWaalsContact O-CZ 3.23Å; G861-R918 PolarHBondContact O-NE 3Å; G861-R918 PolarHBondContact O-NH2 3.39Å; G861-S969 WeakPolarHBondContact CA-O 3.48Å
862	C	86.6	Confident	85.7	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.079	C	C	.	.			trans	-150.2	163.6	-179.3	53.7	0	0	0	0	110.4	E857 L913 R918 Y974	E857-C862 CarbonylContact C-O 3.53Å; E857-C862 WeakPolarHBondContact CB-O 3.36Å; E857-C862 CarbonylContact O-C 3.55Å; E857-C862 PolarHBondContact O-N 3.12Å; E857-C862 VanDerWaalsContact O-O 3.07Å; C862-L913 HydrophobicContact CB-CD2 3.97Å; C862-L913 VanDerWaalsContact SG-CD2 3.51Å; C862-R918 HydrophobicContact CB-CG 3.97Å; C862-Y974 VanDerWaalsContact O-CE2 3.31Å; C862-Y974 WeakPolarHBondContact O-CE2 3.28Å; C862-Y974 VanDerWaalsContact O-CZ 3.29Å; C862-Y974 PolarHBondContact O-OH 2.83Å
863	V	88.8	Confident	85.9	Confident	1 Å²	1	15.5 Å²	15.5	1%	0.006	8%	0.08	C	C	.	.			trans	-79.7	139	171.9	-173	0	0	0	0	109.5	K854 E857 H858 C865 V919	K854-V863 HydrophobicContact CG-CG1 4.49Å; E857-V863 WeakPolarHBondContact OE2-CA 3.48Å; H858-V863 HydrophobicContact CB-CG2 3.95Å; V863-C865 WeakPolarHBondContact CG1-O 3.49Å; V863-V919 HydrophobicContact CB-CG1 4.21Å; V863-V919 PolarHBondContact N-O 2.8Å; V863-V919 WeakPolarHBondContact O-CB 3.45Å
864	L	87.2	Confident	86.2	Confident	9 Å²	9	12.1 Å²	12.1	5%	0.047	6%	0.063	C	C	.	.	S	Bend	trans	-78.2	-21.6	-178.8	-71	-170.1	0	0	0	114.5	E857 C909 L913 I953 L956 Y974 Q978	E857-L864 PolarHBondContact OE2-N 3.34Å; L864-C909 WeakPolarHBondContact O-CB 3.37Å; L864-L913 HydrophobicContact CD2-CD1 3.82Å; L864-I953 HydrophobicContact CD1-CD1 4.23Å; L864-I953 HydrophobicContact CD1-CG1 3.81Å; L864-L956 HydrophobicContact CD2-CD2 3.52Å; L864-Y974 HydrophobicContact CD2-CE1 4.25Å; L864-Y974 VanDerWaalsContact CD2-OH 3.23Å; L864-Y974 WeakPolarHBondContact CD2-OH 3.47Å; L864-Y974 WeakPolarHBondContact CG-OH 3.39Å; L864-Q978 HydrophobicContact CD1-CG 4.3Å
865	C	86.4	Confident	86.4	Confident	24 Å²	24	10.5 Å²	10.5	16%	0.162	6%	0.057	C	C	.	.			trans	-145.6	128.8	-177.7	-174.2	0	0	0	0	111.9	V863 R906	V863-C865 WeakPolarHBondContact CG1-O 3.49Å; C865-R906 HydrophobicContact CB-CB 4.36Å; C865-R906 HydrophobicContact CB-CG 4.18Å
866	A	84.7	Confident	86.5	Confident	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.067	C	C	.	.			trans	-96	106.7	164.6	0	0	0	0	0	107.6	A825 C827 S871 F873 C909 V919	A825-A866 HydrophobicContact CB-CB 4.32Å; C827-A866 HydrophobicContact CB-CB 3.98Å; A866-S871 WeakPolarHBondContact CB-OG 3.31Å; A866-F873 HydrophobicContact CB-CZ 4.11Å; A866-C909 PolarHBondContact N-SG 2.94Å; A866-V919 HydrophobicContact CB-CG1 4.07Å
867	P	76.2	Confident	86.6	Confident	30 Å²	30	11.8 Å²	11.8	20%	0.195	7%	0.067	C	C	.	.			trans	-65.4	135.9	-176.1	27.3	-35.8	0	0	0	111.2	C869 F870 S871	P867-C869 PolarHBondContact O-N 2.93Å; P867-C869 VanDerWaalsContact O-N 3.13Å; P867-F870 PolarHBondContact O-N 3.15Å; P867-S871 WeakPolarHBondContact O-CB 3.49Å; P867-S871 PolarHBondContact O-OG 3.38Å
868	G	69.6	Low	86.7	Confident	2 Å²	2	11.6 Å²	11.6	2%	0.021	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-29.6	-171.2	0	0	0	0	0	114.8	T798 L799 F870 D905	T798-G868 CarbonylContact C-O 3.57Å; T798-G868 VanDerWaalsContact CB-O 3.31Å; T798-G868 WeakPolarHBondContact CB-O 3.07Å; T798-G868 PolarHBondContact OG1-O 3.4Å; L799-G868 PolarHBondContact N-O 2.8Å; G868-F870 VanDerWaalsContact C-N 3.3Å; G868-F870 PolarHBondContact O-N 2.89Å; G868-D905 WeakPolarHBondContact CA-OD2 3.47Å; G868-D905 PolarHBondContact N-OD2 3.09Å
869	C	82.2	Confident	86.7	Confident	13 Å²	13	13.2 Å²	13.2	9%	0.088	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.8	-176.5	54.2	0	0	0	0	115.8	D800 M830 P867	D800-C869 HydrophobicContact CB-CB 3.95Å; D800-C869 WeakPolarHBondContact OD2-CA 3.26Å; D800-C869 WeakPolarHBondContact OD2-CB 3.47Å; D800-C869 PolarHBondContact OD2-N 3.46Å; M830-C869 HydrophobicContact CE-CB 4.23Å; P867-C869 PolarHBondContact O-N 2.93Å; P867-C869 VanDerWaalsContact O-N 3.13Å
870	F	91.4	Very high	86.8	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	76.2	175.8	-165.2	-120	0	0	0	112.1	L797 L799 F805 V810 L813 G828 M830 P867 G868 S925 A927	L797-F870 HydrophobicContact CD1-CD2 4.03Å; L797-F870 HydrophobicContact CD1-CE2 3.95Å; L797-F870 HydrophobicContact CD2-CE2 4.44Å; L799-F870 HydrophobicContact CD2-CD2 3.88Å; L799-F870 HydrophobicContact CD2-CE2 4.48Å; F805-F870 HydrophobicContact CB-CD2 4.33Å; F805-F870 HydrophobicContact CB-CE2 3.85Å; F805-F870 HydrophobicContact CB-CZ 4.07Å; F805-F870 AromaticContact CD1-CD2 3.93Å; F805-F870 HydrophobicContact CD1-CD2 3.93Å; F805-F870 AromaticContact CD1-CE2 3.74Å; F805-F870 HydrophobicContact CD1-CE2 3.74Å; F805-F870 AromaticContact CD2-CE2 3.64Å; F805-F870 HydrophobicContact CD2-CE2 3.64Å; F805-F870 HydrophobicContact CD2-CZ 4.09Å; F805-F870 HydrophobicContact CE1-CD2 4.41Å; F805-F870 HydrophobicContact CE1-CE2 4.19Å; F805-F870 HydrophobicContact CE2-CE2 4.1Å; F805-F870 HydrophobicContact CG-CD2 4.05Å; F805-F870 AromaticContact CG-CE2 3.45Å; F805-F870 HydrophobicContact CG-CE2 3.45Å; F805-F870 VanDerWaalsContact CG-CE2 3.45Å; F805-F870 HydrophobicContact CG-CZ 4.06Å; F805-F870 HydrophobicContact CZ-CE2 4.36Å; V810-F870 HydrophobicContact CG2-CE2 3.89Å; V810-F870 HydrophobicContact CG2-CZ 3.8Å; L813-F870 HydrophobicContact CD1-CD1 4.21Å; L813-F870 HydrophobicContact CD1-CE1 3.76Å; L813-F870 HydrophobicContact CD1-CZ 4.01Å; G828-F870 PolarHBondContact N-O 3.42Å; M830-F870 HydrophobicContact CE-CB 4.22Å; M830-F870 HydrophobicContact SD-CB 3.56Å; M830-F870 VanDerWaalsContact SD-CB 3.56Å; M830-F870 HydrophobicContact SD-CG 4.49Å; P867-F870 PolarHBondContact O-N 3.15Å; G868-F870 VanDerWaalsContact C-N 3.3Å; G868-F870 PolarHBondContact O-N 2.89Å; F870-S925 WeakPolarHBondContact CE1-OG 3.42Å; F870-A927 HydrophobicContact CB-CB 4.03Å; F870-A927 HydrophobicContact CD1-CB 3.55Å; F870-A927 HydrophobicContact CD2-CB 4.25Å; F870-A927 HydrophobicContact CE1-CB 4.03Å; F870-A927 HydrophobicContact CG-CB 3.69Å
871	S	93.1	Very high	86.4	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143.5	-179.7	-69.6	0	0	0	0	112.3	L797 T798 C827 A866 P867	L797-S871 CarbonylContact C-O 3.06Å; L797-S871 WeakPolarHBondContact CA-O 3.13Å; T798-S871 PolarHBondContact N-O 2.9Å; T798-S871 PolarHBondContact O-N 3.44Å; T798-S871 PolarHBondContact OG1-O 2.86Å; C827-S871 VanDerWaalsContact CB-OG 3.28Å; C827-S871 WeakPolarHBondContact CB-OG 3.41Å; A866-S871 WeakPolarHBondContact CB-OG 3.31Å; P867-S871 WeakPolarHBondContact O-CB 3.49Å; P867-S871 PolarHBondContact O-OG 3.38Å
872	L	94.1	Very high	86.3	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	113.1	-175.6	-172.9	69.1	0	0	0	110	L630 Y795 I796 L797 L813 V814 M817 A825 A826	L630-L872 HydrophobicContact CD1-CD1 3.55Å; Y795-L872 HydrophobicContact CG-CG 4.46Å; I796-L872 CarbonylContact O-C 3.36Å; I796-L872 WeakPolarHBondContact O-CA 3.37Å; L797-L872 HydrophobicContact CB-CD1 3.89Å; L797-L872 HydrophobicContact CD1-CD1 4.41Å; L813-L872 HydrophobicContact CB-CB 4.17Å; L813-L872 HydrophobicContact CB-CD2 3.67Å; L813-L872 HydrophobicContact CD1-CB 4.16Å; V814-L872 HydrophobicContact CG2-CD2 3.76Å; M817-L872 WeakPolarHBondContact CE-O 3.46Å; M817-L872 HydrophobicContact CG-CD2 3.83Å; M817-L872 HydrophobicContact CG-CG 4.34Å; A825-L872 CarbonylContact C-O 3.54Å; A825-L872 VanDerWaalsContact CA-O 3.25Å; A825-L872 WeakPolarHBondContact CA-O 3.46Å; A826-L872 PolarHBondContact N-O 3.02Å; A826-L872 PolarHBondContact O-N 3.13Å
873	F	94.7	Very high	86.4	Confident	5 Å²	5	19 Å²	19	2%	0.022	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	148.9	-179	-65.8	-100.4	0	0	0	111.4	Y795 I796 T798 G824 A825 A866 L878 L908 L912	Y795-F873 CarbonylContact C-O 3.55Å; Y795-F873 WeakPolarHBondContact CA-O 3.41Å; Y795-F873 WeakPolarHBondContact CB-O 3.45Å; I796-F873 PolarHBondContact N-O 3.14Å; I796-F873 PolarHBondContact O-N 2.66Å; T798-F873 HydrophobicContact CG2-CD2 3.74Å; T798-F873 HydrophobicContact CG2-CE2 3.69Å; G824-F873 CarbonylContact O-C 3.58Å; G824-F873 WeakPolarHBondContact O-CA 3.41Å; A825-F873 HydrophobicContact CB-CD1 3.55Å; A825-F873 HydrophobicContact CB-CE1 3.69Å; A825-F873 HydrophobicContact CB-CG 4.07Å; A825-F873 HydrophobicContact CB-CZ 4.32Å; A866-F873 HydrophobicContact CB-CZ 4.11Å; F873-L878 HydrophobicContact CB-CD1 3.9Å; F873-L878 HydrophobicContact CB-CD2 4.49Å; F873-L878 HydrophobicContact CB-CG 4.29Å; F873-L878 HydrophobicContact CD1-CD2 4.13Å; F873-L908 HydrophobicContact CD1-CD2 4.28Å; F873-L908 HydrophobicContact CE1-CD2 3.7Å; F873-L908 HydrophobicContact CE1-CG 4.2Å; F873-L908 HydrophobicContact CZ-CD2 3.94Å; F873-L912 HydrophobicContact CD1-CD1 3.83Å; F873-L912 HydrophobicContact CE1-CD1 3.87Å
874	R	93.9	Very high	86.3	Confident	6 Å²	6	19.7 Å²	19.7	2%	0.023	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.1	174.7	-172.1	-173.6	-55.8	-84.3	-5.1	110.6	E792 Y795 M817 N820 R821 L823 G824 A876 A877 L878	E792-R874 PolarHBondContact O-NH1 3.43Å; Y795-R874 HydrophobicContact CD1-CB 4.17Å; Y795-R874 HydrophobicContact CD1-CG 4.36Å; Y795-R874 HydrophobicContact CE1-CB 4.17Å; Y795-R874 HydrophobicContact CE1-CG 4.04Å; Y795-R874 PolarHBondContact OH-NH1 3.47Å; M817-R874 HydrophobicContact CE-CB 3.81Å; M817-R874 PolarHBondContact O-NH2 2.69Å; N820-R874 PolarHBondContact O-NH2 3.5Å; R821-R874 PolarHBondContact O-NE 3.24Å; L823-R874 PolarHBondContact O-NE 3.48Å; L823-R874 PolarHBondContact O-NH2 2.81Å; L823-R874 VanDerWaalsContact O-NH2 3.14Å; G824-R874 PolarHBondContact O-N 3.31Å; R874-A876 HydrophobicContact CG-CB 4.28Å; R874-A876 PolarHBondContact O-N 3.39Å; R874-A877 HydrophobicContact CB-CB 4.16Å; R874-A877 PolarHBondContact O-N 2.92Å; R874-L878 PolarHBondContact O-N 2.62Å
875	S	92.5	Very high	86.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-54.3	-47.8	177.7	-68.1	0	0	0	0	112.9	L773 A791 T794 A877 L878 M879	L773-S875 VanDerWaalsContact CD2-CB 3.44Å; L773-S875 VanDerWaalsContact CD2-OG 3.22Å; L773-S875 WeakPolarHBondContact CD2-OG 3.41Å; A791-S875 WeakPolarHBondContact O-CB 3.46Å; T794-S875 WeakPolarHBondContact CB-OG 3.28Å; T794-S875 WeakPolarHBondContact CG2-OG 3.45Å; T794-S875 PolarHBondContact O-N 3.28Å; T794-S875 PolarHBondContact O-OG 3.35Å; S875-A877 PolarHBondContact O-N 2.85Å; S875-A877 VanDerWaalsContact O-N 3.15Å; S875-L878 PolarHBondContact O-N 3Å; S875-L878 VanDerWaalsContact O-N 3.16Å; S875-M879 WeakPolarHBondContact O-CG 3.49Å; S875-M879 PolarHBondContact O-N 3.4Å
876	A	89	Confident	86.3	Confident	27 Å²	27	32.2 Å²	32.2	22%	0.223	16%	0.155	C	C	.	.	H	α-helix	trans	-58.8	-24.8	176.2	0	0	0	0	0	114.8	A791 E792 R874	A791-A876 HydrophobicContact CB-CB 3.92Å; A791-A876 WeakPolarHBondContact O-CB 3.37Å; A791-A876 PolarHBondContact O-N 2.85Å; E792-A876 HydrophobicContact CG-CB 4.27Å; R874-A876 HydrophobicContact CG-CB 4.28Å; R874-A876 PolarHBondContact O-N 3.39Å
877	A	91.4	Very high	86.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-86.5	-30.2	178.1	0	0	0	0	0	112.6	R874 S875 L912 Y917	R874-A877 HydrophobicContact CB-CB 4.16Å; R874-A877 PolarHBondContact O-N 2.92Å; S875-A877 PolarHBondContact O-N 2.85Å; S875-A877 VanDerWaalsContact O-N 3.15Å; A877-L912 HydrophobicContact CB-CD2 3.86Å; A877-L912 WeakPolarHBondContact O-CD2 3.47Å; A877-Y917 HydrophobicContact CB-CD1 3.6Å; A877-Y917 HydrophobicContact CB-CD2 4.17Å; A877-Y917 HydrophobicContact CB-CE1 3.67Å; A877-Y917 HydrophobicContact CB-CE2 4.23Å; A877-Y917 HydrophobicContact CB-CG 3.89Å
878	L	90.8	Very high	87	Confident	1 Å²	1	31 Å²	31	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-73.7	-33.6	174.2	-67	174	0	0	0	112.3	M769 L773 I796 F873 R874 S875 D880 V883 L884 L908	M769-L878 HydrophobicContact CE-CD2 4.46Å; M769-L878 HydrophobicContact SD-CD2 4.42Å; L773-L878 HydrophobicContact CD1-CB 3.7Å; L773-L878 HydrophobicContact CD1-CD1 4.1Å; I796-L878 HydrophobicContact CD1-CD1 4.03Å; F873-L878 HydrophobicContact CB-CD1 3.9Å; F873-L878 HydrophobicContact CB-CD2 4.49Å; F873-L878 HydrophobicContact CB-CG 4.29Å; F873-L878 HydrophobicContact CD1-CD2 4.13Å; R874-L878 PolarHBondContact O-N 2.62Å; S875-L878 PolarHBondContact O-N 3Å; S875-L878 VanDerWaalsContact O-N 3.16Å; L878-D880 VanDerWaalsContact C-N 3.29Å; L878-D880 PolarHBondContact O-N 3.25Å; L878-V883 HydrophobicContact CD2-CG1 4.46Å; L878-L884 WeakPolarHBondContact O-CB 3.34Å; L878-L884 PolarHBondContact O-N 3.46Å; L878-L908 HydrophobicContact CD2-CD1 3.96Å; L878-L908 HydrophobicContact CD2-CD2 4.36Å; L878-L908 HydrophobicContact CD2-CG 4.43Å
879	M	86	Confident	87.9	Confident	48 Å²	48	33.6 Å²	33.6	24%	0.236	16%	0.163	C	C	.	.	S	Bend	trans	-79	-1.3	-179.5	-67.4	-168.1	-55.7	0	0	115.3	L773 L777 M778 A791 S875 D881	L773-M879 HydrophobicContact CB-CG 3.77Å; L773-M879 HydrophobicContact CB-SD 3.8Å; L773-M879 HydrophobicContact CD1-CG 3.95Å; L773-M879 HydrophobicContact CD2-CG 4.38Å; L773-M879 HydrophobicContact CD2-SD 4.44Å; L773-M879 HydrophobicContact CG-CG 4.26Å; L777-M879 HydrophobicContact CD2-CE 3.7Å; L777-M879 HydrophobicContact CD2-SD 3.83Å; M778-M879 HydrophobicContact CE-CE 3.64Å; M778-M879 HydrophobicContact CE-SD 3.73Å; M778-M879 HydrophobicContact CG-SD 3.9Å; M778-M879 HydrophobicContact SD-CE 4.44Å; M778-M879 HydrophobicContact SD-SD 4.12Å; A791-M879 HydrophobicContact CB-CE 3.35Å; S875-M879 WeakPolarHBondContact O-CG 3.49Å; S875-M879 PolarHBondContact O-N 3.4Å; M879-D881 PolarHBondContact O-N 2.81Å
880	D	84	Confident	87.8	Confident	38 Å²	38	34.9 Å²	34.9	20%	0.203	17%	0.171	C	C	.	.	S	Bend	trans	-58.1	130.4	171.8	-169.8	-53.4	0	0	0	109.3	L878 N882 V883 R915 Y917	L878-D880 VanDerWaalsContact C-N 3.29Å; L878-D880 PolarHBondContact O-N 3.25Å; D880-N882 PolarHBondContact O-N 3.42Å; D880-V883 HydrophobicContact CB-CG2 3.99Å; D880-V883 PolarHBondContact O-N 3.41Å; D880-R915 WeakPolarHBondContact OD1-CD 3.42Å; D880-R915 IonicContact OD1-NH1 3.33Å; D880-Y917 HydrophobicContact CB-CE2 4.05Å; D880-Y917 WeakPolarHBondContact OD2-CE2 3.17Å; D880-Y917 PolarHBondContact OD2-OH 3.07Å
881	D	72.2	Confident	87.3	Confident	126 Å²	126	35.2 Å²	35.2	67%	0.674	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-17.4	-166	-74.7	-39.3	0	0	0	116	M879 R885	M879-D881 PolarHBondContact O-N 2.81Å; D881-R885 VanDerWaalsContact O-CB 3.27Å; D881-R885 WeakPolarHBondContact O-CB 3.42Å
882	N	78.1	Confident	86.7	Confident	69 Å²	69	41.4 Å²	41.4	37%	0.369	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	1.4	-173.6	-64.5	-121	0	0	0	113.1	D880 R886 R915	D880-N882 PolarHBondContact O-N 3.42Å; N882-R886 WeakPolarHBondContact O-CB 3.46Å; N882-R915 VanDerWaalsContact CG-NH2 3.26Å; N882-R915 PolarHBondContact ND2-NH1 2.81Å; N882-R915 PolarHBondContact OD1-NH2 2.82Å; N882-R915 VanDerWaalsContact OD1-NH2 3.12Å
883	V	88.4	Confident	86.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-79	168.4	-178.4	0	0	0	0	108.3	L878 D880 R885 R886 Y887 L908 L911 L912 R915	L878-V883 HydrophobicContact CD2-CG1 4.46Å; D880-V883 HydrophobicContact CB-CG2 3.99Å; D880-V883 PolarHBondContact O-N 3.41Å; V883-R885 PolarHBondContact O-N 2.81Å; V883-R886 PolarHBondContact O-N 3.09Å; V883-R886 VanDerWaalsContact O-N 3.1Å; V883-Y887 WeakPolarHBondContact O-CB 3.43Å; V883-Y887 PolarHBondContact O-N 2.67Å; V883-L908 HydrophobicContact CG1-CD1 4.07Å; V883-L911 HydrophobicContact CG1-CB 4.39Å; V883-L912 HydrophobicContact CG1-CD2 4.14Å; V883-L912 HydrophobicContact CG1-CG 4.23Å; V883-L912 HydrophobicContact CG2-CD2 4.18Å; V883-R915 HydrophobicContact CG2-CB 4.28Å; V883-R915 HydrophobicContact CG2-CG 3.74Å
884	L	86.3	Confident	85.5	Confident	15 Å²	15	44 Å²	44	8%	0.079	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-42.8	-174.5	-179.7	57.2	0	0	0	113	M769 Y770 L878 R886 Y887 A888	M769-L884 HydrophobicContact CB-CD1 3.61Å; M769-L884 HydrophobicContact CB-CD2 4.2Å; M769-L884 HydrophobicContact CG-CD1 4.35Å; M769-L884 HydrophobicContact SD-CD1 3.87Å; Y770-L884 HydrophobicContact CD1-CD2 4.37Å; Y770-L884 HydrophobicContact CD2-CD1 3.89Å; Y770-L884 HydrophobicContact CD2-CD2 3.95Å; Y770-L884 HydrophobicContact CD2-CG 4.03Å; Y770-L884 HydrophobicContact CE1-CD2 4.28Å; Y770-L884 HydrophobicContact CE2-CD1 3.64Å; Y770-L884 HydrophobicContact CE2-CD2 3.85Å; Y770-L884 HydrophobicContact CE2-CG 3.52Å; Y770-L884 HydrophobicContact CG-CD2 4.22Å; L878-L884 WeakPolarHBondContact O-CB 3.34Å; L878-L884 PolarHBondContact O-N 3.46Å; L884-R886 VanDerWaalsContact C-N 3.32Å; L884-R886 PolarHBondContact O-N 3.1Å; L884-Y887 PolarHBondContact O-N 3.05Å; L884-A888 WeakPolarHBondContact O-CB 3.25Å; L884-A888 PolarHBondContact O-N 3.19Å
885	R	86	Confident	85	Confident	182 Å²	182	48.1 Å²	48.1	69%	0.687	24%	0.243	S	C	*	.	H	α-helix	trans	-60.3	-39.3	177.6	-176.7	-179.9	173.7	174.4	-0.3	112.7	D881 V883	D881-R885 VanDerWaalsContact O-CB 3.27Å; D881-R885 WeakPolarHBondContact O-CB 3.42Å; V883-R885 PolarHBondContact O-N 2.81Å
886	R	87.5	Confident	84.6	Confident	114 Å²	114	49.3 Å²	49.3	43%	0.43	25%	0.249	S	C	.	.	H	α-helix	trans	-79	-36.8	178.7	-167.1	163.4	178	-179.3	-3.9	111	N882 V883 L884 A888 T889 W907 L911	N882-R886 WeakPolarHBondContact O-CB 3.46Å; V883-R886 PolarHBondContact O-N 3.09Å; V883-R886 VanDerWaalsContact O-N 3.1Å; L884-R886 VanDerWaalsContact C-N 3.32Å; L884-R886 PolarHBondContact O-N 3.1Å; R886-A888 PolarHBondContact O-N 3.35Å; R886-T889 PolarHBondContact O-N 3.28Å; R886-T889 PolarHBondContact O-OG1 3.33Å; R886-W907 HydrophobicContact CG-CZ2 4.39Å; R886-W907 WeakPolarHBondContact O-CH2 3.13Å; R886-L911 HydrophobicContact CB-CD1 4.37Å; R886-L911 HydrophobicContact CB-CD2 4.14Å; R886-L911 HydrophobicContact CG-CD2 3.94Å
887	Y	89.7	Confident	84.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-26.8	173.8	-171.7	-100.5	0	0	0	113	R762 Q765 V766 M769 V883 L884 W907 L908 L911	R762-Y887 HydrophobicContact CG-CE1 4.24Å; R762-Y887 PolarHBondContact NE-O 2.7Å; R762-Y887 PolarHBondContact NH2-O 3.47Å; Q765-Y887 HydrophobicContact CB-CE1 4.09Å; Q765-Y887 PolarHBondContact OE1-OH 3.5Å; V766-Y887 HydrophobicContact CG2-CD1 3.74Å; V766-Y887 HydrophobicContact CG2-CE1 3.75Å; M769-Y887 HydrophobicContact SD-CD1 4.49Å; V883-Y887 WeakPolarHBondContact O-CB 3.43Å; V883-Y887 PolarHBondContact O-N 2.67Å; L884-Y887 PolarHBondContact O-N 3.05Å; Y887-W907 HydrophobicContact CD2-CD2 4.38Å; Y887-W907 AromaticContact CD2-CE3 3.5Å; Y887-W907 HydrophobicContact CD2-CE3 3.5Å; Y887-W907 AromaticContact CD2-CZ3 3.61Å; Y887-W907 HydrophobicContact CD2-CZ3 3.61Å; Y887-W907 AromaticContact CE2-CE3 3.75Å; Y887-W907 HydrophobicContact CE2-CE3 3.75Å; Y887-W907 HydrophobicContact CE2-CZ3 4.08Å; Y887-W907 HydrophobicContact CG-CE3 4.49Å; Y887-W907 HydrophobicContact CG-CZ3 4.19Å; Y887-W907 WeakPolarHBondContact O-CZ3 3.2Å; Y887-L908 HydrophobicContact CD2-CB 4.04Å; Y887-L908 HydrophobicContact CD2-CD1 3.87Å; Y887-L908 HydrophobicContact CE2-CB 3.83Å; Y887-L908 HydrophobicContact CE2-CD1 4.26Å; Y887-L908 HydrophobicContact CG-CD1 4.05Å; Y887-L911 HydrophobicContact CD2-CD1 4.33Å
888	A	86.9	Confident	83.9	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.033	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	1.1	178.1	0	0	0	0	0	115.9	W763 V766 Y770 L884 R886 Y1286	W763-A888 WeakPolarHBondContact CH2-O 3.38Å; V766-A888 HydrophobicContact CG1-CB 4.04Å; V766-A888 HydrophobicContact CG2-CB 4.33Å; Y770-A888 HydrophobicContact CE2-CB 4.09Å; L884-A888 WeakPolarHBondContact O-CB 3.25Å; L884-A888 PolarHBondContact O-N 3.19Å; R886-A888 PolarHBondContact O-N 3.35Å; A888-Y1286 HydrophobicContact CB-CD1 4.03Å; A888-Y1286 HydrophobicContact CB-CE1 4.26Å
889	T	87.1	Confident	83.6	Confident	57 Å²	57	50.2 Å²	50.2	35%	0.35	25%	0.248	S	C	.	.			trans	-70.3	147.8	-179.1	58.4	0	0	0	0	112.6	R762 R886	R762-T889 PolarHBondContact NH2-O 2.83Å; R886-T889 PolarHBondContact O-N 3.28Å; R886-T889 PolarHBondContact O-OG1 3.33Å
890	T	80.9	Confident	83.5	Confident	41 Å²	41	49 Å²	49	25%	0.252	24%	0.241	S	C	.	.			trans	-57.3	152.8	168.9	27.5	0	0	0	0	112	E892 M1290	T890-E892 PolarHBondContact OG1-OE1 3.41Å; T890-M1290 HydrophobicContact CG2-CE 4.13Å; T890-M1290 HydrophobicContact CG2-SD 3.51Å; T890-M1290 VanDerWaalsContact CG2-SD 3.51Å
891	A	82	Confident	83.2	Confident	7 Å²	7	47.7 Å²	47.7	6%	0.058	23%	0.234	C	C	.	.			trans	-93.5	113.8	168.3	0	0	0	0	0	107.3	D896 Y897 Y900	A891-D896 HydrophobicContact CB-CB 3.68Å; A891-Y897 HydrophobicContact CB-CD1 4.16Å; A891-Y897 HydrophobicContact CB-CD2 4.01Å; A891-Y897 HydrophobicContact CB-CE1 4.03Å; A891-Y897 HydrophobicContact CB-CE2 3.84Å; A891-Y897 HydrophobicContact CB-CG 4.16Å; A891-Y897 WeakPolarHBondContact O-CE2 3.45Å; A891-Y897 PolarHBondContact O-OH 2.93Å; A891-Y900 HydrophobicContact CB-CD2 4.33Å
892	E	80.4	Confident	83.4	Confident	130 Å²	130	42 Å²	42	61%	0.607	20%	0.203	S	C	*	.			trans	-110.9	-41	-172	-74.7	161.7	-149.1	0	0	110.7	T890 D896	T890-E892 PolarHBondContact OG1-OE1 3.41Å; E892-D896 PolarHBondContact N-OD2 2.85Å
893	A	82.5	Confident	83.5	Confident	49 Å²	49	38.9 Å²	38.9	41%	0.405	19%	0.187	S	C	.	.	S	Bend	trans	-90.5	153.1	174.3	0	0	0	0	0	112.3	K895 D896 Y897	A893-K895 PolarHBondContact O-N 3.26Å; A893-K895 VanDerWaalsContact O-N 3.09Å; A893-D896 PolarHBondContact N-OD2 3.03Å; A893-D896 VanDerWaalsContact O-CB 3.29Å; A893-D896 WeakPolarHBondContact O-CB 3.29Å; A893-D896 PolarHBondContact O-N 3.37Å; A893-Y897 WeakPolarHBondContact O-CD2 3.48Å
894	A	80.5	Confident	83.3	Confident	11 Å²	11	39 Å²	39	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-53.1	-32.8	174.6	0	0	0	0	0	113.8	D1303 L1304 L1307	A894-D1303 HydrophobicContact CB-CB 3.99Å; A894-L1304 HydrophobicContact CB-CD2 3.95Å; A894-L1304 HydrophobicContact CB-CG 3.97Å; A894-L1304 WeakPolarHBondContact O-CD2 3.37Å; A894-L1307 HydrophobicContact CB-CB 4.46Å; A894-L1307 HydrophobicContact CB-CD2 3.91Å
895	K	83	Confident	83.4	Confident	92 Å²	92	39.3 Å²	39.3	40%	0.4	19%	0.189	S	C	.	.	H	α-helix	trans	-62.7	-38.7	173.7	-173.3	-163.9	167.5	-156.7	0	112.5	A893 Y897 I898 Q899 L1307	A893-K895 PolarHBondContact O-N 3.26Å; A893-K895 VanDerWaalsContact O-N 3.09Å; K895-Y897 VanDerWaalsContact C-N 3.32Å; K895-Y897 PolarHBondContact O-N 3.05Å; K895-I898 PolarHBondContact O-N 2.68Å; K895-I898 VanDerWaalsContact O-N 3.13Å; K895-Q899 PolarHBondContact O-N 3.33Å; K895-L1307 HydrophobicContact CB-CD2 4.49Å
896	D	84.3	Confident	83.5	Confident	25 Å²	25	32.9 Å²	32.9	13%	0.134	17%	0.165	C	C	.	.	H	α-helix	trans	-65.2	-36.5	-174.9	-63.8	-31.3	0	0	0	111.6	A891 E892 A893 I898 Q899 Y900	A891-D896 HydrophobicContact CB-CB 3.68Å; E892-D896 PolarHBondContact N-OD2 2.85Å; A893-D896 PolarHBondContact N-OD2 3.03Å; A893-D896 VanDerWaalsContact O-CB 3.29Å; A893-D896 WeakPolarHBondContact O-CB 3.29Å; A893-D896 PolarHBondContact O-N 3.37Å; D896-I898 PolarHBondContact O-N 2.91Å; D896-Q899 PolarHBondContact O-N 3.03Å; D896-Y900 HydrophobicContact CB-CD2 3.65Å; D896-Y900 HydrophobicContact CB-CE2 3.42Å; D896-Y900 VanDerWaalsContact CB-CE2 3.42Å; D896-Y900 HydrophobicContact CB-CG 4.42Å; D896-Y900 VanDerWaalsContact CG-CE2 3.4Å; D896-Y900 VanDerWaalsContact O-CB 3.31Å; D896-Y900 WeakPolarHBondContact O-CB 3.32Å; D896-Y900 PolarHBondContact O-N 3.21Å; D896-Y900 WeakPolarHBondContact OD1-CE2 3.49Å; D896-Y900 PolarHBondContact OD1-OH 3.44Å
897	Y	82.5	Confident	83.7	Confident	36 Å²	36	27.5 Å²	27.5	14%	0.141	15%	0.145	C	C	.	.	I	π-helix	trans	-61.3	-33	175.1	-74.2	-84	0	0	0	112.8	A891 A893 K895 D901 Q902 I1300	A891-Y897 HydrophobicContact CB-CD1 4.16Å; A891-Y897 HydrophobicContact CB-CD2 4.01Å; A891-Y897 HydrophobicContact CB-CE1 4.03Å; A891-Y897 HydrophobicContact CB-CE2 3.84Å; A891-Y897 HydrophobicContact CB-CG 4.16Å; A891-Y897 WeakPolarHBondContact O-CE2 3.45Å; A891-Y897 PolarHBondContact O-OH 2.93Å; A893-Y897 WeakPolarHBondContact O-CD2 3.48Å; K895-Y897 VanDerWaalsContact C-N 3.32Å; K895-Y897 PolarHBondContact O-N 3.05Å; Y897-D901 WeakPolarHBondContact O-CB 3.37Å; Y897-D901 PolarHBondContact O-N 3.34Å; Y897-Q902 PolarHBondContact O-N 2.85Å; Y897-I1300 HydrophobicContact CD2-CG2 4.04Å; Y897-I1300 HydrophobicContact CE2-CD1 4Å; Y897-I1300 HydrophobicContact CE2-CG1 4.3Å; Y897-I1300 HydrophobicContact CE2-CG2 3.77Å
898	I	82.9	Confident	83.8	Confident	9 Å²	9	27.5 Å²	27.5	5%	0.046	15%	0.145	C	C	.	.	I	π-helix	trans	-79.9	-37.1	177.8	-59.8	150.8	0	0	0	111.2	K895 D896 Q902 P947 A951 L1119 L1304 L1307	K895-I898 PolarHBondContact O-N 2.68Å; K895-I898 VanDerWaalsContact O-N 3.13Å; D896-I898 PolarHBondContact O-N 2.91Å; I898-Q902 WeakPolarHBondContact O-CB 3.18Å; I898-P947 HydrophobicContact CG2-CB 3.9Å; I898-A951 HydrophobicContact CG2-CB 4.31Å; I898-L1119 HydrophobicContact CD1-CD1 3.67Å; I898-L1119 HydrophobicContact CD1-CD2 3.85Å; I898-L1119 HydrophobicContact CD1-CG 3.62Å; I898-L1119 HydrophobicContact CG1-CD1 3.84Å; I898-L1119 HydrophobicContact CG1-CG 4.17Å; I898-L1119 HydrophobicContact CG2-CD1 3.94Å; I898-L1304 HydrophobicContact CD1-CD2 4.35Å; I898-L1307 HydrophobicContact CD1-CD2 3.53Å; I898-L1307 HydrophobicContact CD1-CG 4.47Å
899	Q	84.1	Confident	84.1	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.143	C	C	.	.	I	π-helix	trans	-82.5	-45.4	-177.6	-168.5	174	-16	0	0	112.8	K895 D896 G903 W907 A951 D955	K895-Q899 PolarHBondContact O-N 3.33Å; D896-Q899 PolarHBondContact O-N 3.03Å; Q899-G903 WeakPolarHBondContact O-CA 3.47Å; Q899-W907 HydrophobicContact CG-CG 4.48Å; Q899-A951 HydrophobicContact CB-CB 4.35Å; Q899-D955 VanDerWaalsContact NE2-CG 3.29Å; Q899-D955 PolarHBondContact NE2-OD2 2.82Å
900	Y	84.8	Confident	84.2	Confident	24 Å²	24	25 Å²	25	9%	0.094	13%	0.129	C	C	.	.	I	π-helix	trans	-93	-46.2	-170	-48.5	-19.5	0	0	0	112.4	A891 D896 E904 W907	A891-Y900 HydrophobicContact CB-CD2 4.33Å; D896-Y900 HydrophobicContact CB-CD2 3.65Å; D896-Y900 HydrophobicContact CB-CE2 3.42Å; D896-Y900 VanDerWaalsContact CB-CE2 3.42Å; D896-Y900 HydrophobicContact CB-CG 4.42Å; D896-Y900 VanDerWaalsContact CG-CE2 3.4Å; D896-Y900 VanDerWaalsContact O-CB 3.31Å; D896-Y900 WeakPolarHBondContact O-CB 3.32Å; D896-Y900 PolarHBondContact O-N 3.21Å; D896-Y900 WeakPolarHBondContact OD1-CE2 3.49Å; D896-Y900 PolarHBondContact OD1-OH 3.44Å; Y900-E904 WeakPolarHBondContact O-CA 3.48Å; Y900-E904 PolarHBondContact O-N 2.85Å; Y900-W907 AromaticContact CD1-CD2 3.45Å; Y900-W907 HydrophobicContact CD1-CD2 3.45Å; Y900-W907 VanDerWaalsContact CD1-CD2 3.45Å; Y900-W907 AromaticContact CD1-CE2 3.14Å; Y900-W907 AromaticContact CD1-CE3 3.86Å; Y900-W907 HydrophobicContact CD1-CE3 3.86Å; Y900-W907 HydrophobicContact CD1-CG 4.01Å; Y900-W907 AromaticContact CD1-CH2 3.66Å; Y900-W907 HydrophobicContact CD1-CH2 3.66Å; Y900-W907 AromaticContact CD1-CZ2 3.27Å; Y900-W907 HydrophobicContact CD1-CZ2 3.27Å; Y900-W907 AromaticContact CD1-CZ3 3.96Å; Y900-W907 HydrophobicContact CD1-CZ3 3.96Å; Y900-W907 AromaticContact CD1-NE1 3.58Å; Y900-W907 AromaticContact CD2-CH2 3.91Å; Y900-W907 HydrophobicContact CD2-CH2 3.91Å; Y900-W907 HydrophobicContact CD2-CZ2 4.13Å; Y900-W907 HydrophobicContact CD2-CZ3 4.42Å; Y900-W907 HydrophobicContact CE1-CD2 4.17Å; Y900-W907 AromaticContact CE1-CE2 3.4Å; Y900-W907 HydrophobicContact CE1-CH2 4.11Å; Y900-W907 AromaticContact CE1-CZ2 3.36Å; Y900-W907 HydrophobicContact CE1-CZ2 3.36Å; Y900-W907 AromaticContact CE1-NE1 3.52Å; Y900-W907 HydrophobicContact CE2-CH2 4.34Å; Y900-W907 HydrophobicContact CE2-CZ2 4.22Å; Y900-W907 HydrophobicContact CG-CD2 4.07Å; Y900-W907 AromaticContact CG-CE2 3.95Å; Y900-W907 AromaticContact CG-CE3 3.99Å; Y900-W907 HydrophobicContact CG-CE3 3.99Å; Y900-W907 AromaticContact CG-CH2 3.57Å; Y900-W907 HydrophobicContact CG-CH2 3.57Å; Y900-W907 AromaticContact CG-CZ2 3.71Å; Y900-W907 HydrophobicContact CG-CZ2 3.71Å; Y900-W907 AromaticContact CG-CZ3 3.76Å; Y900-W907 HydrophobicContact CG-CZ3 3.76Å; Y900-W907 AromaticContact CZ-CZ2 3.88Å
901	D	76.4	Confident	84.7	Confident	10 Å²	10	23.1 Å²	23.1	5%	0.053	12%	0.117	C	C	.	.	I	π-helix	trans	-92.9	-33.2	-171.4	-95.5	44.9	0	0	0	113.5	R760 R762 Y897	R760-D901 IonicContact CZ-OD2 3.95Å; R760-D901 IonicContact NH1-OD2 3.67Å; R760-D901 PolarHBondContact NH1-OD2 3.4Å; R762-D901 WeakPolarHBondContact CD-OD1 3.12Å; R762-D901 IonicContact CZ-OD1 3.65Å; R762-D901 IonicContact NE-OD1 3.7Å; R762-D901 IonicContact NH1-OD1 2.71Å; R762-D901 PolarHBondContact NH1-OD1 2.81Å; Y897-D901 WeakPolarHBondContact O-CB 3.37Å; Y897-D901 PolarHBondContact O-N 3.34Å
902	Q	78	Confident	85.2	Confident	7 Å²	7	22.8 Å²	22.8	3%	0.033	11%	0.114	C	C	.	.	S	Bend	trans	-85.2	-11.7	168.9	-74.9	-175.6	-8.2	0	0	113.5	Y897 I898 R944 S948 V1121 V1122	Y897-Q902 PolarHBondContact O-N 2.85Å; I898-Q902 WeakPolarHBondContact O-CB 3.18Å; Q902-R944 HydrophobicContact CB-CG 3.92Å; Q902-R944 HydrophobicContact CG-CG 4.21Å; Q902-R944 WeakPolarHBondContact O-CG 3.45Å; Q902-R944 PolarHBondContact O-NH1 2.83Å; Q902-S948 PolarHBondContact O-OG 2.84Å; Q902-V1121 PolarHBondContact NE2-O 3.45Å; Q902-V1122 HydrophobicContact CG-CG1 4.1Å
903	G	79	Confident	85.7	Confident	3 Å²	3	16.6 Å²	16.6	3%	0.031	9%	0.086	C	C	.	.	S	Bend	trans	-129.5	24.1	-168.1	0	0	0	0	0	115.2	Q899 D905 R906 W907	Q899-G903 WeakPolarHBondContact O-CA 3.47Å; G903-D905 PolarHBondContact O-N 2.66Å; G903-R906 PolarHBondContact O-N 3.39Å; G903-W907 WeakPolarHBondContact O-CB 3.4Å; G903-W907 PolarHBondContact O-N 2.84Å
904	E	85.6	Confident	86	Confident	2 Å²	2	15 Å²	15	1%	0.009	7%	0.07	C	C	.	.	H	α-helix	trans	-51.1	-53.7	-162.7	74.4	-68.2	-180	0	0	114.2	K761 R762 Y900 R906 W907 L908 R944 W1124	K761-E904 HydrophobicContact CG-CG 4.42Å; K761-E904 IonicContact NZ-OE1 2.59Å; R762-E904 HydrophobicContact CB-CB 4.11Å; Y900-E904 WeakPolarHBondContact O-CA 3.48Å; Y900-E904 PolarHBondContact O-N 2.85Å; E904-R906 VanDerWaalsContact C-N 3.33Å; E904-R906 PolarHBondContact O-N 3.1Å; E904-W907 PolarHBondContact O-N 2.88Å; E904-L908 PolarHBondContact O-N 2.78Å; E904-L908 VanDerWaalsContact O-N 3.14Å; E904-R944 IonicContact OE1-CZ 3.54Å; E904-R944 IonicContact OE1-NH1 2.73Å; E904-R944 IonicContact OE1-NH2 3.61Å; E904-R944 PolarHBondContact OE1-NH2 2.94Å; E904-R944 IonicContact OE2-CZ 2.71Å; E904-R944 IonicContact OE2-NH1 3.39Å; E904-R944 PolarHBondContact OE2-NH1 3.47Å; E904-R944 IonicContact OE2-NH2 3.12Å; E904-W1124 WeakPolarHBondContact OE1-CH2 3.45Å
905	D	87.1	Confident	86.3	Confident	22 Å²	22	18.7 Å²	18.7	12%	0.118	8%	0.081	C	C	.	.	H	α-helix	trans	-66.7	-34.7	-178.9	-65.8	-21	0	0	0	111.6	K761 Q765 G868 G903 C909	K761-D905 WeakPolarHBondContact CE-OD1 3.31Å; K761-D905 IonicContact NZ-OD1 2.92Å; K761-D905 IonicContact NZ-OD2 3.81Å; K761-D905 PolarHBondContact NZ-OD2 2.97Å; Q765-D905 PolarHBondContact NE2-OD1 3.06Å; G868-D905 WeakPolarHBondContact CA-OD2 3.47Å; G868-D905 PolarHBondContact N-OD2 3.09Å; G903-D905 PolarHBondContact O-N 2.66Å; D905-C909 PolarHBondContact O-N 2.9Å; D905-C909 PolarHBondContact O-SG 2.81Å
906	R	89	Confident	86.5	Confident	46 Å²	46	14.8 Å²	14.8	17%	0.174	7%	0.067	C	C	.	.	H	α-helix	trans	-75.1	-41.3	179.2	-175.7	-179.4	-71.1	-103.5	5.3	111.4	C865 G903 E904 C909 T910 T949 N952	C865-R906 HydrophobicContact CB-CB 4.36Å; C865-R906 HydrophobicContact CB-CG 4.18Å; G903-R906 PolarHBondContact O-N 3.39Å; E904-R906 VanDerWaalsContact C-N 3.33Å; E904-R906 PolarHBondContact O-N 3.1Å; R906-C909 CarbonylContact O-C 3.49Å; R906-C909 WeakPolarHBondContact O-CA 3.44Å; R906-C909 VanDerWaalsContact O-CB 3.32Å; R906-C909 WeakPolarHBondContact O-CB 3.41Å; R906-C909 PolarHBondContact O-N 2.92Å; R906-C909 VanDerWaalsContact O-N 3.11Å; R906-T910 PolarHBondContact O-N 3.24Å; R906-T910 PolarHBondContact O-OG1 2.77Å; R906-T910 VanDerWaalsContact O-OG1 3.09Å; R906-T949 PolarHBondContact NE-OG1 3.33Å; R906-T949 PolarHBondContact NH2-OG1 2.89Å; R906-N952 HydrophobicContact CG-CB 3.92Å
907	W	90.6	Very high	86.8	Confident	1 Å²	1	15.7 Å²	15.7	0%	0.004	7%	0.069	C	C	.	.	H	α-helix	trans	-68.2	-37.4	-179.3	178.3	54	0	0	0	112.4	R886 Y887 Q899 Y900 G903 E904 C909 T910 L911 N952	R886-W907 HydrophobicContact CG-CZ2 4.39Å; R886-W907 WeakPolarHBondContact O-CH2 3.13Å; Y887-W907 HydrophobicContact CD2-CD2 4.38Å; Y887-W907 AromaticContact CD2-CE3 3.5Å; Y887-W907 HydrophobicContact CD2-CE3 3.5Å; Y887-W907 AromaticContact CD2-CZ3 3.61Å; Y887-W907 HydrophobicContact CD2-CZ3 3.61Å; Y887-W907 AromaticContact CE2-CE3 3.75Å; Y887-W907 HydrophobicContact CE2-CE3 3.75Å; Y887-W907 HydrophobicContact CE2-CZ3 4.08Å; Y887-W907 HydrophobicContact CG-CE3 4.49Å; Y887-W907 HydrophobicContact CG-CZ3 4.19Å; Y887-W907 WeakPolarHBondContact O-CZ3 3.2Å; Q899-W907 HydrophobicContact CG-CG 4.48Å; Y900-W907 AromaticContact CD1-CD2 3.45Å; Y900-W907 HydrophobicContact CD1-CD2 3.45Å; Y900-W907 VanDerWaalsContact CD1-CD2 3.45Å; Y900-W907 AromaticContact CD1-CE2 3.14Å; Y900-W907 AromaticContact CD1-CE3 3.86Å; Y900-W907 HydrophobicContact CD1-CE3 3.86Å; Y900-W907 HydrophobicContact CD1-CG 4.01Å; Y900-W907 AromaticContact CD1-CH2 3.66Å; Y900-W907 HydrophobicContact CD1-CH2 3.66Å; Y900-W907 AromaticContact CD1-CZ2 3.27Å; Y900-W907 HydrophobicContact CD1-CZ2 3.27Å; Y900-W907 AromaticContact CD1-CZ3 3.96Å; Y900-W907 HydrophobicContact CD1-CZ3 3.96Å; Y900-W907 AromaticContact CD1-NE1 3.58Å; Y900-W907 AromaticContact CD2-CH2 3.91Å; Y900-W907 HydrophobicContact CD2-CH2 3.91Å; Y900-W907 HydrophobicContact CD2-CZ2 4.13Å; Y900-W907 HydrophobicContact CD2-CZ3 4.42Å; Y900-W907 HydrophobicContact CE1-CD2 4.17Å; Y900-W907 AromaticContact CE1-CE2 3.4Å; Y900-W907 HydrophobicContact CE1-CH2 4.11Å; Y900-W907 AromaticContact CE1-CZ2 3.36Å; Y900-W907 HydrophobicContact CE1-CZ2 3.36Å; Y900-W907 AromaticContact CE1-NE1 3.52Å; Y900-W907 HydrophobicContact CE2-CH2 4.34Å; Y900-W907 HydrophobicContact CE2-CZ2 4.22Å; Y900-W907 HydrophobicContact CG-CD2 4.07Å; Y900-W907 AromaticContact CG-CE2 3.95Å; Y900-W907 AromaticContact CG-CE3 3.99Å; Y900-W907 HydrophobicContact CG-CE3 3.99Å; Y900-W907 AromaticContact CG-CH2 3.57Å; Y900-W907 HydrophobicContact CG-CH2 3.57Å; Y900-W907 AromaticContact CG-CZ2 3.71Å; Y900-W907 HydrophobicContact CG-CZ2 3.71Å; Y900-W907 AromaticContact CG-CZ3 3.76Å; Y900-W907 HydrophobicContact CG-CZ3 3.76Å; Y900-W907 AromaticContact CZ-CZ2 3.88Å; G903-W907 WeakPolarHBondContact O-CB 3.4Å; G903-W907 PolarHBondContact O-N 2.84Å; E904-W907 PolarHBondContact O-N 2.88Å; W907-C909 PolarHBondContact O-N 2.84Å; W907-T910 WeakPolarHBondContact O-CB 3.43Å; W907-T910 PolarHBondContact O-N 2.83Å; W907-T910 VanDerWaalsContact O-N 3.13Å; W907-L911 HydrophobicContact CD2-CD1 4.23Å; W907-L911 HydrophobicContact CZ2-CD1 4.14Å; W907-L911 WeakPolarHBondContact O-CG 3.49Å; W907-L911 PolarHBondContact O-N 3.27Å; W907-N952 WeakPolarHBondContact CA-OD1 3.09Å
908	L	91.6	Very high	87.1	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-55.4	-41.7	168.2	-175.8	65.1	0	0	0	111.7	M769 F873 L878 V883 Y887 E904 L912	M769-L908 HydrophobicContact CE-CD1 4.34Å; M769-L908 HydrophobicContact CE-CD2 3.69Å; F873-L908 HydrophobicContact CD1-CD2 4.28Å; F873-L908 HydrophobicContact CE1-CD2 3.7Å; F873-L908 HydrophobicContact CE1-CG 4.2Å; F873-L908 HydrophobicContact CZ-CD2 3.94Å; L878-L908 HydrophobicContact CD2-CD1 3.96Å; L878-L908 HydrophobicContact CD2-CD2 4.36Å; L878-L908 HydrophobicContact CD2-CG 4.43Å; V883-L908 HydrophobicContact CG1-CD1 4.07Å; Y887-L908 HydrophobicContact CD2-CB 4.04Å; Y887-L908 HydrophobicContact CD2-CD1 3.87Å; Y887-L908 HydrophobicContact CE2-CB 3.83Å; Y887-L908 HydrophobicContact CE2-CD1 4.26Å; Y887-L908 HydrophobicContact CG-CD1 4.05Å; E904-L908 PolarHBondContact O-N 2.78Å; E904-L908 VanDerWaalsContact O-N 3.14Å; L908-L912 WeakPolarHBondContact O-CG 3.46Å; L908-L912 PolarHBondContact O-N 2.79Å; L908-L912 VanDerWaalsContact O-N 3.15Å
909	C	92.9	Very high	87.5	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-67	-43	174.5	-62.7	0	0	0	0	112.2	L864 A866 D905 R906 W907 L911 L912 L913	L864-C909 WeakPolarHBondContact O-CB 3.37Å; A866-C909 PolarHBondContact N-SG 2.94Å; D905-C909 PolarHBondContact O-N 2.9Å; D905-C909 PolarHBondContact O-SG 2.81Å; R906-C909 CarbonylContact O-C 3.49Å; R906-C909 WeakPolarHBondContact O-CA 3.44Å; R906-C909 VanDerWaalsContact O-CB 3.32Å; R906-C909 WeakPolarHBondContact O-CB 3.41Å; R906-C909 PolarHBondContact O-N 2.92Å; R906-C909 VanDerWaalsContact O-N 3.11Å; W907-C909 PolarHBondContact O-N 2.84Å; C909-L911 VanDerWaalsContact C-N 3.31Å; C909-L911 PolarHBondContact O-N 3.32Å; C909-L912 PolarHBondContact O-N 2.66Å; C909-L913 WeakPolarHBondContact O-CG 3.5Å; C909-L913 PolarHBondContact O-N 3.41Å
910	T	90.9	Very high	87.8	Confident	7 Å²	7	15.2 Å²	15.2	4%	0.043	7%	0.066	C	C	.	.	H	α-helix	trans	-54.7	-46	174.8	-51.9	0	0	0	0	111.5	R906 W907 L913 Q914 N952	R906-T910 PolarHBondContact O-N 3.24Å; R906-T910 PolarHBondContact O-OG1 2.77Å; R906-T910 VanDerWaalsContact O-OG1 3.09Å; W907-T910 WeakPolarHBondContact O-CB 3.43Å; W907-T910 PolarHBondContact O-N 2.83Å; W907-T910 VanDerWaalsContact O-N 3.13Å; T910-L913 PolarHBondContact O-N 2.75Å; T910-Q914 WeakPolarHBondContact O-CB 3.29Å; T910-Q914 WeakPolarHBondContact O-CG 3.34Å; T910-Q914 PolarHBondContact O-N 3.05Å; T910-N952 PolarHBondContact OG1-OD1 2.79Å
911	L	91.3	Very high	87.9	Confident	2 Å²	2	14.3 Å²	14.3	1%	0.01	6%	0.063	C	C	.	.	H	α-helix	trans	-62.5	-43.9	177.4	-67.8	172.3	0	0	0	112.2	V883 R886 Y887 W907 C909 L913 Q914 R915	V883-L911 HydrophobicContact CG1-CB 4.39Å; R886-L911 HydrophobicContact CB-CD1 4.37Å; R886-L911 HydrophobicContact CB-CD2 4.14Å; R886-L911 HydrophobicContact CG-CD2 3.94Å; Y887-L911 HydrophobicContact CD2-CD1 4.33Å; W907-L911 HydrophobicContact CD2-CD1 4.23Å; W907-L911 HydrophobicContact CZ2-CD1 4.14Å; W907-L911 WeakPolarHBondContact O-CG 3.49Å; W907-L911 PolarHBondContact O-N 3.27Å; C909-L911 VanDerWaalsContact C-N 3.31Å; C909-L911 PolarHBondContact O-N 3.32Å; L911-L913 VanDerWaalsContact C-N 3.34Å; L911-L913 PolarHBondContact O-N 2.93Å; L911-Q914 PolarHBondContact O-N 3.19Å; L911-R915 WeakPolarHBondContact O-CB 3.2Å; L911-R915 VanDerWaalsContact O-CG 3.29Å; L911-R915 WeakPolarHBondContact O-CG 3.38Å; L911-R915 PolarHBondContact O-N 2.82Å; L911-R915 VanDerWaalsContact O-N 3.08Å
912	L	91.7	Very high	88.4	Confident	0 Å²	0	14 Å²	14	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61.4	-40.2	174.9	-73.8	165.3	0	0	0	112.2	F873 A877 V883 L908 C909 R915 G916 Y917	F873-L912 HydrophobicContact CD1-CD1 3.83Å; F873-L912 HydrophobicContact CE1-CD1 3.87Å; A877-L912 HydrophobicContact CB-CD2 3.86Å; A877-L912 WeakPolarHBondContact O-CD2 3.47Å; V883-L912 HydrophobicContact CG1-CD2 4.14Å; V883-L912 HydrophobicContact CG1-CG 4.23Å; V883-L912 HydrophobicContact CG2-CD2 4.18Å; L908-L912 WeakPolarHBondContact O-CG 3.46Å; L908-L912 PolarHBondContact O-N 2.79Å; L908-L912 VanDerWaalsContact O-N 3.15Å; C909-L912 PolarHBondContact O-N 2.66Å; L912-R915 PolarHBondContact O-N 2.81Å; L912-G916 PolarHBondContact O-N 3.26Å; L912-Y917 HydrophobicContact CD2-CD2 4Å; L912-Y917 HydrophobicContact CD2-CG 4.38Å; L912-Y917 WeakPolarHBondContact O-CB 3.27Å; L912-Y917 PolarHBondContact O-N 3.2Å; L912-Y917 VanDerWaalsContact O-N 3.09Å
913	L	90.2	Very high	88.5	Confident	1 Å²	1	14 Å²	14	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-69.5	-42.1	178	-67.6	-176.5	0	0	0	112.3	C862 L864 C909 T910 L911 R915 G916 Y917 V919 L956 N967 I970	C862-L913 HydrophobicContact CB-CD2 3.97Å; C862-L913 VanDerWaalsContact SG-CD2 3.51Å; L864-L913 HydrophobicContact CD2-CD1 3.82Å; C909-L913 WeakPolarHBondContact O-CG 3.5Å; C909-L913 PolarHBondContact O-N 3.41Å; T910-L913 PolarHBondContact O-N 2.75Å; L911-L913 VanDerWaalsContact C-N 3.34Å; L911-L913 PolarHBondContact O-N 2.93Å; L913-R915 PolarHBondContact O-N 2.81Å; L913-G916 PolarHBondContact O-N 3.41Å; L913-G916 VanDerWaalsContact O-N 3.15Å; L913-Y917 WeakPolarHBondContact CD2-O 3.45Å; L913-V919 HydrophobicContact CD2-CG2 4.05Å; L913-L956 HydrophobicContact CB-CD1 4.42Å; L913-N967 PolarHBondContact O-ND2 3.19Å; L913-I970 HydrophobicContact CB-CD1 4.11Å; L913-I970 HydrophobicContact CD2-CD1 4.41Å
914	Q	88.6	Confident	88.5	Confident	14 Å²	14	14.6 Å²	14.6	7%	0.065	7%	0.067	C	C	.	.	H	α-helix	trans	-58.7	-31.9	172.6	-76.5	170.6	-2.9	0	0	112	T910 L911 D955 V963 L966	T910-Q914 WeakPolarHBondContact O-CB 3.29Å; T910-Q914 WeakPolarHBondContact O-CG 3.34Å; T910-Q914 PolarHBondContact O-N 3.05Å; L911-Q914 PolarHBondContact O-N 3.19Å; Q914-D955 PolarHBondContact NE2-OD2 2.9Å; Q914-D955 VanDerWaalsContact NE2-OD2 3.14Å; Q914-V963 HydrophobicContact CG-CG2 4.01Å; Q914-L966 WeakPolarHBondContact O-CD1 3.44Å
915	R	88.4	Confident	88.6	Confident	90 Å²	90	14.5 Å²	14.5	34%	0.34	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.1	178.2	-73.6	-77.2	119.3	161.3	11.9	115.3	D880 N882 V883 L911 L912 L913 Y917	D880-R915 WeakPolarHBondContact OD1-CD 3.42Å; D880-R915 IonicContact OD1-NH1 3.33Å; N882-R915 VanDerWaalsContact CG-NH2 3.26Å; N882-R915 PolarHBondContact ND2-NH1 2.81Å; N882-R915 PolarHBondContact OD1-NH2 2.82Å; N882-R915 VanDerWaalsContact OD1-NH2 3.12Å; V883-R915 HydrophobicContact CG2-CB 4.28Å; V883-R915 HydrophobicContact CG2-CG 3.74Å; L911-R915 WeakPolarHBondContact O-CB 3.2Å; L911-R915 VanDerWaalsContact O-CG 3.29Å; L911-R915 WeakPolarHBondContact O-CG 3.38Å; L911-R915 PolarHBondContact O-N 2.82Å; L911-R915 VanDerWaalsContact O-N 3.08Å; L912-R915 PolarHBondContact O-N 2.81Å; L913-R915 PolarHBondContact O-N 2.81Å; R915-Y917 HydrophobicContact CB-CD2 3.83Å; R915-Y917 HydrophobicContact CB-CE2 3.87Å
916	G	86.8	Confident	88.5	Confident	9 Å²	9	16.1 Å²	16.1	9%	0.093	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	93	5.2	177.4	0	0	0	0	0	115.5	L912 L913	L912-G916 PolarHBondContact O-N 3.26Å; L913-G916 PolarHBondContact O-N 3.41Å; L913-G916 VanDerWaalsContact O-N 3.15Å
917	Y	90.4	Very high	88.6	Confident	45 Å²	45	14 Å²	14	18%	0.176	7%	0.068	C	C	.	.			trans	-76.1	156.2	169.8	-60.1	-78.6	0	0	0	110.8	A877 D880 L912 L913 R915 N967	A877-Y917 HydrophobicContact CB-CD1 3.6Å; A877-Y917 HydrophobicContact CB-CD2 4.17Å; A877-Y917 HydrophobicContact CB-CE1 3.67Å; A877-Y917 HydrophobicContact CB-CE2 4.23Å; A877-Y917 HydrophobicContact CB-CG 3.89Å; D880-Y917 HydrophobicContact CB-CE2 4.05Å; D880-Y917 WeakPolarHBondContact OD2-CE2 3.17Å; D880-Y917 PolarHBondContact OD2-OH 3.07Å; L912-Y917 HydrophobicContact CD2-CD2 4Å; L912-Y917 HydrophobicContact CD2-CG 4.38Å; L912-Y917 WeakPolarHBondContact O-CB 3.27Å; L912-Y917 PolarHBondContact O-N 3.2Å; L912-Y917 VanDerWaalsContact O-N 3.09Å; L913-Y917 WeakPolarHBondContact CD2-O 3.45Å; R915-Y917 HydrophobicContact CB-CD2 3.83Å; R915-Y917 HydrophobicContact CB-CE2 3.87Å; Y917-N967 PolarHBondContact O-ND2 2.87Å
918	R	89	Confident	88.5	Confident	28 Å²	28	16.9 Å²	16.9	11%	0.106	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	154.5	171.3	-158.8	174.1	-175.4	-130.7	-4	110.3	R822 L823 G824 A825 H858 G861 C862 E920 S969	R822-R918 PolarHBondContact O-N 3.44Å; L823-R918 HydrophobicContact CD1-CB 4.05Å; L823-R918 HydrophobicContact CD1-CG 4.44Å; L823-R918 WeakPolarHBondContact CD1-O 3.33Å; G824-R918 PolarHBondContact N-O 3.29Å; A825-R918 PolarHBondContact N-O 2.97Å; H858-R918 PolarHBondContact O-NH2 3.25Å; G861-R918 VanDerWaalsContact O-CZ 3.23Å; G861-R918 PolarHBondContact O-NE 3Å; G861-R918 PolarHBondContact O-NH2 3.39Å; C862-R918 HydrophobicContact CB-CG 3.97Å; R918-E920 WeakPolarHBondContact CD-OE1 3.44Å; R918-E920 HydrophobicContact CG-CG 4.22Å; R918-E920 IonicContact CZ-OE1 3.71Å; R918-E920 IonicContact NE-OE1 3.81Å; R918-E920 VanDerWaalsContact NH1-CG 3.29Å; R918-E920 IonicContact NH1-OE1 3Å; R918-E920 PolarHBondContact NH1-OE1 3.47Å; R918-E920 IonicContact NH1-OE2 3.78Å; R918-E920 PolarHBondContact NH1-OE2 3.31Å; R918-S969 WeakPolarHBondContact CD-OG 3.44Å
919	V	91.5	Very high	88.4	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.7	162.6	-176.9	0	0	0	0	108.4	A825 V863 A866 L913	A825-V919 HydrophobicContact CB-CG1 4.23Å; A825-V919 HydrophobicContact CB-CG2 4.23Å; A825-V919 WeakPolarHBondContact O-CA 3.28Å; V863-V919 HydrophobicContact CB-CG1 4.21Å; V863-V919 PolarHBondContact N-O 2.8Å; V863-V919 WeakPolarHBondContact O-CB 3.45Å; A866-V919 HydrophobicContact CB-CG1 4.07Å; L913-V919 HydrophobicContact CD2-CG2 4.05Å
920	E	88.9	Confident	87.9	Confident	7 Å²	7	20.7 Å²	20.7	3%	0.033	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	150.7	-177.8	-69.4	176.4	-147.7	0	0	111.4	L816 N820 L823 A825 A826 C827 H858 R918	L816-E920 HydrophobicContact CD2-CB 4.04Å; N820-E920 PolarHBondContact ND2-OE1 2.89Å; N820-E920 VanDerWaalsContact ND2-OE1 3.16Å; L823-E920 HydrophobicContact CD1-CB 3.69Å; L823-E920 HydrophobicContact CD1-CG 3.42Å; L823-E920 VanDerWaalsContact CD1-CG 3.42Å; L823-E920 HydrophobicContact CD2-CB 4.15Å; L823-E920 HydrophobicContact CD2-CG 4.3Å; A825-E920 PolarHBondContact O-N 2.78Å; A826-E920 WeakPolarHBondContact CA-O 3.29Å; C827-E920 PolarHBondContact N-O 3.18Å; H858-E920 IonicContact NE2-OE2 2.7Å; R918-E920 WeakPolarHBondContact CD-OE1 3.44Å; R918-E920 HydrophobicContact CG-CG 4.22Å; R918-E920 IonicContact CZ-OE1 3.71Å; R918-E920 IonicContact NE-OE1 3.81Å; R918-E920 VanDerWaalsContact NH1-CG 3.29Å; R918-E920 IonicContact NH1-OE1 3Å; R918-E920 PolarHBondContact NH1-OE1 3.47Å; R918-E920 IonicContact NH1-OE2 3.78Å; R918-E920 PolarHBondContact NH1-OE2 3.31Å
921	Y	88.7	Confident	87.6	Confident	5 Å²	5	20.9 Å²	20.9	2%	0.02	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.8	177.9	162.3	-128.8	0	0	0	110.4	R829 K854 H858 A923 H1394	R829-Y921 HydrophobicContact CB-CE2 3.98Å; R829-Y921 WeakPolarHBondContact CD-OH 3.47Å; R829-Y921 WeakPolarHBondContact CG-OH 3.45Å; K854-Y921 HydrophobicContact CB-CD1 3.76Å; K854-Y921 HydrophobicContact CB-CE1 4.08Å; K854-Y921 HydrophobicContact CB-CG 4.29Å; K854-Y921 HydrophobicContact CD-CD1 4.46Å; K854-Y921 HydrophobicContact CD-CD2 4.37Å; K854-Y921 HydrophobicContact CD-CG 4.34Å; H858-Y921 PolarHBondContact CE1-O 2.92Å; H858-Y921 PolarHBondContact ND1-O 3.46Å; Y921-A923 HydrophobicContact CE1-CB 3.82Å; Y921-A923 HydrophobicContact CE2-CB 4.36Å; Y921-H1394 AromaticContact CD1-CE1 3.58Å; Y921-H1394 AromaticContact CD1-NE2 3.87Å; Y921-H1394 AromaticContact CE1-CE1 3.65Å
922	C	85.2	Confident	87.3	Confident	5 Å²	5	21 Å²	21	3%	0.034	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	83.8	-178.1	-165.7	0	0	0	0	111.2	L812 L813 L816 C827 A924 S925	L812-C922 PolarHBondContact O-SG 2.91Å; L813-C922 HydrophobicContact CD2-CB 3.69Å; L816-C922 HydrophobicContact CD2-CB 3.83Å; C827-C922 PolarHBondContact O-N 2.83Å; C922-A924 PolarHBondContact O-N 3.1Å; C922-S925 WeakPolarHBondContact O-CB 3.25Å; C922-S925 PolarHBondContact O-N 3.4Å
923	A	81.4	Confident	87	Confident	5 Å²	5	25.7 Å²	25.7	4%	0.041	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	0.5	179.4	0	0	0	0	0	116.1	Y921 T1398	Y921-A923 HydrophobicContact CE1-CB 3.82Å; Y921-A923 HydrophobicContact CE2-CB 4.36Å; A923-T1398 HydrophobicContact CB-CG2 4.07Å
924	A	79.3	Confident	86.8	Confident	17 Å²	17	27 Å²	27	14%	0.14	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-9.8	170.8	0	0	0	0	0	113	L812 C922 T1398 I1402	L812-A924 HydrophobicContact CD1-CB 4.22Å; L812-A924 WeakPolarHBondContact CD1-O 3.43Å; C922-A924 PolarHBondContact O-N 3.1Å; A924-T1398 HydrophobicContact CB-CG2 4.35Å; A924-I1402 HydrophobicContact CB-CG1 4.17Å
925	S	87	Confident	86.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	101.7	-176.5	-178.2	0	0	0	0	109.9	S809 L813 G828 R829 F870 C922	S809-S925 VanDerWaalsContact C-OG 3.22Å; S809-S925 WeakPolarHBondContact CA-OG 3.49Å; S809-S925 WeakPolarHBondContact CB-OG 3.27Å; S809-S925 PolarHBondContact O-OG 3.05Å; L813-S925 WeakPolarHBondContact CG-OG 3.49Å; G828-S925 CarbonylContact C-O 3.56Å; G828-S925 WeakPolarHBondContact CA-O 3.27Å; R829-S925 PolarHBondContact N-O 3.02Å; F870-S925 WeakPolarHBondContact CE1-OG 3.42Å; C922-S925 WeakPolarHBondContact O-CB 3.25Å; C922-S925 PolarHBondContact O-N 3.4Å
926	D	86	Confident	86.8	Confident	55 Å²	55	26.9 Å²	26.9	29%	0.294	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	136.5	-172.5	-73.6	-45.9	0	0	0	113.6	S809 R829 H831	S809-D926 VanDerWaalsContact CB-O 3.32Å; S809-D926 WeakPolarHBondContact CB-O 3.14Å; S809-D926 PolarHBondContact OG-N 3.47Å; S809-D926 PolarHBondContact OG-O 3.5Å; R829-D926 IonicContact CZ-OD1 3.84Å; R829-D926 IonicContact CZ-OD2 2.76Å; R829-D926 IonicContact NE-OD1 3.22Å; R829-D926 PolarHBondContact NE-OD1 3.35Å; R829-D926 VanDerWaalsContact NH2-CG 3.26Å; R829-D926 IonicContact NH2-OD1 2.87Å; R829-D926 PolarHBondContact NH2-OD1 3.24Å; R829-D926 IonicContact NH2-OD2 3.71Å; R829-D926 PolarHBondContact NH2-OD2 3Å; H831-D926 IonicContact CD2-OD1 3.31Å; H831-D926 IonicContact CE1-OD1 2.71Å; H831-D926 IonicContact NE2-OD1 3.91Å; H831-D926 PolarHBondContact NE2-OD1 3.17Å
927	A	89.9	Confident	86.7	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.008	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	153.1	167.1	0	0	0	0	0	111.1	V803 D804 F805 R829 M830 H831 F870	V803-A927 HydrophobicContact CG2-CB 4.09Å; D804-A927 WeakPolarHBondContact O-CA 3.17Å; F805-A927 HydrophobicContact CB-CB 3.82Å; R829-A927 PolarHBondContact O-N 3.3Å; M830-A927 WeakPolarHBondContact CA-O 3.38Å; M830-A927 HydrophobicContact CE-CB 3.83Å; M830-A927 HydrophobicContact SD-CB 3.87Å; H831-A927 PolarHBondContact CD2-O 3.05Å; H831-A927 PolarHBondContact N-O 3.45Å; F870-A927 HydrophobicContact CB-CB 4.03Å; F870-A927 HydrophobicContact CD1-CB 3.55Å; F870-A927 HydrophobicContact CD2-CB 4.25Å; F870-A927 HydrophobicContact CE1-CB 4.03Å; F870-A927 HydrophobicContact CG-CB 3.69Å
928	L	89.4	Confident	86.6	Confident	62 Å²	62	27.6 Å²	27.6	33%	0.325	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	146.7	177	-36.1	177.3	0	0	0	109.8	V803 D804 H831	V803-L928 WeakPolarHBondContact CA-O 3.06Å; V803-L928 WeakPolarHBondContact CG2-O 3.26Å; D804-L928 HydrophobicContact CB-CB 3.94Å; D804-L928 HydrophobicContact CB-CD1 4.11Å; D804-L928 HydrophobicContact CB-CG 4.12Å; D804-L928 PolarHBondContact N-O 3.41Å; D804-L928 PolarHBondContact O-N 2.91Å; H831-L928 HydrophobicContact CB-CD2 3.73Å; H831-L928 WeakPolarHBondContact O-CA 3.38Å
929	T	88.3	Confident	86.7	Confident	17 Å²	17	26.3 Å²	26.3	10%	0.104	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	145.2	178	169.6	0	0	0	0	109.3	D802 M830 H831 R833	D802-T929 WeakPolarHBondContact OD2-CA 3.4Å; D802-T929 WeakPolarHBondContact OD2-CB 3.45Å; D802-T929 PolarHBondContact OD2-OG1 2.98Å; M830-T929 HydrophobicContact CB-CG2 4.23Å; M830-T929 HydrophobicContact CE-CG2 3.7Å; H831-T929 PolarHBondContact O-N 3.19Å; H831-T929 VanDerWaalsContact O-N 3.09Å; R833-T929 WeakPolarHBondContact CB-O 3.42Å; R833-T929 PolarHBondContact N-O 2.92Å
930	F	83.9	Confident	86.5	Confident	64 Å²	64	27.3 Å²	27.3	28%	0.281	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	124.4	171.7	-75.9	-90.6	0	0	0	109.4	E643 C646 D802 R833	E643-F930 HydrophobicContact CG-CD2 4.36Å; C646-F930 HydrophobicContact CB-CE2 4.3Å; D802-F930 HydrophobicContact CB-CB 4.38Å; D802-F930 HydrophobicContact CB-CD2 4.18Å; D802-F930 PolarHBondContact OD2-N 3.4Å; R833-F930 HydrophobicContact CG-CD1 4.39Å; R833-F930 HydrophobicContact CG-CE1 4.17Å; R833-F930 HydrophobicContact CG-CZ 4.47Å
931	A	84.4	Confident	86.4	Confident	12 Å²	12	28.6 Å²	28.6	10%	0.099	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-103	155.3	178.4	0	0	0	0	0	110.1	P832 R833 I839 E933	P832-A931 HydrophobicContact CB-CB 3.62Å; R833-A931 PolarHBondContact O-N 3.48Å; I839-A931 HydrophobicContact CD1-CB 3.61Å; I839-A931 VanDerWaalsContact CD1-O 3.3Å; I839-A931 WeakPolarHBondContact CD1-O 3.15Å; A931-E933 PolarHBondContact O-N 3.39Å
932	P	84.8	Confident	86.4	Confident	5 Å²	5	29.1 Å²	29.1	3%	0.032	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-60.2	123.8	179.5	24	-35.5	0	0	0	111.1	Q842 E937 F938	Q842-P932 PolarHBondContact NE2-O 2.95Å; P932-E937 VanDerWaalsContact CA-OE2 3.31Å; P932-E937 WeakPolarHBondContact CA-OE2 3.35Å; P932-E937 HydrophobicContact CB-CB 3.95Å; P932-E937 VanDerWaalsContact CB-CD 3.46Å; P932-E937 HydrophobicContact CB-CG 3.71Å; P932-E937 VanDerWaalsContact CB-OE2 3.26Å; P932-E937 WeakPolarHBondContact CB-OE2 3.16Å; P932-F938 HydrophobicContact CB-CB 4.35Å; P932-F938 HydrophobicContact CG-CB 4.1Å; P932-F938 HydrophobicContact CG-CD2 4.14Å
933	E	85.7	Confident	86.6	Confident	97 Å²	97	29.1 Å²	29.1	45%	0.453	16%	0.155	S	C	.	.			trans	-83.4	-27.3	177.7	-58.2	-161.4	170.3	0	0	111.5	G834 K835 M838 I839 A931	G834-E933 WeakPolarHBondContact CA-OE1 3.49Å; K835-E933 VanDerWaalsContact N-CD 3.3Å; K835-E933 PolarHBondContact N-OE1 3.38Å; M838-E933 WeakPolarHBondContact CB-O 3.35Å; I839-E933 HydrophobicContact CD1-CG 4.1Å; I839-E933 HydrophobicContact CG1-CG 3.99Å; A931-E933 PolarHBondContact O-N 3.39Å
934	G	85.7	Confident	86.7	Confident	29 Å²	29	30.3 Å²	30.3	30%	0.299	16%	0.158	S	C	.	.	S	Bend	trans	-90.9	145.7	-178.1	0	0	0	0	0	114.5	N936 F938	G934-N936 PolarHBondContact O-N 3.07Å; G934-F938 WeakPolarHBondContact O-CB 3.22Å; G934-F938 PolarHBondContact O-N 2.78Å; G934-F938 VanDerWaalsContact O-N 3.09Å
935	F	88.3	Confident	87	Confident	47 Å²	47	33.5 Å²	33.5	21%	0.206	17%	0.167	C	C	.	.	H	α-helix	trans	-61	-45	179.7	-176.5	-79	0	0	0	113	M838 F938 F939 A1038 Q1039	M838-F935 HydrophobicContact CE-CB 4.17Å; M838-F935 HydrophobicContact CE-CD2 3.62Å; M838-F935 HydrophobicContact CE-CE2 4.41Å; M838-F935 HydrophobicContact CE-CG 4.15Å; F935-F938 PolarHBondContact O-N 2.95Å; F935-F939 AromaticContact CD1-CD2 3.86Å; F935-F939 HydrophobicContact CD1-CD2 3.86Å; F935-F939 HydrophobicContact CD1-CE2 4.24Å; F935-F939 HydrophobicContact CD1-CG 4.37Å; F935-F939 HydrophobicContact CD2-CE2 4.34Å; F935-F939 HydrophobicContact CE1-CD1 4.28Å; F935-F939 AromaticContact CE1-CD2 3.48Å; F935-F939 HydrophobicContact CE1-CD2 3.48Å; F935-F939 VanDerWaalsContact CE1-CD2 3.48Å; F935-F939 HydrophobicContact CE1-CE1 4.3Å; F935-F939 AromaticContact CE1-CE2 3.53Å; F935-F939 HydrophobicContact CE1-CE2 3.53Å; F935-F939 AromaticContact CE1-CG 3.91Å; F935-F939 HydrophobicContact CE1-CG 3.91Å; F935-F939 AromaticContact CE1-CZ 3.96Å; F935-F939 HydrophobicContact CE1-CZ 3.96Å; F935-F939 HydrophobicContact CE2-CD2 4.2Å; F935-F939 AromaticContact CE2-CE2 3.65Å; F935-F939 HydrophobicContact CE2-CE2 3.65Å; F935-F939 HydrophobicContact CE2-CZ 4.3Å; F935-F939 HydrophobicContact CG-CD2 4.37Å; F935-F939 AromaticContact CZ-CD2 3.68Å; F935-F939 HydrophobicContact CZ-CD2 3.68Å; F935-F939 HydrophobicContact CZ-CE1 4.26Å; F935-F939 AromaticContact CZ-CE2 3.19Å; F935-F939 HydrophobicContact CZ-CE2 3.19Å; F935-F939 HydrophobicContact CZ-CG 4.42Å; F935-F939 AromaticContact CZ-CZ 3.54Å; F935-F939 HydrophobicContact CZ-CZ 3.54Å; F935-F939 PolarHBondContact O-N 2.64Å; F935-A1038 HydrophobicContact CE1-CB 4.22Å; F935-A1038 HydrophobicContact CZ-CB 4.41Å; F935-Q1039 HydrophobicContact CB-CG 4.49Å; F935-Q1039 HydrophobicContact CD1-CG 3.36Å; F935-Q1039 HydrophobicContact CD2-CG 4.35Å; F935-Q1039 HydrophobicContact CE1-CB 4.36Å; F935-Q1039 HydrophobicContact CE1-CG 3.46Å; F935-Q1039 VanDerWaalsContact CE1-CG 3.46Å; F935-Q1039 HydrophobicContact CE2-CG 4.42Å; F935-Q1039 HydrophobicContact CG-CG 3.84Å; F935-Q1039 HydrophobicContact CZ-CG 4Å
936	N	88.6	Confident	87.1	Confident	54 Å²	54	35.1 Å²	35.1	29%	0.289	18%	0.175	S	C	.	.	H	α-helix	trans	-65.9	-42.5	-177.5	-69.6	-4.5	0	0	0	111.9	G934 F939 N940 L1035 Q1039	G934-N936 PolarHBondContact O-N 3.07Å; N936-F939 PolarHBondContact O-N 3.09Å; N936-N940 WeakPolarHBondContact O-CB 3.21Å; N936-N940 PolarHBondContact O-N 2.98Å; N936-L1035 HydrophobicContact CB-CD1 4.13Å; N936-Q1039 PolarHBondContact OD1-NE2 2.91Å
937	E	84.9	Confident	87.1	Confident	70 Å²	70	33 Å²	33	33%	0.327	17%	0.165	S	C	.	.	H	α-helix	trans	-62.1	-45.3	176.8	-167.3	-169.5	-173	0	0	111	P932 N940 Q941 T1126	P932-E937 VanDerWaalsContact CA-OE2 3.31Å; P932-E937 WeakPolarHBondContact CA-OE2 3.35Å; P932-E937 HydrophobicContact CB-CB 3.95Å; P932-E937 VanDerWaalsContact CB-CD 3.46Å; P932-E937 HydrophobicContact CB-CG 3.71Å; P932-E937 VanDerWaalsContact CB-OE2 3.26Å; P932-E937 WeakPolarHBondContact CB-OE2 3.16Å; E937-N940 PolarHBondContact O-N 3.32Å; E937-Q941 WeakPolarHBondContact O-CB 3.32Å; E937-Q941 PolarHBondContact O-N 3.41Å; E937-T1126 HydrophobicContact CG-CG2 3.65Å
938	F	88.7	Confident	87	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-49.2	174.1	177.2	-93.9	0	0	0	112.2	M838 Y841 Q842 P932 G934 F935 N940 Q941 R942 M1107 L1111	M838-F938 HydrophobicContact CE-CB 4.31Å; M838-F938 HydrophobicContact CE-CD1 3.99Å; M838-F938 HydrophobicContact CE-CG 4.21Å; M838-F938 HydrophobicContact CG-CB 3.9Å; M838-F938 HydrophobicContact CG-CD2 4.12Å; M838-F938 HydrophobicContact CG-CG 3.96Å; M838-F938 HydrophobicContact SD-CB 4.1Å; M838-F938 HydrophobicContact SD-CD1 3.73Å; M838-F938 HydrophobicContact SD-CD2 3.93Å; M838-F938 HydrophobicContact SD-CE1 4.12Å; M838-F938 HydrophobicContact SD-CE2 4.27Å; M838-F938 HydrophobicContact SD-CG 3.64Å; M838-F938 HydrophobicContact SD-CZ 4.37Å; Y841-F938 HydrophobicContact CD1-CE2 4.47Å; Y841-F938 HydrophobicContact CD1-CZ 4.1Å; Y841-F938 AromaticContact CE1-CZ 3.91Å; Y841-F938 HydrophobicContact CE1-CZ 3.91Å; Q842-F938 HydrophobicContact CG-CD2 3.97Å; Q842-F938 HydrophobicContact CG-CE2 3.56Å; P932-F938 HydrophobicContact CB-CB 4.35Å; P932-F938 HydrophobicContact CG-CB 4.1Å; P932-F938 HydrophobicContact CG-CD2 4.14Å; G934-F938 WeakPolarHBondContact O-CB 3.22Å; G934-F938 PolarHBondContact O-N 2.78Å; G934-F938 VanDerWaalsContact O-N 3.09Å; F935-F938 PolarHBondContact O-N 2.95Å; F938-N940 VanDerWaalsContact C-N 3.33Å; F938-N940 PolarHBondContact O-N 2.94Å; F938-Q941 PolarHBondContact O-N 2.99Å; F938-R942 HydrophobicContact CD1-CG 4.43Å; F938-R942 HydrophobicContact CD2-CG 4.45Å; F938-R942 HydrophobicContact CE1-CG 4.05Å; F938-R942 HydrophobicContact CE2-CG 4.1Å; F938-R942 VanDerWaalsContact CE2-CZ 3.45Å; F938-R942 HydrophobicContact CZ-CG 3.89Å; F938-R942 WeakPolarHBondContact O-CG 3.39Å; F938-R942 PolarHBondContact O-N 3.15Å; F938-M1107 HydrophobicContact CD1-CE 4.43Å; F938-M1107 HydrophobicContact CE1-CE 3.94Å; F938-M1107 HydrophobicContact CE1-SD 3.67Å; F938-M1107 HydrophobicContact CZ-SD 4.45Å; F938-L1111 HydrophobicContact CE1-CD2 4.08Å
939	F	90.2	Very high	86.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-41.4	177.3	-96.3	-115.8	0	0	0	112	F935 N936 R942 R943 L1035 A1038 M1107 L1111 Y1114	F935-F939 AromaticContact CD1-CD2 3.86Å; F935-F939 HydrophobicContact CD1-CD2 3.86Å; F935-F939 HydrophobicContact CD1-CE2 4.24Å; F935-F939 HydrophobicContact CD1-CG 4.37Å; F935-F939 HydrophobicContact CD2-CE2 4.34Å; F935-F939 HydrophobicContact CE1-CD1 4.28Å; F935-F939 AromaticContact CE1-CD2 3.48Å; F935-F939 HydrophobicContact CE1-CD2 3.48Å; F935-F939 VanDerWaalsContact CE1-CD2 3.48Å; F935-F939 HydrophobicContact CE1-CE1 4.3Å; F935-F939 AromaticContact CE1-CE2 3.53Å; F935-F939 HydrophobicContact CE1-CE2 3.53Å; F935-F939 AromaticContact CE1-CG 3.91Å; F935-F939 HydrophobicContact CE1-CG 3.91Å; F935-F939 AromaticContact CE1-CZ 3.96Å; F935-F939 HydrophobicContact CE1-CZ 3.96Å; F935-F939 HydrophobicContact CE2-CD2 4.2Å; F935-F939 AromaticContact CE2-CE2 3.65Å; F935-F939 HydrophobicContact CE2-CE2 3.65Å; F935-F939 HydrophobicContact CE2-CZ 4.3Å; F935-F939 HydrophobicContact CG-CD2 4.37Å; F935-F939 AromaticContact CZ-CD2 3.68Å; F935-F939 HydrophobicContact CZ-CD2 3.68Å; F935-F939 HydrophobicContact CZ-CE1 4.26Å; F935-F939 AromaticContact CZ-CE2 3.19Å; F935-F939 HydrophobicContact CZ-CE2 3.19Å; F935-F939 HydrophobicContact CZ-CG 4.42Å; F935-F939 AromaticContact CZ-CZ 3.54Å; F935-F939 HydrophobicContact CZ-CZ 3.54Å; F935-F939 PolarHBondContact O-N 2.64Å; N936-F939 PolarHBondContact O-N 3.09Å; F939-R942 PolarHBondContact O-N 3.46Å; F939-R943 PolarHBondContact O-N 3.02Å; F939-L1035 HydrophobicContact CB-CD2 3.45Å; F939-L1035 VanDerWaalsContact CB-CD2 3.45Å; F939-L1035 HydrophobicContact CD1-CD2 4.11Å; F939-L1035 HydrophobicContact CG-CD2 4.03Å; F939-A1038 HydrophobicContact CD1-CB 4.42Å; F939-A1038 HydrophobicContact CE1-CB 4Å; F939-M1107 HydrophobicContact CE2-CE 4.32Å; F939-M1107 HydrophobicContact CE2-SD 3.95Å; F939-M1107 HydrophobicContact CZ-SD 4.39Å; F939-L1111 HydrophobicContact CB-CD1 4.38Å; F939-L1111 HydrophobicContact CD1-CD1 3.53Å; F939-L1111 HydrophobicContact CD2-CD1 4.17Å; F939-L1111 HydrophobicContact CE1-CB 3.89Å; F939-L1111 HydrophobicContact CE1-CD1 3.66Å; F939-L1111 HydrophobicContact CE1-CG 4.38Å; F939-L1111 HydrophobicContact CE2-CD1 4.25Å; F939-L1111 HydrophobicContact CG-CD1 3.78Å; F939-L1111 HydrophobicContact CZ-CB 3.83Å; F939-L1111 HydrophobicContact CZ-CD1 4.01Å; F939-L1111 HydrophobicContact CZ-CG 4.43Å; F939-Y1114 HydrophobicContact CB-CD1 4.42Å; F939-Y1114 HydrophobicContact CB-CE1 4.01Å; F939-Y1114 AromaticContact CD1-CD1 3.69Å; F939-Y1114 HydrophobicContact CD1-CD1 3.69Å; F939-Y1114 HydrophobicContact CD1-CE1 4.08Å; F939-Y1114 HydrophobicContact CD1-CG 4.12Å
940	N	87.2	Confident	87	Confident	22 Å²	22	32.5 Å²	32.5	12%	0.118	16%	0.164	C	C	.	.	H	α-helix	trans	-65.6	-40.6	176.3	-76.2	-13.5	0	0	0	112.9	N936 E937 F938 R942 R943 Y1114 G1125	N936-N940 WeakPolarHBondContact O-CB 3.21Å; N936-N940 PolarHBondContact O-N 2.98Å; E937-N940 PolarHBondContact O-N 3.32Å; F938-N940 VanDerWaalsContact C-N 3.33Å; F938-N940 PolarHBondContact O-N 2.94Å; N940-R942 PolarHBondContact O-N 3.03Å; N940-R943 WeakPolarHBondContact O-CB 3.41Å; N940-Y1114 PolarHBondContact OD1-OH 3.09Å; N940-G1125 WeakPolarHBondContact CB-O 3.18Å; N940-G1125 PolarHBondContact ND2-O 2.89Å
941	Q	87	Confident	87.2	Confident	34 Å²	34	30.1 Å²	30.1	16%	0.159	16%	0.156	C	C	.	.	H	α-helix	trans	-59.6	-46.4	172.8	-177.6	-168.3	83.2	0	0	111	E937 F938 R944 W945	E937-Q941 WeakPolarHBondContact O-CB 3.32Å; E937-Q941 PolarHBondContact O-N 3.41Å; F938-Q941 PolarHBondContact O-N 2.99Å; Q941-R944 WeakPolarHBondContact O-CB 3.48Å; Q941-R944 PolarHBondContact O-N 2.97Å; Q941-R944 VanDerWaalsContact O-N 3.14Å; Q941-W945 VanDerWaalsContact CD-CH2 3.41Å; Q941-W945 VanDerWaalsContact CD-CZ2 3.41Å; Q941-W945 HydrophobicContact CG-CD2 4.12Å; Q941-W945 HydrophobicContact CG-CH2 4.02Å; Q941-W945 HydrophobicContact CG-CZ2 3.57Å; Q941-W945 HydrophobicContact CG-CZ3 4.48Å; Q941-W945 PolarHBondContact O-N 3.25Å
942	R	88.6	Confident	87.5	Confident	16 Å²	16	29.7 Å²	29.7	6%	0.06	15%	0.152	C	C	.	.	H	α-helix	trans	-75.1	-26	-176.6	-60.8	-42.6	179.7	81.6	-2.1	114	E845 F938 F939 N940 R944 W945 I946 L1111	E845-R942 VanDerWaalsContact CD-NH1 3.34Å; E845-R942 IonicContact OE1-CZ 2.71Å; E845-R942 IonicContact OE1-NH1 3.82Å; E845-R942 PolarHBondContact OE1-NH1 3.02Å; E845-R942 IonicContact OE1-NH2 3.69Å; E845-R942 IonicContact OE2-CZ 3.21Å; E845-R942 IonicContact OE2-NH1 3.9Å; E845-R942 PolarHBondContact OE2-NH1 3.45Å; E845-R942 IonicContact OE2-NH2 2.79Å; E845-R942 PolarHBondContact OE2-NH2 3.31Å; F938-R942 HydrophobicContact CD1-CG 4.43Å; F938-R942 HydrophobicContact CD2-CG 4.45Å; F938-R942 HydrophobicContact CE1-CG 4.05Å; F938-R942 HydrophobicContact CE2-CG 4.1Å; F938-R942 VanDerWaalsContact CE2-CZ 3.45Å; F938-R942 HydrophobicContact CZ-CG 3.89Å; F938-R942 WeakPolarHBondContact O-CG 3.39Å; F938-R942 PolarHBondContact O-N 3.15Å; F939-R942 PolarHBondContact O-N 3.46Å; N940-R942 PolarHBondContact O-N 3.03Å; R942-R944 PolarHBondContact O-N 3.29Å; R942-W945 VanDerWaalsContact CD-CE3 3.41Å; R942-W945 VanDerWaalsContact NE-CZ3 3.34Å; R942-W945 PolarHBondContact O-N 3.1Å; R942-W945 VanDerWaalsContact O-N 3.17Å; R942-I946 HydrophobicContact CB-CD1 4.46Å; R942-I946 PolarHBondContact O-N 3.2Å; R942-L1111 HydrophobicContact CB-CD1 3.95Å; R942-L1111 HydrophobicContact CB-CD2 3.91Å; R942-L1111 HydrophobicContact CB-CG 4.33Å; R942-L1111 HydrophobicContact CG-CD2 4.2Å
943	R	88.9	Confident	87.8	Confident	5 Å²	5	30.1 Å²	30.1	2%	0.019	15%	0.154	C	C	.	.	H	α-helix	trans	-52.7	-36.9	164.6	-174.8	-169.3	72	-160.7	8.2	112.1	F939 N940 P947 Y1114 N1118 V1121 S1123	F939-R943 PolarHBondContact O-N 3.02Å; N940-R943 WeakPolarHBondContact O-CB 3.41Å; R943-P947 WeakPolarHBondContact O-CD 3.46Å; R943-P947 VanDerWaalsContact O-CG 3.32Å; R943-P947 WeakPolarHBondContact O-CG 3.47Å; R943-Y1114 HydrophobicContact CB-CE1 4.01Å; R943-Y1114 HydrophobicContact CG-CE1 4.42Å; R943-N1118 HydrophobicContact CG-CB 4.05Å; R943-V1121 PolarHBondContact NH2-O 3.4Å; R943-S1123 PolarHBondContact NH2-O 3.07Å; R943-S1123 PolarHBondContact NH2-OG 3.29Å
944	R	83.8	Confident	88.1	Confident	30 Å²	30	29.4 Å²	29.4	11%	0.113	15%	0.153	C	C	.	.	H	α-helix	trans	-77	-40.1	176.4	-174.5	168.5	87.5	87.3	-27.2	112.5	Q902 E904 Q941 R942 S948	Q902-R944 HydrophobicContact CB-CG 3.92Å; Q902-R944 HydrophobicContact CG-CG 4.21Å; Q902-R944 WeakPolarHBondContact O-CG 3.45Å; Q902-R944 PolarHBondContact O-NH1 2.83Å; E904-R944 IonicContact OE1-CZ 3.54Å; E904-R944 IonicContact OE1-NH1 2.73Å; E904-R944 IonicContact OE1-NH2 3.61Å; E904-R944 PolarHBondContact OE1-NH2 2.94Å; E904-R944 IonicContact OE2-CZ 2.71Å; E904-R944 IonicContact OE2-NH1 3.39Å; E904-R944 PolarHBondContact OE2-NH1 3.47Å; E904-R944 IonicContact OE2-NH2 3.12Å; Q941-R944 WeakPolarHBondContact O-CB 3.48Å; Q941-R944 PolarHBondContact O-N 2.97Å; Q941-R944 VanDerWaalsContact O-N 3.14Å; R942-R944 PolarHBondContact O-N 3.29Å; R944-S948 WeakPolarHBondContact O-CB 3.44Å; R944-S948 PolarHBondContact O-OG 3.36Å
945	W	85.7	Confident	88.3	Confident	83 Å²	83	29.1 Å²	29.1	31%	0.314	14%	0.144	S	C	.	.	H	α-helix	trans	-79.4	-34	-170.7	-66.3	0.7	0	0	0	114.7	Y846 Q941 R942 S948 T949	Y846-W945 WeakPolarHBondContact OH-CH2 3.41Å; Q941-W945 VanDerWaalsContact CD-CH2 3.41Å; Q941-W945 VanDerWaalsContact CD-CZ2 3.41Å; Q941-W945 HydrophobicContact CG-CD2 4.12Å; Q941-W945 HydrophobicContact CG-CH2 4.02Å; Q941-W945 HydrophobicContact CG-CZ2 3.57Å; Q941-W945 HydrophobicContact CG-CZ3 4.48Å; Q941-W945 PolarHBondContact O-N 3.25Å; R942-W945 VanDerWaalsContact CD-CE3 3.41Å; R942-W945 VanDerWaalsContact NE-CZ3 3.34Å; R942-W945 PolarHBondContact O-N 3.1Å; R942-W945 VanDerWaalsContact O-N 3.17Å; W945-S948 PolarHBondContact O-OG 2.96Å; W945-T949 WeakPolarHBondContact O-CB 3.44Å; W945-T949 PolarHBondContact O-N 3.37Å; W945-T949 VanDerWaalsContact O-N 3.11Å; W945-T949 PolarHBondContact O-OG1 2.93Å
946	I	88.4	Confident	88.3	Confident	34 Å²	34	27.1 Å²	27.1	17%	0.174	14%	0.135	C	C	.	.	H	α-helix	trans	-70.4	-50.2	-177.2	-63.5	167.1	0	0	0	111.5	R942 T949 V950 L1111	R942-I946 HydrophobicContact CB-CD1 4.46Å; R942-I946 PolarHBondContact O-N 3.2Å; I946-T949 WeakPolarHBondContact O-CB 3.43Å; I946-T949 PolarHBondContact O-N 2.91Å; I946-V950 PolarHBondContact O-N 3.43Å; I946-V950 VanDerWaalsContact O-N 3.07Å; I946-L1111 HydrophobicContact CD1-CD2 4.37Å; I946-L1111 HydrophobicContact CD1-CG 4.1Å
947	P	87.8	Confident	88.4	Confident	12 Å²	12	25.9 Å²	25.9	8%	0.078	13%	0.129	C	C	.	.	H	α-helix	trans	-67.6	-40.6	-179.9	-21.7	35.6	0	0	0	113.3	I898 R943 T949 V950 A951 L1119	I898-P947 HydrophobicContact CG2-CB 3.9Å; R943-P947 WeakPolarHBondContact O-CD 3.46Å; R943-P947 VanDerWaalsContact O-CG 3.32Å; R943-P947 WeakPolarHBondContact O-CG 3.47Å; P947-T949 VanDerWaalsContact C-N 3.27Å; P947-T949 PolarHBondContact O-N 3.27Å; P947-V950 PolarHBondContact O-N 3.46Å; P947-A951 WeakPolarHBondContact O-CB 3.48Å; P947-A951 PolarHBondContact O-N 3.38Å; P947-L1119 HydrophobicContact CB-CD1 3.47Å; P947-L1119 VanDerWaalsContact CB-CD1 3.47Å; P947-L1119 HydrophobicContact CG-CD1 3.92Å
948	S	86.1	Confident	88.7	Confident	5 Å²	5	26.2 Å²	26.2	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-29.4	176	58.3	0	0	0	0	112.9	Q902 R944 W945 N952	Q902-S948 PolarHBondContact O-OG 2.84Å; R944-S948 WeakPolarHBondContact O-CB 3.44Å; R944-S948 PolarHBondContact O-OG 3.36Å; W945-S948 PolarHBondContact O-OG 2.96Å; S948-N952 WeakPolarHBondContact O-CB 3.4Å; S948-N952 PolarHBondContact O-N 3.1Å; S948-N952 PolarHBondContact O-ND2 3.5Å
949	T	87.9	Confident	88.8	Confident	30 Å²	30	28.8 Å²	28.8	18%	0.184	16%	0.157	C	C	.	.	H	α-helix	trans	-64.6	-51.9	169	-66.4	0	0	0	0	111.1	R906 W945 I946 P947 I953	R906-T949 PolarHBondContact NE-OG1 3.33Å; R906-T949 PolarHBondContact NH2-OG1 2.89Å; W945-T949 WeakPolarHBondContact O-CB 3.44Å; W945-T949 PolarHBondContact O-N 3.37Å; W945-T949 VanDerWaalsContact O-N 3.11Å; W945-T949 PolarHBondContact O-OG1 2.93Å; I946-T949 WeakPolarHBondContact O-CB 3.43Å; I946-T949 PolarHBondContact O-N 2.91Å; P947-T949 VanDerWaalsContact C-N 3.27Å; P947-T949 PolarHBondContact O-N 3.27Å; T949-I953 HydrophobicContact CG2-CD1 3.81Å; T949-I953 VanDerWaalsContact O-CG1 3.3Å; T949-I953 WeakPolarHBondContact O-CG1 3.39Å; T949-I953 PolarHBondContact O-N 3.08Å; T949-I953 VanDerWaalsContact O-N 3.11Å
950	V	89.7	Confident	88.7	Confident	34 Å²	34	32.7 Å²	32.7	21%	0.206	17%	0.172	C	C	.	.	H	α-helix	trans	-60.9	-48.2	179.3	168.4	0	0	0	0	111.3	I946 P947 N952 I953 I954 L982	I946-V950 PolarHBondContact O-N 3.43Å; I946-V950 VanDerWaalsContact O-N 3.07Å; P947-V950 PolarHBondContact O-N 3.46Å; V950-N952 PolarHBondContact O-N 2.92Å; V950-I953 PolarHBondContact O-N 3.27Å; V950-I954 HydrophobicContact CG1-CD1 3.63Å; V950-I954 HydrophobicContact CG1-CG1 4.43Å; V950-I954 WeakPolarHBondContact O-CG1 3.45Å; V950-I954 PolarHBondContact O-N 2.98Å; V950-L982 HydrophobicContact CB-CD1 4.49Å; V950-L982 HydrophobicContact CG1-CD1 4.14Å; V950-L982 HydrophobicContact CG2-CD1 4.2Å
951	A	89.8	Confident	88.8	Confident	13 Å²	13	38.6 Å²	38.6	11%	0.107	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-46.1	-178.5	0	0	0	0	0	112.9	I898 Q899 P947 I954 D955	I898-A951 HydrophobicContact CG2-CB 4.31Å; Q899-A951 HydrophobicContact CB-CB 4.35Å; P947-A951 WeakPolarHBondContact O-CB 3.48Å; P947-A951 PolarHBondContact O-N 3.38Å; A951-I954 PolarHBondContact O-N 3.06Å; A951-D955 PolarHBondContact O-N 2.74Å
952	N	89.8	Confident	88.9	Confident	4 Å²	4	40.6 Å²	40.6	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-70.6	-32.7	179.2	-83	-77.9	0	0	0	113	R906 W907 T910 S948 V950 L956	R906-N952 HydrophobicContact CG-CB 3.92Å; W907-N952 WeakPolarHBondContact CA-OD1 3.09Å; T910-N952 PolarHBondContact OG1-OD1 2.79Å; S948-N952 WeakPolarHBondContact O-CB 3.4Å; S948-N952 PolarHBondContact O-N 3.1Å; S948-N952 PolarHBondContact O-ND2 3.5Å; V950-N952 PolarHBondContact O-N 2.92Å; N952-L956 WeakPolarHBondContact O-CB 3.36Å; N952-L956 PolarHBondContact O-N 3.45Å; N952-L956 VanDerWaalsContact O-N 3.1Å
953	I	90.5	Very high	88.8	Confident	14 Å²	14	39.8 Å²	39.8	7%	0.072	21%	0.206	C	C	.	.	H	α-helix	trans	-68.4	-43.4	173.3	-66.8	168.6	0	0	0	110	L864 T949 V950 D955 L956 L957 L982	L864-I953 HydrophobicContact CD1-CD1 4.23Å; L864-I953 HydrophobicContact CD1-CG1 3.81Å; T949-I953 HydrophobicContact CG2-CD1 3.81Å; T949-I953 VanDerWaalsContact O-CG1 3.3Å; T949-I953 WeakPolarHBondContact O-CG1 3.39Å; T949-I953 PolarHBondContact O-N 3.08Å; T949-I953 VanDerWaalsContact O-N 3.11Å; V950-I953 PolarHBondContact O-N 3.27Å; I953-D955 VanDerWaalsContact C-N 3.33Å; I953-D955 PolarHBondContact O-N 2.91Å; I953-L956 PolarHBondContact O-N 3.04Å; I953-L957 HydrophobicContact CG2-CD1 3.71Å; I953-L957 HydrophobicContact CG2-CG 4.08Å; I953-L957 WeakPolarHBondContact O-CB 3.39Å; I953-L957 WeakPolarHBondContact O-CG 3.44Å; I953-L957 PolarHBondContact O-N 3.38Å; I953-L982 HydrophobicContact CG2-CB 4.13Å; I953-L982 HydrophobicContact CG2-CD2 4.18Å
954	I	91.9	Very high	88.6	Confident	82 Å²	82	41.6 Å²	41.6	42%	0.421	22%	0.215	S	C	.	.	H	α-helix	trans	-60	-41.7	175.7	-70.2	169.9	0	0	0	111.4	V950 A951 L957 A958 L982	V950-I954 HydrophobicContact CG1-CD1 3.63Å; V950-I954 HydrophobicContact CG1-CG1 4.43Å; V950-I954 WeakPolarHBondContact O-CG1 3.45Å; V950-I954 PolarHBondContact O-N 2.98Å; A951-I954 PolarHBondContact O-N 3.06Å; I954-L957 PolarHBondContact O-N 3.26Å; I954-A958 WeakPolarHBondContact O-CB 3.46Å; I954-A958 PolarHBondContact O-N 2.87Å; I954-L982 HydrophobicContact CG1-CD2 3.77Å
955	D	89.8	Confident	88.7	Confident	23 Å²	23	49.1 Å²	49.1	12%	0.123	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-43.6	177.1	-163.6	55.8	0	0	0	112.4	Q899 Q914 A951 I953 A958 D959	Q899-D955 VanDerWaalsContact NE2-CG 3.29Å; Q899-D955 PolarHBondContact NE2-OD2 2.82Å; Q914-D955 PolarHBondContact NE2-OD2 2.9Å; Q914-D955 VanDerWaalsContact NE2-OD2 3.14Å; A951-D955 PolarHBondContact O-N 2.74Å; I953-D955 VanDerWaalsContact C-N 3.33Å; I953-D955 PolarHBondContact O-N 2.91Å; D955-A958 PolarHBondContact O-N 2.92Å; D955-D959 PolarHBondContact O-N 3.33Å
956	L	88.7	Confident	88.6	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-36.8	175.1	-169.4	75.2	0	0	0	112.7	L864 L913 N952 I953 Y960 V963	L864-L956 HydrophobicContact CD2-CD2 3.52Å; L913-L956 HydrophobicContact CB-CD1 4.42Å; N952-L956 WeakPolarHBondContact O-CB 3.36Å; N952-L956 PolarHBondContact O-N 3.45Å; N952-L956 VanDerWaalsContact O-N 3.1Å; I953-L956 PolarHBondContact O-N 3.04Å; L956-Y960 PolarHBondContact O-N 3.05Å; L956-V963 HydrophobicContact CD1-CG1 4.02Å; L956-V963 HydrophobicContact CD1-CG2 4Å
957	L	91.5	Very high	88.3	Confident	28 Å²	28	47.8 Å²	47.8	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-74.2	-28	176.9	-70	177.1	0	0	0	112.4	I953 I954 Y960 I975 Q978 F979 L982	I953-L957 HydrophobicContact CG2-CD1 3.71Å; I953-L957 HydrophobicContact CG2-CG 4.08Å; I953-L957 WeakPolarHBondContact O-CB 3.39Å; I953-L957 WeakPolarHBondContact O-CG 3.44Å; I953-L957 PolarHBondContact O-N 3.38Å; I954-L957 PolarHBondContact O-N 3.26Å; L957-Y960 WeakPolarHBondContact O-CD1 3.43Å; L957-I975 HydrophobicContact CD2-CD1 4.43Å; L957-I975 HydrophobicContact CD2-CG2 3.81Å; L957-Q978 HydrophobicContact CD2-CB 4.4Å; L957-F979 HydrophobicContact CD1-CB 4.21Å; L957-F979 HydrophobicContact CD1-CD2 4.27Å; L957-F979 HydrophobicContact CD2-CB 4.2Å; L957-L982 HydrophobicContact CD1-CD2 3.71Å
958	A	91.6	Very high	87.7	Confident	77 Å²	77	49.8 Å²	49.8	64%	0.636	25%	0.253	S	S	*	.	H	α-helix	trans	-70.6	-48.1	174.5	0	0	0	0	0	111.5	I954 D955 Y960	I954-A958 WeakPolarHBondContact O-CB 3.46Å; I954-A958 PolarHBondContact O-N 2.87Å; D955-A958 PolarHBondContact O-N 2.92Å; A958-Y960 VanDerWaalsContact C-N 3.27Å; A958-Y960 PolarHBondContact O-N 2.79Å
959	D	89.3	Confident	87.3	Confident	54 Å²	54	50.4 Å²	50.4	29%	0.289	26%	0.257	S	S	.	.	S	Bend	trans	-86.4	12.9	-178.1	-163	39.7	0	0	0	114.1	D955 K961 N962 V963	D955-D959 PolarHBondContact O-N 3.33Å; D959-K961 PolarHBondContact O-N 3.32Å; D959-N962 PolarHBondContact O-N 3.5Å; D959-N962 WeakPolarHBondContact OD1-CB 3.39Å; D959-N962 PolarHBondContact OD1-ND2 2.79Å; D959-V963 HydrophobicContact CB-CG2 4.3Å; D959-V963 WeakPolarHBondContact O-CG2 3.28Å; D959-V963 PolarHBondContact O-N 3.37Å; D959-V963 VanDerWaalsContact O-N 3.08Å
960	Y	89.7	Confident	87.1	Confident	82 Å²	82	49 Å²	49	32%	0.322	25%	0.248	S	C	.	.	H	α-helix	trans	-50.3	-33.3	-170.1	79.5	-82.4	0	0	0	114.8	L956 L957 A958 V963 I964 I972 I975	L956-Y960 PolarHBondContact O-N 3.05Å; L957-Y960 WeakPolarHBondContact O-CD1 3.43Å; A958-Y960 VanDerWaalsContact C-N 3.27Å; A958-Y960 PolarHBondContact O-N 2.79Å; Y960-V963 PolarHBondContact O-N 2.91Å; Y960-I964 HydrophobicContact CD2-CD1 4.05Å; Y960-I964 WeakPolarHBondContact O-CB 3.37Å; Y960-I964 VanDerWaalsContact O-CG1 3.27Å; Y960-I964 WeakPolarHBondContact O-CG1 3.31Å; Y960-I964 PolarHBondContact O-N 2.79Å; Y960-I972 HydrophobicContact CD2-CD1 4.31Å; Y960-I972 HydrophobicContact CE2-CD1 4.23Å; Y960-I975 HydrophobicContact CD2-CG2 4.38Å; Y960-I975 HydrophobicContact CG-CG2 4.37Å
961	K	88.9	Confident	86.8	Confident	146 Å²	146	47.6 Å²	47.6	64%	0.635	24%	0.24	S	C	*	.	H	α-helix	trans	-64.4	-39.9	178.9	-64.6	-178.5	-178.2	174.8	0	112.4	D959 R965	D959-K961 PolarHBondContact O-N 3.32Å; K961-R965 WeakPolarHBondContact O-CB 3.19Å; K961-R965 PolarHBondContact O-N 3.12Å
962	N	88.1	Confident	86.6	Confident	76 Å²	76	51 Å²	51	41%	0.406	26%	0.255	S	S	.	.	H	α-helix	trans	-80	-40.2	177	-66.7	-43.5	0	0	0	110.7	D959 I964 R965 L966	D959-N962 PolarHBondContact O-N 3.5Å; D959-N962 WeakPolarHBondContact OD1-CB 3.39Å; D959-N962 PolarHBondContact OD1-ND2 2.79Å; N962-I964 PolarHBondContact O-N 2.75Å; N962-R965 WeakPolarHBondContact O-CB 3.3Å; N962-R965 PolarHBondContact O-N 2.92Å; N962-R965 VanDerWaalsContact O-N 3.09Å; N962-L966 WeakPolarHBondContact O-CG 3.21Å; N962-L966 PolarHBondContact O-N 3.39Å
963	V	86.8	Confident	86.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-55.5	-51.2	175.6	179.3	0	0	0	0	111.6	Q914 L956 D959 Y960 R965 L966 N967 I970	Q914-V963 HydrophobicContact CG-CG2 4.01Å; L956-V963 HydrophobicContact CD1-CG1 4.02Å; L956-V963 HydrophobicContact CD1-CG2 4Å; D959-V963 HydrophobicContact CB-CG2 4.3Å; D959-V963 WeakPolarHBondContact O-CG2 3.28Å; D959-V963 PolarHBondContact O-N 3.37Å; D959-V963 VanDerWaalsContact O-N 3.08Å; Y960-V963 PolarHBondContact O-N 2.91Å; V963-R965 VanDerWaalsContact C-N 3.28Å; V963-R965 PolarHBondContact O-N 3.46Å; V963-L966 PolarHBondContact O-N 2.9Å; V963-N967 VanDerWaalsContact O-CB 3.22Å; V963-N967 WeakPolarHBondContact O-CB 3.02Å; V963-N967 PolarHBondContact O-N 3.01Å; V963-I970 HydrophobicContact CG1-CB 4.2Å; V963-I970 HydrophobicContact CG1-CD1 3.43Å; V963-I970 VanDerWaalsContact CG1-CD1 3.43Å; V963-I970 HydrophobicContact CG1-CG1 4.39Å; V963-I970 HydrophobicContact CG1-CG2 3.95Å
964	I	86	Confident	86.2	Confident	42 Å²	42	56.1 Å²	56.1	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-65.1	-31.7	177.5	-66.5	168.3	0	0	0	111.7	Y960 N962 I970 I972 I975	Y960-I964 HydrophobicContact CD2-CD1 4.05Å; Y960-I964 WeakPolarHBondContact O-CB 3.37Å; Y960-I964 VanDerWaalsContact O-CG1 3.27Å; Y960-I964 WeakPolarHBondContact O-CG1 3.31Å; Y960-I964 PolarHBondContact O-N 2.79Å; N962-I964 PolarHBondContact O-N 2.75Å; I964-I970 HydrophobicContact CG1-CG2 4.21Å; I964-I972 HydrophobicContact CD1-CB 4.19Å; I964-I972 HydrophobicContact CD1-CD1 3.99Å; I964-I975 HydrophobicContact CD1-CG1 4.03Å; I964-I975 HydrophobicContact CG1-CG1 4.23Å
965	R	84.1	Confident	86.2	Confident	189 Å²	189	52.8 Å²	52.8	71%	0.713	26%	0.257	S	S	*	.	H	α-helix	trans	-70.6	-36.2	178.7	-178	177.8	177.7	177	-0.7	112.3	N149 K961 N962 V963	N149-R965 PolarHBondContact ND2-O 3.15Å; K961-R965 WeakPolarHBondContact O-CB 3.19Å; K961-R965 PolarHBondContact O-N 3.12Å; N962-R965 WeakPolarHBondContact O-CB 3.3Å; N962-R965 PolarHBondContact O-N 2.92Å; N962-R965 VanDerWaalsContact O-N 3.09Å; V963-R965 VanDerWaalsContact C-N 3.28Å; V963-R965 PolarHBondContact O-N 3.46Å
966	L	84.3	Confident	86.2	Confident	89 Å²	89	54 Å²	54	47%	0.466	27%	0.27	S	S	.	.	H	α-helix	trans	-92.5	-35.8	-177	-65.3	172.8	0	0	0	113.2	Q914 N962 V963	Q914-L966 WeakPolarHBondContact O-CD1 3.44Å; N962-L966 WeakPolarHBondContact O-CG 3.21Å; N962-L966 PolarHBondContact O-N 3.39Å; V963-L966 PolarHBondContact O-N 2.9Å
967	N	82.2	Confident	86.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.271	C	S	.	.			trans	-102.5	100.1	-172	-157.6	-37.1	0	0	0	112.5	L913 Y917 V963 S969 I970	L913-N967 PolarHBondContact O-ND2 3.19Å; Y917-N967 PolarHBondContact O-ND2 2.87Å; V963-N967 VanDerWaalsContact O-CB 3.22Å; V963-N967 WeakPolarHBondContact O-CB 3.02Å; V963-N967 PolarHBondContact O-N 3.01Å; N967-S969 PolarHBondContact O-N 2.79Å; N967-S969 WeakPolarHBondContact OD1-CB 3.34Å; N967-S969 PolarHBondContact OD1-N 2.88Å; N967-S969 PolarHBondContact OD1-OG 3.22Å; N967-I970 HydrophobicContact CB-CB 4.23Å; N967-I970 HydrophobicContact CB-CD1 4.16Å; N967-I970 HydrophobicContact CB-CG1 4.23Å; N967-I970 PolarHBondContact O-N 3.46Å
968	D	74.7	Confident	86.3	Confident	54 Å²	54	53.1 Å²	53.1	29%	0.289	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-7.7	174.6	-64.9	-19.9	0	0	0	114.1	R148 R822	R148-D968 VanDerWaalsContact CG-O 3.3Å; R148-D968 WeakPolarHBondContact CG-O 3.25Å; R822-D968 IonicContact CZ-OD2 3.95Å; R822-D968 IonicContact NH1-OD2 3.42Å; R822-D968 PolarHBondContact NH1-OD2 3.36Å; R822-D968 IonicContact NH2-OD2 2.72Å
969	S	78.2	Confident	86.4	Confident	17 Å²	17	55.3 Å²	55.3	12%	0.119	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-17.7	177.3	-40.1	0	0	0	0	114.2	G861 R918 N967	G861-S969 WeakPolarHBondContact CA-O 3.48Å; R918-S969 WeakPolarHBondContact CD-OG 3.44Å; N967-S969 PolarHBondContact O-N 2.79Å; N967-S969 WeakPolarHBondContact OD1-CB 3.34Å; N967-S969 PolarHBondContact OD1-N 2.88Å; N967-S969 PolarHBondContact OD1-OG 3.22Å
970	I	83.5	Confident	86.4	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	25%	0.252	C	S	.	.			trans	-104.9	119.3	-176	-64.5	174.2	0	0	0	109	L913 V963 I964 N967 Y974 I975	L913-I970 HydrophobicContact CB-CD1 4.11Å; L913-I970 HydrophobicContact CD2-CD1 4.41Å; V963-I970 HydrophobicContact CG1-CB 4.2Å; V963-I970 HydrophobicContact CG1-CD1 3.43Å; V963-I970 VanDerWaalsContact CG1-CD1 3.43Å; V963-I970 HydrophobicContact CG1-CG1 4.39Å; V963-I970 HydrophobicContact CG1-CG2 3.95Å; I964-I970 HydrophobicContact CG1-CG2 4.21Å; N967-I970 HydrophobicContact CB-CB 4.23Å; N967-I970 HydrophobicContact CB-CD1 4.16Å; N967-I970 HydrophobicContact CB-CG1 4.23Å; N967-I970 PolarHBondContact O-N 3.46Å; I970-Y974 HydrophobicContact CG2-CD1 4Å; I970-I975 HydrophobicContact CG2-CD1 3.89Å; I970-I975 HydrophobicContact CG2-CG1 3.85Å
971	S	84.3	Confident	86.4	Confident	4 Å²	4	51.4 Å²	51.4	3%	0.028	25%	0.246	C	C	.	.			trans	-105	162.5	-179.8	64.9	0	0	0	0	111.8	F147 W973 Y974 I975	F147-S971 WeakPolarHBondContact O-CB 3.09Å; S971-W973 PolarHBondContact O-N 3.11Å; S971-Y974 WeakPolarHBondContact O-CB 3.5Å; S971-Y974 PolarHBondContact O-N 2.93Å; S971-Y974 VanDerWaalsContact O-N 3.1Å; S971-Y974 WeakPolarHBondContact OG-CB 3.3Å; S971-Y974 PolarHBondContact OG-N 2.99Å; S971-I975 PolarHBondContact O-N 3.35Å
972	I	85.3	Confident	86.6	Confident	83 Å²	83	45.5 Å²	45.5	43%	0.426	22%	0.221	S	C	.	.	H	α-helix	trans	-58	-34.1	172.1	-169.9	60.8	0	0	0	111.9	Y960 I964 I975 A976	Y960-I972 HydrophobicContact CD2-CD1 4.31Å; Y960-I972 HydrophobicContact CE2-CD1 4.23Å; I964-I972 HydrophobicContact CD1-CB 4.19Å; I964-I972 HydrophobicContact CD1-CD1 3.99Å; I972-I975 PolarHBondContact O-N 3.4Å; I972-A976 WeakPolarHBondContact O-CB 3.26Å; I972-A976 PolarHBondContact O-N 3.36Å
973	W	84.6	Confident	86.7	Confident	126 Å²	126	44.9 Å²	44.9	48%	0.477	22%	0.217	S	C	.	.	H	α-helix	trans	-71.2	-34.7	175.9	-62.7	109.8	0	0	0	113.1	W146 F147 S971 A976 Y977	W146-W973 HydrophobicContact CE3-CZ2 4.23Å; W146-W973 AromaticContact CE3-NE1 3.64Å; W146-W973 AromaticContact CZ3-CZ2 3.86Å; W146-W973 HydrophobicContact CZ3-CZ2 3.86Å; F147-W973 HydrophobicContact CD1-CB 4.09Å; F147-W973 AromaticContact CD1-CD1 3.91Å; F147-W973 HydrophobicContact CD1-CG 4.3Å; F147-W973 HydrophobicContact CE1-CB 3.49Å; F147-W973 VanDerWaalsContact CE1-CB 3.49Å; F147-W973 AromaticContact CE1-CD1 3.45Å; F147-W973 VanDerWaalsContact CE1-CD1 3.45Å; F147-W973 AromaticContact CE1-CG 3.58Å; F147-W973 HydrophobicContact CE1-CG 3.58Å; F147-W973 AromaticContact CE2-CD1 3.74Å; F147-W973 HydrophobicContact CE2-CG 4.5Å; F147-W973 HydrophobicContact CZ-CB 4.11Å; F147-W973 AromaticContact CZ-CD1 3.34Å; F147-W973 HydrophobicContact CZ-CD2 4.4Å; F147-W973 AromaticContact CZ-CG 3.7Å; F147-W973 HydrophobicContact CZ-CG 3.7Å; F147-W973 AromaticContact CZ-NE1 3.88Å; S971-W973 PolarHBondContact O-N 3.11Å; W973-A976 PolarHBondContact O-N 3.31Å; W973-Y977 WeakPolarHBondContact O-CB 3.23Å; W973-Y977 PolarHBondContact O-N 3.15Å
974	Y	88	Confident	86.7	Confident	1 Å²	1	46 Å²	46	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-42.1	171	179.2	-82.3	0	0	0	111.2	F860 C862 L864 I970 S971 Y977 Q978	F860-Y974 HydrophobicContact CB-CD2 4.09Å; C862-Y974 VanDerWaalsContact O-CE2 3.31Å; C862-Y974 WeakPolarHBondContact O-CE2 3.28Å; C862-Y974 VanDerWaalsContact O-CZ 3.29Å; C862-Y974 PolarHBondContact O-OH 2.83Å; L864-Y974 HydrophobicContact CD2-CE1 4.25Å; L864-Y974 VanDerWaalsContact CD2-OH 3.23Å; L864-Y974 WeakPolarHBondContact CD2-OH 3.47Å; L864-Y974 WeakPolarHBondContact CG-OH 3.39Å; I970-Y974 HydrophobicContact CG2-CD1 4Å; S971-Y974 WeakPolarHBondContact O-CB 3.5Å; S971-Y974 PolarHBondContact O-N 2.93Å; S971-Y974 VanDerWaalsContact O-N 3.1Å; S971-Y974 WeakPolarHBondContact OG-CB 3.3Å; S971-Y974 PolarHBondContact OG-N 2.99Å; Y974-Y977 PolarHBondContact O-N 2.94Å; Y974-Q978 HydrophobicContact CD1-CG 4.09Å; Y974-Q978 HydrophobicContact CE1-CG 3.62Å; Y974-Q978 WeakPolarHBondContact O-CG 3.49Å; Y974-Q978 PolarHBondContact O-N 3.12Å; Y974-Q978 PolarHBondContact OH-NE2 3.01Å
975	I	90.4	Very high	86.9	Confident	12 Å²	12	47 Å²	47	6%	0.062	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-42.4	174	-70.4	-61.8	0	0	0	111.1	L957 Y960 I964 I970 S971 I972 Y977 Q978 F979	L957-I975 HydrophobicContact CD2-CD1 4.43Å; L957-I975 HydrophobicContact CD2-CG2 3.81Å; Y960-I975 HydrophobicContact CD2-CG2 4.38Å; Y960-I975 HydrophobicContact CG-CG2 4.37Å; I964-I975 HydrophobicContact CD1-CG1 4.03Å; I964-I975 HydrophobicContact CG1-CG1 4.23Å; I970-I975 HydrophobicContact CG2-CD1 3.89Å; I970-I975 HydrophobicContact CG2-CG1 3.85Å; S971-I975 PolarHBondContact O-N 3.35Å; I972-I975 PolarHBondContact O-N 3.4Å; I975-Y977 PolarHBondContact O-N 3.35Å; I975-Q978 PolarHBondContact O-N 3.27Å; I975-F979 PolarHBondContact O-N 2.73Å
976	A	89.9	Confident	87.2	Confident	48 Å²	48	39.3 Å²	39.3	40%	0.397	21%	0.205	S	C	.	.	H	α-helix	trans	-62.5	-40.2	174	0	0	0	0	0	112.7	I972 W973 F979 A980	I972-A976 WeakPolarHBondContact O-CB 3.26Å; I972-A976 PolarHBondContact O-N 3.36Å; W973-A976 PolarHBondContact O-N 3.31Å; A976-F979 PolarHBondContact O-N 3.25Å; A976-A980 WeakPolarHBondContact O-CB 3.3Å; A976-A980 PolarHBondContact O-N 3.34Å
977	Y	90.6	Very high	87.4	Confident	12 Å²	12	36.3 Å²	36.3	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-44.6	172.5	170.7	-98.2	0	0	0	112	T856 W973 Y974 I975 F979 A980 M981 L1383 L1386 Q1387	T856-Y977 HydrophobicContact CG2-CE1 4.16Å; T856-Y977 HydrophobicContact CG2-CE2 3.94Å; W973-Y977 WeakPolarHBondContact O-CB 3.23Å; W973-Y977 PolarHBondContact O-N 3.15Å; Y974-Y977 PolarHBondContact O-N 2.94Å; I975-Y977 PolarHBondContact O-N 3.35Å; Y977-F979 PolarHBondContact O-N 2.92Å; Y977-A980 PolarHBondContact O-N 2.69Å; Y977-M981 HydrophobicContact CD1-CG 4.28Å; Y977-M981 HydrophobicContact CD2-CG 4.31Å; Y977-M981 HydrophobicContact CE1-CG 3.78Å; Y977-M981 HydrophobicContact CE2-CG 3.81Å; Y977-M981 HydrophobicContact CE2-SD 4Å; Y977-M981 WeakPolarHBondContact O-CG 3.49Å; Y977-M981 PolarHBondContact O-N 3.04Å; Y977-L1383 HydrophobicContact CD2-CD2 4.03Å; Y977-L1383 HydrophobicContact CE2-CD2 4.06Å; Y977-L1386 HydrophobicContact CD2-CD2 3.83Å; Y977-L1386 HydrophobicContact CE2-CD2 4.27Å; Y977-Q1387 HydrophobicContact CE2-CG 4.49Å; Y977-Q1387 PolarHBondContact OH-NE2 2.97Å
978	Q	92.1	Very high	87.7	Confident	2 Å²	2	37 Å²	37	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-68	-33.8	178	-66.3	-63	-0.9	0	0	112.7	L864 L957 Y974 I975 L982	L864-Q978 HydrophobicContact CD1-CG 4.3Å; L957-Q978 HydrophobicContact CD2-CB 4.4Å; Y974-Q978 HydrophobicContact CD1-CG 4.09Å; Y974-Q978 HydrophobicContact CE1-CG 3.62Å; Y974-Q978 WeakPolarHBondContact O-CG 3.49Å; Y974-Q978 PolarHBondContact O-N 3.12Å; Y974-Q978 PolarHBondContact OH-NE2 3.01Å; I975-Q978 PolarHBondContact O-N 3.27Å; Q978-L982 WeakPolarHBondContact O-CB 3.28Å; Q978-L982 PolarHBondContact O-N 3.02Å
979	F	92.7	Very high	88.4	Confident	122 Å²	122	34.7 Å²	34.7	54%	0.535	18%	0.184	S	C	.	.	H	α-helix	trans	-64.4	-44	169.8	177	-96.8	0	0	0	111.9	L957 I975 A976 Y977 L982 L983	L957-F979 HydrophobicContact CD1-CB 4.21Å; L957-F979 HydrophobicContact CD1-CD2 4.27Å; L957-F979 HydrophobicContact CD2-CB 4.2Å; I975-F979 PolarHBondContact O-N 2.73Å; A976-F979 PolarHBondContact O-N 3.25Å; Y977-F979 PolarHBondContact O-N 2.92Å; F979-L982 PolarHBondContact O-N 2.82Å; F979-L983 HydrophobicContact CE1-CD2 4.37Å; F979-L983 WeakPolarHBondContact O-CB 3.4Å; F979-L983 PolarHBondContact O-N 2.84Å
980	A	90.8	Very high	88.9	Confident	15 Å²	15	34 Å²	34	12%	0.124	18%	0.179	C	C	.	.	H	α-helix	trans	-62.3	-42.2	176	0	0	0	0	0	112.3	A976 Y977 L983 S984 F1379 L1383	A976-A980 WeakPolarHBondContact O-CB 3.3Å; A976-A980 PolarHBondContact O-N 3.34Å; Y977-A980 PolarHBondContact O-N 2.69Å; A980-L983 PolarHBondContact O-N 2.96Å; A980-S984 VanDerWaalsContact O-CB 3.27Å; A980-S984 WeakPolarHBondContact O-CB 3.4Å; A980-S984 PolarHBondContact O-N 2.88Å; A980-F1379 HydrophobicContact CB-CE2 3.93Å; A980-F1379 HydrophobicContact CB-CZ 3.88Å; A980-L1383 HydrophobicContact CB-CD2 4.33Å
981	M	89.8	Confident	89	Confident	40 Å²	40	35.2 Å²	35.2	20%	0.197	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-40.3	174.1	-71.4	-61.6	-59.1	0	0	112.3	Y977 N985	Y977-M981 HydrophobicContact CD1-CG 4.28Å; Y977-M981 HydrophobicContact CD2-CG 4.31Å; Y977-M981 HydrophobicContact CE1-CG 3.78Å; Y977-M981 HydrophobicContact CE2-CG 3.81Å; Y977-M981 HydrophobicContact CE2-SD 4Å; Y977-M981 WeakPolarHBondContact O-CG 3.49Å; Y977-M981 PolarHBondContact O-N 3.04Å; M981-N985 WeakPolarHBondContact O-CB 3.43Å; M981-N985 PolarHBondContact O-N 2.8Å
982	L	91.5	Very high	89.2	Confident	22 Å²	22	36.1 Å²	36.1	12%	0.115	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-49.9	174.5	177.5	63.1	0	0	0	111.2	V950 I953 I954 L957 Q978 F979 S984 N985 V986	V950-L982 HydrophobicContact CB-CD1 4.49Å; V950-L982 HydrophobicContact CG1-CD1 4.14Å; V950-L982 HydrophobicContact CG2-CD1 4.2Å; I953-L982 HydrophobicContact CG2-CB 4.13Å; I953-L982 HydrophobicContact CG2-CD2 4.18Å; I954-L982 HydrophobicContact CG1-CD2 3.77Å; L957-L982 HydrophobicContact CD1-CD2 3.71Å; Q978-L982 WeakPolarHBondContact O-CB 3.28Å; Q978-L982 PolarHBondContact O-N 3.02Å; F979-L982 PolarHBondContact O-N 2.82Å; L982-S984 VanDerWaalsContact C-N 3.33Å; L982-S984 PolarHBondContact O-N 3.34Å; L982-N985 PolarHBondContact O-N 2.85Å; L982-N985 VanDerWaalsContact O-N 3.09Å; L982-V986 HydrophobicContact CD1-CG2 4.22Å; L982-V986 WeakPolarHBondContact O-CG2 3.45Å; L982-V986 PolarHBondContact O-N 2.95Å
983	L	90.2	Very high	89.4	Confident	63 Å²	63	32.6 Å²	32.6	33%	0.33	17%	0.173	S	C	.	.	H	α-helix	trans	-59.5	-43.8	178.6	-177.5	61.4	0	0	0	111.5	F979 A980 N985 V986 L987 M1318	F979-L983 HydrophobicContact CE1-CD2 4.37Å; F979-L983 WeakPolarHBondContact O-CB 3.4Å; F979-L983 PolarHBondContact O-N 2.84Å; A980-L983 PolarHBondContact O-N 2.96Å; L983-N985 VanDerWaalsContact C-N 3.31Å; L983-N985 PolarHBondContact O-N 2.69Å; L983-V986 PolarHBondContact O-N 3.46Å; L983-L987 HydrophobicContact CD1-CD1 3.76Å; L983-L987 HydrophobicContact CD1-CG 4.17Å; L983-L987 HydrophobicContact CG-CD1 4.05Å; L983-L987 WeakPolarHBondContact O-CB 3.41Å; L983-L987 PolarHBondContact O-N 3.03Å; L983-M1318 HydrophobicContact CD1-CE 3.86Å
984	S	88.4	Confident	89.4	Confident	23 Å²	23	27.4 Å²	27.4	16%	0.161	16%	0.155	C	C	.	.	H	α-helix	trans	-59.3	-38	173.4	178.4	0	0	0	0	112.9	A980 L982 G988 F1380	A980-S984 VanDerWaalsContact O-CB 3.27Å; A980-S984 WeakPolarHBondContact O-CB 3.4Å; A980-S984 PolarHBondContact O-N 2.88Å; L982-S984 VanDerWaalsContact C-N 3.33Å; L982-S984 PolarHBondContact O-N 3.34Å; S984-G988 WeakPolarHBondContact O-CA 3.38Å; S984-G988 PolarHBondContact O-N 2.9Å; S984-F1380 VanDerWaalsContact OG-CE1 3.26Å; S984-F1380 WeakPolarHBondContact OG-CE1 3.41Å; S984-F1380 WeakPolarHBondContact OG-CZ 3.48Å
985	N	89	Confident	89.1	Confident	62 Å²	62	31.1 Å²	31.1	33%	0.332	17%	0.173	S	C	.	.	H	α-helix	trans	-74.7	-33.9	180	-169.8	62.7	0	0	0	112.2	M981 L982 L983	M981-N985 WeakPolarHBondContact O-CB 3.43Å; M981-N985 PolarHBondContact O-N 2.8Å; L982-N985 PolarHBondContact O-N 2.85Å; L982-N985 VanDerWaalsContact O-N 3.09Å; L983-N985 VanDerWaalsContact C-N 3.31Å; L983-N985 PolarHBondContact O-N 2.69Å
986	V	89.9	Confident	88.8	Confident	28 Å²	28	30.5 Å²	30.5	17%	0.17	17%	0.17	C	C	.	.	H	α-helix	trans	-77	-34.9	178.5	-179.9	0	0	0	0	112.1	L982 L983 F1315 M1318 N1319	L982-V986 HydrophobicContact CD1-CG2 4.22Å; L982-V986 WeakPolarHBondContact O-CG2 3.45Å; L982-V986 PolarHBondContact O-N 2.95Å; L983-V986 PolarHBondContact O-N 3.46Å; V986-F1315 HydrophobicContact CG1-CD2 4.11Å; V986-F1315 HydrophobicContact CG1-CE2 4.46Å; V986-M1318 HydrophobicContact CB-CE 4.12Å; V986-M1318 HydrophobicContact CG1-CE 3.56Å; V986-M1318 HydrophobicContact CG1-SD 3.81Å; V986-N1319 PolarHBondContact O-ND2 3.49Å; V986-N1319 PolarHBondContact O-OD1 3.48Å
987	L	89.2	Confident	88.6	Confident	27 Å²	27	28.3 Å²	28.3	14%	0.141	15%	0.152	C	C	.	.	H	α-helix	trans	-89.3	-10.1	176.9	-66.5	177.7	0	0	0	114.7	L983 P989 G990 T991 M1318 F1322	L983-L987 HydrophobicContact CD1-CD1 3.76Å; L983-L987 HydrophobicContact CD1-CG 4.17Å; L983-L987 HydrophobicContact CG-CD1 4.05Å; L983-L987 WeakPolarHBondContact O-CB 3.41Å; L983-L987 PolarHBondContact O-N 3.03Å; L987-P989 VanDerWaalsContact C-CD 3.43Å; L987-G990 PolarHBondContact O-N 2.81Å; L987-T991 PolarHBondContact O-N 2.92Å; L987-T991 VanDerWaalsContact O-N 3.08Å; L987-T991 PolarHBondContact O-OG1 3.32Å; L987-M1318 HydrophobicContact CD1-CE 4.45Å; L987-M1318 HydrophobicContact CD2-CE 3.52Å; L987-M1318 HydrophobicContact CD2-CG 4.06Å; L987-M1318 HydrophobicContact CG-CE 3.74Å; L987-F1322 HydrophobicContact CD1-CD2 4.3Å; L987-F1322 HydrophobicContact CD1-CE2 4.46Å; L987-F1322 HydrophobicContact CD2-CB 3.88Å; L987-F1322 HydrophobicContact CD2-CD1 4.47Å; L987-F1322 HydrophobicContact CD2-CD2 4.25Å; L987-F1322 HydrophobicContact CD2-CG 3.95Å
988	G	87.9	Confident	88.1	Confident	13 Å²	13	29.1 Å²	29.1	13%	0.134	16%	0.163	C	C	.	.	H	α-helix	trans	-51.2	-44.1	179.5	0	0	0	0	0	115	S984 G990 T991 I992	S984-G988 WeakPolarHBondContact O-CA 3.38Å; S984-G988 PolarHBondContact O-N 2.9Å; G988-G990 PolarHBondContact O-N 2.88Å; G988-T991 WeakPolarHBondContact O-CB 3.43Å; G988-T991 PolarHBondContact O-N 3.42Å; G988-I992 WeakPolarHBondContact O-CG1 3.34Å; G988-I992 PolarHBondContact O-N 3.37Å
989	P	90.4	Very high	87.5	Confident	6 Å²	6	29.5 Å²	29.5	4%	0.039	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-47.6	178.2	-22.1	31.2	0	0	0	113.1	L987 T991 I992 L993 L1109 T1112 F1315	L987-P989 VanDerWaalsContact C-CD 3.43Å; P989-T991 VanDerWaalsContact C-N 3.32Å; P989-T991 PolarHBondContact O-N 2.78Å; P989-I992 PolarHBondContact O-N 3.01Å; P989-L993 WeakPolarHBondContact O-CB 3.23Å; P989-L993 PolarHBondContact O-N 3.09Å; P989-L1109 HydrophobicContact CB-CD1 3.73Å; P989-T1112 HydrophobicContact CG-CG2 4.1Å; P989-F1315 HydrophobicContact CG-CE2 4.29Å; P989-F1315 HydrophobicContact CG-CZ 3.67Å
990	G	88.9	Confident	87	Confident	3 Å²	3	24 Å²	24	3%	0.031	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-37.7	176.8	0	0	0	0	0	112.6	L987 G988 L993 L994 N1319	L987-G990 PolarHBondContact O-N 2.81Å; G988-G990 PolarHBondContact O-N 2.88Å; G990-L993 PolarHBondContact O-N 2.94Å; G990-L994 WeakPolarHBondContact O-CD1 3.46Å; G990-L994 WeakPolarHBondContact O-CG 3.32Å; G990-L994 PolarHBondContact O-N 2.78Å; G990-N1319 PolarHBondContact N-OD1 2.94Å
991	T	86.4	Confident	86.7	Confident	27 Å²	27	25.2 Å²	25.2	17%	0.166	15%	0.148	C	C	.	.	H	α-helix	trans	-60.8	-50	173.6	-55.5	0	0	0	0	111.8	L987 G988 P989 L993 L994 M995 F1376	L987-T991 PolarHBondContact O-N 2.92Å; L987-T991 VanDerWaalsContact O-N 3.08Å; L987-T991 PolarHBondContact O-OG1 3.32Å; G988-T991 WeakPolarHBondContact O-CB 3.43Å; G988-T991 PolarHBondContact O-N 3.42Å; P989-T991 VanDerWaalsContact C-N 3.32Å; P989-T991 PolarHBondContact O-N 2.78Å; T991-L993 VanDerWaalsContact C-N 3.32Å; T991-L993 PolarHBondContact O-N 3.21Å; T991-L994 PolarHBondContact O-N 3.47Å; T991-M995 WeakPolarHBondContact O-CB 3.48Å; T991-M995 PolarHBondContact O-N 2.96Å; T991-F1376 HydrophobicContact CG2-CE1 3.48Å; T991-F1376 VanDerWaalsContact CG2-CE1 3.48Å; T991-F1376 HydrophobicContact CG2-CE2 4.39Å; T991-F1376 HydrophobicContact CG2-CZ 3.29Å; T991-F1376 WeakPolarHBondContact OG1-CZ 3.45Å
992	I	87.8	Confident	86	Confident	23 Å²	23	26 Å²	26	12%	0.118	15%	0.152	C	C	.	.	H	α-helix	trans	-65.5	-37.6	-179.5	-67	-57.3	0	0	0	110.8	G988 P989 M995 I996 I1104 P1105 L1109	G988-I992 WeakPolarHBondContact O-CG1 3.34Å; G988-I992 PolarHBondContact O-N 3.37Å; P989-I992 PolarHBondContact O-N 3.01Å; I992-M995 HydrophobicContact CD1-CE 4Å; I992-M995 HydrophobicContact CD1-SD 4.2Å; I992-M995 HydrophobicContact CG2-CE 4.48Å; I992-M995 PolarHBondContact O-N 2.79Å; I992-I996 HydrophobicContact CG2-CD1 3.73Å; I992-I996 HydrophobicContact CG2-CG1 4.43Å; I992-I996 VanDerWaalsContact O-CD1 3.3Å; I992-I996 WeakPolarHBondContact O-CD1 3.23Å; I992-I996 WeakPolarHBondContact O-CG1 3.33Å; I992-I996 PolarHBondContact O-N 3.45Å; I992-I1104 HydrophobicContact CD1-CG2 3.67Å; I992-I1104 HydrophobicContact CG1-CG2 4.28Å; I992-I1104 HydrophobicContact CG2-CG2 4.2Å; I992-P1105 HydrophobicContact CG2-CB 4.3Å; I992-L1109 HydrophobicContact CG2-CB 4.28Å
993	L	88.8	Confident	85.5	Confident	9 Å²	9	26.9 Å²	26.9	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-59.8	-48.9	173.1	-174.9	147	0	0	0	111.8	P989 G990 T991 I996 V997 F1012 I1015 F1016 V1019 L1109 V1323	P989-L993 WeakPolarHBondContact O-CB 3.23Å; P989-L993 PolarHBondContact O-N 3.09Å; G990-L993 PolarHBondContact O-N 2.94Å; T991-L993 VanDerWaalsContact C-N 3.32Å; T991-L993 PolarHBondContact O-N 3.21Å; L993-I996 PolarHBondContact O-N 3.12Å; L993-V997 HydrophobicContact CD2-CG2 4.27Å; L993-V997 WeakPolarHBondContact O-CG2 3.48Å; L993-V997 PolarHBondContact O-N 3.03Å; L993-F1012 HydrophobicContact CD2-CE2 4.42Å; L993-I1015 HydrophobicContact CG-CG2 4.08Å; L993-F1016 HydrophobicContact CD1-CD2 4.36Å; L993-V1019 HydrophobicContact CD1-CB 4.3Å; L993-V1019 HydrophobicContact CD1-CG1 4.16Å; L993-V1019 HydrophobicContact CD1-CG2 4.25Å; L993-L1109 HydrophobicContact CB-CD2 4.48Å; L993-V1323 HydrophobicContact CD2-CG1 3.99Å; L993-V1323 HydrophobicContact CD2-CG2 4.28Å
994	L	84.9	Confident	85.2	Confident	17 Å²	17	30.2 Å²	30.2	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-62.3	-43	177.2	-72.7	161.4	0	0	0	112.7	G990 T991 I996 V997 G998 F1322 V1323 I1326	G990-L994 WeakPolarHBondContact O-CD1 3.46Å; G990-L994 WeakPolarHBondContact O-CG 3.32Å; G990-L994 PolarHBondContact O-N 2.78Å; T991-L994 PolarHBondContact O-N 3.47Å; L994-I996 VanDerWaalsContact C-N 3.31Å; L994-I996 PolarHBondContact O-N 2.82Å; L994-V997 PolarHBondContact O-N 3.28Å; L994-G998 PolarHBondContact O-N 2.88Å; L994-F1322 HydrophobicContact CD1-CD1 4.28Å; L994-F1322 HydrophobicContact CD1-CE1 3.88Å; L994-V1323 HydrophobicContact CD1-CG2 4.27Å; L994-V1323 HydrophobicContact CD2-CG1 4.18Å; L994-V1323 HydrophobicContact CG-CG1 4.46Å; L994-V1323 HydrophobicContact CG-CG2 4.19Å; L994-I1326 HydrophobicContact CD1-CB 3.67Å; L994-I1326 HydrophobicContact CD1-CG1 3.69Å; L994-I1326 HydrophobicContact CD1-CG2 3.84Å; L994-I1326 HydrophobicContact CD2-CB 4.14Å; L994-I1326 HydrophobicContact CD2-CG2 4.02Å
995	M	81.9	Confident	84.9	Confident	79 Å²	79	36 Å²	36	39%	0.389	20%	0.201	S	C	.	.	H	α-helix	trans	-57.1	-45.3	176.3	-178.7	-166.3	76	0	0	111.2	T991 I992 A999 M1049 I1104	T991-M995 WeakPolarHBondContact O-CB 3.48Å; T991-M995 PolarHBondContact O-N 2.96Å; I992-M995 HydrophobicContact CD1-CE 4Å; I992-M995 HydrophobicContact CD1-SD 4.2Å; I992-M995 HydrophobicContact CG2-CE 4.48Å; I992-M995 PolarHBondContact O-N 2.79Å; M995-A999 WeakPolarHBondContact O-CB 3.48Å; M995-A999 PolarHBondContact O-N 3.12Å; M995-M1049 HydrophobicContact CE-CE 4.22Å; M995-M1049 HydrophobicContact CE-SD 4.27Å; M995-I1104 HydrophobicContact CE-CG2 4.49Å
996	I	84.8	Confident	84.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-45.2	178.5	-65	161.9	0	0	0	110.7	I992 L993 L994 G998 A999 V1000 I1015 F1045 L1048 M1049 P1105	I992-I996 HydrophobicContact CG2-CD1 3.73Å; I992-I996 HydrophobicContact CG2-CG1 4.43Å; I992-I996 VanDerWaalsContact O-CD1 3.3Å; I992-I996 WeakPolarHBondContact O-CD1 3.23Å; I992-I996 WeakPolarHBondContact O-CG1 3.33Å; I992-I996 PolarHBondContact O-N 3.45Å; L993-I996 PolarHBondContact O-N 3.12Å; L994-I996 VanDerWaalsContact C-N 3.31Å; L994-I996 PolarHBondContact O-N 2.82Å; I996-G998 PolarHBondContact O-N 2.83Å; I996-A999 PolarHBondContact O-N 2.9Å; I996-V1000 HydrophobicContact CG2-CG2 4.24Å; I996-V1000 WeakPolarHBondContact O-CB 3.32Å; I996-V1000 VanDerWaalsContact O-CG2 3.28Å; I996-V1000 WeakPolarHBondContact O-CG2 3.41Å; I996-V1000 PolarHBondContact O-N 3.29Å; I996-I1015 HydrophobicContact CG2-CD1 3.56Å; I996-I1015 HydrophobicContact CG2-CG1 3.9Å; I996-I1015 HydrophobicContact CG2-CG2 4.22Å; I996-F1045 HydrophobicContact CD1-CD1 4.34Å; I996-F1045 HydrophobicContact CD1-CE1 4.34Å; I996-L1048 HydrophobicContact CG2-CD2 3.32Å; I996-M1049 HydrophobicContact CG1-SD 4.41Å; I996-P1105 HydrophobicContact CD1-CB 3.75Å; I996-P1105 HydrophobicContact CD1-CG 3.68Å; I996-P1105 HydrophobicContact CG1-CG 4.48Å
997	V	85.8	Confident	84.3	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.012	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-45.8	178.3	168.6	0	0	0	0	111.8	L993 L994 V1000 N1001 F1012 I1015	L993-V997 HydrophobicContact CD2-CG2 4.27Å; L993-V997 WeakPolarHBondContact O-CG2 3.48Å; L993-V997 PolarHBondContact O-N 3.03Å; L994-V997 PolarHBondContact O-N 3.28Å; V997-V1000 PolarHBondContact O-N 3.41Å; V997-N1001 PolarHBondContact O-N 3.44Å; V997-N1001 VanDerWaalsContact O-N 3.1Å; V997-F1012 HydrophobicContact CG1-CB 4.04Å; V997-F1012 HydrophobicContact CG1-CD2 4.31Å; V997-F1012 HydrophobicContact CG2-CD2 4.45Å; V997-I1015 HydrophobicContact CG2-CB 3.76Å; V997-I1015 HydrophobicContact CG2-CG1 3.96Å; V997-I1015 HydrophobicContact CG2-CG2 4.11Å
998	G	78.9	Confident	84	Confident	28 Å²	28	41.3 Å²	41.3	29%	0.289	23%	0.228	S	C	.	.	H	α-helix	trans	-63.5	-43.4	177.2	0	0	0	0	0	112.6	L994 I996 N1001 I1002	L994-G998 PolarHBondContact O-N 2.88Å; I996-G998 PolarHBondContact O-N 2.83Å; G998-N1001 WeakPolarHBondContact O-CB 3.48Å; G998-N1001 PolarHBondContact O-N 3.13Å; G998-I1002 WeakPolarHBondContact O-CG1 3.37Å; G998-I1002 PolarHBondContact O-N 2.94Å; G998-I1002 VanDerWaalsContact O-N 3.1Å
999	A	79.8	Confident	83.8	Confident	11 Å²	11	46.2 Å²	46.2	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-70.7	-31.7	178.2	0	0	0	0	0	113.4	M995 I996 I1002 S1003 V1052	M995-A999 WeakPolarHBondContact O-CB 3.48Å; M995-A999 PolarHBondContact O-N 3.12Å; I996-A999 PolarHBondContact O-N 2.9Å; A999-I1002 PolarHBondContact O-N 2.81Å; A999-S1003 VanDerWaalsContact O-CB 3.26Å; A999-S1003 WeakPolarHBondContact O-CB 3.12Å; A999-S1003 PolarHBondContact O-N 2.86Å; A999-S1003 PolarHBondContact O-OG 3.28Å; A999-V1052 HydrophobicContact CB-CB 4.05Å; A999-V1052 HydrophobicContact CB-CG1 3.68Å; A999-V1052 HydrophobicContact CB-CG2 3.84Å
1000	V	82.2	Confident	83.7	Confident	6 Å²	6	49.7 Å²	49.7	4%	0.036	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-47.4	172	164.3	0	0	0	0	110.7	I996 V997 I1002 S1003 F1004 I1015 L1048	I996-V1000 HydrophobicContact CG2-CG2 4.24Å; I996-V1000 WeakPolarHBondContact O-CB 3.32Å; I996-V1000 VanDerWaalsContact O-CG2 3.28Å; I996-V1000 WeakPolarHBondContact O-CG2 3.41Å; I996-V1000 PolarHBondContact O-N 3.29Å; V997-V1000 PolarHBondContact O-N 3.41Å; V1000-I1002 PolarHBondContact O-N 2.94Å; V1000-S1003 PolarHBondContact O-N 3.36Å; V1000-F1004 HydrophobicContact CG1-CD2 4.1Å; V1000-F1004 WeakPolarHBondContact O-CD2 3.19Å; V1000-F1004 PolarHBondContact O-N 3.21Å; V1000-I1015 HydrophobicContact CG2-CD1 4.3Å; V1000-L1048 HydrophobicContact CG2-CD1 4.38Å; V1000-L1048 HydrophobicContact CG2-CD2 3.85Å; V1000-L1048 HydrophobicContact CG2-CG 4.37Å
1001	N	83.6	Confident	83.7	Confident	41 Å²	41	49.6 Å²	49.6	22%	0.219	26%	0.263	C	S	.	.	H	α-helix	trans	-52.4	-52.9	173.4	174	-37.1	0	0	0	110.8	V997 G998 S1003 N1005 T1006 T1008	V997-N1001 PolarHBondContact O-N 3.44Å; V997-N1001 VanDerWaalsContact O-N 3.1Å; G998-N1001 WeakPolarHBondContact O-CB 3.48Å; G998-N1001 PolarHBondContact O-N 3.13Å; N1001-S1003 VanDerWaalsContact C-N 3.35Å; N1001-S1003 PolarHBondContact O-N 3.42Å; N1001-N1005 WeakPolarHBondContact O-CA 3.46Å; N1001-N1005 PolarHBondContact O-N 3Å; N1001-T1006 PolarHBondContact ND2-O 2.97Å; N1001-T1006 PolarHBondContact O-N 2.75Å; N1001-T1008 PolarHBondContact ND2-OG1 2.66Å; N1001-T1008 VanDerWaalsContact ND2-OG1 3.09Å
1002	I	76.9	Confident	83.7	Confident	55 Å²	55	49.7 Å²	49.7	28%	0.282	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-37.2	179.9	-65.3	168.8	0	0	0	112.7	G998 A999 V1000 Q1059	G998-I1002 WeakPolarHBondContact O-CG1 3.37Å; G998-I1002 PolarHBondContact O-N 2.94Å; G998-I1002 VanDerWaalsContact O-N 3.1Å; A999-I1002 PolarHBondContact O-N 2.81Å; V1000-I1002 PolarHBondContact O-N 2.94Å; I1002-Q1059 HydrophobicContact CD1-CB 4.47Å; I1002-Q1059 HydrophobicContact CD1-CG 4.42Å
1003	S	81	Confident	83.8	Confident	42 Å²	42	55.4 Å²	55.4	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-76.7	-37.6	-174.8	-57.1	0	0	0	0	113.6	A999 V1000 N1001 A1051 G1055	A999-S1003 VanDerWaalsContact O-CB 3.26Å; A999-S1003 WeakPolarHBondContact O-CB 3.12Å; A999-S1003 PolarHBondContact O-N 2.86Å; A999-S1003 PolarHBondContact O-OG 3.28Å; V1000-S1003 PolarHBondContact O-N 3.36Å; N1001-S1003 VanDerWaalsContact C-N 3.35Å; N1001-S1003 PolarHBondContact O-N 3.42Å; S1003-A1051 PolarHBondContact OG-O 3.49Å; S1003-G1055 WeakPolarHBondContact OG-CA 3.23Å
1004	F	82.4	Confident	83.7	Confident	132 Å²	132	59.4 Å²	59.4	58%	0.579	31%	0.306	S	S	*	.	H	α-helix	trans	-108.2	-0.9	-175.5	-63.2	-78	0	0	0	113.3	V1000 T1006 A1051	V1000-F1004 HydrophobicContact CG1-CD2 4.1Å; V1000-F1004 WeakPolarHBondContact O-CD2 3.19Å; V1000-F1004 PolarHBondContact O-N 3.21Å; F1004-T1006 HydrophobicContact CB-CG2 3.88Å; F1004-T1006 PolarHBondContact O-N 3.46Å; F1004-A1051 HydrophobicContact CE2-CB 4.14Å; F1004-A1051 HydrophobicContact CZ-CB 4.16Å
1005	N	82	Confident	83.9	Confident	144 Å²	144	58.7 Å²	58.7	77%	0.77	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	34.4	-174.5	-158.6	60.3	0	0	0	112.8	N1001	N1001-N1005 WeakPolarHBondContact O-CA 3.46Å; N1001-N1005 PolarHBondContact O-N 3Å
1006	T	81.8	Confident	84.2	Confident	48 Å²	48	59.2 Å²	59.2	29%	0.294	30%	0.303	S	S	.	.			trans	-92.5	144.9	-177.4	45	0	0	0	0	111.7	N1001 F1004 S1011	N1001-T1006 PolarHBondContact ND2-O 2.97Å; N1001-T1006 PolarHBondContact O-N 2.75Å; F1004-T1006 HydrophobicContact CB-CG2 3.88Å; F1004-T1006 PolarHBondContact O-N 3.46Å; T1006-S1011 PolarHBondContact O-OG 2.84Å; T1006-S1011 PolarHBondContact OG1-OG 3.12Å
1007	E	84.9	Confident	84.5	Confident	140 Å²	140	66.2 Å²	66.2	65%	0.654	33%	0.333	S	S	*	.			trans	-50.7	144	175.7	-65.7	-176.2	-169.4	0	0	112.6	Y1009 V1010 S1011	E1007-Y1009 PolarHBondContact O-N 3.24Å; E1007-V1010 HydrophobicContact CB-CG2 4.21Å; E1007-V1010 PolarHBondContact O-N 2.8Å; E1007-S1011 WeakPolarHBondContact O-CB 3.41Å; E1007-S1011 PolarHBondContact O-N 3.05Å; E1007-S1011 PolarHBondContact O-OG 2.85Å
1008	T	82.3	Confident	84.7	Confident	42 Å²	42	68 Å²	68	26%	0.258	35%	0.345	S	S	.	.	H	α-helix	trans	-59.2	-36.2	-176.7	-33.5	0	0	0	0	112	N1001 F1012 F1327	N1001-T1008 PolarHBondContact ND2-OG1 2.66Å; N1001-T1008 VanDerWaalsContact ND2-OG1 3.09Å; T1008-F1012 VanDerWaalsContact O-CB 3.26Å; T1008-F1012 WeakPolarHBondContact O-CB 3.33Å; T1008-F1012 PolarHBondContact O-N 3.45Å; T1008-F1327 HydrophobicContact CG2-CE2 3.92Å
1009	Y	84.8	Confident	85.3	Confident	116 Å²	116	67.2 Å²	67.2	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-64.7	-48.3	176.6	-58.8	-78	0	0	0	112.4	E1007 S1011 F1012 F1013 F1327 L1331	E1007-Y1009 PolarHBondContact O-N 3.24Å; Y1009-S1011 VanDerWaalsContact C-N 3.33Å; Y1009-S1011 PolarHBondContact O-N 3.36Å; Y1009-F1012 WeakPolarHBondContact O-CB 3.44Å; Y1009-F1012 PolarHBondContact O-N 2.8Å; Y1009-F1013 VanDerWaalsContact O-CD2 3.25Å; Y1009-F1013 WeakPolarHBondContact O-CD2 3.4Å; Y1009-F1013 PolarHBondContact O-N 3.22Å; Y1009-F1327 HydrophobicContact CD1-CE1 4.05Å; Y1009-F1327 AromaticContact CD1-CZ 3.64Å; Y1009-F1327 HydrophobicContact CD1-CZ 3.64Å; Y1009-F1327 AromaticContact CE1-CE1 3.94Å; Y1009-F1327 HydrophobicContact CE1-CE1 3.94Å; Y1009-F1327 AromaticContact CE1-CZ 3.85Å; Y1009-F1327 HydrophobicContact CE1-CZ 3.85Å; Y1009-F1327 HydrophobicContact CG-CZ 4.45Å; Y1009-L1331 HydrophobicContact CE1-CD1 3.86Å; Y1009-L1331 HydrophobicContact CE1-CD2 4.08Å; Y1009-L1331 HydrophobicContact CE2-CD2 4.19Å; Y1009-L1331 WeakPolarHBondContact OH-CD1 3.41Å; Y1009-L1331 WeakPolarHBondContact OH-CD2 3.3Å
1010	V	88.2	Confident	85.8	Confident	78 Å²	78	67.9 Å²	67.9	47%	0.473	34%	0.343	S	S	.	.	H	α-helix	trans	-61.7	-45.1	177.9	179.3	0	0	0	0	110.2	E1007 F1012 F1013 L1014	E1007-V1010 HydrophobicContact CB-CG2 4.21Å; E1007-V1010 PolarHBondContact O-N 2.8Å; V1010-F1012 VanDerWaalsContact C-N 3.29Å; V1010-F1012 PolarHBondContact O-N 2.89Å; V1010-F1013 PolarHBondContact O-N 3.41Å; V1010-L1014 VanDerWaalsContact O-CB 3.29Å; V1010-L1014 WeakPolarHBondContact O-CB 3.19Å; V1010-L1014 PolarHBondContact O-N 2.92Å
1011	S	88.1	Confident	86.2	Confident	1 Å²	1	72 Å²	72	1%	0.007	36%	0.364	C	S	.	.	H	α-helix	trans	-60	-38.6	176.4	-49.6	0	0	0	0	111.8	T1006 E1007 Y1009	T1006-S1011 PolarHBondContact O-OG 2.84Å; T1006-S1011 PolarHBondContact OG1-OG 3.12Å; E1007-S1011 WeakPolarHBondContact O-CB 3.41Å; E1007-S1011 PolarHBondContact O-N 3.05Å; E1007-S1011 PolarHBondContact O-OG 2.85Å; Y1009-S1011 VanDerWaalsContact C-N 3.33Å; Y1009-S1011 PolarHBondContact O-N 3.36Å
1012	F	87.4	Confident	86.7	Confident	30 Å²	30	70.2 Å²	70.2	13%	0.132	36%	0.355	C	S	.	.	H	α-helix	trans	-66.8	-52.8	176.2	-172.7	-83.9	0	0	0	112	L993 V997 T1008 Y1009 V1010 L1014 I1015 F1016 V1323 F1327	L993-F1012 HydrophobicContact CD2-CE2 4.42Å; V997-F1012 HydrophobicContact CG1-CB 4.04Å; V997-F1012 HydrophobicContact CG1-CD2 4.31Å; V997-F1012 HydrophobicContact CG2-CD2 4.45Å; T1008-F1012 VanDerWaalsContact O-CB 3.26Å; T1008-F1012 WeakPolarHBondContact O-CB 3.33Å; T1008-F1012 PolarHBondContact O-N 3.45Å; Y1009-F1012 WeakPolarHBondContact O-CB 3.44Å; Y1009-F1012 PolarHBondContact O-N 2.8Å; V1010-F1012 VanDerWaalsContact C-N 3.29Å; V1010-F1012 PolarHBondContact O-N 2.89Å; F1012-L1014 VanDerWaalsContact C-N 3.32Å; F1012-L1014 PolarHBondContact O-N 3.07Å; F1012-I1015 PolarHBondContact O-N 2.65Å; F1012-F1016 HydrophobicContact CD1-CB 4.15Å; F1012-F1016 HydrophobicContact CE1-CB 3.97Å; F1012-F1016 AromaticContact CE1-CD2 3.98Å; F1012-F1016 HydrophobicContact CE1-CD2 3.98Å; F1012-F1016 AromaticContact CE1-CG 3.98Å; F1012-F1016 HydrophobicContact CE1-CG 3.98Å; F1012-F1016 HydrophobicContact CZ-CD2 4.11Å; F1012-F1016 VanDerWaalsContact O-CB 3.25Å; F1012-F1016 WeakPolarHBondContact O-CB 3.48Å; F1012-F1016 PolarHBondContact O-N 2.91Å; F1012-V1323 HydrophobicContact CE2-CG1 3.46Å; F1012-V1323 VanDerWaalsContact CE2-CG1 3.46Å; F1012-V1323 HydrophobicContact CZ-CG1 3.65Å; F1012-F1327 HydrophobicContact CB-CE2 4.13Å; F1012-F1327 HydrophobicContact CB-CZ 4.48Å; F1012-F1327 AromaticContact CD2-CD2 3.76Å; F1012-F1327 HydrophobicContact CD2-CD2 3.76Å; F1012-F1327 AromaticContact CD2-CE2 3.87Å; F1012-F1327 HydrophobicContact CD2-CE2 3.87Å; F1012-F1327 HydrophobicContact CD2-CG 4.31Å; F1012-F1327 HydrophobicContact CE2-CD2 4.16Å; F1012-F1327 HydrophobicContact CE2-CG 4.3Å; F1012-F1327 HydrophobicContact CG-CD2 4.5Å; F1012-F1327 HydrophobicContact CG-CE2 4.18Å
1013	F	88.6	Confident	87.3	Confident	143 Å²	143	68.2 Å²	68.2	63%	0.627	35%	0.346	S	S	*	.	H	α-helix	trans	-60.4	-40.2	-179.8	-82.2	-68.6	0	0	0	112.5	Y1009 V1010 I1015 F1016 F1017	Y1009-F1013 VanDerWaalsContact O-CD2 3.25Å; Y1009-F1013 WeakPolarHBondContact O-CD2 3.4Å; Y1009-F1013 PolarHBondContact O-N 3.22Å; V1010-F1013 PolarHBondContact O-N 3.41Å; F1013-I1015 VanDerWaalsContact C-N 3.26Å; F1013-I1015 PolarHBondContact O-N 2.92Å; F1013-F1016 PolarHBondContact O-N 2.8Å; F1013-F1017 WeakPolarHBondContact O-CB 3.18Å; F1013-F1017 PolarHBondContact O-N 3.42Å
1014	L	87.4	Confident	87.8	Confident	92 Å²	92	70.2 Å²	70.2	48%	0.482	36%	0.356	S	S	.	.	H	α-helix	trans	-61.2	-31.8	-179.7	-175.9	147.6	0	0	0	113.1	V1010 F1012 P1018	V1010-L1014 VanDerWaalsContact O-CB 3.29Å; V1010-L1014 WeakPolarHBondContact O-CB 3.19Å; V1010-L1014 PolarHBondContact O-N 2.92Å; F1012-L1014 VanDerWaalsContact C-N 3.32Å; F1012-L1014 PolarHBondContact O-N 3.07Å; L1014-P1018 WeakPolarHBondContact O-CD 3.09Å; L1014-P1018 WeakPolarHBondContact O-CG 3.34Å
1015	I	89.3	Confident	88.4	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-93.4	-37.8	177.4	-59.6	-62.6	0	0	0	111.9	L993 I996 V997 V1000 F1012 F1013 P1018 V1019 F1045 L1048	L993-I1015 HydrophobicContact CG-CG2 4.08Å; I996-I1015 HydrophobicContact CG2-CD1 3.56Å; I996-I1015 HydrophobicContact CG2-CG1 3.9Å; I996-I1015 HydrophobicContact CG2-CG2 4.22Å; V997-I1015 HydrophobicContact CG2-CB 3.76Å; V997-I1015 HydrophobicContact CG2-CG1 3.96Å; V997-I1015 HydrophobicContact CG2-CG2 4.11Å; V1000-I1015 HydrophobicContact CG2-CD1 4.3Å; F1012-I1015 PolarHBondContact O-N 2.65Å; F1013-I1015 VanDerWaalsContact C-N 3.26Å; F1013-I1015 PolarHBondContact O-N 2.92Å; I1015-P1018 WeakPolarHBondContact O-CD 3.25Å; I1015-V1019 VanDerWaalsContact O-CG2 3.27Å; I1015-V1019 WeakPolarHBondContact O-CG2 3.27Å; I1015-F1045 HydrophobicContact CD1-CE1 4.33Å; I1015-F1045 HydrophobicContact CG2-CE1 4.35Å; I1015-L1048 HydrophobicContact CD1-CD1 3.72Å; I1015-L1048 HydrophobicContact CD1-CD2 4.19Å
1016	F	89	Confident	88.8	Confident	91 Å²	91	58 Å²	58	40%	0.399	30%	0.298	S	S	.	.	H	α-helix	trans	-66.6	-39	-178.7	-172.4	-92.5	0	0	0	112.2	L993 F1012 F1013 V1019 G1020	L993-F1016 HydrophobicContact CD1-CD2 4.36Å; F1012-F1016 HydrophobicContact CD1-CB 4.15Å; F1012-F1016 HydrophobicContact CE1-CB 3.97Å; F1012-F1016 AromaticContact CE1-CD2 3.98Å; F1012-F1016 HydrophobicContact CE1-CD2 3.98Å; F1012-F1016 AromaticContact CE1-CG 3.98Å; F1012-F1016 HydrophobicContact CE1-CG 3.98Å; F1012-F1016 HydrophobicContact CZ-CD2 4.11Å; F1012-F1016 VanDerWaalsContact O-CB 3.25Å; F1012-F1016 WeakPolarHBondContact O-CB 3.48Å; F1012-F1016 PolarHBondContact O-N 2.91Å; F1013-F1016 PolarHBondContact O-N 2.8Å; F1016-V1019 PolarHBondContact O-N 3.29Å; F1016-G1020 PolarHBondContact O-N 3.4Å
1017	F	89.8	Confident	89.2	Confident	146 Å²	146	58.4 Å²	58.4	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-63	-50.3	-177.5	176.5	-93.2	0	0	0	113.5	F1013 V1019 G1020 L1021	F1013-F1017 WeakPolarHBondContact O-CB 3.18Å; F1013-F1017 PolarHBondContact O-N 3.42Å; F1017-V1019 VanDerWaalsContact C-N 3.3Å; F1017-V1019 PolarHBondContact O-N 2.9Å; F1017-G1020 PolarHBondContact O-N 2.92Å; F1017-L1021 HydrophobicContact CE1-CD2 4.47Å; F1017-L1021 VanDerWaalsContact O-CB 3.31Å; F1017-L1021 WeakPolarHBondContact O-CB 3.36Å; F1017-L1021 PolarHBondContact O-N 3.12Å
1018	P	90	Very high	89.4	Confident	40 Å²	40	56.7 Å²	56.7	26%	0.26	30%	0.297	S	S	.	.	H	α-helix	trans	-58.6	-36.9	173.9	-26.5	35.4	0	0	0	114.1	L1014 I1015 F1022	L1014-P1018 WeakPolarHBondContact O-CD 3.09Å; L1014-P1018 WeakPolarHBondContact O-CG 3.34Å; I1015-P1018 WeakPolarHBondContact O-CD 3.25Å; P1018-F1022 WeakPolarHBondContact O-CB 3.39Å; P1018-F1022 PolarHBondContact O-N 2.91Å
1019	V	91.7	Very high	89.8	Confident	11 Å²	11	57.1 Å²	57.1	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-72.6	-43	-179.5	176.6	0	0	0	0	111.3	L993 I1015 F1016 F1017 F1022 A1023 F1045 L1109 I1113	L993-V1019 HydrophobicContact CD1-CB 4.3Å; L993-V1019 HydrophobicContact CD1-CG1 4.16Å; L993-V1019 HydrophobicContact CD1-CG2 4.25Å; I1015-V1019 VanDerWaalsContact O-CG2 3.27Å; I1015-V1019 WeakPolarHBondContact O-CG2 3.27Å; F1016-V1019 PolarHBondContact O-N 3.29Å; F1017-V1019 VanDerWaalsContact C-N 3.3Å; F1017-V1019 PolarHBondContact O-N 2.9Å; V1019-F1022 PolarHBondContact O-N 3.45Å; V1019-A1023 PolarHBondContact O-N 3.45Å; V1019-F1045 HydrophobicContact CG2-CE2 4.34Å; V1019-F1045 HydrophobicContact CG2-CZ 3.8Å; V1019-L1109 HydrophobicContact CG1-CD1 3.98Å; V1019-L1109 HydrophobicContact CG1-CG 4.48Å; V1019-L1109 HydrophobicContact CG2-CD2 3.85Å; V1019-I1113 HydrophobicContact CG1-CD1 3.85Å
1020	G	90.4	Very high	89.9	Confident	26 Å²	26	56 Å²	56	27%	0.268	31%	0.307	S	S	.	.	H	α-helix	trans	-62.6	-43.9	173.7	0	0	0	0	0	112.1	F1016 F1017 F1022 A1023 V1024	F1016-G1020 PolarHBondContact O-N 3.4Å; F1017-G1020 PolarHBondContact O-N 2.92Å; G1020-F1022 VanDerWaalsContact C-N 3.35Å; G1020-F1022 PolarHBondContact O-N 2.95Å; G1020-A1023 PolarHBondContact O-N 3.34Å; G1020-V1024 WeakPolarHBondContact O-CG2 3.3Å; G1020-V1024 PolarHBondContact O-N 3.11Å
1021	L	91.3	Very high	89.8	Confident	92 Å²	92	54.2 Å²	54.2	48%	0.482	30%	0.296	S	S	.	.	H	α-helix	trans	-59.5	-44.5	173.9	-178.4	63.6	0	0	0	111.5	F1017 V1024 V1025	F1017-L1021 HydrophobicContact CE1-CD2 4.47Å; F1017-L1021 VanDerWaalsContact O-CB 3.31Å; F1017-L1021 WeakPolarHBondContact O-CB 3.36Å; F1017-L1021 PolarHBondContact O-N 3.12Å; L1021-V1024 PolarHBondContact O-N 3.14Å; L1021-V1025 WeakPolarHBondContact O-CG2 3.37Å; L1021-V1025 PolarHBondContact O-N 2.83Å
1022	F	92.8	Very high	89.8	Confident	3 Å²	3	60.2 Å²	60.2	1%	0.013	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-40.5	176.3	-178	-105.7	0	0	0	112.7	P1018 V1019 G1020 V1025 C1026 V1037 A1038 L1110 I1113	P1018-F1022 WeakPolarHBondContact O-CB 3.39Å; P1018-F1022 PolarHBondContact O-N 2.91Å; V1019-F1022 PolarHBondContact O-N 3.45Å; G1020-F1022 VanDerWaalsContact C-N 3.35Å; G1020-F1022 PolarHBondContact O-N 2.95Å; F1022-V1025 PolarHBondContact O-N 3.2Å; F1022-C1026 VanDerWaalsContact CE1-SG 3.51Å; F1022-C1026 WeakPolarHBondContact CZ-SG 3.49Å; F1022-C1026 WeakPolarHBondContact O-CB 3.44Å; F1022-C1026 PolarHBondContact O-N 3.42Å; F1022-C1026 PolarHBondContact O-SG 2.86Å; F1022-V1037 HydrophobicContact CD2-CG1 3.93Å; F1022-V1037 HydrophobicContact CE2-CG1 4.48Å; F1022-A1038 HydrophobicContact CE2-CB 3.76Å; F1022-A1038 HydrophobicContact CZ-CB 3.91Å; F1022-L1110 HydrophobicContact CB-CD2 4.38Å; F1022-L1110 HydrophobicContact CD1-CB 4.4Å; F1022-L1110 HydrophobicContact CD1-CD2 3.61Å; F1022-L1110 HydrophobicContact CE1-CB 3.93Å; F1022-L1110 HydrophobicContact CE1-CD2 4.02Å; F1022-L1110 WeakPolarHBondContact CE1-O 3.4Å; F1022-L1110 HydrophobicContact CG-CD2 3.93Å; F1022-L1110 HydrophobicContact CZ-CB 4.28Å; F1022-I1113 HydrophobicContact CD1-CB 4.39Å; F1022-I1113 HydrophobicContact CD1-CG2 4.02Å; F1022-I1113 HydrophobicContact CE1-CB 4.23Å; F1022-I1113 HydrophobicContact CE1-CG2 4.07Å
1023	A	91.3	Very high	89.9	Confident	13 Å²	13	61.5 Å²	61.5	11%	0.107	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-40.9	175.3	0	0	0	0	0	112.1	V1019 G1020 C1026 L1027 I1113 I1316	V1019-A1023 PolarHBondContact O-N 3.45Å; G1020-A1023 PolarHBondContact O-N 3.34Å; A1023-C1026 PolarHBondContact O-N 3.09Å; A1023-L1027 WeakPolarHBondContact O-CG 3.48Å; A1023-L1027 PolarHBondContact O-N 3.06Å; A1023-I1113 HydrophobicContact CB-CG2 4.11Å; A1023-I1316 HydrophobicContact CB-CD1 4.45Å
1024	V	91.4	Very high	90.1	Very high	84 Å²	84	54.9 Å²	54.9	51%	0.509	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-48.7	173.4	171.1	0	0	0	0	110.9	G1020 L1021 C1026 L1027 T1028	G1020-V1024 WeakPolarHBondContact O-CG2 3.3Å; G1020-V1024 PolarHBondContact O-N 3.11Å; L1021-V1024 PolarHBondContact O-N 3.14Å; V1024-C1026 VanDerWaalsContact C-N 3.27Å; V1024-C1026 PolarHBondContact O-N 2.88Å; V1024-L1027 PolarHBondContact O-N 2.82Å; V1024-T1028 HydrophobicContact CG1-CG2 4.47Å; V1024-T1028 PolarHBondContact O-N 3.25Å; V1024-T1028 VanDerWaalsContact O-N 3.08Å; V1024-T1028 PolarHBondContact O-OG1 3.45Å; V1024-T1028 VanDerWaalsContact O-OG1 3.06Å
1025	V	93.3	Very high	90.3	Very high	21 Å²	21	50.9 Å²	50.9	13%	0.127	29%	0.285	C	S	.	.	H	α-helix	trans	-56.9	-39.4	176.2	166.4	0	0	0	0	111.6	L1021 F1022 L1027 C1029 Q1034 V1037	L1021-V1025 WeakPolarHBondContact O-CG2 3.37Å; L1021-V1025 PolarHBondContact O-N 2.83Å; F1022-V1025 PolarHBondContact O-N 3.2Å; V1025-L1027 VanDerWaalsContact C-N 3.25Å; V1025-L1027 PolarHBondContact O-N 2.93Å; V1025-C1029 HydrophobicContact CG1-CB 4.02Å; V1025-C1029 VanDerWaalsContact O-CB 3.27Å; V1025-C1029 WeakPolarHBondContact O-CB 3.43Å; V1025-C1029 PolarHBondContact O-N 3.43Å; V1025-Q1034 HydrophobicContact CG1-CG 4.19Å; V1025-V1037 HydrophobicContact CG1-CB 4.44Å; V1025-V1037 HydrophobicContact CG1-CG2 4.36Å
1026	C	91.4	Very high	90.4	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.6	-16.8	176.7	-68.1	0	0	0	0	114.6	F1022 A1023 V1024 Q1034 C1117	F1022-C1026 VanDerWaalsContact CE1-SG 3.51Å; F1022-C1026 WeakPolarHBondContact CZ-SG 3.49Å; F1022-C1026 WeakPolarHBondContact O-CB 3.44Å; F1022-C1026 PolarHBondContact O-N 3.42Å; F1022-C1026 PolarHBondContact O-SG 2.86Å; A1023-C1026 PolarHBondContact O-N 3.09Å; V1024-C1026 VanDerWaalsContact C-N 3.27Å; V1024-C1026 PolarHBondContact O-N 2.88Å; C1026-Q1034 PolarHBondContact O-NE2 2.95Å; C1026-C1117 HydrophobicContact CB-CB 3.58Å
1027	L	89.3	Confident	90.6	Very high	55 Å²	55	54.5 Å²	54.5	29%	0.288	31%	0.305	S	S	.	.	H	α-helix	trans	-97	-28	178.1	-70.2	170.4	0	0	0	113.3	A1023 V1024 V1025 C1117 R1308 I1316	A1023-L1027 WeakPolarHBondContact O-CG 3.48Å; A1023-L1027 PolarHBondContact O-N 3.06Å; V1024-L1027 PolarHBondContact O-N 2.82Å; V1025-L1027 VanDerWaalsContact C-N 3.25Å; V1025-L1027 PolarHBondContact O-N 2.93Å; L1027-C1117 HydrophobicContact CD2-CB 4.07Å; L1027-C1117 HydrophobicContact CG-CB 4.45Å; L1027-R1308 PolarHBondContact O-NH1 2.91Å; L1027-R1308 VanDerWaalsContact O-NH1 3.13Å; L1027-R1308 PolarHBondContact O-NH2 2.73Å; L1027-I1316 HydrophobicContact CD1-CD1 4.49Å
1028	T	89.7	Confident	90.7	Very high	104 Å²	104	47.6 Å²	47.6	64%	0.638	28%	0.275	S	S	*	.	H	α-helix	trans	-112.3	-31.9	-172.4	61.8	0	0	0	0	115.4	V1024	V1024-T1028 HydrophobicContact CG1-CG2 4.47Å; V1024-T1028 PolarHBondContact O-N 3.25Å; V1024-T1028 VanDerWaalsContact O-N 3.08Å; V1024-T1028 PolarHBondContact O-OG1 3.45Å; V1024-T1028 VanDerWaalsContact O-OG1 3.06Å
1029	C	89.9	Confident	90.8	Very high	52 Å²	52	48.9 Å²	48.9	35%	0.351	28%	0.277	S	S	.	.	S	Bend	trans	-93.8	169.2	-172.6	-56.5	0	0	0	0	113.1	V1025 T1033 Q1034	V1025-C1029 HydrophobicContact CG1-CB 4.02Å; V1025-C1029 VanDerWaalsContact O-CB 3.27Å; V1025-C1029 WeakPolarHBondContact O-CB 3.43Å; V1025-C1029 PolarHBondContact O-N 3.43Å; C1029-T1033 WeakPolarHBondContact CB-OG1 3.43Å; C1029-Q1034 HydrophobicContact CB-CG 4.42Å; C1029-Q1034 PolarHBondContact O-NE2 3.29Å
1030	T	88	Confident	90.8	Very high	92 Å²	92	53.6 Å²	53.6	56%	0.564	31%	0.306	S	S	*	.			trans	-73.9	152.1	178.2	59.3	0	0	0	0	112.4	E1032 T1033 Q1034	T1030-E1032 VanDerWaalsContact C-N 3.25Å; T1030-E1032 PolarHBondContact O-N 3.21Å; T1030-E1032 VanDerWaalsContact O-N 3.13Å; T1030-T1033 PolarHBondContact N-OG1 3.1Å; T1030-T1033 PolarHBondContact O-N 3.13Å; T1030-T1033 PolarHBondContact O-OG1 3.26Å; T1030-T1033 PolarHBondContact OG1-OG1 3.05Å; T1030-Q1034 WeakPolarHBondContact O-CG 3.12Å; T1030-Q1034 PolarHBondContact O-N 2.73Å
1031	T	86	Confident	90.8	Very high	41 Å²	41	53.2 Å²	53.2	25%	0.252	30%	0.299	S	S	.	.	H	α-helix	trans	-55.2	-36.4	-176.6	-48.4	0	0	0	0	113.5	L1035 Y1114	T1031-L1035 HydrophobicContact CG2-CD1 4.25Å; T1031-L1035 WeakPolarHBondContact O-CB 3.28Å; T1031-L1035 VanDerWaalsContact O-CG 3.24Å; T1031-L1035 WeakPolarHBondContact O-CG 3.14Å; T1031-L1035 PolarHBondContact O-N 3.3Å; T1031-Y1114 HydrophobicContact CG2-CE2 4.23Å; T1031-Y1114 WeakPolarHBondContact CG2-OH 3.24Å
1032	E	87.9	Confident	90.8	Very high	126 Å²	126	49.1 Å²	49.1	59%	0.589	28%	0.279	S	S	*	.	H	α-helix	trans	-61.4	-45.5	172.6	-81.6	-172	-127	0	0	114	T1030 L1035 K1036	T1030-E1032 VanDerWaalsContact C-N 3.25Å; T1030-E1032 PolarHBondContact O-N 3.21Å; T1030-E1032 VanDerWaalsContact O-N 3.13Å; E1032-L1035 PolarHBondContact O-N 2.77Å; E1032-K1036 WeakPolarHBondContact O-CB 3.42Å; E1032-K1036 WeakPolarHBondContact O-CD 3.21Å; E1032-K1036 VanDerWaalsContact O-CG 3.3Å; E1032-K1036 WeakPolarHBondContact O-CG 3.46Å; E1032-K1036 PolarHBondContact O-N 3.39Å; E1032-K1036 IonicContact OE2-NZ 3.79Å; E1032-K1036 PolarHBondContact OE2-NZ 3.19Å
1033	T	89.9	Confident	90.6	Very high	58 Å²	58	51.8 Å²	51.8	36%	0.356	30%	0.302	S	S	.	.	H	α-helix	trans	-71.7	-37.3	-177.3	47.8	0	0	0	0	110.3	C1029 T1030 L1035 K1036 V1037	C1029-T1033 WeakPolarHBondContact CB-OG1 3.43Å; T1030-T1033 PolarHBondContact N-OG1 3.1Å; T1030-T1033 PolarHBondContact O-N 3.13Å; T1030-T1033 PolarHBondContact O-OG1 3.26Å; T1030-T1033 PolarHBondContact OG1-OG1 3.05Å; T1033-L1035 PolarHBondContact O-N 3.49Å; T1033-K1036 PolarHBondContact O-N 3.41Å; T1033-V1037 VanDerWaalsContact O-CG2 3.31Å; T1033-V1037 WeakPolarHBondContact O-CG2 3.39Å; T1033-V1037 PolarHBondContact O-N 3.02Å
1034	Q	92.5	Very high	90.6	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.019	32%	0.323	C	S	.	.	H	α-helix	trans	-56.8	-47.1	168.4	-61.3	171.9	12.8	0	0	112.3	V1025 C1026 C1029 T1030 V1037 A1038 Y1114 N1118	V1025-Q1034 HydrophobicContact CG1-CG 4.19Å; C1026-Q1034 PolarHBondContact O-NE2 2.95Å; C1029-Q1034 HydrophobicContact CB-CG 4.42Å; C1029-Q1034 PolarHBondContact O-NE2 3.29Å; T1030-Q1034 WeakPolarHBondContact O-CG 3.12Å; T1030-Q1034 PolarHBondContact O-N 2.73Å; Q1034-V1037 PolarHBondContact O-N 3.14Å; Q1034-A1038 WeakPolarHBondContact O-CB 3.34Å; Q1034-A1038 PolarHBondContact O-N 2.84Å; Q1034-Y1114 HydrophobicContact CB-CD2 4.36Å; Q1034-Y1114 HydrophobicContact CB-CE2 4.22Å; Q1034-N1118 VanDerWaalsContact OE1-CG 3.3Å; Q1034-N1118 PolarHBondContact OE1-ND2 3.26Å; Q1034-N1118 PolarHBondContact OE1-OD1 3.37Å; Q1034-N1118 VanDerWaalsContact OE1-OD1 3.11Å
1035	L	91.1	Very high	90.6	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-64.8	-42.4	178.3	-74.5	169.7	0	0	0	112.3	N936 F939 T1031 E1032 T1033 V1037 A1038 Q1039 Y1114	N936-L1035 HydrophobicContact CB-CD1 4.13Å; F939-L1035 HydrophobicContact CB-CD2 3.45Å; F939-L1035 VanDerWaalsContact CB-CD2 3.45Å; F939-L1035 HydrophobicContact CD1-CD2 4.11Å; F939-L1035 HydrophobicContact CG-CD2 4.03Å; T1031-L1035 HydrophobicContact CG2-CD1 4.25Å; T1031-L1035 WeakPolarHBondContact O-CB 3.28Å; T1031-L1035 VanDerWaalsContact O-CG 3.24Å; T1031-L1035 WeakPolarHBondContact O-CG 3.14Å; T1031-L1035 PolarHBondContact O-N 3.3Å; E1032-L1035 PolarHBondContact O-N 2.77Å; T1033-L1035 PolarHBondContact O-N 3.49Å; L1035-V1037 PolarHBondContact O-N 2.98Å; L1035-A1038 WeakPolarHBondContact O-CB 3.5Å; L1035-A1038 PolarHBondContact O-N 2.91Å; L1035-Q1039 WeakPolarHBondContact O-CG 3.22Å; L1035-Q1039 PolarHBondContact O-N 3.36Å; L1035-Y1114 HydrophobicContact CD2-CE1 4.2Å; L1035-Y1114 HydrophobicContact CD2-CE2 4.12Å; L1035-Y1114 HydrophobicContact CG-CE2 4.25Å
1036	K	91.5	Very high	90.4	Very high	110 Å²	110	53.1 Å²	53.1	48%	0.478	31%	0.307	S	S	.	.	H	α-helix	trans	-60.5	-43.1	174.5	-72.7	160.6	179.7	161.9	0	111.1	E1032 T1033 Q1039 V1040	E1032-K1036 WeakPolarHBondContact O-CB 3.42Å; E1032-K1036 WeakPolarHBondContact O-CD 3.21Å; E1032-K1036 VanDerWaalsContact O-CG 3.3Å; E1032-K1036 WeakPolarHBondContact O-CG 3.46Å; E1032-K1036 PolarHBondContact O-N 3.39Å; E1032-K1036 IonicContact OE2-NZ 3.79Å; E1032-K1036 PolarHBondContact OE2-NZ 3.19Å; T1033-K1036 PolarHBondContact O-N 3.41Å; K1036-Q1039 PolarHBondContact O-N 3.33Å; K1036-V1040 WeakPolarHBondContact O-CG2 3.24Å; K1036-V1040 PolarHBondContact O-N 3.13Å
1037	V	93	Very high	90.3	Very high	59 Å²	59	59.1 Å²	59.1	36%	0.358	34%	0.338	S	S	.	.	H	α-helix	trans	-68.2	-37.5	174.3	178.1	0	0	0	0	111.5	F1022 V1025 T1033 Q1034 L1035 Q1039 V1040 S1041	F1022-V1037 HydrophobicContact CD2-CG1 3.93Å; F1022-V1037 HydrophobicContact CE2-CG1 4.48Å; V1025-V1037 HydrophobicContact CG1-CB 4.44Å; V1025-V1037 HydrophobicContact CG1-CG2 4.36Å; T1033-V1037 VanDerWaalsContact O-CG2 3.31Å; T1033-V1037 WeakPolarHBondContact O-CG2 3.39Å; T1033-V1037 PolarHBondContact O-N 3.02Å; Q1034-V1037 PolarHBondContact O-N 3.14Å; L1035-V1037 PolarHBondContact O-N 2.98Å; V1037-Q1039 VanDerWaalsContact C-N 3.34Å; V1037-Q1039 PolarHBondContact O-N 2.88Å; V1037-V1040 PolarHBondContact O-N 3.37Å; V1037-S1041 WeakPolarHBondContact O-CB 3.09Å; V1037-S1041 PolarHBondContact O-N 2.86Å; V1037-S1041 PolarHBondContact O-OG 3.13Å
1038	A	92.2	Very high	90.2	Very high	0 Å²	0	58 Å²	58	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-36.6	176.8	0	0	0	0	0	112.5	F935 F939 F1022 Q1034 L1035 G1042	F935-A1038 HydrophobicContact CE1-CB 4.22Å; F935-A1038 HydrophobicContact CZ-CB 4.41Å; F939-A1038 HydrophobicContact CD1-CB 4.42Å; F939-A1038 HydrophobicContact CE1-CB 4Å; F1022-A1038 HydrophobicContact CE2-CB 3.76Å; F1022-A1038 HydrophobicContact CZ-CB 3.91Å; Q1034-A1038 WeakPolarHBondContact O-CB 3.34Å; Q1034-A1038 PolarHBondContact O-N 2.84Å; L1035-A1038 WeakPolarHBondContact O-CB 3.5Å; L1035-A1038 PolarHBondContact O-N 2.91Å; A1038-G1042 WeakPolarHBondContact O-CA 3.44Å; A1038-G1042 PolarHBondContact O-N 3.2Å
1039	Q	91.5	Very high	90.1	Very high	67 Å²	67	53.5 Å²	53.5	31%	0.313	30%	0.304	S	S	.	.	H	α-helix	trans	-63.3	-52.4	172.2	-71.1	-179.3	14.5	0	0	111.6	F935 N936 L1035 K1036 V1037 G1042 A1043	F935-Q1039 HydrophobicContact CB-CG 4.49Å; F935-Q1039 HydrophobicContact CD1-CG 3.36Å; F935-Q1039 HydrophobicContact CD2-CG 4.35Å; F935-Q1039 HydrophobicContact CE1-CB 4.36Å; F935-Q1039 HydrophobicContact CE1-CG 3.46Å; F935-Q1039 VanDerWaalsContact CE1-CG 3.46Å; F935-Q1039 HydrophobicContact CE2-CG 4.42Å; F935-Q1039 HydrophobicContact CG-CG 3.84Å; F935-Q1039 HydrophobicContact CZ-CG 4Å; N936-Q1039 PolarHBondContact OD1-NE2 2.91Å; L1035-Q1039 WeakPolarHBondContact O-CG 3.22Å; L1035-Q1039 PolarHBondContact O-N 3.36Å; K1036-Q1039 PolarHBondContact O-N 3.33Å; V1037-Q1039 VanDerWaalsContact C-N 3.34Å; V1037-Q1039 PolarHBondContact O-N 2.88Å; Q1039-G1042 PolarHBondContact O-N 3.33Å; Q1039-A1043 WeakPolarHBondContact O-CB 3.31Å; Q1039-A1043 PolarHBondContact O-N 3.3Å
1040	V	91.9	Very high	90	Very high	110 Å²	110	56 Å²	56	67%	0.667	31%	0.312	S	S	*	.	H	α-helix	trans	-65.2	-48	-176	174.8	0	0	0	0	111.7	K1036 V1037 A1043 L1044	K1036-V1040 WeakPolarHBondContact O-CG2 3.24Å; K1036-V1040 PolarHBondContact O-N 3.13Å; V1037-V1040 PolarHBondContact O-N 3.37Å; V1040-A1043 PolarHBondContact O-N 3.33Å; V1040-L1044 PolarHBondContact O-N 3.29Å; V1040-L1044 VanDerWaalsContact O-N 3.09Å
1041	S	91	Very high	89.7	Confident	19 Å²	19	52.8 Å²	52.8	13%	0.133	30%	0.295	C	S	.	.	H	α-helix	trans	-67.5	-37.3	176	55.5	0	0	0	0	112.2	V1037 A1043 L1044 F1045 L1110	V1037-S1041 WeakPolarHBondContact O-CB 3.09Å; V1037-S1041 PolarHBondContact O-N 2.86Å; V1037-S1041 PolarHBondContact O-OG 3.13Å; S1041-A1043 VanDerWaalsContact C-N 3.34Å; S1041-A1043 PolarHBondContact O-N 3.19Å; S1041-L1044 WeakPolarHBondContact O-CB 3.2Å; S1041-L1044 PolarHBondContact O-N 3.41Å; S1041-F1045 VanDerWaalsContact O-CD2 3.23Å; S1041-F1045 WeakPolarHBondContact O-CD2 3.33Å; S1041-F1045 PolarHBondContact O-N 3.36Å; S1041-L1110 WeakPolarHBondContact OG-CD1 3.5Å
1042	G	90.8	Very high	89.6	Confident	6 Å²	6	51.1 Å²	51.1	6%	0.062	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-41.1	173.3	0	0	0	0	0	113.1	A1038 Q1039 F1045 A1046	A1038-G1042 WeakPolarHBondContact O-CA 3.44Å; A1038-G1042 PolarHBondContact O-N 3.2Å; Q1039-G1042 PolarHBondContact O-N 3.33Å; G1042-F1045 PolarHBondContact O-N 3.22Å; G1042-A1046 WeakPolarHBondContact O-CB 3.28Å; G1042-A1046 PolarHBondContact O-N 2.9Å
1043	A	90.2	Very high	89.4	Confident	58 Å²	58	49.1 Å²	49.1	48%	0.479	28%	0.277	S	S	.	.	H	α-helix	trans	-66	-42.7	174.2	0	0	0	0	0	112.3	Q1039 V1040 S1041 F1045 A1046 L1047	Q1039-A1043 WeakPolarHBondContact O-CB 3.31Å; Q1039-A1043 PolarHBondContact O-N 3.3Å; V1040-A1043 PolarHBondContact O-N 3.33Å; S1041-A1043 VanDerWaalsContact C-N 3.34Å; S1041-A1043 PolarHBondContact O-N 3.19Å; A1043-F1045 PolarHBondContact O-N 3Å; A1043-A1046 PolarHBondContact O-N 3.36Å; A1043-L1047 PolarHBondContact O-N 3.23Å; A1043-L1047 VanDerWaalsContact O-N 3.09Å
1044	L	90.7	Very high	89.1	Confident	107 Å²	107	50.7 Å²	50.7	56%	0.56	29%	0.287	S	S	*	.	H	α-helix	trans	-59.7	-45.5	174.6	-169.2	78.1	0	0	0	111.4	V1040 S1041 A1046 L1047 L1048	V1040-L1044 PolarHBondContact O-N 3.29Å; V1040-L1044 VanDerWaalsContact O-N 3.09Å; S1041-L1044 WeakPolarHBondContact O-CB 3.2Å; S1041-L1044 PolarHBondContact O-N 3.41Å; L1044-A1046 PolarHBondContact O-N 3.22Å; L1044-L1047 PolarHBondContact O-N 3.07Å; L1044-L1048 WeakPolarHBondContact O-CB 3.5Å; L1044-L1048 PolarHBondContact O-N 2.88Å
1045	F	91	Very high	88.5	Confident	8 Å²	8	50.6 Å²	50.6	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-33.7	176.6	-85.8	-65.8	0	0	0	113.2	I996 I1015 V1019 S1041 G1042 A1043 L1048 M1049 P1105 L1110	I996-F1045 HydrophobicContact CD1-CD1 4.34Å; I996-F1045 HydrophobicContact CD1-CE1 4.34Å; I1015-F1045 HydrophobicContact CD1-CE1 4.33Å; I1015-F1045 HydrophobicContact CG2-CE1 4.35Å; V1019-F1045 HydrophobicContact CG2-CE2 4.34Å; V1019-F1045 HydrophobicContact CG2-CZ 3.8Å; S1041-F1045 VanDerWaalsContact O-CD2 3.23Å; S1041-F1045 WeakPolarHBondContact O-CD2 3.33Å; S1041-F1045 PolarHBondContact O-N 3.36Å; G1042-F1045 PolarHBondContact O-N 3.22Å; A1043-F1045 PolarHBondContact O-N 3Å; F1045-L1048 PolarHBondContact O-N 3.33Å; F1045-M1049 WeakPolarHBondContact O-CG 3.45Å; F1045-M1049 PolarHBondContact O-N 2.86Å; F1045-P1105 HydrophobicContact CB-CB 3.89Å; F1045-P1105 HydrophobicContact CB-CG 4.2Å; F1045-P1105 HydrophobicContact CD1-CB 3.92Å; F1045-P1105 HydrophobicContact CD1-CG 4.37Å; F1045-P1105 HydrophobicContact CG-CB 3.94Å; F1045-L1110 HydrophobicContact CD2-CD1 4.05Å; F1045-L1110 HydrophobicContact CD2-CD2 4.48Å; F1045-L1110 HydrophobicContact CD2-CG 4.44Å; F1045-L1110 HydrophobicContact CE2-CD2 4.18Å
1046	A	89.7	Confident	88	Confident	31 Å²	31	52 Å²	52	26%	0.256	30%	0.296	S	S	.	.	H	α-helix	trans	-67.3	-37.8	175.3	0	0	0	0	0	112.4	G1042 A1043 L1044 M1049 M1050	G1042-A1046 WeakPolarHBondContact O-CB 3.28Å; G1042-A1046 PolarHBondContact O-N 2.9Å; A1043-A1046 PolarHBondContact O-N 3.36Å; L1044-A1046 PolarHBondContact O-N 3.22Å; A1046-M1049 PolarHBondContact O-N 3Å; A1046-M1050 PolarHBondContact O-N 3.33Å
1047	L	87.8	Confident	87.5	Confident	127 Å²	127	49.8 Å²	49.8	67%	0.665	30%	0.297	S	S	*	.	H	α-helix	trans	-64.2	-42.1	169.9	-68.4	173.9	0	0	0	111.3	A1043 L1044 M1049 M1050	A1043-L1047 PolarHBondContact O-N 3.23Å; A1043-L1047 VanDerWaalsContact O-N 3.09Å; L1044-L1047 PolarHBondContact O-N 3.07Å; L1047-M1049 VanDerWaalsContact C-N 3.31Å; L1047-M1049 PolarHBondContact O-N 3.39Å; L1047-M1050 WeakPolarHBondContact O-CB 3.21Å; L1047-M1050 PolarHBondContact O-N 3.12Å; L1047-M1050 VanDerWaalsContact O-N 3.15Å
1048	L	87.3	Confident	87	Confident	31 Å²	31	49.3 Å²	49.3	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-66.1	-32.9	178.1	-164.4	146.5	0	0	0	111.9	I996 V1000 I1015 L1044 F1045 M1050 A1051 V1052	I996-L1048 HydrophobicContact CG2-CD2 3.32Å; V1000-L1048 HydrophobicContact CG2-CD1 4.38Å; V1000-L1048 HydrophobicContact CG2-CD2 3.85Å; V1000-L1048 HydrophobicContact CG2-CG 4.37Å; I1015-L1048 HydrophobicContact CD1-CD1 3.72Å; I1015-L1048 HydrophobicContact CD1-CD2 4.19Å; L1044-L1048 WeakPolarHBondContact O-CB 3.5Å; L1044-L1048 PolarHBondContact O-N 2.88Å; F1045-L1048 PolarHBondContact O-N 3.33Å; L1048-M1050 VanDerWaalsContact C-N 3.28Å; L1048-M1050 PolarHBondContact O-N 3.23Å; L1048-A1051 WeakPolarHBondContact O-CB 3.14Å; L1048-A1051 PolarHBondContact O-N 3.09Å; L1048-A1051 VanDerWaalsContact O-N 3.08Å; L1048-V1052 HydrophobicContact CD2-CG2 4.02Å; L1048-V1052 WeakPolarHBondContact O-CG2 3.29Å; L1048-V1052 PolarHBondContact O-N 3.26Å
1049	M	89	Confident	86.3	Confident	10 Å²	10	51.2 Å²	51.2	5%	0.049	30%	0.303	C	S	.	.	H	α-helix	trans	-63.7	-27.7	172.3	-76.9	-58.9	-60.6	0	0	113.9	M995 I996 F1045 A1046 L1047 A1051 V1052 I1053 L1102 P1105	M995-M1049 HydrophobicContact CE-CE 4.22Å; M995-M1049 HydrophobicContact CE-SD 4.27Å; I996-M1049 HydrophobicContact CG1-SD 4.41Å; F1045-M1049 WeakPolarHBondContact O-CG 3.45Å; F1045-M1049 PolarHBondContact O-N 2.86Å; A1046-M1049 PolarHBondContact O-N 3Å; L1047-M1049 VanDerWaalsContact C-N 3.31Å; L1047-M1049 PolarHBondContact O-N 3.39Å; M1049-A1051 VanDerWaalsContact C-N 3.31Å; M1049-A1051 PolarHBondContact O-N 2.85Å; M1049-V1052 HydrophobicContact CE-CB 4.3Å; M1049-V1052 HydrophobicContact CE-CG1 4.01Å; M1049-V1052 PolarHBondContact O-N 2.87Å; M1049-V1052 HydrophobicContact SD-CB 4.11Å; M1049-V1052 HydrophobicContact SD-CG1 4.18Å; M1049-V1052 HydrophobicContact SD-CG2 4.08Å; M1049-I1053 WeakPolarHBondContact O-CG1 3.38Å; M1049-I1053 PolarHBondContact O-N 3.34Å; M1049-L1102 HydrophobicContact CB-CD2 4.12Å; M1049-P1105 VanDerWaalsContact CG-CD 3.45Å; M1049-P1105 HydrophobicContact CG-CG 3.45Å; M1049-P1105 VanDerWaalsContact CG-CG 3.45Å; M1049-P1105 HydrophobicContact SD-CG 3.58Å; M1049-P1105 VanDerWaalsContact SD-CG 3.58Å
1050	M	86.3	Confident	85.8	Confident	104 Å²	104	50 Å²	50	51%	0.512	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-41.2	170.7	-69.3	-66.6	-54.8	0	0	111.1	A1046 L1047 L1048 I1053 V1054 L1102	A1046-M1050 PolarHBondContact O-N 3.33Å; L1047-M1050 WeakPolarHBondContact O-CB 3.21Å; L1047-M1050 PolarHBondContact O-N 3.12Å; L1047-M1050 VanDerWaalsContact O-N 3.15Å; L1048-M1050 VanDerWaalsContact C-N 3.28Å; L1048-M1050 PolarHBondContact O-N 3.23Å; M1050-I1053 PolarHBondContact O-N 3.03Å; M1050-V1054 PolarHBondContact O-N 2.9Å; M1050-L1102 HydrophobicContact CG-CD2 3.96Å; M1050-L1102 HydrophobicContact SD-CD1 4Å; M1050-L1102 HydrophobicContact SD-CD2 3.45Å; M1050-L1102 WeakPolarHBondContact SD-CD2 3.2Å; M1050-L1102 HydrophobicContact SD-CG 4.38Å
1051	A	82.7	Confident	85.3	Confident	25 Å²	25	52.6 Å²	52.6	21%	0.207	31%	0.305	C	S	.	.	H	α-helix	trans	-66.6	-42.6	174.4	0	0	0	0	0	111.4	S1003 F1004 L1048 M1049 I1053 V1054 G1055	S1003-A1051 PolarHBondContact OG-O 3.49Å; F1004-A1051 HydrophobicContact CE2-CB 4.14Å; F1004-A1051 HydrophobicContact CZ-CB 4.16Å; L1048-A1051 WeakPolarHBondContact O-CB 3.14Å; L1048-A1051 PolarHBondContact O-N 3.09Å; L1048-A1051 VanDerWaalsContact O-N 3.08Å; M1049-A1051 VanDerWaalsContact C-N 3.31Å; M1049-A1051 PolarHBondContact O-N 2.85Å; A1051-I1053 VanDerWaalsContact C-N 3.28Å; A1051-I1053 PolarHBondContact O-N 3.47Å; A1051-V1054 PolarHBondContact O-N 2.93Å; A1051-V1054 VanDerWaalsContact O-N 3.08Å; A1051-G1055 PolarHBondContact O-N 3.38Å
1052	V	83.1	Confident	84.7	Confident	6 Å²	6	58 Å²	58	4%	0.036	33%	0.326	C	S	.	.	H	α-helix	trans	-55	-42.4	175.1	172	0	0	0	0	111.8	A999 L1048 M1049 G1055 T1056	A999-V1052 HydrophobicContact CB-CB 4.05Å; A999-V1052 HydrophobicContact CB-CG1 3.68Å; A999-V1052 HydrophobicContact CB-CG2 3.84Å; L1048-V1052 HydrophobicContact CD2-CG2 4.02Å; L1048-V1052 WeakPolarHBondContact O-CG2 3.29Å; L1048-V1052 PolarHBondContact O-N 3.26Å; M1049-V1052 HydrophobicContact CE-CB 4.3Å; M1049-V1052 HydrophobicContact CE-CG1 4.01Å; M1049-V1052 PolarHBondContact O-N 2.87Å; M1049-V1052 HydrophobicContact SD-CB 4.11Å; M1049-V1052 HydrophobicContact SD-CG1 4.18Å; M1049-V1052 HydrophobicContact SD-CG2 4.08Å; V1052-G1055 PolarHBondContact O-N 3.32Å; V1052-T1056 WeakPolarHBondContact O-CB 3.4Å; V1052-T1056 PolarHBondContact O-N 3.2Å; V1052-T1056 PolarHBondContact O-OG1 2.99Å
1053	I	84.5	Confident	84	Confident	83 Å²	83	59.3 Å²	59.3	43%	0.426	33%	0.332	S	S	.	.	H	α-helix	trans	-63.4	-41.8	177.6	-69.4	163.8	0	0	0	111.3	M1049 M1050 A1051 T1056 A1057 L1102	M1049-I1053 WeakPolarHBondContact O-CG1 3.38Å; M1049-I1053 PolarHBondContact O-N 3.34Å; M1050-I1053 PolarHBondContact O-N 3.03Å; A1051-I1053 VanDerWaalsContact C-N 3.28Å; A1051-I1053 PolarHBondContact O-N 3.47Å; I1053-T1056 PolarHBondContact O-N 3.06Å; I1053-A1057 PolarHBondContact O-N 3.36Å; I1053-A1057 VanDerWaalsContact O-N 3.07Å; I1053-L1102 HydrophobicContact CD1-CD2 3.68Å
1054	V	83.3	Confident	83.5	Confident	92 Å²	92	57.8 Å²	57.8	56%	0.558	32%	0.321	S	S	*	.	H	α-helix	trans	-67.4	-46.7	176.6	176.2	0	0	0	0	111.4	M1050 A1051 T1056 A1057 V1058	M1050-V1054 PolarHBondContact O-N 2.9Å; A1051-V1054 PolarHBondContact O-N 2.93Å; A1051-V1054 VanDerWaalsContact O-N 3.08Å; V1054-T1056 VanDerWaalsContact C-N 3.3Å; V1054-T1056 PolarHBondContact O-N 3.23Å; V1054-A1057 WeakPolarHBondContact O-CB 3.4Å; V1054-A1057 PolarHBondContact O-N 2.61Å; V1054-A1057 VanDerWaalsContact O-N 3.11Å; V1054-V1058 WeakPolarHBondContact O-CG2 3.05Å; V1054-V1058 PolarHBondContact O-N 3.32Å
1055	G	80	Confident	83.1	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-59.3	-39.3	175.4	0	0	0	0	0	112.9	S1003 A1051 V1052 V1058 Q1059	S1003-G1055 WeakPolarHBondContact OG-CA 3.23Å; A1051-G1055 PolarHBondContact O-N 3.38Å; V1052-G1055 PolarHBondContact O-N 3.32Å; G1055-V1058 PolarHBondContact O-N 3.33Å; G1055-Q1059 PolarHBondContact O-N 2.91Å
1056	T	79.7	Confident	82.6	Confident	39 Å²	39	64.3 Å²	64.3	24%	0.239	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-42	173.9	-51.2	0	0	0	0	111.4	V1052 I1053 V1054 Q1059 V1060 L1073	V1052-T1056 WeakPolarHBondContact O-CB 3.4Å; V1052-T1056 PolarHBondContact O-N 3.2Å; V1052-T1056 PolarHBondContact O-OG1 2.99Å; I1053-T1056 PolarHBondContact O-N 3.06Å; V1054-T1056 VanDerWaalsContact C-N 3.3Å; V1054-T1056 PolarHBondContact O-N 3.23Å; T1056-Q1059 PolarHBondContact O-N 2.93Å; T1056-V1060 WeakPolarHBondContact O-CG2 3.38Å; T1056-V1060 PolarHBondContact O-N 3.13Å; T1056-L1073 HydrophobicContact CG2-CD1 3.66Å
1057	A	82.3	Confident	82.2	Confident	62 Å²	62	62.8 Å²	62.8	51%	0.512	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-41.3	176.5	0	0	0	0	0	112.3	I1053 V1054 Q1059 V1060 Q1061	I1053-A1057 PolarHBondContact O-N 3.36Å; I1053-A1057 VanDerWaalsContact O-N 3.07Å; V1054-A1057 WeakPolarHBondContact O-CB 3.4Å; V1054-A1057 PolarHBondContact O-N 2.61Å; V1054-A1057 VanDerWaalsContact O-N 3.11Å; A1057-Q1059 VanDerWaalsContact C-N 3.33Å; A1057-Q1059 PolarHBondContact O-N 3.39Å; A1057-V1060 PolarHBondContact O-N 3.29Å; A1057-Q1061 PolarHBondContact O-N 3.44Å; A1057-Q1061 VanDerWaalsContact O-N 3.07Å
1058	V	82.3	Confident	81.8	Confident	49 Å²	49	57.1 Å²	57.1	30%	0.297	30%	0.304	S	S	.	.	H	α-helix	trans	-64	-37.5	173.8	173.1	0	0	0	0	111.3	V1054 G1055 Q1061 K1062	V1054-V1058 WeakPolarHBondContact O-CG2 3.05Å; V1054-V1058 PolarHBondContact O-N 3.32Å; G1055-V1058 PolarHBondContact O-N 3.33Å; V1058-Q1061 PolarHBondContact O-N 2.96Å; V1058-K1062 HydrophobicContact CG1-CD 4.18Å; V1058-K1062 WeakPolarHBondContact O-CG 3.25Å; V1058-K1062 PolarHBondContact O-N 2.97Å
1059	Q	77	Confident	81.4	Confident	41 Å²	41	59.8 Å²	59.8	19%	0.192	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-47.4	174.7	-172.6	179.4	0.8	0	0	111.6	I1002 G1055 T1056 A1057 Q1061 K1062 D1063	I1002-Q1059 HydrophobicContact CD1-CB 4.47Å; I1002-Q1059 HydrophobicContact CD1-CG 4.42Å; G1055-Q1059 PolarHBondContact O-N 2.91Å; T1056-Q1059 PolarHBondContact O-N 2.93Å; A1057-Q1059 VanDerWaalsContact C-N 3.33Å; A1057-Q1059 PolarHBondContact O-N 3.39Å; Q1059-Q1061 PolarHBondContact O-N 3.49Å; Q1059-K1062 PolarHBondContact O-N 2.79Å; Q1059-D1063 WeakPolarHBondContact CG-OD2 3.42Å; Q1059-D1063 PolarHBondContact NE2-OD2 3.44Å; Q1059-D1063 PolarHBondContact O-N 3.16Å
1060	V	80.2	Confident	81.1	Confident	41 Å²	41	59.5 Å²	59.5	25%	0.248	32%	0.315	C	S	.	.	H	α-helix	trans	-60.1	-31.9	177.1	174.2	0	0	0	0	111.8	T1056 A1057 G1064 A1070	T1056-V1060 WeakPolarHBondContact O-CG2 3.38Å; T1056-V1060 PolarHBondContact O-N 3.13Å; A1057-V1060 PolarHBondContact O-N 3.29Å; V1060-G1064 CarbonylContact O-C 3.49Å; V1060-G1064 WeakPolarHBondContact O-CA 3.35Å; V1060-G1064 PolarHBondContact O-N 3.18Å; V1060-A1070 HydrophobicContact CB-CB 4.41Å; V1060-A1070 HydrophobicContact CG1-CB 3.91Å; V1060-A1070 HydrophobicContact CG2-CB 3.9Å
1061	Q	82.5	Confident	81.1	Confident	164 Å²	164	56.9 Å²	56.9	77%	0.766	30%	0.304	S	S	*	.	H	α-helix	trans	-71.6	-35.4	174.1	-170.8	-179.9	6.2	0	0	113.3	A1057 V1058 Q1059	A1057-Q1061 PolarHBondContact O-N 3.44Å; A1057-Q1061 VanDerWaalsContact O-N 3.07Å; V1058-Q1061 PolarHBondContact O-N 2.96Å; Q1059-Q1061 PolarHBondContact O-N 3.49Å
1062	K	78.7	Confident	81.3	Confident	133 Å²	133	58.4 Å²	58.4	58%	0.578	31%	0.307	S	S	*	.	H	α-helix	trans	-80.5	-49.7	179.9	-73.2	175.9	177.9	179.3	0	113	V1058 Q1059 G1064	V1058-K1062 HydrophobicContact CG1-CD 4.18Å; V1058-K1062 WeakPolarHBondContact O-CG 3.25Å; V1058-K1062 PolarHBondContact O-N 2.97Å; Q1059-K1062 PolarHBondContact O-N 2.79Å; K1062-G1064 VanDerWaalsContact C-N 3.3Å
1063	D	74.9	Confident	81.4	Confident	34 Å²	34	61.4 Å²	61.4	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-83	-11.3	-174.6	-60	-7.5	0	0	0	112.1	Q1059 L1367	Q1059-D1063 WeakPolarHBondContact CG-OD2 3.42Å; Q1059-D1063 PolarHBondContact NE2-OD2 3.44Å; Q1059-D1063 PolarHBondContact O-N 3.16Å; D1063-L1367 HydrophobicContact CB-CD1 4.49Å; D1063-L1367 HydrophobicContact CB-CD2 4.47Å
1064	G	80.5	Confident	81.6	Confident	25 Å²	25	61.5 Å²	61.5	26%	0.258	32%	0.323	S	S	.	.			trans	79.9	162.9	-177.8	0	0	0	0	0	114.2	V1060 K1062 Y1066 S1067	V1060-G1064 CarbonylContact O-C 3.49Å; V1060-G1064 WeakPolarHBondContact O-CA 3.35Å; V1060-G1064 PolarHBondContact O-N 3.18Å; K1062-G1064 VanDerWaalsContact C-N 3.3Å; G1064-Y1066 PolarHBondContact O-N 2.9Å; G1064-S1067 WeakPolarHBondContact O-CB 3.34Å; G1064-S1067 PolarHBondContact O-N 3.35Å; G1064-S1067 VanDerWaalsContact O-N 3.11Å; G1064-S1067 PolarHBondContact O-OG 2.91Å
1065	I	82	Confident	82	Confident	98 Å²	98	59 Å²	59	50%	0.503	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-19.5	-176.2	-160.5	167.1	0	0	0	113.8	A1070 V1071	I1065-A1070 WeakPolarHBondContact O-CB 3.48Å; I1065-V1071 WeakPolarHBondContact O-CG2 3.23Å
1066	Y	81.5	Confident	82.5	Confident	154 Å²	154	60 Å²	60	60%	0.604	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.4	176.5	-60.1	-59.5	0	0	0	113.8	G1064 W1340	G1064-Y1066 PolarHBondContact O-N 2.9Å; Y1066-W1340 PolarHBondContact O-NE1 2.92Å
1067	S	80.7	Confident	83	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.327	C	S	.	.	S	Bend	trans	-61.7	145.3	169.3	64.8	0	0	0	0	110.8	G1064 H1069 A1070 V1071	G1064-S1067 WeakPolarHBondContact O-CB 3.34Å; G1064-S1067 PolarHBondContact O-N 3.35Å; G1064-S1067 VanDerWaalsContact O-N 3.11Å; G1064-S1067 PolarHBondContact O-OG 2.91Å; S1067-H1069 PolarHBondContact O-N 3.46Å; S1067-A1070 PolarHBondContact O-N 3.38Å; S1067-A1070 VanDerWaalsContact O-N 3.1Å; S1067-A1070 WeakPolarHBondContact OG-CB 3.31Å; S1067-A1070 PolarHBondContact OG-N 3.05Å; S1067-V1071 WeakPolarHBondContact O-CG2 3.49Å; S1067-V1071 PolarHBondContact O-N 3.47Å
1068	P	80.3	Confident	83.4	Confident	7 Å²	7	62.6 Å²	62.6	5%	0.045	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-29	-174.7	26.3	-36.5	0	0	0	112.9	F1072 W1340 L1369 L1377	P1068-F1072 VanDerWaalsContact O-CB 3.26Å; P1068-F1072 WeakPolarHBondContact O-CB 3.38Å; P1068-F1072 PolarHBondContact O-N 3.26Å; P1068-W1340 HydrophobicContact CB-CH2 4.4Å; P1068-W1340 HydrophobicContact CB-CZ2 4.31Å; P1068-L1369 HydrophobicContact CG-CD1 3.72Å; P1068-L1369 HydrophobicContact CG-CD2 3.57Å; P1068-L1369 HydrophobicContact CG-CG 4.31Å; P1068-L1377 HydrophobicContact CB-CD2 4.24Å
1069	H	77.7	Confident	83.9	Confident	87 Å²	87	60.4 Å²	60.4	40%	0.403	31%	0.307	S	S	.	.	H	α-helix	trans	-69.1	-43.8	174.4	-61.4	-65.3	0	0	0	112	S1067 F1072 L1073	S1067-H1069 PolarHBondContact O-N 3.46Å; H1069-F1072 PolarHBondContact O-N 2.85Å; H1069-L1073 WeakPolarHBondContact O-CB 3.49Å; H1069-L1073 PolarHBondContact O-N 3.49Å
1070	A	83.3	Confident	84.6	Confident	4 Å²	4	59.9 Å²	59.9	3%	0.033	30%	0.304	C	S	.	.	H	α-helix	trans	-63.3	-45.4	174	0	0	0	0	0	111.7	V1060 I1065 S1067 F1072 L1073 L1074	V1060-A1070 HydrophobicContact CB-CB 4.41Å; V1060-A1070 HydrophobicContact CG1-CB 3.91Å; V1060-A1070 HydrophobicContact CG2-CB 3.9Å; I1065-A1070 WeakPolarHBondContact O-CB 3.48Å; S1067-A1070 PolarHBondContact O-N 3.38Å; S1067-A1070 VanDerWaalsContact O-N 3.1Å; S1067-A1070 WeakPolarHBondContact OG-CB 3.31Å; S1067-A1070 PolarHBondContact OG-N 3.05Å; A1070-F1072 PolarHBondContact O-N 3.49Å; A1070-L1073 PolarHBondContact O-N 3.38Å; A1070-L1074 VanDerWaalsContact O-CB 3.28Å; A1070-L1074 WeakPolarHBondContact O-CB 3.48Å; A1070-L1074 PolarHBondContact O-N 3.13Å
1071	V	86.6	Confident	85.2	Confident	49 Å²	49	63.2 Å²	63.2	30%	0.297	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-42.8	178.2	173.8	0	0	0	0	111.5	I1065 S1067 V1075 M1381	I1065-V1071 WeakPolarHBondContact O-CG2 3.23Å; S1067-V1071 WeakPolarHBondContact O-CG2 3.49Å; S1067-V1071 PolarHBondContact O-N 3.47Å; V1071-V1075 WeakPolarHBondContact O-CB 3.36Å; V1071-V1075 WeakPolarHBondContact O-CG2 3.49Å; V1071-V1075 PolarHBondContact O-N 2.94Å; V1071-M1381 HydrophobicContact CG1-CE 4Å
1072	F	86.5	Confident	85.7	Confident	57 Å²	57	58.9 Å²	58.9	25%	0.25	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-49.1	175	178.2	-96.7	0	0	0	111.8	P1068 H1069 A1070 L1074 V1075 V1076 L1377 F1380 M1381	P1068-F1072 VanDerWaalsContact O-CB 3.26Å; P1068-F1072 WeakPolarHBondContact O-CB 3.38Å; P1068-F1072 PolarHBondContact O-N 3.26Å; H1069-F1072 PolarHBondContact O-N 2.85Å; A1070-F1072 PolarHBondContact O-N 3.49Å; F1072-L1074 PolarHBondContact O-N 2.98Å; F1072-V1075 PolarHBondContact O-N 2.92Å; F1072-V1076 HydrophobicContact CD1-CG2 4.24Å; F1072-V1076 HydrophobicContact CE1-CG2 3.85Å; F1072-V1076 HydrophobicContact CE2-CG2 4.46Å; F1072-V1076 HydrophobicContact CZ-CG2 3.97Å; F1072-V1076 WeakPolarHBondContact O-CG2 3.26Å; F1072-V1076 PolarHBondContact O-N 2.77Å; F1072-L1377 HydrophobicContact CB-CD1 3.99Å; F1072-L1377 HydrophobicContact CB-CD2 4.22Å; F1072-L1377 HydrophobicContact CB-CG 4.17Å; F1072-L1377 HydrophobicContact CD2-CD2 4.46Å; F1072-L1377 HydrophobicContact CD2-CG 4.15Å; F1072-L1377 HydrophobicContact CG-CD1 4.28Å; F1072-L1377 HydrophobicContact CG-CG 4.21Å; F1072-F1380 HydrophobicContact CE2-CB 4.01Å; F1072-F1380 HydrophobicContact CZ-CB 4.25Å; F1072-M1381 HydrophobicContact CD2-CB 4.19Å; F1072-M1381 HydrophobicContact CD2-SD 3.78Å; F1072-M1381 HydrophobicContact CE2-CB 4.47Å; F1072-M1381 HydrophobicContact CE2-SD 4.48Å
1073	L	85.8	Confident	86.2	Confident	69 Å²	69	52.5 Å²	52.5	36%	0.361	27%	0.269	S	S	.	.	H	α-helix	trans	-63.2	-40.5	179.4	179.7	144	0	0	0	112.1	T1056 H1069 A1070 V1076 I1077	T1056-L1073 HydrophobicContact CG2-CD1 3.66Å; H1069-L1073 WeakPolarHBondContact O-CB 3.49Å; H1069-L1073 PolarHBondContact O-N 3.49Å; A1070-L1073 PolarHBondContact O-N 3.38Å; L1073-V1076 PolarHBondContact O-N 3.46Å; L1073-I1077 HydrophobicContact CD2-CD1 3.6Å; L1073-I1077 HydrophobicContact CG-CD1 4.16Å; L1073-I1077 WeakPolarHBondContact O-CG1 3.37Å; L1073-I1077 PolarHBondContact O-N 3.29Å
1074	L	88.9	Confident	87	Confident	85 Å²	85	50.9 Å²	50.9	45%	0.445	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-47.4	173.5	-174.3	74.4	0	0	0	110.9	A1070 F1072 I1077 C1078	A1070-L1074 VanDerWaalsContact O-CB 3.28Å; A1070-L1074 WeakPolarHBondContact O-CB 3.48Å; A1070-L1074 PolarHBondContact O-N 3.13Å; F1072-L1074 PolarHBondContact O-N 2.98Å; L1074-I1077 PolarHBondContact O-N 3.27Å; L1074-C1078 VanDerWaalsContact O-CB 3.28Å; L1074-C1078 WeakPolarHBondContact O-CB 3.33Å; L1074-C1078 PolarHBondContact O-N 2.9Å; L1074-C1078 PolarHBondContact O-SG 2.87Å; L1074-C1078 VanDerWaalsContact O-SG 3.32Å
1075	V	90.7	Very high	87.4	Confident	40 Å²	40	52.9 Å²	52.9	24%	0.242	27%	0.27	C	S	.	.	H	α-helix	trans	-66.7	-36.7	179.1	169.5	0	0	0	0	112	V1071 F1072 S1079 M1381 L1384 L1385	V1071-V1075 WeakPolarHBondContact O-CB 3.36Å; V1071-V1075 WeakPolarHBondContact O-CG2 3.49Å; V1071-V1075 PolarHBondContact O-N 2.94Å; F1072-V1075 PolarHBondContact O-N 2.92Å; V1075-S1079 WeakPolarHBondContact O-CB 3.31Å; V1075-S1079 PolarHBondContact O-N 2.85Å; V1075-S1079 PolarHBondContact O-OG 2.98Å; V1075-M1381 HydrophobicContact CB-CE 3.8Å; V1075-M1381 HydrophobicContact CB-SD 4.09Å; V1075-M1381 HydrophobicContact CG1-CE 4.04Å; V1075-M1381 HydrophobicContact CG1-SD 3.89Å; V1075-M1381 HydrophobicContact CG2-CE 3.65Å; V1075-L1384 HydrophobicContact CG1-CD2 4.16Å; V1075-L1385 HydrophobicContact CG1-CD2 4.21Å
1076	V	90	Very high	87.5	Confident	23 Å²	23	51.3 Å²	51.3	14%	0.139	26%	0.262	C	S	.	.	H	α-helix	trans	-58.1	-56.1	170.8	171	0	0	0	0	110.5	F1072 L1073 C1078 S1079 F1080 L1384	F1072-V1076 HydrophobicContact CD1-CG2 4.24Å; F1072-V1076 HydrophobicContact CE1-CG2 3.85Å; F1072-V1076 HydrophobicContact CE2-CG2 4.46Å; F1072-V1076 HydrophobicContact CZ-CG2 3.97Å; F1072-V1076 WeakPolarHBondContact O-CG2 3.26Å; F1072-V1076 PolarHBondContact O-N 2.77Å; L1073-V1076 PolarHBondContact O-N 3.46Å; V1076-C1078 PolarHBondContact O-N 3.47Å; V1076-S1079 PolarHBondContact O-N 2.83Å; V1076-S1079 PolarHBondContact O-OG 3.43Å; V1076-F1080 HydrophobicContact CG1-CD2 4.32Å; V1076-F1080 HydrophobicContact CG1-CE2 4Å; V1076-F1080 HydrophobicContact CG1-CZ 4.1Å; V1076-F1080 PolarHBondContact O-N 3.44Å; V1076-L1384 HydrophobicContact CB-CD2 4.42Å; V1076-L1384 HydrophobicContact CG2-CD2 3.63Å
1077	I	90	Very high	87.7	Confident	98 Å²	98	44.3 Å²	44.3	50%	0.503	24%	0.235	S	C	.	.	H	α-helix	trans	-61.1	-47.7	-177.6	-67.3	173.1	0	0	0	111.2	L1073 L1074 S1079 F1080 F1081	L1073-I1077 HydrophobicContact CD2-CD1 3.6Å; L1073-I1077 HydrophobicContact CG-CD1 4.16Å; L1073-I1077 WeakPolarHBondContact O-CG1 3.37Å; L1073-I1077 PolarHBondContact O-N 3.29Å; L1074-I1077 PolarHBondContact O-N 3.27Å; I1077-S1079 PolarHBondContact O-N 3.14Å; I1077-F1080 PolarHBondContact O-N 3.03Å; I1077-F1081 WeakPolarHBondContact O-CB 3.49Å; I1077-F1081 PolarHBondContact O-N 2.98Å
1078	C	91.9	Very high	87.6	Confident	56 Å²	56	48.7 Å²	48.7	38%	0.378	26%	0.263	S	S	.	.	H	α-helix	trans	-62.5	-41.2	177.7	-71.9	0	0	0	0	112.1	L1074 V1076 F1080 F1081 I1082	L1074-C1078 VanDerWaalsContact O-CB 3.28Å; L1074-C1078 WeakPolarHBondContact O-CB 3.33Å; L1074-C1078 PolarHBondContact O-N 2.9Å; L1074-C1078 PolarHBondContact O-SG 2.87Å; L1074-C1078 VanDerWaalsContact O-SG 3.32Å; V1076-C1078 PolarHBondContact O-N 3.47Å; C1078-F1080 PolarHBondContact O-N 3.02Å; C1078-F1081 PolarHBondContact O-N 2.99Å; C1078-I1082 WeakPolarHBondContact O-CB 3.43Å; C1078-I1082 WeakPolarHBondContact O-CD1 3.39Å; C1078-I1082 WeakPolarHBondContact O-CG1 3.3Å; C1078-I1082 PolarHBondContact O-N 2.79Å
1079	S	92.5	Very high	87.4	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-41.8	178.7	74.5	0	0	0	0	111.9	V1075 V1076 I1077 A1083	V1075-S1079 WeakPolarHBondContact O-CB 3.31Å; V1075-S1079 PolarHBondContact O-N 2.85Å; V1075-S1079 PolarHBondContact O-OG 2.98Å; V1076-S1079 PolarHBondContact O-N 2.83Å; V1076-S1079 PolarHBondContact O-OG 3.43Å; I1077-S1079 PolarHBondContact O-N 3.14Å; S1079-A1083 VanDerWaalsContact O-CB 3.24Å; S1079-A1083 WeakPolarHBondContact O-CB 3.33Å; S1079-A1083 PolarHBondContact O-N 3.49Å
1080	F	91.8	Very high	87.7	Confident	30 Å²	30	48.5 Å²	48.5	13%	0.132	27%	0.271	C	S	.	.	H	α-helix	trans	-70.7	-41.8	178.7	-70.6	5.4	0	0	0	111.4	F844 I848 F852 V1076 I1077 C1078 A1083 A1084 F1101 L1384	F844-F1080 HydrophobicContact CZ-CD2 4.11Å; F844-F1080 HydrophobicContact CZ-CE2 4.39Å; I848-F1080 HydrophobicContact CD1-CD2 3.89Å; I848-F1080 HydrophobicContact CD1-CE1 4.2Å; I848-F1080 HydrophobicContact CD1-CE2 3.51Å; I848-F1080 HydrophobicContact CD1-CG 4.39Å; I848-F1080 HydrophobicContact CD1-CZ 3.69Å; F852-F1080 AromaticContact CE2-CD1 3.66Å; F852-F1080 HydrophobicContact CE2-CD1 3.66Å; F852-F1080 AromaticContact CE2-CE1 3.94Å; F852-F1080 HydrophobicContact CE2-CE1 3.94Å; F852-F1080 AromaticContact CZ-CD1 3.66Å; F852-F1080 HydrophobicContact CZ-CD1 3.66Å; F852-F1080 HydrophobicContact CZ-CE1 4.05Å; V1076-F1080 HydrophobicContact CG1-CD2 4.32Å; V1076-F1080 HydrophobicContact CG1-CE2 4Å; V1076-F1080 HydrophobicContact CG1-CZ 4.1Å; V1076-F1080 PolarHBondContact O-N 3.44Å; I1077-F1080 PolarHBondContact O-N 3.03Å; C1078-F1080 PolarHBondContact O-N 3.02Å; F1080-A1083 PolarHBondContact O-N 2.7Å; F1080-A1084 PolarHBondContact O-N 2.88Å; F1080-F1101 AromaticContact CD2-CZ 3.94Å; F1080-F1101 HydrophobicContact CD2-CZ 3.94Å; F1080-F1101 HydrophobicContact CE2-CE1 4.41Å; F1080-F1101 AromaticContact CE2-CZ 3.74Å; F1080-F1101 HydrophobicContact CE2-CZ 3.74Å; F1080-L1384 HydrophobicContact CE1-CD1 4.42Å
1081	F	92	Very high	87.8	Confident	112 Å²	112	51.8 Å²	51.8	49%	0.491	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-46.2	175.4	-175	-102	0	0	0	112	I1077 C1078 A1084 C1085 F1091 I1094	I1077-F1081 WeakPolarHBondContact O-CB 3.49Å; I1077-F1081 PolarHBondContact O-N 2.98Å; C1078-F1081 PolarHBondContact O-N 2.99Å; F1081-A1084 PolarHBondContact O-N 3.23Å; F1081-C1085 WeakPolarHBondContact O-CB 3.36Å; F1081-C1085 PolarHBondContact O-N 3.4Å; F1081-C1085 PolarHBondContact O-SG 3.32Å; F1081-C1085 VanDerWaalsContact O-SG 3.36Å; F1081-F1091 HydrophobicContact CE2-CE2 4.14Å; F1081-F1091 HydrophobicContact CE2-CZ 4.22Å; F1081-I1094 HydrophobicContact CD2-CD1 4.36Å
1082	I	92.7	Very high	87.9	Confident	72 Å²	72	57.2 Å²	57.2	37%	0.369	30%	0.304	S	S	.	.	H	α-helix	trans	-65	-40.1	176.3	-66.7	165	0	0	0	110.8	C1078 A1084 C1085 L1086 F1388	C1078-I1082 WeakPolarHBondContact O-CB 3.43Å; C1078-I1082 WeakPolarHBondContact O-CD1 3.39Å; C1078-I1082 WeakPolarHBondContact O-CG1 3.3Å; C1078-I1082 PolarHBondContact O-N 2.79Å; I1082-A1084 VanDerWaalsContact C-N 3.35Å; I1082-A1084 PolarHBondContact O-N 2.63Å; I1082-C1085 PolarHBondContact O-N 3.18Å; I1082-L1086 HydrophobicContact CG2-CD1 4.02Å; I1082-L1086 HydrophobicContact CG2-CG 4.45Å; I1082-L1086 WeakPolarHBondContact O-CB 3.38Å; I1082-L1086 VanDerWaalsContact O-CG 3.3Å; I1082-L1086 WeakPolarHBondContact O-CG 3.21Å; I1082-L1086 PolarHBondContact O-N 3.41Å; I1082-F1388 HydrophobicContact CB-CE2 4.03Å; I1082-F1388 HydrophobicContact CB-CZ 4.07Å; I1082-F1388 HydrophobicContact CD1-CZ 4.02Å; I1082-F1388 HydrophobicContact CG2-CE2 3.94Å; I1082-F1388 HydrophobicContact CG2-CZ 3.82Å
1083	A	91	Very high	87.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-44.1	175.1	0	0	0	0	0	112	W851 F852 S1079 F1080 L1086 H1087 M1391	W851-A1083 HydrophobicContact CD2-CB 4.24Å; W851-A1083 HydrophobicContact CE3-CB 3.7Å; W851-A1083 HydrophobicContact CZ3-CB 4.26Å; F852-A1083 HydrophobicContact CE2-CB 3.76Å; F852-A1083 HydrophobicContact CZ-CB 3.81Å; S1079-A1083 VanDerWaalsContact O-CB 3.24Å; S1079-A1083 WeakPolarHBondContact O-CB 3.33Å; S1079-A1083 PolarHBondContact O-N 3.49Å; F1080-A1083 PolarHBondContact O-N 2.7Å; A1083-L1086 PolarHBondContact O-N 3Å; A1083-H1087 PolarHBondContact O-N 3.03Å; A1083-H1087 PolarHBondContact O-ND1 2.85Å; A1083-M1391 HydrophobicContact CB-CE 3.86Å; A1083-M1391 HydrophobicContact CB-SD 4.38Å
1084	A	90	Very high	88.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68.3	-42.7	177.1	0	0	0	0	0	112.8	W851 F1080 F1081 I1082 L1086 H1087 F1091 I1094	W851-A1084 HydrophobicContact CH2-CB 3.59Å; W851-A1084 HydrophobicContact CZ2-CB 4.37Å; W851-A1084 HydrophobicContact CZ3-CB 3.98Å; F1080-A1084 PolarHBondContact O-N 2.88Å; F1081-A1084 PolarHBondContact O-N 3.23Å; I1082-A1084 VanDerWaalsContact C-N 3.35Å; I1082-A1084 PolarHBondContact O-N 2.63Å; A1084-L1086 PolarHBondContact O-N 2.91Å; A1084-H1087 CarbonylContact O-C 3.58Å; A1084-H1087 WeakPolarHBondContact O-CA 3.4Å; A1084-H1087 PolarHBondContact O-N 2.9Å; A1084-F1091 HydrophobicContact CB-CD2 3.98Å; A1084-I1094 HydrophobicContact CB-CD1 3.26Å; A1084-I1094 HydrophobicContact CB-CG1 3.7Å
1085	C	89	Confident	88.1	Confident	66 Å²	66	54.8 Å²	54.8	45%	0.446	30%	0.299	S	S	.	.	H	α-helix	trans	-58.7	-35.8	173.7	-75.6	0	0	0	0	112.2	F1081 I1082 H1087	F1081-C1085 WeakPolarHBondContact O-CB 3.36Å; F1081-C1085 PolarHBondContact O-N 3.4Å; F1081-C1085 PolarHBondContact O-SG 3.32Å; F1081-C1085 VanDerWaalsContact O-SG 3.36Å; I1082-C1085 PolarHBondContact O-N 3.18Å; C1085-H1087 VanDerWaalsContact C-N 3.28Å; C1085-H1087 PolarHBondContact O-N 3.4Å
1086	L	85.5	Confident	88	Confident	65 Å²	65	53.5 Å²	53.5	34%	0.34	29%	0.292	S	S	.	.	H	α-helix	trans	-71.3	-20.5	173.2	-73.8	171.5	0	0	0	113.3	I1082 A1083 A1084 P1088 M1391 I1392 R1395	I1082-L1086 HydrophobicContact CG2-CD1 4.02Å; I1082-L1086 HydrophobicContact CG2-CG 4.45Å; I1082-L1086 WeakPolarHBondContact O-CB 3.38Å; I1082-L1086 VanDerWaalsContact O-CG 3.3Å; I1082-L1086 WeakPolarHBondContact O-CG 3.21Å; I1082-L1086 PolarHBondContact O-N 3.41Å; A1083-L1086 PolarHBondContact O-N 3Å; A1084-L1086 PolarHBondContact O-N 2.91Å; L1086-P1088 VanDerWaalsContact C-CD 3.41Å; L1086-P1088 VanDerWaalsContact O-CD 3.22Å; L1086-P1088 WeakPolarHBondContact O-CD 3.31Å; L1086-M1391 HydrophobicContact CD1-CE 3.94Å; L1086-M1391 HydrophobicContact CD1-SD 3.78Å; L1086-I1392 HydrophobicContact CD1-CG1 4.39Å; L1086-R1395 HydrophobicContact CB-CG 4.25Å; L1086-R1395 PolarHBondContact O-NE 3.24Å; L1086-R1395 PolarHBondContact O-NH2 3.44Å
1087	H	85	Confident	87.9	Confident	7 Å²	7	52.5 Å²	52.5	3%	0.032	29%	0.286	C	S	.	.			trans	-114.5	67.7	179.6	-66.5	86.8	0	0	0	111.7	W851 A1083 A1084 C1085 S1089 E1090 F1091 R1395	W851-H1087 AromaticContact CD1-CD2 3.64Å; W851-H1087 AromaticContact CD1-CE1 3.52Å; W851-H1087 AromaticContact CD1-CG 3.68Å; W851-H1087 AromaticContact CD1-ND1 3.6Å; W851-H1087 AromaticContact CD1-NE2 3.61Å; W851-H1087 AromaticContact CE2-CG 3.99Å; W851-H1087 AromaticContact CG-CE1 3.97Å; W851-H1087 HydrophobicContact CZ2-CB 4.13Å; W851-H1087 AromaticContact NE1-CD2 3.56Å; W851-H1087 AromaticContact NE1-CG 3.35Å; W851-H1087 AromaticContact NE1-ND1 3.65Å; A1083-H1087 PolarHBondContact O-N 3.03Å; A1083-H1087 PolarHBondContact O-ND1 2.85Å; A1084-H1087 CarbonylContact O-C 3.58Å; A1084-H1087 WeakPolarHBondContact O-CA 3.4Å; A1084-H1087 PolarHBondContact O-N 2.9Å; C1085-H1087 VanDerWaalsContact C-N 3.28Å; C1085-H1087 PolarHBondContact O-N 3.4Å; H1087-S1089 PolarHBondContact O-N 2.99Å; H1087-E1090 HydrophobicContact CB-CB 4.29Å; H1087-E1090 WeakPolarHBondContact CB-OE2 3.22Å; H1087-E1090 IonicContact CD2-OE2 2.76Å; H1087-E1090 PolarHBondContact CD2-OE2 3.43Å; H1087-E1090 IonicContact CG-OE2 2.74Å; H1087-E1090 CarbonylContact O-C 3.54Å; H1087-E1090 WeakPolarHBondContact O-CA 3.47Å; H1087-E1090 PolarHBondContact O-N 3.48Å; H1087-F1091 PolarHBondContact O-N 2.88Å; H1087-F1091 VanDerWaalsContact O-N 3.09Å; H1087-R1395 VanDerWaalsContact CD2-CZ 3.46Å; H1087-R1395 PolarHBondContact CD2-NH1 2.91Å; H1087-R1395 WeakPolarHBondContact NE2-CD 3.19Å; H1087-R1395 PolarHBondContact NE2-NH1 2.85Å
1088	P	78.4	Confident	87.8	Confident	93 Å²	93	53.5 Å²	53.5	60%	0.604	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-24.2	-170.2	23.4	-35.3	0	0	0	115.1	L1086 E1090	L1086-P1088 VanDerWaalsContact C-CD 3.41Å; L1086-P1088 VanDerWaalsContact O-CD 3.22Å; L1086-P1088 WeakPolarHBondContact O-CD 3.31Å; P1088-E1090 PolarHBondContact O-N 3.32Å
1089	S	77.1	Confident	87.7	Confident	81 Å²	81	53.7 Å²	53.7	57%	0.566	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-20.9	172.5	59.4	0	0	0	0	113.9	H1087	H1087-S1089 PolarHBondContact O-N 2.99Å
1090	E	82.6	Confident	87.7	Confident	8 Å²	8	54.3 Å²	54.3	4%	0.037	29%	0.29	C	S	.	.	S	Bend	trans	-121.6	7.3	-173.5	-63.4	164.1	154.5	0	0	111.4	R829 H831 W851 H1087 P1088 F1092 C1093	R829-E1090 VanDerWaalsContact CD-OE1 3.28Å; R829-E1090 WeakPolarHBondContact CD-OE1 3.41Å; R829-E1090 IonicContact CZ-OE1 2.69Å; R829-E1090 IonicContact NE-OE1 3.72Å; R829-E1090 PolarHBondContact NE-OE1 3.23Å; R829-E1090 IonicContact NH1-OE1 3.35Å; R829-E1090 PolarHBondContact NH1-OE1 3.05Å; R829-E1090 IonicContact NH1-OE2 2.78Å; R829-E1090 PolarHBondContact NH1-OE2 3.03Å; H831-E1090 IonicContact CE1-OE1 3.67Å; H831-E1090 PolarHBondContact CE1-OE1 3.34Å; H831-E1090 VanDerWaalsContact CE1-OE1 3.26Å; H831-E1090 IonicContact ND1-OE1 3.7Å; W851-E1090 HydrophobicContact CZ2-CB 3.79Å; W851-E1090 PolarHBondContact NE1-OE2 3.33Å; H1087-E1090 HydrophobicContact CB-CB 4.29Å; H1087-E1090 WeakPolarHBondContact CB-OE2 3.22Å; H1087-E1090 IonicContact CD2-OE2 2.76Å; H1087-E1090 PolarHBondContact CD2-OE2 3.43Å; H1087-E1090 IonicContact CG-OE2 2.74Å; H1087-E1090 CarbonylContact O-C 3.54Å; H1087-E1090 WeakPolarHBondContact O-CA 3.47Å; H1087-E1090 PolarHBondContact O-N 3.48Å; P1088-E1090 PolarHBondContact O-N 3.32Å; E1090-F1092 PolarHBondContact O-N 3.4Å; E1090-C1093 WeakPolarHBondContact O-CB 3.34Å; E1090-C1093 PolarHBondContact O-N 3.09Å; E1090-C1093 PolarHBondContact O-SG 2.67Å
1091	F	86	Confident	87.5	Confident	74 Å²	74	56.4 Å²	56.4	33%	0.325	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-54.5	-41.8	-177.6	178.1	-97.2	0	0	0	112	F1081 A1084 H1087 C1093 I1094	F1081-F1091 HydrophobicContact CE2-CE2 4.14Å; F1081-F1091 HydrophobicContact CE2-CZ 4.22Å; A1084-F1091 HydrophobicContact CB-CD2 3.98Å; H1087-F1091 PolarHBondContact O-N 2.88Å; H1087-F1091 VanDerWaalsContact O-N 3.09Å; F1091-C1093 PolarHBondContact O-N 3.38Å; F1091-C1093 VanDerWaalsContact O-N 3.14Å; F1091-I1094 PolarHBondContact O-N 2.73Å
1092	F	87.8	Confident	87.4	Confident	162 Å²	162	52.5 Å²	52.5	71%	0.711	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-65.4	-11.7	176.8	-65	-73.2	0	0	0	114.6	E1090 I1094 V1095 P1096	E1090-F1092 PolarHBondContact O-N 3.4Å; F1092-I1094 PolarHBondContact O-N 2.89Å; F1092-V1095 PolarHBondContact O-N 2.96Å; F1092-P1096 WeakPolarHBondContact O-CD 3.2Å
1093	C	87.8	Confident	87.4	Confident	26 Å²	26	49.7 Å²	49.7	18%	0.176	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-65.1	-20.7	172.1	-64.4	0	0	0	0	112.4	F844 A847 E1090 F1091 V1095 P1096	F844-C1093 WeakPolarHBondContact CD2-O 3.46Å; A847-C1093 HydrophobicContact CB-CB 4.15Å; E1090-C1093 WeakPolarHBondContact O-CB 3.34Å; E1090-C1093 PolarHBondContact O-N 3.09Å; E1090-C1093 PolarHBondContact O-SG 2.67Å; F1091-C1093 PolarHBondContact O-N 3.38Å; F1091-C1093 VanDerWaalsContact O-N 3.14Å; C1093-V1095 VanDerWaalsContact C-N 3.26Å; C1093-V1095 PolarHBondContact O-N 3.32Å; C1093-P1096 WeakPolarHBondContact O-CD 3.45Å
1094	I	88.9	Confident	87.3	Confident	50 Å²	50	51 Å²	51	26%	0.256	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-59.1	-34	171.8	-84.7	-174	0	0	0	112.6	F844 F1081 A1084 F1091 F1092 G1097	F844-I1094 HydrophobicContact CE2-CG1 4.41Å; F1081-I1094 HydrophobicContact CD2-CD1 4.36Å; A1084-I1094 HydrophobicContact CB-CD1 3.26Å; A1084-I1094 HydrophobicContact CB-CG1 3.7Å; F1091-I1094 PolarHBondContact O-N 2.73Å; F1092-I1094 PolarHBondContact O-N 2.89Å; I1094-G1097 VanDerWaalsContact O-CA 3.3Å; I1094-G1097 WeakPolarHBondContact O-CA 3.48Å; I1094-G1097 PolarHBondContact O-N 3.37Å
1095	V	89.1	Confident	87.3	Confident	85 Å²	85	51 Å²	51	52%	0.515	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-47.2	-175.7	176.6	0	0	0	0	111.5	F1092 C1093 G1097 I1098	F1092-V1095 PolarHBondContact O-N 2.96Å; C1093-V1095 VanDerWaalsContact C-N 3.26Å; C1093-V1095 PolarHBondContact O-N 3.32Å; V1095-G1097 PolarHBondContact O-N 2.79Å; V1095-G1097 VanDerWaalsContact O-N 3.14Å; V1095-I1098 PolarHBondContact O-N 2.83Å
1096	P	89.2	Confident	87.4	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.084	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-20.6	163.4	-31.5	36.5	0	0	0	116.7	W840 F844 F1092 C1093 I1098 L1099 Y1100	W840-P1096 HydrophobicContact CB-CB 3.96Å; W840-P1096 HydrophobicContact CB-CG 4.3Å; W840-P1096 HydrophobicContact CD2-CG 4.24Å; W840-P1096 HydrophobicContact CE3-CB 4.38Å; W840-P1096 HydrophobicContact CE3-CG 4.1Å; W840-P1096 HydrophobicContact CG-CG 4.35Å; W840-P1096 VanDerWaalsContact O-CB 3.23Å; W840-P1096 WeakPolarHBondContact O-CB 3.48Å; F844-P1096 HydrophobicContact CB-CB 4.33Å; F1092-P1096 WeakPolarHBondContact O-CD 3.2Å; C1093-P1096 WeakPolarHBondContact O-CD 3.45Å; P1096-I1098 PolarHBondContact O-N 3.47Å; P1096-L1099 WeakPolarHBondContact O-CB 3.28Å; P1096-L1099 PolarHBondContact O-N 3.48Å; P1096-L1099 VanDerWaalsContact O-N 3.12Å; P1096-Y1100 PolarHBondContact O-N 3.21Å
1097	G	87.2	Confident	87.7	Confident	2 Å²	2	45.9 Å²	45.9	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-26.8	178.6	0	0	0	0	0	114.2	F844 I1094 V1095 L1099 Y1100 F1101	F844-G1097 VanDerWaalsContact CG-CA 3.5Å; I1094-G1097 VanDerWaalsContact O-CA 3.3Å; I1094-G1097 WeakPolarHBondContact O-CA 3.48Å; I1094-G1097 PolarHBondContact O-N 3.37Å; V1095-G1097 PolarHBondContact O-N 2.79Å; V1095-G1097 VanDerWaalsContact O-N 3.14Å; G1097-L1099 VanDerWaalsContact C-N 3.32Å; G1097-L1099 PolarHBondContact O-N 2.76Å; G1097-Y1100 WeakPolarHBondContact O-CB 3.2Å; G1097-Y1100 PolarHBondContact O-N 2.67Å; G1097-Y1100 VanDerWaalsContact O-N 3.11Å; G1097-F1101 WeakPolarHBondContact O-CD2 3.19Å; G1097-F1101 PolarHBondContact O-N 2.79Å
1098	I	88.6	Confident	87.9	Confident	118 Å²	118	50.2 Å²	50.2	61%	0.605	26%	0.263	S	S	*	.	H	α-helix	trans	-59.8	-45	174	-57.7	175.5	0	0	0	110.4	V1095 P1096 Y1100 F1101 L1102	V1095-I1098 PolarHBondContact O-N 2.83Å; P1096-I1098 PolarHBondContact O-N 3.47Å; I1098-Y1100 VanDerWaalsContact C-N 3.29Å; I1098-Y1100 PolarHBondContact O-N 3.24Å; I1098-F1101 PolarHBondContact O-N 3.11Å; I1098-L1102 HydrophobicContact CG2-CD1 4.35Å; I1098-L1102 WeakPolarHBondContact O-CG 3.45Å; I1098-L1102 PolarHBondContact O-N 3.29Å
1099	L	90.4	Very high	88.5	Confident	61 Å²	61	45.9 Å²	45.9	32%	0.319	24%	0.235	S	C	.	.	H	α-helix	trans	-65.2	-34.3	175.9	178.3	63.5	0	0	0	111.7	P837 W840 P1096 G1097 L1102 A1103	P837-L1099 HydrophobicContact CB-CD2 3.83Å; P837-L1099 VanDerWaalsContact O-CD2 3.26Å; P837-L1099 WeakPolarHBondContact O-CD2 3.36Å; W840-L1099 HydrophobicContact CB-CD2 4.09Å; P1096-L1099 WeakPolarHBondContact O-CB 3.28Å; P1096-L1099 PolarHBondContact O-N 3.48Å; P1096-L1099 VanDerWaalsContact O-N 3.12Å; G1097-L1099 VanDerWaalsContact C-N 3.32Å; G1097-L1099 PolarHBondContact O-N 2.76Å; L1099-L1102 PolarHBondContact O-N 2.92Å; L1099-A1103 VanDerWaalsContact O-CB 3.25Å; L1099-A1103 WeakPolarHBondContact O-CB 3.33Å; L1099-A1103 PolarHBondContact O-N 3.1Å
1100	Y	91.3	Very high	89.2	Confident	16 Å²	16	42 Å²	42	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-47.2	176.1	-175.7	-85.5	0	0	0	112.3	Y841 F844 E845 P1096 G1097 I1098 L1102 A1103 I1104 Y1108	Y841-Y1100 AromaticContact CD2-CD2 3.69Å; Y841-Y1100 HydrophobicContact CD2-CD2 3.69Å; Y841-Y1100 HydrophobicContact CD2-CG 4.24Å; Y841-Y1100 HydrophobicContact CE1-CD2 4.17Å; Y841-Y1100 HydrophobicContact CE1-CE2 4.19Å; Y841-Y1100 AromaticContact CE2-CD2 3.14Å; Y841-Y1100 HydrophobicContact CE2-CD2 3.14Å; Y841-Y1100 AromaticContact CE2-CE2 3.68Å; Y841-Y1100 HydrophobicContact CE2-CE2 3.68Å; Y841-Y1100 AromaticContact CE2-CG 3.78Å; Y841-Y1100 HydrophobicContact CE2-CG 3.78Å; Y841-Y1100 HydrophobicContact CG-CD2 4.37Å; Y841-Y1100 AromaticContact CZ-CD2 3.4Å; Y841-Y1100 AromaticContact CZ-CE2 3.43Å; Y841-Y1100 VanDerWaalsContact CZ-CE2 3.43Å; Y841-Y1100 WeakPolarHBondContact OH-CE2 3.23Å; F844-Y1100 AromaticContact CD1-CD1 3.77Å; F844-Y1100 HydrophobicContact CD1-CD1 3.77Å; F844-Y1100 AromaticContact CD1-CD2 3.76Å; F844-Y1100 HydrophobicContact CD1-CD2 3.76Å; F844-Y1100 HydrophobicContact CD1-CE1 4.43Å; F844-Y1100 HydrophobicContact CD1-CE2 4.44Å; F844-Y1100 AromaticContact CD1-CG 3.38Å; F844-Y1100 HydrophobicContact CD1-CG 3.38Å; F844-Y1100 AromaticContact CE1-CD1 3.6Å; F844-Y1100 HydrophobicContact CE1-CD1 3.6Å; F844-Y1100 HydrophobicContact CE1-CD2 4.44Å; F844-Y1100 HydrophobicContact CE1-CE1 4.23Å; F844-Y1100 AromaticContact CE1-CG 3.72Å; F844-Y1100 HydrophobicContact CE1-CG 3.72Å; E845-Y1100 HydrophobicContact CB-CD2 4.26Å; E845-Y1100 HydrophobicContact CB-CE2 3.83Å; E845-Y1100 HydrophobicContact CG-CE2 4.08Å; P1096-Y1100 PolarHBondContact O-N 3.21Å; G1097-Y1100 WeakPolarHBondContact O-CB 3.2Å; G1097-Y1100 PolarHBondContact O-N 2.67Å; G1097-Y1100 VanDerWaalsContact O-N 3.11Å; I1098-Y1100 VanDerWaalsContact C-N 3.29Å; I1098-Y1100 PolarHBondContact O-N 3.24Å; Y1100-L1102 VanDerWaalsContact C-N 3.33Å; Y1100-L1102 PolarHBondContact O-N 2.94Å; Y1100-A1103 PolarHBondContact O-N 3.28Å; Y1100-I1104 PolarHBondContact O-N 2.88Å; Y1100-Y1108 HydrophobicContact CE1-CE2 4.49Å; Y1100-Y1108 PolarHBondContact OH-OH 3.44Å
1101	F	88.2	Confident	89.7	Confident	73 Å²	73	42 Å²	42	32%	0.32	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-39.3	176.9	-76	-69.7	0	0	0	112.4	F844 F1080 G1097 I1098 A1103 I1104	F844-F1101 HydrophobicContact CE1-CE2 4.48Å; F844-F1101 HydrophobicContact CZ-CE2 4.22Å; F1080-F1101 AromaticContact CD2-CZ 3.94Å; F1080-F1101 HydrophobicContact CD2-CZ 3.94Å; F1080-F1101 HydrophobicContact CE2-CE1 4.41Å; F1080-F1101 AromaticContact CE2-CZ 3.74Å; F1080-F1101 HydrophobicContact CE2-CZ 3.74Å; G1097-F1101 WeakPolarHBondContact O-CD2 3.19Å; G1097-F1101 PolarHBondContact O-N 2.79Å; I1098-F1101 PolarHBondContact O-N 3.11Å; F1101-A1103 VanDerWaalsContact C-N 3.35Å; F1101-I1104 HydrophobicContact CD1-CD1 3.78Å; F1101-I1104 WeakPolarHBondContact O-CB 3.41Å; F1101-I1104 WeakPolarHBondContact O-CG1 3.35Å; F1101-I1104 PolarHBondContact O-N 3.24Å
1102	L	90.4	Very high	90	Very high	31 Å²	31	38.8 Å²	38.8	16%	0.162	20%	0.195	C	C	.	.	H	α-helix	trans	-68	-33.2	175.1	-65.4	173.3	0	0	0	113	M1049 M1050 I1053 I1098 L1099 Y1100 I1104	M1049-L1102 HydrophobicContact CB-CD2 4.12Å; M1050-L1102 HydrophobicContact CG-CD2 3.96Å; M1050-L1102 HydrophobicContact SD-CD1 4Å; M1050-L1102 HydrophobicContact SD-CD2 3.45Å; M1050-L1102 WeakPolarHBondContact SD-CD2 3.2Å; M1050-L1102 HydrophobicContact SD-CG 4.38Å; I1053-L1102 HydrophobicContact CD1-CD2 3.68Å; I1098-L1102 HydrophobicContact CG2-CD1 4.35Å; I1098-L1102 WeakPolarHBondContact O-CG 3.45Å; I1098-L1102 PolarHBondContact O-N 3.29Å; L1099-L1102 PolarHBondContact O-N 2.92Å; Y1100-L1102 VanDerWaalsContact C-N 3.33Å; Y1100-L1102 PolarHBondContact O-N 2.94Å; L1102-I1104 VanDerWaalsContact C-N 3.3Å; L1102-I1104 PolarHBondContact O-N 2.72Å
1103	A	90.9	Very high	90.2	Very high	13 Å²	13	31.6 Å²	31.6	11%	0.107	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-2.1	179.1	0	0	0	0	0	114.3	Y841 L1099 Y1100 F1101 C1106 M1107	Y841-A1103 HydrophobicContact CD2-CB 3.88Å; Y841-A1103 HydrophobicContact CE2-CB 3.84Å; L1099-A1103 VanDerWaalsContact O-CB 3.25Å; L1099-A1103 WeakPolarHBondContact O-CB 3.33Å; L1099-A1103 PolarHBondContact O-N 3.1Å; Y1100-A1103 PolarHBondContact O-N 3.28Å; F1101-A1103 VanDerWaalsContact C-N 3.35Å; A1103-C1106 WeakPolarHBondContact O-CB 3.33Å; A1103-C1106 PolarHBondContact O-N 2.9Å; A1103-M1107 HydrophobicContact CB-CG 4.03Å; A1103-M1107 WeakPolarHBondContact O-CG 3.32Å; A1103-M1107 PolarHBondContact O-N 3.48Å
1104	I	89.6	Confident	90.5	Very high	26 Å²	26	30.3 Å²	30.3	13%	0.133	16%	0.155	C	C	.	.	H	α-helix	trans	-48.5	-50.3	-174.2	-79.5	173.7	0	0	0	113.7	I992 M995 Y1100 F1101 L1102 C1106 M1107 Y1108	I992-I1104 HydrophobicContact CD1-CG2 3.67Å; I992-I1104 HydrophobicContact CG1-CG2 4.28Å; I992-I1104 HydrophobicContact CG2-CG2 4.2Å; M995-I1104 HydrophobicContact CE-CG2 4.49Å; Y1100-I1104 PolarHBondContact O-N 2.88Å; F1101-I1104 HydrophobicContact CD1-CD1 3.78Å; F1101-I1104 WeakPolarHBondContact O-CB 3.41Å; F1101-I1104 WeakPolarHBondContact O-CG1 3.35Å; F1101-I1104 PolarHBondContact O-N 3.24Å; L1102-I1104 VanDerWaalsContact C-N 3.3Å; L1102-I1104 PolarHBondContact O-N 2.72Å; I1104-C1106 PolarHBondContact O-N 2.85Å; I1104-M1107 PolarHBondContact O-N 3.4Å; I1104-Y1108 HydrophobicContact CG1-CD2 4.48Å; I1104-Y1108 HydrophobicContact CG2-CD2 4.34Å; I1104-Y1108 WeakPolarHBondContact O-CB 3.39Å; I1104-Y1108 PolarHBondContact O-N 2.95Å
1105	P	89.8	Confident	90.6	Very high	1 Å²	1	28 Å²	28	1%	0.006	14%	0.143	C	C	.	.	I	π-helix	trans	-70.8	-32.1	-178.7	-14	27.9	0	0	0	112.6	I992 I996 F1045 M1049 M1107 L1109 L1110	I992-P1105 HydrophobicContact CG2-CB 4.3Å; I996-P1105 HydrophobicContact CD1-CB 3.75Å; I996-P1105 HydrophobicContact CD1-CG 3.68Å; I996-P1105 HydrophobicContact CG1-CG 4.48Å; F1045-P1105 HydrophobicContact CB-CB 3.89Å; F1045-P1105 HydrophobicContact CB-CG 4.2Å; F1045-P1105 HydrophobicContact CD1-CB 3.92Å; F1045-P1105 HydrophobicContact CD1-CG 4.37Å; F1045-P1105 HydrophobicContact CG-CB 3.94Å; M1049-P1105 VanDerWaalsContact CG-CD 3.45Å; M1049-P1105 HydrophobicContact CG-CG 3.45Å; M1049-P1105 VanDerWaalsContact CG-CG 3.45Å; M1049-P1105 HydrophobicContact SD-CG 3.58Å; M1049-P1105 VanDerWaalsContact SD-CG 3.58Å; P1105-M1107 VanDerWaalsContact C-N 3.3Å; P1105-M1107 PolarHBondContact O-N 2.86Å; P1105-L1109 WeakPolarHBondContact O-CA 3.29Å; P1105-L1109 VanDerWaalsContact O-CB 3.28Å; P1105-L1109 WeakPolarHBondContact O-CB 3.44Å; P1105-L1109 PolarHBondContact O-N 3Å; P1105-L1110 PolarHBondContact O-N 3.42Å
1106	C	92.1	Very high	90.7	Very high	8 Å²	8	24.8 Å²	24.8	5%	0.054	12%	0.124	C	C	.	.	I	π-helix	trans	-63.5	-39.9	174.2	-172.1	0	0	0	0	111	A1103 I1104 L1110 L1111	A1103-C1106 WeakPolarHBondContact O-CB 3.33Å; A1103-C1106 PolarHBondContact O-N 2.9Å; I1104-C1106 PolarHBondContact O-N 2.85Å; C1106-L1110 WeakPolarHBondContact O-CB 3.31Å; C1106-L1111 WeakPolarHBondContact O-CB 3.28Å; C1106-L1111 PolarHBondContact O-N 3.19Å
1107	M	90.6	Very high	90.7	Very high	16 Å²	16	24.2 Å²	24.2	8%	0.079	12%	0.12	C	C	.	.	I	π-helix	trans	-98.2	-24.8	-169.6	-56.3	-57.2	-173.7	0	0	115.2	M838 Y841 F938 F939 A1103 I1104 P1105 L1111	M838-M1107 HydrophobicContact CE-CE 3.87Å; M838-M1107 HydrophobicContact SD-CE 4.13Å; Y841-M1107 HydrophobicContact CD2-CG 4.5Å; Y841-M1107 HydrophobicContact CE1-CG 4.24Å; Y841-M1107 HydrophobicContact CE2-CB 4.31Å; Y841-M1107 HydrophobicContact CE2-CG 3.7Å; Y841-M1107 VanDerWaalsContact OH-CB 3.3Å; Y841-M1107 WeakPolarHBondContact OH-CB 3.36Å; F938-M1107 HydrophobicContact CD1-CE 4.43Å; F938-M1107 HydrophobicContact CE1-CE 3.94Å; F938-M1107 HydrophobicContact CE1-SD 3.67Å; F938-M1107 HydrophobicContact CZ-SD 4.45Å; F939-M1107 HydrophobicContact CE2-CE 4.32Å; F939-M1107 HydrophobicContact CE2-SD 3.95Å; F939-M1107 HydrophobicContact CZ-SD 4.39Å; A1103-M1107 HydrophobicContact CB-CG 4.03Å; A1103-M1107 WeakPolarHBondContact O-CG 3.32Å; A1103-M1107 PolarHBondContact O-N 3.48Å; I1104-M1107 PolarHBondContact O-N 3.4Å; P1105-M1107 VanDerWaalsContact C-N 3.3Å; P1105-M1107 PolarHBondContact O-N 2.86Å; M1107-L1111 HydrophobicContact SD-CD2 4.19Å
1108	Y	88.9	Confident	90.9	Very high	97 Å²	97	24.2 Å²	24.2	38%	0.38	12%	0.119	S	C	.	.	I	π-helix	trans	-103.3	-23.2	177	-79.2	-84.3	0	0	0	114.2	Y1100 I1104 T1112	Y1100-Y1108 HydrophobicContact CE1-CE2 4.49Å; Y1100-Y1108 PolarHBondContact OH-OH 3.44Å; I1104-Y1108 HydrophobicContact CG1-CD2 4.48Å; I1104-Y1108 HydrophobicContact CG2-CD2 4.34Å; I1104-Y1108 WeakPolarHBondContact O-CB 3.39Å; I1104-Y1108 PolarHBondContact O-N 2.95Å; Y1108-T1112 VanDerWaalsContact C-OG1 3.31Å; Y1108-T1112 WeakPolarHBondContact O-CB 3.48Å; Y1108-T1112 PolarHBondContact O-OG1 2.88Å
1109	L	91.9	Very high	90.8	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.016	9%	0.093	C	C	.	.	I	π-helix	trans	-107.2	-63.5	179.8	169.9	61.8	0	0	0	111.1	P989 I992 L993 V1019 P1105 I1113	P989-L1109 HydrophobicContact CB-CD1 3.73Å; I992-L1109 HydrophobicContact CG2-CB 4.28Å; L993-L1109 HydrophobicContact CB-CD2 4.48Å; V1019-L1109 HydrophobicContact CG1-CD1 3.98Å; V1019-L1109 HydrophobicContact CG1-CG 4.48Å; V1019-L1109 HydrophobicContact CG2-CD2 3.85Å; P1105-L1109 WeakPolarHBondContact O-CA 3.29Å; P1105-L1109 VanDerWaalsContact O-CB 3.28Å; P1105-L1109 WeakPolarHBondContact O-CB 3.44Å; P1105-L1109 PolarHBondContact O-N 3Å; L1109-I1113 HydrophobicContact CD1-CD1 3.73Å; L1109-I1113 HydrophobicContact CG-CD1 4.48Å; L1109-I1113 WeakPolarHBondContact O-CG1 3.5Å; L1109-I1113 PolarHBondContact O-N 3.48Å; L1109-I1113 VanDerWaalsContact O-N 3.16Å
1110	L	92.9	Very high	90.6	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.088	C	C	.	.	I	π-helix	trans	-65.7	-50.6	-177.2	-57.2	-179.3	0	0	0	112.5	F1022 S1041 F1045 P1105 C1106 T1112 I1113 Y1114	F1022-L1110 HydrophobicContact CB-CD2 4.38Å; F1022-L1110 HydrophobicContact CD1-CB 4.4Å; F1022-L1110 HydrophobicContact CD1-CD2 3.61Å; F1022-L1110 HydrophobicContact CE1-CB 3.93Å; F1022-L1110 HydrophobicContact CE1-CD2 4.02Å; F1022-L1110 WeakPolarHBondContact CE1-O 3.4Å; F1022-L1110 HydrophobicContact CG-CD2 3.93Å; F1022-L1110 HydrophobicContact CZ-CB 4.28Å; S1041-L1110 WeakPolarHBondContact OG-CD1 3.5Å; F1045-L1110 HydrophobicContact CD2-CD1 4.05Å; F1045-L1110 HydrophobicContact CD2-CD2 4.48Å; F1045-L1110 HydrophobicContact CD2-CG 4.44Å; F1045-L1110 HydrophobicContact CE2-CD2 4.18Å; P1105-L1110 PolarHBondContact O-N 3.42Å; C1106-L1110 WeakPolarHBondContact O-CB 3.31Å; L1110-T1112 VanDerWaalsContact C-N 3.29Å; L1110-T1112 PolarHBondContact O-N 2.86Å; L1110-I1113 PolarHBondContact O-N 3.15Å; L1110-Y1114 WeakPolarHBondContact O-CB 3.45Å; L1110-Y1114 PolarHBondContact O-N 3.18Å
1111	L	92.6	Very high	90.1	Very high	6 Å²	6	19 Å²	19	3%	0.031	9%	0.093	C	C	.	.	H	α-helix	trans	-60.2	-38.2	-179.6	177.2	61.1	0	0	0	112.6	F938 F939 R942 I946 C1106 M1107 Y1114 S1115	F938-L1111 HydrophobicContact CE1-CD2 4.08Å; F939-L1111 HydrophobicContact CB-CD1 4.38Å; F939-L1111 HydrophobicContact CD1-CD1 3.53Å; F939-L1111 HydrophobicContact CD2-CD1 4.17Å; F939-L1111 HydrophobicContact CE1-CB 3.89Å; F939-L1111 HydrophobicContact CE1-CD1 3.66Å; F939-L1111 HydrophobicContact CE1-CG 4.38Å; F939-L1111 HydrophobicContact CE2-CD1 4.25Å; F939-L1111 HydrophobicContact CG-CD1 3.78Å; F939-L1111 HydrophobicContact CZ-CB 3.83Å; F939-L1111 HydrophobicContact CZ-CD1 4.01Å; F939-L1111 HydrophobicContact CZ-CG 4.43Å; R942-L1111 HydrophobicContact CB-CD1 3.95Å; R942-L1111 HydrophobicContact CB-CD2 3.91Å; R942-L1111 HydrophobicContact CB-CG 4.33Å; R942-L1111 HydrophobicContact CG-CD2 4.2Å; I946-L1111 HydrophobicContact CD1-CD2 4.37Å; I946-L1111 HydrophobicContact CD1-CG 4.1Å; C1106-L1111 WeakPolarHBondContact O-CB 3.28Å; C1106-L1111 PolarHBondContact O-N 3.19Å; M1107-L1111 HydrophobicContact SD-CD2 4.19Å; L1111-Y1114 HydrophobicContact CD1-CD1 4.27Å; L1111-Y1114 PolarHBondContact O-N 3.39Å; L1111-S1115 WeakPolarHBondContact O-CB 3.39Å; L1111-S1115 PolarHBondContact O-N 3.48Å
1112	T	91.9	Very high	89.5	Confident	8 Å²	8	16.7 Å²	16.7	5%	0.049	9%	0.085	C	C	.	.	H	α-helix	trans	-65.2	-47.7	177.9	-43.7	0	0	0	0	110.7	P989 Y1108 L1110 Y1114 S1115 V1116 F1315	P989-T1112 HydrophobicContact CG-CG2 4.1Å; Y1108-T1112 VanDerWaalsContact C-OG1 3.31Å; Y1108-T1112 WeakPolarHBondContact O-CB 3.48Å; Y1108-T1112 PolarHBondContact O-OG1 2.88Å; L1110-T1112 VanDerWaalsContact C-N 3.29Å; L1110-T1112 PolarHBondContact O-N 2.86Å; T1112-Y1114 PolarHBondContact O-N 2.91Å; T1112-S1115 PolarHBondContact O-N 3.2Å; T1112-S1115 PolarHBondContact O-OG 3.3Å; T1112-V1116 WeakPolarHBondContact O-CG2 3.39Å; T1112-V1116 PolarHBondContact O-N 3.13Å; T1112-V1116 VanDerWaalsContact O-N 3.09Å; T1112-F1315 HydrophobicContact CG2-CE2 4.14Å; T1112-F1315 HydrophobicContact CG2-CZ 3.65Å
1113	I	92.2	Very high	88.5	Confident	10 Å²	10	16.9 Å²	16.9	5%	0.051	9%	0.089	C	C	.	.	H	α-helix	trans	-57.2	-49.3	173.5	-68.5	167	0	0	0	110.7	V1019 F1022 A1023 L1109 L1110 S1115 V1116 C1117 F1315	V1019-I1113 HydrophobicContact CG1-CD1 3.85Å; F1022-I1113 HydrophobicContact CD1-CB 4.39Å; F1022-I1113 HydrophobicContact CD1-CG2 4.02Å; F1022-I1113 HydrophobicContact CE1-CB 4.23Å; F1022-I1113 HydrophobicContact CE1-CG2 4.07Å; A1023-I1113 HydrophobicContact CB-CG2 4.11Å; L1109-I1113 HydrophobicContact CD1-CD1 3.73Å; L1109-I1113 HydrophobicContact CG-CD1 4.48Å; L1109-I1113 WeakPolarHBondContact O-CG1 3.5Å; L1109-I1113 PolarHBondContact O-N 3.48Å; L1109-I1113 VanDerWaalsContact O-N 3.16Å; L1110-I1113 PolarHBondContact O-N 3.15Å; I1113-S1115 VanDerWaalsContact C-N 3.3Å; I1113-S1115 PolarHBondContact O-N 3.21Å; I1113-V1116 PolarHBondContact O-N 3.2Å; I1113-C1117 WeakPolarHBondContact O-CB 3.25Å; I1113-C1117 PolarHBondContact O-N 3.49Å; I1113-C1117 PolarHBondContact O-SG 3.29Å; I1113-F1315 HydrophobicContact CG1-CE1 4.23Å
1114	Y	93.6	Very high	87	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-56.9	-41.8	177.4	173.4	-104.3	0	0	0	112.4	F939 N940 R943 T1031 Q1034 L1035 L1110 L1111 T1112 N1118	F939-Y1114 HydrophobicContact CB-CD1 4.42Å; F939-Y1114 HydrophobicContact CB-CE1 4.01Å; F939-Y1114 AromaticContact CD1-CD1 3.69Å; F939-Y1114 HydrophobicContact CD1-CD1 3.69Å; F939-Y1114 HydrophobicContact CD1-CE1 4.08Å; F939-Y1114 HydrophobicContact CD1-CG 4.12Å; N940-Y1114 PolarHBondContact OD1-OH 3.09Å; R943-Y1114 HydrophobicContact CB-CE1 4.01Å; R943-Y1114 HydrophobicContact CG-CE1 4.42Å; T1031-Y1114 HydrophobicContact CG2-CE2 4.23Å; T1031-Y1114 WeakPolarHBondContact CG2-OH 3.24Å; Q1034-Y1114 HydrophobicContact CB-CD2 4.36Å; Q1034-Y1114 HydrophobicContact CB-CE2 4.22Å; L1035-Y1114 HydrophobicContact CD2-CE1 4.2Å; L1035-Y1114 HydrophobicContact CD2-CE2 4.12Å; L1035-Y1114 HydrophobicContact CG-CE2 4.25Å; L1110-Y1114 WeakPolarHBondContact O-CB 3.45Å; L1110-Y1114 PolarHBondContact O-N 3.18Å; L1111-Y1114 HydrophobicContact CD1-CD1 4.27Å; L1111-Y1114 PolarHBondContact O-N 3.39Å; T1112-Y1114 PolarHBondContact O-N 2.91Å; Y1114-N1118 VanDerWaalsContact CD2-ND2 3.27Å; Y1114-N1118 WeakPolarHBondContact CD2-ND2 3.38Å; Y1114-N1118 WeakPolarHBondContact CE2-ND2 3.2Å; Y1114-N1118 WeakPolarHBondContact O-CB 3.48Å; Y1114-N1118 PolarHBondContact O-N 2.83Å; Y1114-N1118 VanDerWaalsContact O-N 3.09Å; Y1114-N1118 PolarHBondContact O-ND2 3.03Å
1115	S	91.7	Very high	85.3	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-67.4	-38.6	180	75.2	0	0	0	0	113.3	L1111 T1112 I1113	L1111-S1115 WeakPolarHBondContact O-CB 3.39Å; L1111-S1115 PolarHBondContact O-N 3.48Å; T1112-S1115 PolarHBondContact O-N 3.2Å; T1112-S1115 PolarHBondContact O-OG 3.3Å; I1113-S1115 VanDerWaalsContact C-N 3.3Å; I1113-S1115 PolarHBondContact O-N 3.21Å
1116	V	90.5	Very high	83.5	Confident	19 Å²	19	21.4 Å²	21.4	12%	0.115	11%	0.114	C	C	.	.	H	α-helix	trans	-76.3	-46.4	179.8	175.7	0	0	0	0	110.8	T1112 I1113 N1118 L1119 V1311 F1315	T1112-V1116 WeakPolarHBondContact O-CG2 3.39Å; T1112-V1116 PolarHBondContact O-N 3.13Å; T1112-V1116 VanDerWaalsContact O-N 3.09Å; I1113-V1116 PolarHBondContact O-N 3.2Å; V1116-N1118 PolarHBondContact O-N 2.67Å; V1116-L1119 VanDerWaalsContact O-CB 3.3Å; V1116-L1119 WeakPolarHBondContact O-CB 3.16Å; V1116-L1119 PolarHBondContact O-N 2.87Å; V1116-V1311 HydrophobicContact CG1-CG1 4.09Å; V1116-F1315 HydrophobicContact CB-CD1 4.31Å; V1116-F1315 HydrophobicContact CB-CE1 4.46Å; V1116-F1315 HydrophobicContact CG1-CB 4.14Å; V1116-F1315 HydrophobicContact CG1-CD1 4.12Å; V1116-F1315 HydrophobicContact CG1-CG 4.14Å; V1116-F1315 HydrophobicContact CG2-CD1 4.28Å; V1116-F1315 HydrophobicContact CG2-CD2 4.26Å; V1116-F1315 HydrophobicContact CG2-CE1 4.22Å; V1116-F1315 HydrophobicContact CG2-CE2 4.21Å; V1116-F1315 HydrophobicContact CG2-CG 4.29Å; V1116-F1315 HydrophobicContact CG2-CZ 4.17Å
1117	C	90.4	Very high	81.8	Confident	1 Å²	1	24 Å²	24	1%	0.007	12%	0.122	C	C	.	.	H	α-helix	trans	-66.8	-22.4	178.8	-65.9	0	0	0	0	113.1	C1026 L1027 I1113 R1308	C1026-C1117 HydrophobicContact CB-CB 3.58Å; L1027-C1117 HydrophobicContact CD2-CB 4.07Å; L1027-C1117 HydrophobicContact CG-CB 4.45Å; I1113-C1117 WeakPolarHBondContact O-CB 3.25Å; I1113-C1117 PolarHBondContact O-N 3.49Å; I1113-C1117 PolarHBondContact O-SG 3.29Å; C1117-R1308 VanDerWaalsContact O-CD 3.23Å; C1117-R1308 WeakPolarHBondContact O-CD 3.45Å; C1117-R1308 VanDerWaalsContact O-CG 3.28Å; C1117-R1308 WeakPolarHBondContact O-CG 3.19Å
1118	N	89.6	Confident	79.6	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	20.9	174.3	-67.3	-82.5	0	0	0	114.8	R943 Q1034 Y1114 V1116 H1120 V1121	R943-N1118 HydrophobicContact CG-CB 4.05Å; Q1034-N1118 VanDerWaalsContact OE1-CG 3.3Å; Q1034-N1118 PolarHBondContact OE1-ND2 3.26Å; Q1034-N1118 PolarHBondContact OE1-OD1 3.37Å; Q1034-N1118 VanDerWaalsContact OE1-OD1 3.11Å; Y1114-N1118 VanDerWaalsContact CD2-ND2 3.27Å; Y1114-N1118 WeakPolarHBondContact CD2-ND2 3.38Å; Y1114-N1118 WeakPolarHBondContact CE2-ND2 3.2Å; Y1114-N1118 WeakPolarHBondContact O-CB 3.48Å; Y1114-N1118 PolarHBondContact O-N 2.83Å; Y1114-N1118 VanDerWaalsContact O-N 3.09Å; Y1114-N1118 PolarHBondContact O-ND2 3.03Å; V1116-N1118 PolarHBondContact O-N 2.67Å; N1118-H1120 PolarHBondContact O-N 3.42Å; N1118-H1120 VanDerWaalsContact O-N 3.07Å; N1118-V1121 HydrophobicContact CB-CG2 4.07Å; N1118-V1121 PolarHBondContact O-N 2.97Å
1119	L	86.8	Confident	77.2	Confident	11 Å²	11	28.9 Å²	28.9	6%	0.058	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-35.8	177	-169.2	64.8	0	0	0	113.7	I898 P947 V1116 V1121 L1307 R1308 V1311	I898-L1119 HydrophobicContact CD1-CD1 3.67Å; I898-L1119 HydrophobicContact CD1-CD2 3.85Å; I898-L1119 HydrophobicContact CD1-CG 3.62Å; I898-L1119 HydrophobicContact CG1-CD1 3.84Å; I898-L1119 HydrophobicContact CG1-CG 4.17Å; I898-L1119 HydrophobicContact CG2-CD1 3.94Å; P947-L1119 HydrophobicContact CB-CD1 3.47Å; P947-L1119 VanDerWaalsContact CB-CD1 3.47Å; P947-L1119 HydrophobicContact CG-CD1 3.92Å; V1116-L1119 VanDerWaalsContact O-CB 3.3Å; V1116-L1119 WeakPolarHBondContact O-CB 3.16Å; V1116-L1119 PolarHBondContact O-N 2.87Å; L1119-V1121 PolarHBondContact O-N 2.71Å; L1119-L1307 HydrophobicContact CD2-CG 4.19Å; L1119-R1308 HydrophobicContact CB-CB 4.24Å; L1119-R1308 HydrophobicContact CB-CG 4.47Å; L1119-V1311 HydrophobicContact CD2-CB 4.2Å; L1119-V1311 HydrophobicContact CD2-CG1 4.39Å; L1119-V1311 HydrophobicContact CD2-CG2 4.25Å
1120	H	86.6	Confident	74.4	Confident	47 Å²	47	34.4 Å²	34.4	22%	0.218	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-11.1	177	71.2	-52.1	0	0	0	116.1	N1118 V1122 L1304 R1305 R1308	N1118-H1120 PolarHBondContact O-N 3.42Å; N1118-H1120 VanDerWaalsContact O-N 3.07Å; H1120-V1122 PolarHBondContact O-N 3.25Å; H1120-L1304 HydrophobicContact CB-CB 4.21Å; H1120-R1305 HydrophobicContact CB-CG 4.25Å; H1120-R1308 HydrophobicContact CB-CB 4.15Å; H1120-R1308 HydrophobicContact CB-CG 4.45Å; H1120-R1308 WeakPolarHBondContact ND1-CD 3.26Å
1121	V	82.1	Confident	71.4	Confident	27 Å²	27	38.8 Å²	38.8	16%	0.164	23%	0.227	C	C	.	.			trans	-96.6	94.3	-174.4	-167.6	0	0	0	0	110.6	Q902 R943 N1118 L1119 S1123	Q902-V1121 PolarHBondContact NE2-O 3.45Å; R943-V1121 PolarHBondContact NH2-O 3.4Å; N1118-V1121 HydrophobicContact CB-CG2 4.07Å; N1118-V1121 PolarHBondContact O-N 2.97Å; L1119-V1121 PolarHBondContact O-N 2.71Å; V1121-S1123 VanDerWaalsContact C-N 3.27Å; V1121-S1123 WeakPolarHBondContact CG1-OG 3.45Å; V1121-S1123 PolarHBondContact O-N 3.14Å
1122	V	73.7	Confident	68.3	Low	25 Å²	25	44.6 Å²	44.6	15%	0.152	26%	0.262	C	S	.	.			trans	-88	21.2	-174.5	-151.2	0	0	0	0	113.8	R760 Q902 H1120 L1304	R760-V1122 PolarHBondContact NH2-O 2.88Å; Q902-V1122 HydrophobicContact CG-CG1 4.1Å; H1120-V1122 PolarHBondContact O-N 3.25Å; V1122-L1304 HydrophobicContact CG2-CD1 3.65Å; V1122-L1304 HydrophobicContact CG2-CD2 4.5Å
1123	S	71	Confident	65.2	Low	35 Å²	35	47.5 Å²	47.5	25%	0.245	29%	0.287	C	S	.	.			trans	-80.2	153.5	170.6	53.3	0	0	0	0	112.3	R943 V1121 E1128	R943-S1123 PolarHBondContact NH2-O 3.07Å; R943-S1123 PolarHBondContact NH2-OG 3.29Å; V1121-S1123 VanDerWaalsContact C-N 3.27Å; V1121-S1123 WeakPolarHBondContact CG1-OG 3.45Å; V1121-S1123 PolarHBondContact O-N 3.14Å; S1123-E1128 WeakPolarHBondContact CB-OE2 3.33Å
1124	W	58.7	Low	62.2	Low	60 Å²	60	51.7 Å²	51.7	23%	0.227	31%	0.31	C	S	.	.			trans	-76.4	-25.6	173.8	-79.2	60.8	0	0	0	112.7	K761 E904 T1126 E1128	K761-W1124 HydrophobicContact CB-CH2 3.87Å; K761-W1124 HydrophobicContact CB-CZ2 4.24Å; K761-W1124 HydrophobicContact CD-CH2 4.07Å; E904-W1124 WeakPolarHBondContact OE1-CH2 3.45Å; W1124-T1126 PolarHBondContact O-N 3.05Å; W1124-E1128 WeakPolarHBondContact CB-OE1 3.38Å; W1124-E1128 PolarHBondContact N-OE1 3.46Å
1125	G	52.7	Low	59.1	Low	18 Å²	18	58.9 Å²	58.9	19%	0.186	35%	0.348	C	S	.	.			trans	69.4	4.4	161.2	0	0	0	0	0	117.6	N940	N940-G1125 WeakPolarHBondContact CB-O 3.18Å; N940-G1125 PolarHBondContact ND2-O 2.89Å
1126	T	52.7	Low	56	Low	57 Å²	57	68.3 Å²	68.3	35%	0.35	38%	0.384	S	S	.	.	S	Bend	trans	-107.9	-39.1	174.6	60.1	0	0	0	0	113.3	E937 W1124	E937-T1126 HydrophobicContact CG-CG2 3.65Å; W1124-T1126 PolarHBondContact O-N 3.05Å
1127	R	55.7	Low	53.1	Low	63 Å²	63	73.5 Å²	73.5	24%	0.238	42%	0.418	C	S	.	.	S	Bend	trans	-133.6	10.8	-178.5	-52.3	-162.6	-162.7	125.4	-14.3	115.4	W637 H638 E639 E643 V1129	W637-R1127 HydrophobicContact CE3-CB 4.49Å; W637-R1127 HydrophobicContact CZ3-CB 4.04Å; H638-R1127 WeakPolarHBondContact O-CD 3.49Å; E639-R1127 IonicContact OE1-CZ 3.67Å; E639-R1127 IonicContact OE1-NH1 2.73Å; E639-R1127 PolarHBondContact OE1-NH1 3.21Å; E639-R1127 IonicContact OE2-CZ 2.69Å; E639-R1127 VanDerWaalsContact OE2-CZ 3.26Å; E639-R1127 IonicContact OE2-NH1 3.65Å; E639-R1127 PolarHBondContact OE2-NH1 3.21Å; E639-R1127 IonicContact OE2-NH2 2.64Å; E639-R1127 PolarHBondContact OE2-NH2 3.31Å; E643-R1127 IonicContact OE1-CZ 3.85Å; E643-R1127 IonicContact OE1-NH2 2.65Å; E643-R1127 PolarHBondContact OE1-NH2 2.59Å; E643-R1127 IonicContact OE2-NH2 3.79Å; E643-R1127 PolarHBondContact OE2-NH2 3.49Å; R1127-V1129 VanDerWaalsContact C-N 3.25Å; R1127-V1129 PolarHBondContact O-N 2.75Å
1128	E	46.4	Very low	50.2	Low	85 Å²	85	81 Å²	81	40%	0.397	45%	0.45	S	S	.	.			trans	-76.7	75.4	169.6	-76.5	176.6	-146.3	0	0	110.2	W637 S1123 W1124 V1130	W637-E1128 HydrophobicContact CH2-CB 4.45Å; W637-E1128 HydrophobicContact CH2-CG 3.68Å; W637-E1128 HydrophobicContact CZ3-CG 4.18Å; S1123-E1128 WeakPolarHBondContact CB-OE2 3.33Å; W1124-E1128 WeakPolarHBondContact CB-OE1 3.38Å; W1124-E1128 PolarHBondContact N-OE1 3.46Å; E1128-V1130 PolarHBondContact O-N 2.77Å
1129	V	37.6	Very low	47.3	Very low	131 Å²	131	92.2 Å²	92.2	79%	0.794	49%	0.492	S	S	*	.			trans	-64.3	117.3	157.3	-178.6	0	0	0	0	106.2	R1127 A1131	R1127-V1129 VanDerWaalsContact C-N 3.25Å; R1127-V1129 PolarHBondContact O-N 2.75Å; V1129-A1131 PolarHBondContact O-N 2.77Å
1130	V	32.6	Very low	44.6	Very low	119 Å²	119	97.8 Å²	97.8	72%	0.721	53%	0.526	S	S	*	.			trans	-61.7	113.2	170.9	177.1	0	0	0	0	106.8	E1128 V1132	E1128-V1130 PolarHBondContact O-N 2.77Å; V1130-V1132 VanDerWaalsContact C-N 3.33Å; V1130-V1132 PolarHBondContact O-N 3.06Å
1131	A	30.2	Very low	41.8	Very low	91 Å²	91	103.2 Å²	103.2	75%	0.752	56%	0.557	S	S	*	*			trans	-60.6	103.3	164.9	0	0	0	0	0	106.5	V1129 A1133	V1129-A1131 PolarHBondContact O-N 2.77Å; A1131-A1133 PolarHBondContact O-N 3.34Å
1132	V	27.1	Very low	39.2	Very low	128 Å²	128	106.2 Å²	106.2	78%	0.776	59%	0.585	S	S	*	*			trans	-61.4	109.2	174.9	177.2	0	0	0	0	106	V1130 D1134	V1130-V1132 VanDerWaalsContact C-N 3.33Å; V1130-V1132 PolarHBondContact O-N 3.06Å; V1132-D1134 PolarHBondContact O-N 3.18Å
1133	A	28.3	Very low	37.2	Very low	70 Å²	70	111.7 Å²	111.7	58%	0.579	62%	0.618	S	S	*	*			trans	-58.2	115.9	171	0	0	0	0	0	106.9	A1131 D1135	A1131-A1133 PolarHBondContact O-N 3.34Å; A1133-D1135 PolarHBondContact O-N 3.14Å
1134	D	27.8	Very low	35.1	Very low	97 Å²	97	116.6 Å²	116.6	52%	0.519	64%	0.642	S	S	.	*			trans	-78.3	56.6	179.8	-165.9	21.5	0	0	0	109.6	V1132 R1136 K1138	V1132-D1134 PolarHBondContact O-N 3.18Å; D1134-R1136 PolarHBondContact O-N 2.7Å; D1134-K1138 VanDerWaalsContact OD2-CE 3.29Å; D1134-K1138 WeakPolarHBondContact OD2-CE 3.41Å; D1134-K1138 IonicContact OD2-NZ 3.99Å; D1134-K1138 PolarHBondContact OD2-NZ 3.02Å
1135	D	28.4	Very low	33.8	Very low	151 Å²	151	123 Å²	123	81%	0.807	67%	0.672	S	S	*	*			trans	-71.2	62.4	175.5	-88.3	-30.7	0	0	0	110	A1133	A1133-D1135 PolarHBondContact O-N 3.14Å
1136	R	27.6	Very low	32.6	Very low	199 Å²	199	129.1 Å²	129.1	75%	0.751	70%	0.7	S	S	*	*	S	Bend	trans	-131.3	110.2	165.7	-63.4	-169.2	-172.1	-149.4	5.3	107.7	D1134 K1138	D1134-R1136 PolarHBondContact O-N 2.7Å; R1136-K1138 PolarHBondContact O-N 3.33Å
1137	P	29.3	Very low	31.4	Very low	127 Å²	127	133 Å²	133	83%	0.825	72%	0.723	S	S	*	*			trans	-64.7	107.1	178.6	26	-33.2	0	0	0	109.6	R1139	P1137-R1139 VanDerWaalsContact C-N 3.27Å; P1137-R1139 PolarHBondContact O-N 2.92Å
1138	K	28.8	Very low	30	Very low	160 Å²	160	136.9 Å²	136.9	70%	0.696	75%	0.754	S	S	*	*			trans	-69.7	80.8	179.4	-74.1	170.5	-174.5	153.7	0	110.6	D1134 R1136 V1140	D1134-K1138 VanDerWaalsContact OD2-CE 3.29Å; D1134-K1138 WeakPolarHBondContact OD2-CE 3.41Å; D1134-K1138 IonicContact OD2-NZ 3.99Å; D1134-K1138 PolarHBondContact OD2-NZ 3.02Å; R1136-K1138 PolarHBondContact O-N 3.33Å; K1138-V1140 PolarHBondContact O-N 2.86Å
1139	R	29.1	Very low	28.9	Very low	235 Å²	235	138.1 Å²	138.1	89%	0.887	77%	0.772	S	S	*	*			trans	-63.1	104.2	162.8	-96.7	-172.9	167.9	-179.3	-3.6	108.8	P1137 N1141	P1137-R1139 VanDerWaalsContact C-N 3.27Å; P1137-R1139 PolarHBondContact O-N 2.92Å; R1139-N1141 PolarHBondContact O-N 3.04Å
1140	V	29.8	Very low	28.4	Very low	128 Å²	128	138.7 Å²	138.7	78%	0.776	78%	0.776	S	S	*	*			trans	-64.6	123.2	167.5	178.2	0	0	0	0	108.6	K1138	K1138-V1140 PolarHBondContact O-N 2.86Å
1141	N	28.7	Very low	28	Very low	162 Å²	162	139 Å²	139	87%	0.866	78%	0.778	S	S	*	*			trans	-137.7	124.7	158.6	-95.8	-12.7	0	0	0	106.4	R1139	R1139-N1141 PolarHBondContact O-N 3.04Å
1142	A	27.7	Very low	27.8	Very low	89 Å²	89	142.4 Å²	142.4	74%	0.736	78%	0.784	S	S	*	*			trans	-103.8	136.7	-179.6	0	0	0	0	0	110.7
1143	T	31.4	Very low	27.7	Very low	140 Å²	140	142.1 Å²	142.1	86%	0.859	78%	0.778	S	S	*	*			trans	-163.4	145.8	145.7	27.8	0	0	0	0	110.5
1144	D	27.4	Very low	27.6	Very low	138 Å²	138	142.8 Å²	142.8	74%	0.738	78%	0.784	S	S	*	*			trans	-57.5	153.7	-169.7	-45	-67.9	0	0	0	117.3
1145	K	31.1	Very low	27.5	Very low	196 Å²	196	143.6 Å²	143.6	85%	0.852	79%	0.792	S	S	*	*				-172.3	121.7	107.8	-98.6	155.4	-171.5	172.8	0	115.9
1146	N	27	Very low	27.4	Very low	145 Å²	145	142.3 Å²	142.3	78%	0.775	79%	0.789	S	S	*	*			trans	29.7	110.5	144.8	-60.9	2.6	0	0	0	121.6
1147	V	27.2	Very low	27.3	Very low	139 Å²	139	140 Å²	140	84%	0.842	79%	0.792	S	S	*	*			trans	7.4	119.2	130.6	-173.3	0	0	0	0	118.2
1148	T	26.5	Very low	27.1	Very low	144 Å²	144	141.5 Å²	141.5	88%	0.883	79%	0.792	S	S	*	*			trans	-136.5	151.1	133.1	23.2	0	0	0	0	109.5
1149	S	23	Very low	27	Very low	112 Å²	112	143 Å²	143	78%	0.783	80%	0.802	S	S	*	*			trans	-102.4	124.1	-171.1	56.1	0	0	0	0	113.3
1150	T	26.9	Very low	26.9	Very low	143 Å²	143	134.3 Å²	134.3	88%	0.877	79%	0.786	S	S	*	*			trans	-148.2	151	148.1	14.9	0	0	0	0	109.8
1151	T	24.3	Very low	26.7	Very low	124 Å²	124	133.7 Å²	133.7	76%	0.761	78%	0.782	S	S	*	*			trans	-66.8	142.6	166.7	45.6	0	0	0	0	110.8
1152	D	26.1	Very low	26.7	Very low	163 Å²	163	136.5 Å²	136.5	87%	0.872	78%	0.782	S	S	*	*			trans	-160.7	168.2	134.8	-99.1	-24	0	0	0	111.3
1153	D	26.2	Very low	26.8	Very low	122 Å²	122	137.6 Å²	137.6	65%	0.652	79%	0.785	S	S	*	*			trans	-64.3	139.6	-159.2	-94.9	-58.3	0	0	0	116.2	T1155	D1153-T1155 PolarHBondContact O-N 2.78Å
1154	A	25.3	Very low	26.4	Very low	85 Å²	85	139 Å²	139	70%	0.702	79%	0.786	S	S	*	*			trans	-74.7	89.8	157.5	0	0	0	0	0	109.4	V1156	A1154-V1156 PolarHBondContact O-N 2.74Å
1155	T	25.4	Very low	26.4	Very low	114 Å²	114	136 Å²	136	70%	0.699	79%	0.788	S	S	*	*			trans	-63.8	104.9	172.1	49.2	0	0	0	0	110.1	D1153 D1157	D1153-T1155 PolarHBondContact O-N 2.78Å; T1155-D1157 PolarHBondContact O-N 2.76Å
1156	V	27.4	Very low	26.3	Very low	123 Å²	123	133.2 Å²	133.2	75%	0.745	79%	0.792	S	S	*	*			trans	-72.1	116.7	161.6	175.7	0	0	0	0	106.8	A1154 L1158	A1154-V1156 PolarHBondContact O-N 2.74Å; V1156-L1158 VanDerWaalsContact C-N 3.32Å; V1156-L1158 PolarHBondContact O-N 2.92Å
1157	D	24.3	Very low	26.6	Very low	152 Å²	152	129.2 Å²	129.2	81%	0.813	78%	0.784	S	S	*	*			trans	-63.9	91.4	176.8	-73.2	-49.4	0	0	0	110.8	T1155	T1155-D1157 PolarHBondContact O-N 2.76Å
1158	L	26	Very low	26.8	Very low	157 Å²	157	129.1 Å²	129.1	82%	0.822	79%	0.79	S	S	*	*			trans	-87.1	107.4	166.6	-156.4	82.3	0	0	0	106.7	V1156 G1160	V1156-L1158 VanDerWaalsContact C-N 3.32Å; V1156-L1158 PolarHBondContact O-N 2.92Å; L1158-G1160 PolarHBondContact O-N 3.26Å
1159	E	25.8	Very low	27	Very low	191 Å²	191	126.6 Å²	126.6	89%	0.893	78%	0.784	S	S	*	*			trans	-64.6	83.7	177.6	-73.8	-163.5	117.8	0	0	111.3	T1161	E1159-T1161 PolarHBondContact O-N 3.33Å; E1159-T1161 VanDerWaalsContact O-N 3.1Å
1160	G	26.9	Very low	27.2	Very low	54 Å²	54	126.8 Å²	126.8	56%	0.557	78%	0.784	S	S	*	*			trans	-69.6	102.4	176.2	0	0	0	0	0	110.7	L1158 Y1162	L1158-G1160 PolarHBondContact O-N 3.26Å; G1160-Y1162 PolarHBondContact O-N 3Å; G1160-Y1162 VanDerWaalsContact O-N 3.1Å
1161	T	26.7	Very low	27.1	Very low	114 Å²	114	131.8 Å²	131.8	70%	0.699	79%	0.787	S	S	*	*			trans	-58.3	115.3	169.4	49.5	0	0	0	0	110.2	E1159 S1163	E1159-T1161 PolarHBondContact O-N 3.33Å; E1159-T1161 VanDerWaalsContact O-N 3.1Å; T1161-S1163 PolarHBondContact O-N 2.89Å
1162	Y	27.7	Very low	27.2	Very low	221 Å²	221	133.5 Å²	133.5	87%	0.867	79%	0.789	S	S	*	*			trans	-63.2	92.8	177.4	-70.8	-89.4	0	0	0	111.9	G1160 L1164	G1160-Y1162 PolarHBondContact O-N 3Å; G1160-Y1162 VanDerWaalsContact O-N 3.1Å; Y1162-L1164 PolarHBondContact O-N 3.39Å
1163	S	29.7	Very low	27.3	Very low	113 Å²	113	133.3 Å²	133.3	79%	0.79	79%	0.788	S	S	*	*			trans	-77.8	96.5	170.8	60.4	0	0	0	0	110.1	T1161 G1165	T1161-S1163 PolarHBondContact O-N 2.89Å; S1163-G1165 VanDerWaalsContact C-N 3.31Å; S1163-G1165 PolarHBondContact O-N 3.24Å
1164	L	23.7	Very low	27.2	Very low	169 Å²	169	133.3 Å²	133.3	89%	0.885	80%	0.796	S	S	*	*			trans	-78.8	77	-175.6	-146.6	142.7	0	0	0	111.3	Y1162	Y1162-L1164 PolarHBondContact O-N 3.39Å
1165	G	28	Very low	27.2	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	80%	0.803	S	S	*	*			trans	-86.6	103.8	178.4	0	0	0	0	0	112.6	S1163	S1163-G1165 VanDerWaalsContact C-N 3.31Å; S1163-G1165 PolarHBondContact O-N 3.24Å
1166	C	27.6	Very low	27.2	Very low	137 Å²	137	138.1 Å²	138.1	93%	0.926	81%	0.813	S	S	*	*			trans	-79.5	119	170	-170.6	0	0	0	0	110.1
1167	G	33.9	Very low	27.2	Very low	60 Å²	60	136.6 Å²	136.6	62%	0.619	81%	0.808	S	S	*	*			trans	162.6	62.7	-178.8	0	0	0	0	0	115.7	A1169	G1167-A1169 PolarHBondContact O-N 3.46Å; G1167-A1169 VanDerWaalsContact O-N 3.15Å
1168	S	31.8	Very low	27.3	Very low	138 Å²	138	135.6 Å²	135.6	97%	0.965	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	6.6	176.6	47.7	0	0	0	0	115.1
1169	A	30	Very low	27.3	Very low	91 Å²	91	132.9 Å²	132.9	75%	0.752	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-2.8	-163.7	0	0	0	0	0	116.4	G1167	G1167-A1169 PolarHBondContact O-N 3.46Å; G1167-A1169 VanDerWaalsContact O-N 3.15Å
1170	C	27.3	Very low	27.5	Very low	116 Å²	116	131.1 Å²	131.1	78%	0.784	79%	0.793	S	S	*	*			trans	-145.4	101.7	178.2	-96.9	0	0	0	0	112.6
1171	R	24.7	Very low	27.7	Very low	248 Å²	248	135.6 Å²	135.6	94%	0.936	80%	0.8	S	S	*	*			trans	-129.7	56.2	173.6	-150.7	179.7	-159.8	-173.8	6.6	111.4
1172	I	27.3	Very low	28.3	Very low	159 Å²	159	133.8 Å²	133.8	82%	0.815	79%	0.792	S	S	*	*			trans	-71.2	135.8	173.9	-66.1	179.5	0	0	0	109.6	C1174	I1172-C1174 PolarHBondContact O-N 2.84Å
1173	L	27.1	Very low	28.8	Very low	160 Å²	160	127.8 Å²	127.8	84%	0.838	78%	0.778	S	S	*	*			trans	-76.4	109.1	-170	-142.6	79.1	0	0	0	111.5
1174	C	24.5	Very low	29.4	Very low	121 Å²	121	128 Å²	128	82%	0.818	77%	0.767	S	S	*	*			trans	-162.8	66.9	167.2	-106.3	0	0	0	0	114.2	I1172	I1172-C1174 PolarHBondContact O-N 2.84Å
1175	C	25.8	Very low	30.4	Very low	126 Å²	126	125.3 Å²	125.3	85%	0.851	75%	0.752	S	S	*	*			trans	-179.9	109.8	150.2	-99.1	0	0	0	0	110.5	S1177	C1175-S1177 PolarHBondContact O-N 3.32Å
1176	L	24.3	Very low	31.1	Very low	174 Å²	174	124.7 Å²	124.7	91%	0.911	74%	0.736	S	S	*	*			trans	-76.1	117.9	162.4	-87.6	76.5	0	0	0	108.6
1177	S	28.6	Very low	32.1	Very low	91 Å²	91	125.6 Å²	125.6	64%	0.636	72%	0.72	S	S	*	*			trans	-94.2	123.7	168	57.9	0	0	0	0	109.9	C1175 T1179	C1175-S1177 PolarHBondContact O-N 3.32Å; S1177-T1179 PolarHBondContact O-N 2.88Å
1178	P	25.7	Very low	33.4	Very low	132 Å²	132	127.2 Å²	127.2	86%	0.857	71%	0.714	S	S	*	*			trans	-82	61.6	179.1	33.8	-35.6	0	0	0	111
1179	T	26.2	Very low	34.7	Very low	100 Å²	100	123.9 Å²	123.9	61%	0.613	69%	0.691	S	S	*	*			trans	-139.7	75.9	-173.5	49	0	0	0	0	113.8	S1177	S1177-T1179 PolarHBondContact O-N 2.88Å
1180	M	29.3	Very low	36	Very low	153 Å²	153	122.2 Å²	122.2	75%	0.754	68%	0.677	S	S	*	*	S	Bend	trans	-132.7	-16.1	153.1	-158.9	179.4	173.8	0	0	113.4
1181	Q	31.1	Very low	37.8	Very low	148 Å²	148	122.6 Å²	122.6	69%	0.692	67%	0.667	S	S	*	*	H	α-helix	trans	-76.4	-24.9	-177.1	-72.4	176.7	-25	0	0	114.6	V1183 Q1184 L1185	Q1181-V1183 PolarHBondContact O-N 2.85Å; Q1181-Q1184 PolarHBondContact O-N 3.28Å; Q1181-L1185 HydrophobicContact CB-CD1 4.19Å; Q1181-L1185 WeakPolarHBondContact O-CB 3.41Å; Q1181-L1185 WeakPolarHBondContact O-CD1 3.27Å; Q1181-L1185 PolarHBondContact O-N 2.92Å
1182	S	39.5	Very low	39.9	Very low	77 Å²	77	116.3 Å²	116.3	54%	0.538	65%	0.652	S	S	.	*	H	α-helix	trans	-66.6	-37.5	-172.3	50.6	0	0	0	0	114.5	S1186	S1182-S1186 PolarHBondContact O-N 3Å; S1182-S1186 PolarHBondContact O-OG 3.06Å
1183	V	39.7	Very low	41.5	Very low	94 Å²	94	115.5 Å²	115.5	57%	0.57	64%	0.644	S	S	*	*	H	α-helix	trans	-77.2	-30.7	178.6	-178	0	0	0	0	111.5	Q1181 S1186 R1187	Q1181-V1183 PolarHBondContact O-N 2.85Å; V1183-S1186 PolarHBondContact O-OG 3.48Å; V1183-R1187 PolarHBondContact O-N 3.38Å; V1183-R1187 VanDerWaalsContact O-N 3.14Å
1184	Q	41.4	Very low	43.5	Very low	119 Å²	119	110.4 Å²	110.4	56%	0.556	63%	0.625	S	S	*	*	H	α-helix	trans	-70.4	-40.8	170	-73.2	-177.5	-32.1	0	0	111.2	Q1181 R1187 L1188	Q1181-Q1184 PolarHBondContact O-N 3.28Å; Q1184-R1187 PolarHBondContact O-N 2.9Å; Q1184-L1188 VanDerWaalsContact O-CB 3.27Å; Q1184-L1188 WeakPolarHBondContact O-CB 3.46Å; Q1184-L1188 VanDerWaalsContact O-CG 3.29Å; Q1184-L1188 WeakPolarHBondContact O-CG 3.46Å; Q1184-L1188 PolarHBondContact O-N 3Å
1185	L	44.1	Very low	45.8	Very low	112 Å²	112	108.4 Å²	108.4	59%	0.586	61%	0.609	S	S	*	*	H	α-helix	trans	-64.1	-37.6	174.8	-102.3	117.2	0	0	0	113.1	Q1181 L1188 S1189	Q1181-L1185 HydrophobicContact CB-CD1 4.19Å; Q1181-L1185 WeakPolarHBondContact O-CB 3.41Å; Q1181-L1185 WeakPolarHBondContact O-CD1 3.27Å; Q1181-L1185 PolarHBondContact O-N 2.92Å; L1185-L1188 PolarHBondContact O-N 3.36Å; L1185-S1189 WeakPolarHBondContact O-CB 3.19Å; L1185-S1189 PolarHBondContact O-N 3.23Å; L1185-S1189 PolarHBondContact O-OG 3.46Å
1186	S	42.4	Very low	47.6	Very low	63 Å²	63	106.9 Å²	106.9	44%	0.441	59%	0.592	S	S	.	*	H	α-helix	trans	-72.5	-37.5	176.6	63.3	0	0	0	0	112.9	S1182 V1183 S1189 A1190	S1182-S1186 PolarHBondContact O-N 3Å; S1182-S1186 PolarHBondContact O-OG 3.06Å; V1183-S1186 PolarHBondContact O-OG 3.48Å; S1186-S1189 WeakPolarHBondContact CA-OG 3.33Å; S1186-S1189 PolarHBondContact O-N 2.85Å; S1186-S1189 PolarHBondContact O-OG 2.9Å; S1186-S1189 VanDerWaalsContact O-OG 3.06Å; S1186-A1190 WeakPolarHBondContact O-CB 3.48Å; S1186-A1190 PolarHBondContact O-N 2.59Å; S1186-A1190 VanDerWaalsContact O-N 3.08Å
1187	R	48.8	Very low	49.7	Very low	156 Å²	156	106 Å²	106	59%	0.589	58%	0.581	S	S	*	*	H	α-helix	trans	-63.4	-42.7	169.5	-78.7	-176.4	168.7	-172	-5.5	111.2	V1183 Q1184 Q1191	V1183-R1187 PolarHBondContact O-N 3.38Å; V1183-R1187 VanDerWaalsContact O-N 3.14Å; Q1184-R1187 PolarHBondContact O-N 2.9Å; R1187-Q1191 WeakPolarHBondContact O-CB 3.46Å; R1187-Q1191 VanDerWaalsContact O-CG 3.3Å; R1187-Q1191 WeakPolarHBondContact O-CG 3.29Å; R1187-Q1191 PolarHBondContact O-N 3.5Å
1188	L	61	Low	51.6	Low	94 Å²	94	110.6 Å²	110.6	49%	0.492	59%	0.585	S	S	.	*	H	α-helix	trans	-65.5	-39	175.9	-79.3	166.1	0	0	0	112.9	Q1184 L1185 Q1191 L1192	Q1184-L1188 VanDerWaalsContact O-CB 3.27Å; Q1184-L1188 WeakPolarHBondContact O-CB 3.46Å; Q1184-L1188 VanDerWaalsContact O-CG 3.29Å; Q1184-L1188 WeakPolarHBondContact O-CG 3.46Å; Q1184-L1188 PolarHBondContact O-N 3Å; L1185-L1188 PolarHBondContact O-N 3.36Å; L1188-Q1191 PolarHBondContact O-N 2.93Å; L1188-L1192 WeakPolarHBondContact O-CB 3.36Å; L1188-L1192 WeakPolarHBondContact O-CD1 3.45Å; L1188-L1192 PolarHBondContact O-N 3.03Å
1189	S	59.8	Low	53.8	Low	68 Å²	68	108.1 Å²	108.1	48%	0.476	56%	0.563	S	S	.	*	H	α-helix	trans	-68.5	-41.1	177.4	65.1	0	0	0	0	111.8	L1185 S1186 Q1191 L1192 E1193	L1185-S1189 WeakPolarHBondContact O-CB 3.19Å; L1185-S1189 PolarHBondContact O-N 3.23Å; L1185-S1189 PolarHBondContact O-OG 3.46Å; S1186-S1189 WeakPolarHBondContact CA-OG 3.33Å; S1186-S1189 PolarHBondContact O-N 2.85Å; S1186-S1189 PolarHBondContact O-OG 2.9Å; S1186-S1189 VanDerWaalsContact O-OG 3.06Å; S1189-Q1191 VanDerWaalsContact C-N 3.34Å; S1189-L1192 PolarHBondContact O-N 2.75Å; S1189-E1193 PolarHBondContact O-N 2.64Å
1190	A	56.6	Low	55.5	Low	56 Å²	56	107.7 Å²	107.7	46%	0.463	56%	0.557	S	S	.	*	H	α-helix	trans	-65.5	-36.8	174.2	0	0	0	0	0	112.2	S1186 A1194	S1186-A1190 WeakPolarHBondContact O-CB 3.48Å; S1186-A1190 PolarHBondContact O-N 2.59Å; S1186-A1190 VanDerWaalsContact O-N 3.08Å; A1190-A1194 WeakPolarHBondContact O-CB 3.42Å; A1190-A1194 PolarHBondContact O-N 3.29Å
1191	Q	66.3	Low	57.2	Low	123 Å²	123	104.4 Å²	104.4	58%	0.575	54%	0.543	S	S	*	.	H	α-helix	trans	-67.3	-38.3	171.4	-76.1	176.6	-19.7	0	0	112.1	R1187 L1188 S1189 A1194 V1195	R1187-Q1191 WeakPolarHBondContact O-CB 3.46Å; R1187-Q1191 VanDerWaalsContact O-CG 3.3Å; R1187-Q1191 WeakPolarHBondContact O-CG 3.29Å; R1187-Q1191 PolarHBondContact O-N 3.5Å; L1188-Q1191 PolarHBondContact O-N 2.93Å; S1189-Q1191 VanDerWaalsContact C-N 3.34Å; Q1191-A1194 PolarHBondContact O-N 3.11Å; Q1191-V1195 WeakPolarHBondContact O-CB 3.44Å; Q1191-V1195 VanDerWaalsContact O-CG2 3.3Å; Q1191-V1195 WeakPolarHBondContact O-CG2 3.44Å; Q1191-V1195 PolarHBondContact O-N 3.37Å
1192	L	68	Low	58.7	Low	117 Å²	117	101.9 Å²	101.9	61%	0.613	53%	0.534	S	S	*	.	H	α-helix	trans	-63.3	-45.7	173.4	-106.5	78.4	0	0	0	111.8	L1188 S1189 A1194 V1195 D1196	L1188-L1192 WeakPolarHBondContact O-CB 3.36Å; L1188-L1192 WeakPolarHBondContact O-CD1 3.45Å; L1188-L1192 PolarHBondContact O-N 3.03Å; S1189-L1192 PolarHBondContact O-N 2.75Å; L1192-A1194 VanDerWaalsContact C-N 3.3Å; L1192-A1194 PolarHBondContact O-N 2.69Å; L1192-V1195 CarbonylContact O-C 3.58Å; L1192-V1195 PolarHBondContact O-N 3.47Å; L1192-D1196 WeakPolarHBondContact O-CB 3.05Å; L1192-D1196 PolarHBondContact O-N 2.85Å
1193	E	61.1	Low	59.1	Low	142 Å²	142	102.1 Å²	102.1	66%	0.664	53%	0.529	S	S	*	.	H	α-helix	trans	-63.4	-35.6	176.2	-73.2	-169.7	130.1	0	0	112.6	S1189 K1197	S1189-E1193 PolarHBondContact O-N 2.64Å; E1193-K1197 WeakPolarHBondContact O-CB 3.3Å; E1193-K1197 PolarHBondContact O-N 3.06Å
1194	A	68.5	Low	59.7	Low	52 Å²	52	106.8 Å²	106.8	43%	0.43	54%	0.536	S	S	.	.	H	α-helix	trans	-68.6	-34.7	173.9	0	0	0	0	0	112.6	A1190 Q1191 L1192 R1198	A1190-A1194 WeakPolarHBondContact O-CB 3.42Å; A1190-A1194 PolarHBondContact O-N 3.29Å; Q1191-A1194 PolarHBondContact O-N 3.11Å; L1192-A1194 VanDerWaalsContact C-N 3.3Å; L1192-A1194 PolarHBondContact O-N 2.69Å; A1194-R1198 WeakPolarHBondContact O-CG 3.03Å; A1194-R1198 PolarHBondContact O-N 3.39Å
1195	V	72.7	Confident	60.1	Low	79 Å²	79	109.6 Å²	109.6	48%	0.479	54%	0.542	S	S	.	.	H	α-helix	trans	-72.4	-43.4	173.3	167	0	0	0	0	111.1	Q1191 L1192 K1197 R1198 I1199	Q1191-V1195 WeakPolarHBondContact O-CB 3.44Å; Q1191-V1195 VanDerWaalsContact O-CG2 3.3Å; Q1191-V1195 WeakPolarHBondContact O-CG2 3.44Å; Q1191-V1195 PolarHBondContact O-N 3.37Å; L1192-V1195 CarbonylContact O-C 3.58Å; L1192-V1195 PolarHBondContact O-N 3.47Å; V1195-K1197 PolarHBondContact O-N 3.25Å; V1195-R1198 CarbonylContact O-C 3.49Å; V1195-R1198 WeakPolarHBondContact O-CA 3.48Å; V1195-R1198 WeakPolarHBondContact O-CB 3.34Å; V1195-R1198 PolarHBondContact O-N 3.07Å; V1195-R1198 VanDerWaalsContact O-N 3.07Å; V1195-I1199 HydrophobicContact CG1-CD1 3.73Å; V1195-I1199 HydrophobicContact CG1-CG1 4.32Å; V1195-I1199 WeakPolarHBondContact O-CG1 3.35Å; V1195-I1199 PolarHBondContact O-N 3.44Å
1196	D	64.3	Low	60	Low	95 Å²	95	108.7 Å²	108.7	51%	0.508	54%	0.537	S	S	.	.	H	α-helix	trans	-66.5	-38.6	-179.2	-165	34.5	0	0	0	111.4	L1192 I1199 N1200	L1192-D1196 WeakPolarHBondContact O-CB 3.05Å; L1192-D1196 PolarHBondContact O-N 2.85Å; D1196-I1199 PolarHBondContact O-N 3.43Å; D1196-N1200 PolarHBondContact O-N 3.27Å; D1196-N1200 PolarHBondContact O-ND2 3.47Å; D1196-N1200 PolarHBondContact OD1-ND2 3.04Å
1197	K	67.6	Low	59.9	Low	156 Å²	156	113.4 Å²	113.4	68%	0.678	55%	0.552	S	S	*	*	H	α-helix	trans	-58.4	-46.9	166.7	-83.1	-179.6	174	173.7	0	112.3	E1193 V1195 I1199 N1200 D1201	E1193-K1197 WeakPolarHBondContact O-CB 3.3Å; E1193-K1197 PolarHBondContact O-N 3.06Å; V1195-K1197 PolarHBondContact O-N 3.25Å; K1197-I1199 VanDerWaalsContact C-N 3.31Å; K1197-I1199 PolarHBondContact O-N 2.86Å; K1197-N1200 PolarHBondContact O-N 2.73Å; K1197-D1201 PolarHBondContact O-N 3.28Å
1198	R	70.2	Confident	59.4	Low	187 Å²	187	111.6 Å²	111.6	71%	0.706	56%	0.558	S	S	*	*	H	α-helix	trans	-63.4	-33.9	177.4	-78.5	176.3	172.6	-173.9	-1.5	112.8	A1194 V1195 L1202	A1194-R1198 WeakPolarHBondContact O-CG 3.03Å; A1194-R1198 PolarHBondContact O-N 3.39Å; V1195-R1198 CarbonylContact O-C 3.49Å; V1195-R1198 WeakPolarHBondContact O-CA 3.48Å; V1195-R1198 WeakPolarHBondContact O-CB 3.34Å; V1195-R1198 PolarHBondContact O-N 3.07Å; V1195-R1198 VanDerWaalsContact O-N 3.07Å; R1198-L1202 VanDerWaalsContact O-CB 3.3Å; R1198-L1202 WeakPolarHBondContact O-CB 3.44Å; R1198-L1202 PolarHBondContact O-N 3.13Å
1199	I	71.9	Confident	57.9	Low	80 Å²	80	110.6 Å²	110.6	41%	0.41	56%	0.564	S	S	.	*	H	α-helix	trans	-68.1	-46.8	174.3	-70.8	167.8	0	0	0	110.3	V1195 D1196 K1197 D1201 L1202 D1203	V1195-I1199 HydrophobicContact CG1-CD1 3.73Å; V1195-I1199 HydrophobicContact CG1-CG1 4.32Å; V1195-I1199 WeakPolarHBondContact O-CG1 3.35Å; V1195-I1199 PolarHBondContact O-N 3.44Å; D1196-I1199 PolarHBondContact O-N 3.43Å; K1197-I1199 VanDerWaalsContact C-N 3.31Å; K1197-I1199 PolarHBondContact O-N 2.86Å; I1199-D1201 VanDerWaalsContact C-N 3.32Å; I1199-D1201 PolarHBondContact O-N 3.46Å; I1199-L1202 CarbonylContact O-C 3.57Å; I1199-L1202 WeakPolarHBondContact O-CA 3.49Å; I1199-L1202 WeakPolarHBondContact O-CB 3.23Å; I1199-L1202 PolarHBondContact O-N 2.91Å; I1199-D1203 PolarHBondContact O-N 3.32Å
1200	N	60.4	Low	56.5	Low	90 Å²	90	113.5 Å²	113.5	48%	0.481	58%	0.579	S	S	.	*	H	α-helix	trans	-62.6	-36	177	-80.3	-90.9	0	0	0	112.8	D1196 K1197 R1204	D1196-N1200 PolarHBondContact O-N 3.27Å; D1196-N1200 PolarHBondContact O-ND2 3.47Å; D1196-N1200 PolarHBondContact OD1-ND2 3.04Å; K1197-N1200 PolarHBondContact O-N 2.73Å; N1200-R1204 WeakPolarHBondContact O-CG 3.3Å; N1200-R1204 PolarHBondContact O-N 3.19Å
1201	D	65.6	Low	55.5	Low	85 Å²	85	119.1 Å²	119.1	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-74	-27.6	172.5	-76.8	-27.6	0	0	0	113.1	K1197 I1199 R1205	K1197-D1201 PolarHBondContact O-N 3.28Å; I1199-D1201 VanDerWaalsContact C-N 3.32Å; I1199-D1201 PolarHBondContact O-N 3.46Å; D1201-R1205 VanDerWaalsContact O-CG 3.3Å; D1201-R1205 WeakPolarHBondContact O-CG 3.11Å; D1201-R1205 PolarHBondContact O-N 3.09Å
1202	L	63.4	Low	53.9	Low	95 Å²	95	120.6 Å²	120.6	50%	0.497	61%	0.612	S	S	.	*	H	α-helix	trans	-72.2	-44.3	172	-95.8	159.3	0	0	0	112.1	R1198 I1199 R1204 R1205 N1206	R1198-L1202 VanDerWaalsContact O-CB 3.3Å; R1198-L1202 WeakPolarHBondContact O-CB 3.44Å; R1198-L1202 PolarHBondContact O-N 3.13Å; I1199-L1202 CarbonylContact O-C 3.57Å; I1199-L1202 WeakPolarHBondContact O-CA 3.49Å; I1199-L1202 WeakPolarHBondContact O-CB 3.23Å; I1199-L1202 PolarHBondContact O-N 2.91Å; L1202-R1204 VanDerWaalsContact C-N 3.3Å; L1202-R1204 PolarHBondContact O-N 2.93Å; L1202-R1205 CarbonylContact O-C 3.57Å; L1202-R1205 PolarHBondContact O-N 2.99Å; L1202-N1206 WeakPolarHBondContact O-CB 3.19Å; L1202-N1206 VanDerWaalsContact O-CG 3.26Å; L1202-N1206 PolarHBondContact O-N 2.9Å; L1202-N1206 PolarHBondContact O-ND2 3Å
1203	D	47.1	Very low	52.2	Low	82 Å²	82	122.6 Å²	122.6	44%	0.439	62%	0.62	S	S	.	*	H	α-helix	trans	-63.6	-36.5	176.4	-82.4	-11.4	0	0	0	111.8	I1199 R1205 N1206 H1207	I1199-D1203 PolarHBondContact O-N 3.32Å; D1203-R1205 VanDerWaalsContact C-N 3.29Å; D1203-R1205 PolarHBondContact O-N 3.41Å; D1203-N1206 PolarHBondContact O-N 2.83Å; D1203-H1207 WeakPolarHBondContact O-CB 3.15Å; D1203-H1207 PolarHBondContact O-CD2 2.99Å; D1203-H1207 VanDerWaalsContact O-CD2 3.29Å; D1203-H1207 PolarHBondContact O-N 3.43Å
1204	R	53	Low	50.8	Low	192 Å²	192	126 Å²	126	73%	0.725	63%	0.627	S	S	*	*	H	α-helix	trans	-60.9	-34.9	170.6	-81.6	176.8	153.9	-171.8	-8.2	113.3	N1200 L1202 T1208	N1200-R1204 WeakPolarHBondContact O-CG 3.3Å; N1200-R1204 PolarHBondContact O-N 3.19Å; L1202-R1204 VanDerWaalsContact C-N 3.3Å; L1202-R1204 PolarHBondContact O-N 2.93Å; R1204-T1208 PolarHBondContact O-OG1 3.15Å
1205	R	48.9	Very low	49.2	Very low	178 Å²	178	127.6 Å²	127.6	67%	0.672	64%	0.64	S	S	*	*	H	α-helix	trans	-80	-39	176.3	-70.1	170.4	-176.9	-168.3	0.7	112.4	D1201 L1202 D1203 H1207 T1208 A1209	D1201-R1205 VanDerWaalsContact O-CG 3.3Å; D1201-R1205 WeakPolarHBondContact O-CG 3.11Å; D1201-R1205 PolarHBondContact O-N 3.09Å; L1202-R1205 CarbonylContact O-C 3.57Å; L1202-R1205 PolarHBondContact O-N 2.99Å; D1203-R1205 VanDerWaalsContact C-N 3.29Å; D1203-R1205 PolarHBondContact O-N 3.41Å; R1205-H1207 VanDerWaalsContact C-N 3.33Å; R1205-H1207 PolarHBondContact O-N 2.9Å; R1205-T1208 PolarHBondContact O-N 3.32Å; R1205-T1208 VanDerWaalsContact O-N 3.13Å; R1205-T1208 PolarHBondContact O-OG1 2.92Å; R1205-T1208 VanDerWaalsContact O-OG1 3.05Å; R1205-A1209 WeakPolarHBondContact O-CB 3.26Å; R1205-A1209 PolarHBondContact O-N 2.96Å
1206	N	41.9	Very low	47	Very low	92 Å²	92	131.2 Å²	131.2	49%	0.492	66%	0.656	S	S	.	*	H	α-helix	trans	-66.3	-34.7	178.4	-70.3	-23	0	0	0	112.1	L1202 D1203 T1208	L1202-N1206 WeakPolarHBondContact O-CB 3.19Å; L1202-N1206 VanDerWaalsContact O-CG 3.26Å; L1202-N1206 PolarHBondContact O-N 2.9Å; L1202-N1206 PolarHBondContact O-ND2 3Å; D1203-N1206 PolarHBondContact O-N 2.83Å; N1206-T1208 PolarHBondContact O-N 3.47Å
1207	H	40.4	Very low	45.7	Very low	162 Å²	162	131.6 Å²	131.6	75%	0.75	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	3	174	-77.1	-52.4	0	0	0	115	D1203 R1205	D1203-H1207 WeakPolarHBondContact O-CB 3.15Å; D1203-H1207 PolarHBondContact O-CD2 2.99Å; D1203-H1207 VanDerWaalsContact O-CD2 3.29Å; D1203-H1207 PolarHBondContact O-N 3.43Å; R1205-H1207 VanDerWaalsContact C-N 3.33Å; R1205-H1207 PolarHBondContact O-N 2.9Å
1208	T	37.8	Very low	43.9	Very low	118 Å²	118	131.4 Å²	131.4	72%	0.724	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	7.6	177.5	42.9	0	0	0	0	114	R1204 R1205 N1206	R1204-T1208 PolarHBondContact O-OG1 3.15Å; R1205-T1208 PolarHBondContact O-N 3.32Å; R1205-T1208 VanDerWaalsContact O-N 3.13Å; R1205-T1208 PolarHBondContact O-OG1 2.92Å; R1205-T1208 VanDerWaalsContact O-OG1 3.05Å; N1206-T1208 PolarHBondContact O-N 3.47Å
1209	A	29.7	Very low	41.8	Very low	73 Å²	73	131.2 Å²	131.2	60%	0.603	68%	0.683	S	S	*	*			trans	-127.8	33.8	-168.1	0	0	0	0	0	115.8	R1205	R1205-A1209 WeakPolarHBondContact O-CB 3.26Å; R1205-A1209 PolarHBondContact O-N 2.96Å
1210	T	31.7	Very low	39.9	Very low	130 Å²	130	132.6 Å²	132.6	80%	0.798	70%	0.698	S	S	*	*			trans	-136.1	47.5	177.7	44.3	0	0	0	0	115.3
1211	L	35.2	Very low	38.2	Very low	174 Å²	174	133 Å²	133	91%	0.911	71%	0.708	S	S	*	*	S	Bend	trans	-142.5	157.5	153.2	-100.4	173.7	0	0	0	110.2
1212	N	31.5	Very low	36.3	Very low	153 Å²	153	140.8 Å²	140.8	82%	0.818	73%	0.731	S	S	*	*			trans	-100.2	153.7	-150.5	-81.7	-37.1	0	0	0	117.4
1213	M	32.8	Very low	34.5	Very low	159 Å²	159	141.2 Å²	141.2	78%	0.783	75%	0.747	S	S	*	*			trans	81.9	113.9	145.3	-91.5	-162.5	169	0	0	122.9
1214	R	33.2	Very low	33.5	Very low	215 Å²	215	141.7 Å²	141.7	81%	0.811	76%	0.763	S	S	*	*				85.9	84.6	116.3	-153.3	176	-161.5	172.3	3.5	120.5
1215	A	33	Very low	32.3	Very low	84 Å²	84	138.7 Å²	138.7	69%	0.694	76%	0.761	S	S	*	*			trans	56.6	104.8	133.1	0	0	0	0	0	121.6
1216	N	28.4	Very low	31.1	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	76%	0.764	S	S	*	*				34.5	152	117.2	-65.8	23.9	0	0	0	121.9
1217	P	36.7	Very low	30.4	Very low	104 Å²	104	140.5 Å²	140.5	68%	0.675	77%	0.774	S	S	*	*			cis	-147.2	141.9	-40.3	38.1	-20.2	0	0	0	115.1
1218	T	29.8	Very low	29.6	Very low	151 Å²	151	137.9 Å²	137.9	93%	0.926	77%	0.769	S	S	*	*			trans	-168.8	151.2	147	-0.9	0	0	0	0	113.1
1219	E	25.2	Very low	29.1	Very low	184 Å²	184	136.8 Å²	136.8	86%	0.86	76%	0.759	S	S	*	*			trans	-103.8	176.2	171.4	-61.8	-166.4	128.6	0	0	109.8
1220	P	32.4	Very low	29.1	Very low	109 Å²	109	141.8 Å²	141.8	71%	0.708	77%	0.767	S	S	*	*			cis	-142.4	169.3	11.4	42	-22.3	0	0	0	119.7
1221	S	25.3	Very low	29	Very low	99 Å²	99	141.7 Å²	141.7	69%	0.692	76%	0.758	S	S	*	*			trans	65.5	104.6	142.8	61.9	0	0	0	0	124.3
1222	R	24.2	Very low	28.5	Very low	248 Å²	248	141.8 Å²	141.8	94%	0.936	75%	0.753	S	S	*	*				83.5	132.2	123.5	-75.7	-176.7	166.7	152.3	-1.5	123.6
1223	A	25.7	Very low	28.2	Very low	103 Å²	103	140.8 Å²	140.8	85%	0.851	75%	0.748	S	S	*	*			trans	73.1	141.2	154	0	0	0	0	0	118.2
1224	A	26.5	Very low	27.9	Very low	92 Å²	92	139.9 Å²	139.9	76%	0.76	75%	0.745	S	S	*	*			cis	-164.2	173.8	-12	0	0	0	0	0	110.3
1225	D	27.2	Very low	27.7	Very low	129 Å²	129	136.3 Å²	136.3	69%	0.69	74%	0.74	S	S	*	*			trans	68.2	142.5	174.1	-102.3	14.9	0	0	0	116
1226	R	25.4	Very low	27.3	Very low	195 Å²	195	141.1 Å²	141.1	74%	0.736	75%	0.749	S	S	*	*			cis	-163.7	154.9	-0.2	-149.7	174.2	-136.8	-179	4.5	112.5
1227	T	25.9	Very low	27.1	Very low	113 Å²	113	140.9 Å²	140.9	69%	0.693	74%	0.742	S	S	*	*			trans	62.3	139.6	148.3	38	0	0	0	0	120.8
1228	T	24.6	Very low	26.5	Very low	107 Å²	107	143.1 Å²	143.1	66%	0.656	74%	0.744	S	S	*	*			cis	-176.4	171.3	-14.5	13.2	0	0	0	0	112.5
1229	L	27.1	Very low	26.4	Very low	96 Å²	96	144.5 Å²	144.5	50%	0.503	74%	0.738	S	S	.	*			trans	78.9	140.5	144.7	-74.5	150.7	0	0	0	118.6	E1231	L1229-E1231 HydrophobicContact CD2-CB 4.26Å; L1229-E1231 HydrophobicContact CD2-CG 3.77Å; L1229-E1231 VanDerWaalsContact CD2-OE1 3.28Å; L1229-E1231 WeakPolarHBondContact CD2-OE1 3.14Å; L1229-E1231 WeakPolarHBondContact CD2-OE2 3.26Å
1230	F	30.3	Very low	26.4	Very low	177 Å²	177	143.8 Å²	143.8	78%	0.776	74%	0.739	S	S	*	*			cis	-112	133.7	2.1	-71.5	-99.4	0	0	0	110.1
1231	E	27.7	Very low	26.2	Very low	129 Å²	129	144 Å²	144	60%	0.603	74%	0.738	S	S	*	*				59.6	113.6	74.1	-75.7	178.4	-171.2	0	0	111.9	L1229	L1229-E1231 HydrophobicContact CD2-CB 4.26Å; L1229-E1231 HydrophobicContact CD2-CG 3.77Å; L1229-E1231 VanDerWaalsContact CD2-OE1 3.28Å; L1229-E1231 WeakPolarHBondContact CD2-OE1 3.14Å; L1229-E1231 WeakPolarHBondContact CD2-OE2 3.26Å
1232	E	25.6	Very low	26.5	Very low	175 Å²	175	143.8 Å²	143.8	82%	0.818	74%	0.743	S	S	*	*				78.4	154.5	72.7	-69.3	178.2	168.2	0	0	111.1
1233	D	25.3	Very low	26.5	Very low	132 Å²	132	137.2 Å²	137.2	71%	0.706	74%	0.735	S	S	*	*			cis	-162.6	-178.7	31	-166.6	9.5	0	0	0	112.6
1234	I	26.4	Very low	26.7	Very low	140 Å²	140	141.2 Å²	141.2	72%	0.718	74%	0.736	S	S	*	*			trans	62.4	117.6	163.1	-4.4	-179.6	0	0	0	116.6
1235	I	29.5	Very low	26.8	Very low	140 Å²	140	142 Å²	142	72%	0.718	74%	0.735	S	S	*	*				-155.8	132.3	54.9	-75.1	165.1	0	0	0	111
1236	E	23.9	Very low	26.7	Very low	186 Å²	186	141.1 Å²	141.1	87%	0.869	74%	0.739	S	S	*	*			trans	-89.7	141.7	154.6	-61	-177	127.4	0	0	110.1
1237	E	24.1	Very low	26.8	Very low	149 Å²	149	141 Å²	141	70%	0.696	75%	0.747	S	S	*	*			trans	-173.9	142.4	145.9	-109.7	168.5	-170.6	0	0	110.5
1238	E	24.3	Very low	26.9	Very low	152 Å²	152	144.3 Å²	144.3	71%	0.71	75%	0.754	S	S	*	*			trans	50	102.7	168.4	-58.3	-169.4	131.9	0	0	119.9
1239	F	28.6	Very low	27.1	Very low	180 Å²	180	146.2 Å²	146.2	79%	0.789	76%	0.76	S	S	*	*				-164.2	85.1	107	-135.5	-99.5	0	0	0	115	V1241	F1239-V1241 VanDerWaalsContact C-N 3.34Å; F1239-V1241 HydrophobicContact CD1-CB 3.95Å; F1239-V1241 HydrophobicContact CD1-CG2 3.9Å; F1239-V1241 HydrophobicContact CE1-CB 3.74Å; F1239-V1241 HydrophobicContact CE1-CG2 3.56Å; F1239-V1241 HydrophobicContact CZ-CG2 4.21Å; F1239-V1241 PolarHBondContact O-N 3.41Å; F1239-V1241 VanDerWaalsContact O-N 3.09Å
1240	D	24.9	Very low	27.3	Very low	168 Å²	168	146 Å²	146	90%	0.898	78%	0.781	S	S	*	*			trans	-85.6	64.3	177.2	-122.1	-27.6	0	0	0	112.4
1241	V	28.1	Very low	27.8	Very low	113 Å²	113	141.1 Å²	141.1	69%	0.685	77%	0.769	S	S	*	*			trans	-142	62.7	176.9	-161.2	0	0	0	0	112.4	F1239	F1239-V1241 VanDerWaalsContact C-N 3.34Å; F1239-V1241 HydrophobicContact CD1-CB 3.95Å; F1239-V1241 HydrophobicContact CD1-CG2 3.9Å; F1239-V1241 HydrophobicContact CE1-CB 3.74Å; F1239-V1241 HydrophobicContact CE1-CG2 3.56Å; F1239-V1241 HydrophobicContact CZ-CG2 4.21Å; F1239-V1241 PolarHBondContact O-N 3.41Å; F1239-V1241 VanDerWaalsContact O-N 3.09Å
1242	A	30.3	Very low	28.5	Very low	95 Å²	95	143.1 Å²	143.1	79%	0.785	78%	0.779	S	S	*	*			trans	-142.7	-14.4	171.9	0	0	0	0	0	115.3	Q1244	A1242-Q1244 PolarHBondContact O-N 3.46Å; A1242-Q1244 VanDerWaalsContact O-N 3.08Å
1243	S	26.2	Very low	29.5	Very low	110 Å²	110	140 Å²	140	77%	0.769	77%	0.768	S	S	*	*			trans	-85.9	72	-177.1	-166	0	0	0	0	112.4
1244	Q	29.4	Very low	30.8	Very low	187 Å²	187	135.2 Å²	135.2	87%	0.874	75%	0.746	S	S	*	*	S	Bend	trans	-158.5	25.1	170.9	-132.6	161.2	72.7	0	0	116.2	A1242	A1242-Q1244 PolarHBondContact O-N 3.46Å; A1242-Q1244 VanDerWaalsContact O-N 3.08Å
1245	C	27.6	Very low	32.7	Very low	110 Å²	110	131.9 Å²	131.9	74%	0.743	73%	0.73	S	S	*	*	S	Bend	trans	-142.8	47.5	178.5	-71.4	0	0	0	0	113.9
1246	S	25.9	Very low	34.5	Very low	110 Å²	110	127.1 Å²	127.1	77%	0.769	71%	0.707	S	S	*	*			trans	-158.8	56.4	178.3	64	0	0	0	0	115.3
1247	E	28.1	Very low	37.2	Very low	192 Å²	192	118.6 Å²	118.6	90%	0.897	67%	0.667	S	S	*	*			trans	-150.1	52.5	172.5	-141.5	165.1	-117.2	0	0	114.7
1248	Q	27.7	Very low	39.8	Very low	183 Å²	183	112.7 Å²	112.7	86%	0.855	64%	0.64	S	S	*	*	S	Bend	trans	-158.5	135.6	156.7	-113.8	155.1	20.7	0	0	113.2
1249	D	28.5	Very low	41.9	Very low	146 Å²	146	108.1 Å²	108.1	78%	0.781	62%	0.624	S	S	*	*			trans	53	93.7	156.4	-56.9	-10.6	0	0	0	122	S1251	D1249-S1251 PolarHBondContact O-N 3.48Å
1250	G	31.6	Very low	44.1	Very low	92 Å²	92	100.5 Å²	100.5	95%	0.948	59%	0.592	S	S	*	*				72.3	5.7	119.8	0	0	0	0	0	120.8
1251	S	39.4	Very low	46.4	Very low	75 Å²	75	98.4 Å²	98.4	52%	0.524	59%	0.585	S	S	.	*			trans	-115	40.9	-167.3	-148.9	0	0	0	0	116.3	D1249 N1253 A1254	D1249-S1251 PolarHBondContact O-N 3.48Å; S1251-N1253 PolarHBondContact O-N 2.9Å; S1251-A1254 PolarHBondContact O-N 3.2Å
1252	E	43.1	Very low	48.4	Very low	170 Å²	170	95.6 Å²	95.6	79%	0.794	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-61.6	-42.6	-178.8	-64.4	-162.9	123.7	0	0	113.1	A1254 N1255	E1252-A1254 PolarHBondContact O-N 2.97Å; E1252-A1254 VanDerWaalsContact O-N 3.13Å; E1252-N1255 PolarHBondContact O-N 3.41Å
1253	N	46.9	Very low	50.5	Low	111 Å²	111	91.2 Å²	91.2	59%	0.594	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-64.1	-19.4	-176.6	-66.5	18.7	0	0	0	114.5	S1251 N1255	S1251-N1253 PolarHBondContact O-N 2.9Å; N1253-N1255 VanDerWaalsContact C-N 3.3Å; N1253-N1255 PolarHBondContact O-N 2.88Å
1254	A	53.5	Low	52.3	Low	30 Å²	30	95 Å²	95	25%	0.248	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-74.8	-18.1	-173.5	0	0	0	0	0	114	S1251 E1252	S1251-A1254 PolarHBondContact O-N 3.2Å; E1252-A1254 PolarHBondContact O-N 2.97Å; E1252-A1254 VanDerWaalsContact O-N 3.13Å
1255	N	64.5	Low	54.1	Low	70 Å²	70	90.6 Å²	90.6	37%	0.374	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-106.7	-0.8	-163.9	-72.5	-36.9	0	0	0	114.8	C730 E1252 N1253 W1257 M1258	C730-N1255 PolarHBondContact SG-OD1 3.22Å; E1252-N1255 PolarHBondContact O-N 3.41Å; N1253-N1255 VanDerWaalsContact C-N 3.3Å; N1253-N1255 PolarHBondContact O-N 2.88Å; N1255-W1257 VanDerWaalsContact C-N 3.28Å; N1255-W1257 PolarHBondContact O-N 3.09Å; N1255-M1258 HydrophobicContact CB-CE 3.68Å; N1255-M1258 WeakPolarHBondContact O-CB 3.31Å; N1255-M1258 PolarHBondContact O-N 3.5Å; N1255-M1258 WeakPolarHBondContact OD1-CE 3.32Å
1256	V	69	Low	56.3	Low	40 Å²	40	86.4 Å²	86.4	24%	0.242	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-57.5	-37	-172.5	-178.1	0	0	0	0	112.9	E695 M1258 S1259	E695-V1256 HydrophobicContact CG-CG2 4.34Å; V1256-M1258 PolarHBondContact O-N 3.44Å; V1256-M1258 VanDerWaalsContact O-N 3.13Å; V1256-S1259 WeakPolarHBondContact O-CB 3.48Å; V1256-S1259 PolarHBondContact O-N 3Å; V1256-S1259 PolarHBondContact O-OG 3.03Å
1257	W	79.4	Confident	58.7	Low	7 Å²	7	87.5 Å²	87.5	3%	0.027	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-57.1	-26.9	177.8	70.2	-88.2	0	0	0	114.3	F688 L698 I728 C730 L737 L751 N1255 S1259 D1260 L1263	F688-W1257 HydrophobicContact CE1-CB 4.22Å; F688-W1257 AromaticContact CE1-CD1 3.98Å; F688-W1257 AromaticContact CE1-CD2 3.86Å; F688-W1257 HydrophobicContact CE1-CD2 3.86Å; F688-W1257 HydrophobicContact CE1-CE3 4.41Å; F688-W1257 AromaticContact CE1-CG 3.77Å; F688-W1257 HydrophobicContact CE1-CG 3.77Å; F688-W1257 HydrophobicContact CZ-CD2 4.42Å; L698-W1257 HydrophobicContact CD2-CB 4.43Å; L698-W1257 HydrophobicContact CD2-CD2 4.49Å; L698-W1257 HydrophobicContact CD2-CE3 3.9Å; L698-W1257 HydrophobicContact CG-CB 4.34Å; L698-W1257 HydrophobicContact CG-CE3 4.39Å; I728-W1257 HydrophobicContact CG2-CH2 3.54Å; I728-W1257 HydrophobicContact CG2-CZ2 4.46Å; I728-W1257 HydrophobicContact CG2-CZ3 3.74Å; C730-W1257 VanDerWaalsContact SG-CZ2 3.57Å; L737-W1257 HydrophobicContact CD2-CZ3 4.32Å; L751-W1257 HydrophobicContact CD1-CZ3 4.19Å; N1255-W1257 VanDerWaalsContact C-N 3.28Å; N1255-W1257 PolarHBondContact O-N 3.09Å; W1257-S1259 PolarHBondContact O-N 3.25Å; W1257-D1260 WeakPolarHBondContact O-CB 3.46Å; W1257-D1260 PolarHBondContact O-N 3.13Å; W1257-L1263 HydrophobicContact CE3-CD1 4.44Å; W1257-L1263 HydrophobicContact CZ3-CD1 4.41Å
1258	M	78.1	Confident	61.2	Low	26 Å²	26	86.5 Å²	86.5	13%	0.128	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-73.1	-2.6	175.5	-62.1	-165.7	-73.9	0	0	113.6	I728 C730 N1255 V1256	I728-M1258 HydrophobicContact CG2-CG 3.92Å; I728-M1258 HydrophobicContact CG2-SD 3.87Å; C730-M1258 VanDerWaalsContact SG-CE 3.52Å; C730-M1258 VanDerWaalsContact SG-SD 3.61Å; N1255-M1258 HydrophobicContact CB-CE 3.68Å; N1255-M1258 WeakPolarHBondContact O-CB 3.31Å; N1255-M1258 PolarHBondContact O-N 3.5Å; N1255-M1258 WeakPolarHBondContact OD1-CE 3.32Å; V1256-M1258 PolarHBondContact O-N 3.44Å; V1256-M1258 VanDerWaalsContact O-N 3.13Å
1259	S	70.2	Confident	63.5	Low	55 Å²	55	82.8 Å²	82.8	39%	0.385	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-104.1	-2	176.9	77.2	0	0	0	0	114.1	V1256 W1257 V1261 R1264	V1256-S1259 WeakPolarHBondContact O-CB 3.48Å; V1256-S1259 PolarHBondContact O-N 3Å; V1256-S1259 PolarHBondContact O-OG 3.03Å; W1257-S1259 PolarHBondContact O-N 3.25Å; S1259-V1261 PolarHBondContact O-N 3.05Å; S1259-R1264 PolarHBondContact O-NE 3.38Å
1260	D	74.7	Confident	65.8	Low	20 Å²	20	80.5 Å²	80.5	11%	0.107	45%	0.452	C	S	.	.			trans	-50.4	136.7	178.5	-171.7	-55.1	0	0	0	110.7	R703 W1257 S1262 L1263 R1264	R703-D1260 IonicContact CZ-OD2 2.7Å; R703-D1260 IonicContact NE-OD2 3.2Å; R703-D1260 PolarHBondContact NE-OD2 3.04Å; R703-D1260 IonicContact NH2-OD2 3.03Å; R703-D1260 PolarHBondContact NH2-OD2 3.29Å; W1257-D1260 WeakPolarHBondContact O-CB 3.46Å; W1257-D1260 PolarHBondContact O-N 3.13Å; D1260-S1262 PolarHBondContact O-N 3.21Å; D1260-S1262 WeakPolarHBondContact OD1-CB 3.5Å; D1260-S1262 PolarHBondContact OD1-N 3.41Å; D1260-S1262 PolarHBondContact OD1-OG 3.4Å; D1260-L1263 PolarHBondContact O-N 2.84Å; D1260-R1264 PolarHBondContact O-N 3.06Å
1261	V	73	Confident	68.2	Low	124 Å²	124	77.4 Å²	77.4	75%	0.752	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-32.6	-179.7	-177.8	0	0	0	0	112.1	S1259 L1263	S1259-V1261 PolarHBondContact O-N 3.05Å; V1261-L1263 PolarHBondContact O-N 3.41Å
1262	S	68.7	Low	70.3	Confident	54 Å²	54	78.1 Å²	78.1	38%	0.378	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-16.4	178.7	-39.9	0	0	0	0	114	D1260	D1260-S1262 PolarHBondContact O-N 3.21Å; D1260-S1262 WeakPolarHBondContact OD1-CB 3.5Å; D1260-S1262 PolarHBondContact OD1-N 3.41Å; D1260-S1262 PolarHBondContact OD1-OG 3.4Å
1263	L	76	Confident	72.2	Confident	4 Å²	4	75.8 Å²	75.8	2%	0.021	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-3.5	-171.5	-72.8	-175.9	0	0	0	114.4	L698 L706 P726 I728 L737 W1257 D1260 V1261 S1265 A1266	L698-L1263 HydrophobicContact CD1-CD1 3.57Å; L698-L1263 HydrophobicContact CD1-CG 4.4Å; L706-L1263 HydrophobicContact CD1-CD2 3.78Å; L706-L1263 HydrophobicContact CD1-CG 3.99Å; L706-L1263 HydrophobicContact CD2-CD2 3.93Å; P726-L1263 HydrophobicContact CG-CD2 4.1Å; I728-L1263 HydrophobicContact CD1-CB 3.85Å; I728-L1263 HydrophobicContact CD1-CD1 3.89Å; I728-L1263 HydrophobicContact CD1-CD2 4.16Å; I728-L1263 HydrophobicContact CD1-CG 4.19Å; L737-L1263 HydrophobicContact CD2-CD1 4.23Å; L737-L1263 HydrophobicContact CD2-CD2 4.41Å; W1257-L1263 HydrophobicContact CE3-CD1 4.44Å; W1257-L1263 HydrophobicContact CZ3-CD1 4.41Å; D1260-L1263 PolarHBondContact O-N 2.84Å; V1261-L1263 PolarHBondContact O-N 3.41Å; L1263-S1265 PolarHBondContact O-N 2.81Å; L1263-A1266 WeakPolarHBondContact O-CB 3.36Å; L1263-A1266 PolarHBondContact O-N 3.47Å
1264	R	63.4	Low	74	Confident	190 Å²	190	74.5 Å²	74.5	72%	0.717	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-14.1	-177	-76.9	-175.4	175.1	-156.1	-3.8	116.6	S1259 D1260	S1259-R1264 PolarHBondContact O-NE 3.38Å; D1260-R1264 PolarHBondContact O-N 3.06Å
1265	S	67.7	Low	75.5	Confident	93 Å²	93	73.8 Å²	73.8	65%	0.65	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	1.3	178.1	53.7	0	0	0	0	114.3	P725 L1263	P725-S1265 WeakPolarHBondContact CG-O 3.46Å; L1263-S1265 PolarHBondContact O-N 2.81Å
1266	A	73.9	Confident	76.6	Confident	22 Å²	22	74.6 Å²	74.6	18%	0.182	38%	0.384	C	S	.	.	S	Bend	trans	-82.2	149.8	-178.1	0	0	0	0	0	113.1	P726 I728 L1263	P726-A1266 HydrophobicContact CG-CB 4.4Å; P726-A1266 WeakPolarHBondContact O-CA 3.22Å; P726-A1266 WeakPolarHBondContact O-CB 3.46Å; I728-A1266 HydrophobicContact CD1-CB 3.32Å; I728-A1266 HydrophobicContact CG1-CB 3.67Å; L1263-A1266 WeakPolarHBondContact O-CB 3.36Å; L1263-A1266 PolarHBondContact O-N 3.47Å
1267	Q	75.9	Confident	77.5	Confident	134 Å²	134	76.9 Å²	76.9	63%	0.626	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	138.6	172.2	-176.5	167.6	-29.5	0	0	109.4	P726 E727 I728	P726-Q1267 PolarHBondContact O-N 2.93Å; E727-Q1267 CarbonylContact C-O 3.57Å; E727-Q1267 WeakPolarHBondContact CA-O 3.15Å; E727-Q1267 HydrophobicContact CG-CB 4.34Å; I728-Q1267 PolarHBondContact N-O 3.29Å
1268	R	80.5	Confident	78	Confident	171 Å²	171	77.9 Å²	77.9	65%	0.645	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	136.8	172.5	-65.6	-179.9	-178.7	173.9	-1.6	109.5	I728	I728-R1268 WeakPolarHBondContact O-CA 3.39Å
1269	E	75.9	Confident	78.5	Confident	104 Å²	104	76.7 Å²	76.7	49%	0.486	39%	0.393	S	S	.	.			trans	-130.7	147	175.1	-169.4	173.5	-136.2	0	0	108.6	I728 C729	I728-E1269 PolarHBondContact O-N 3.3Å; C729-E1269 WeakPolarHBondContact CA-O 3.44Å; C729-E1269 WeakPolarHBondContact CB-O 3.19Å; C729-E1269 PolarHBondContact SG-O 2.96Å; C729-E1269 VanDerWaalsContact SG-O 3.33Å
1270	C	77.3	Confident	79.3	Confident	98 Å²	98	75.9 Å²	75.9	66%	0.662	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-99.6	148.5	174	-66.3	0	0	0	0	109.6
1271	L	81.8	Confident	79.9	Confident	28 Å²	28	80.2 Å²	80.2	15%	0.147	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-69.8	148.7	178.2	-142.7	72.7	0	0	0	110.2	C729 T731 E1275 E1276	C729-L1271 VanDerWaalsContact SG-CD1 3.59Å; C729-L1271 PolarHBondContact SG-N 2.99Å; T731-L1271 HydrophobicContact CG2-CD1 4.23Å; L1271-E1275 HydrophobicContact CD2-CB 3.99Å; L1271-E1275 HydrophobicContact CD2-CG 4.17Å; L1271-E1275 HydrophobicContact CG-CB 4.09Å; L1271-E1275 HydrophobicContact CG-CG 4.47Å; L1271-E1276 HydrophobicContact CD2-CB 4.22Å
1272	E	82.3	Confident	80.5	Confident	89 Å²	89	74.7 Å²	74.7	42%	0.416	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-69.7	135	171.7	-165.6	165	-133.6	0	0	109.1	K780 D1274 E1275 E1276	K780-E1272 IonicContact NZ-OE2 2.9Å; K780-E1272 PolarHBondContact NZ-OE2 2.72Å; E1272-D1274 VanDerWaalsContact C-N 3.3Å; E1272-D1274 PolarHBondContact O-N 3.19Å; E1272-E1275 WeakPolarHBondContact O-CA 3.38Å; E1272-E1275 VanDerWaalsContact O-CB 3.3Å; E1272-E1275 WeakPolarHBondContact O-CB 3.41Å; E1272-E1275 PolarHBondContact O-N 3.03Å; E1272-E1276 PolarHBondContact O-N 3.38Å
1273	H	83	Confident	81.4	Confident	122 Å²	122	74.6 Å²	74.6	57%	0.565	37%	0.366	S	S	*	.	H	α-helix	trans	-56	-42.4	-168.8	-174.1	60.2	0	0	0	113	E1275 E1276 L1277	H1273-E1275 PolarHBondContact O-N 2.98Å; H1273-E1276 PolarHBondContact O-N 2.93Å; H1273-E1276 VanDerWaalsContact O-N 3.08Å; H1273-L1277 WeakPolarHBondContact O-CG 3.5Å; H1273-L1277 PolarHBondContact O-N 3.48Å
1274	D	84.4	Confident	81.8	Confident	84 Å²	84	80.1 Å²	80.1	45%	0.449	39%	0.392	S	S	.	.	H	α-helix	trans	-59.4	-34.5	174.5	-52.6	-12.1	0	0	0	112.2	Y775 E1272 F1278	Y775-D1274 HydrophobicContact CE2-CB 4.24Å; Y775-D1274 WeakPolarHBondContact CE2-O 3.45Å; E1272-D1274 VanDerWaalsContact C-N 3.3Å; E1272-D1274 PolarHBondContact O-N 3.19Å; D1274-F1278 WeakPolarHBondContact O-CB 3.3Å; D1274-F1278 PolarHBondContact O-N 3.13Å; D1274-F1278 VanDerWaalsContact O-N 3.09Å
1275	E	86.7	Confident	82.7	Confident	15 Å²	15	78.2 Å²	78.2	7%	0.07	39%	0.389	C	S	.	.	H	α-helix	trans	-72.5	-37.6	175.4	-153.4	-174.5	126.3	0	0	111.2	R736 Y771 Y775 L1271 E1272 H1273 F1278 W1279	R736-E1275 IonicContact CZ-OE1 2.85Å; R736-E1275 IonicContact NH1-OE1 2.9Å; R736-E1275 PolarHBondContact NH1-OE1 3.47Å; R736-E1275 IonicContact NH1-OE2 3.2Å; R736-E1275 PolarHBondContact NH1-OE2 2.85Å; R736-E1275 IonicContact NH2-OE1 3.41Å; R736-E1275 PolarHBondContact NH2-OE1 3.33Å; Y771-E1275 VanDerWaalsContact CE2-CD 3.48Å; Y771-E1275 HydrophobicContact CE2-CG 4.04Å; Y771-E1275 VanDerWaalsContact CE2-OE1 3.31Å; Y771-E1275 WeakPolarHBondContact CE2-OE1 3.22Å; Y771-E1275 PolarHBondContact OH-OE1 2.83Å; Y771-E1275 PolarHBondContact OH-OE2 3.07Å; Y775-E1275 HydrophobicContact CD1-CG 3.99Å; Y775-E1275 HydrophobicContact CE1-CB 3.87Å; Y775-E1275 HydrophobicContact CE1-CG 3.47Å; Y775-E1275 VanDerWaalsContact CE1-CG 3.47Å; Y775-E1275 HydrophobicContact CE2-CB 4.18Å; Y775-E1275 HydrophobicContact CE2-CG 4.28Å; Y775-E1275 VanDerWaalsContact CZ-CA 3.48Å; Y775-E1275 WeakPolarHBondContact OH-CA 3.47Å; Y775-E1275 VanDerWaalsContact OH-CB 3.27Å; Y775-E1275 WeakPolarHBondContact OH-CB 3.3Å; Y775-E1275 PolarHBondContact OH-N 2.66Å; Y775-E1275 VanDerWaalsContact OH-N 3.1Å; L1271-E1275 HydrophobicContact CD2-CB 3.99Å; L1271-E1275 HydrophobicContact CD2-CG 4.17Å; L1271-E1275 HydrophobicContact CG-CB 4.09Å; L1271-E1275 HydrophobicContact CG-CG 4.47Å; E1272-E1275 WeakPolarHBondContact O-CA 3.38Å; E1272-E1275 VanDerWaalsContact O-CB 3.3Å; E1272-E1275 WeakPolarHBondContact O-CB 3.41Å; E1272-E1275 PolarHBondContact O-N 3.03Å; H1273-E1275 PolarHBondContact O-N 2.98Å; E1275-F1278 PolarHBondContact O-N 3.26Å; E1275-W1279 PolarHBondContact O-N 3.14Å; E1275-W1279 PolarHBondContact OE1-NE1 2.87Å
1276	E	87.2	Confident	83.4	Confident	86 Å²	86	76.2 Å²	76.2	40%	0.402	37%	0.367	S	S	.	.	H	α-helix	trans	-67.3	-41.7	178.4	-176.3	162.9	-131	0	0	112.3	P732 L1271 E1272 H1273 W1279 T1280	P732-E1276 HydrophobicContact CG-CG 3.89Å; L1271-E1276 HydrophobicContact CD2-CB 4.22Å; E1272-E1276 PolarHBondContact O-N 3.38Å; H1273-E1276 PolarHBondContact O-N 2.93Å; H1273-E1276 VanDerWaalsContact O-N 3.08Å; E1276-W1279 PolarHBondContact O-N 2.99Å; E1276-T1280 WeakPolarHBondContact O-CB 3.43Å; E1276-T1280 PolarHBondContact O-N 3.01Å; E1276-T1280 PolarHBondContact O-OG1 2.98Å
1277	L	87.8	Confident	83.9	Confident	89 Å²	89	75.1 Å²	75.1	47%	0.466	36%	0.359	S	S	.	.	H	α-helix	trans	-58.8	-51.5	169.9	-68.8	173.4	0	0	0	110.7	H1273 W1279 T1280 D1281	H1273-L1277 WeakPolarHBondContact O-CG 3.5Å; H1273-L1277 PolarHBondContact O-N 3.48Å; L1277-W1279 VanDerWaalsContact C-N 3.34Å; L1277-W1279 PolarHBondContact O-N 3.09Å; L1277-T1280 WeakPolarHBondContact O-CB 3.42Å; L1277-T1280 PolarHBondContact O-N 3.31Å; L1277-T1280 VanDerWaalsContact O-N 3.09Å; L1277-D1281 PolarHBondContact O-N 3.07Å
1278	F	88.8	Confident	84.2	Confident	27 Å²	27	74.2 Å²	74.2	12%	0.118	35%	0.35	C	S	.	.	H	α-helix	trans	-55.1	-44.5	176.8	168.6	-91.5	0	0	0	113	Y770 Y771 Y775 D1274 E1275 T1280 L1282	Y770-F1278 WeakPolarHBondContact O-CZ 3.33Å; Y771-F1278 HydrophobicContact CD2-CE1 4.17Å; Y775-F1278 HydrophobicContact CD2-CB 3.66Å; Y775-F1278 HydrophobicContact CD2-CD1 4.16Å; Y775-F1278 HydrophobicContact CD2-CD2 4.02Å; Y775-F1278 AromaticContact CD2-CG 3.65Å; Y775-F1278 HydrophobicContact CD2-CG 3.65Å; Y775-F1278 HydrophobicContact CE2-CB 4.08Å; Y775-F1278 HydrophobicContact CG-CB 4.43Å; Y775-F1278 HydrophobicContact CG-CD1 4.09Å; Y775-F1278 HydrophobicContact CG-CD2 4.34Å; Y775-F1278 HydrophobicContact CG-CG 4Å; D1274-F1278 WeakPolarHBondContact O-CB 3.3Å; D1274-F1278 PolarHBondContact O-N 3.13Å; D1274-F1278 VanDerWaalsContact O-N 3.09Å; E1275-F1278 PolarHBondContact O-N 3.26Å; F1278-T1280 VanDerWaalsContact C-N 3.34Å; F1278-L1282 HydrophobicContact CE1-CD2 3.89Å; F1278-L1282 HydrophobicContact CZ-CB 4.5Å; F1278-L1282 HydrophobicContact CZ-CD2 3.87Å; F1278-L1282 WeakPolarHBondContact O-CB 3.32Å; F1278-L1282 PolarHBondContact O-N 2.95Å
1279	W	88.5	Confident	83.9	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.008	33%	0.329	C	S	.	.	H	α-helix	trans	-68.7	-32.6	178	-77.7	116.3	0	0	0	113.1	P732 Y733 M767 Y771 E1275 E1276 L1277 L1282 R1283	P732-W1279 HydrophobicContact CB-CB 4.2Å; P732-W1279 HydrophobicContact CG-CB 3.98Å; Y733-W1279 AromaticContact CD1-CD2 3.79Å; Y733-W1279 HydrophobicContact CD1-CD2 3.79Å; Y733-W1279 AromaticContact CD1-CE3 3.87Å; Y733-W1279 HydrophobicContact CD1-CE3 3.87Å; Y733-W1279 HydrophobicContact CD1-CG 4.14Å; Y733-W1279 HydrophobicContact CD1-CZ3 4.33Å; Y733-W1279 AromaticContact CE1-CD2 3.77Å; Y733-W1279 HydrophobicContact CE1-CD2 3.77Å; Y733-W1279 AromaticContact CE1-CE2 3.67Å; Y733-W1279 HydrophobicContact CE1-CE3 4.14Å; Y733-W1279 HydrophobicContact CE1-CG 4.2Å; Y733-W1279 HydrophobicContact CE1-CH2 4.3Å; Y733-W1279 AromaticContact CE1-CZ2 3.95Å; Y733-W1279 HydrophobicContact CE1-CZ2 3.95Å; Y733-W1279 HydrophobicContact CE1-CZ3 4.4Å; M767-W1279 HydrophobicContact CE-CE3 4.33Å; M767-W1279 HydrophobicContact CE-CH2 3.71Å; M767-W1279 HydrophobicContact CE-CZ3 3.61Å; M767-W1279 HydrophobicContact CG-CH2 3.87Å; M767-W1279 HydrophobicContact CG-CZ3 3.58Å; M767-W1279 HydrophobicContact SD-CZ3 4.48Å; Y771-W1279 HydrophobicContact CD1-CZ2 4.15Å; Y771-W1279 AromaticContact CD2-CE2 3.92Å; Y771-W1279 HydrophobicContact CD2-CH2 4.06Å; Y771-W1279 AromaticContact CD2-CZ2 3.34Å; Y771-W1279 HydrophobicContact CD2-CZ2 3.34Å; Y771-W1279 AromaticContact CE2-CZ2 3.88Å; Y771-W1279 HydrophobicContact CE2-CZ2 3.88Å; Y771-W1279 AromaticContact CG-CH2 3.83Å; Y771-W1279 HydrophobicContact CG-CH2 3.83Å; Y771-W1279 AromaticContact CG-CZ2 3.5Å; Y771-W1279 HydrophobicContact CG-CZ2 3.5Å; Y771-W1279 VanDerWaalsContact CG-CZ2 3.5Å; E1275-W1279 PolarHBondContact O-N 3.14Å; E1275-W1279 PolarHBondContact OE1-NE1 2.87Å; E1276-W1279 PolarHBondContact O-N 2.99Å; L1277-W1279 VanDerWaalsContact C-N 3.34Å; L1277-W1279 PolarHBondContact O-N 3.09Å; W1279-L1282 HydrophobicContact CE3-CD2 3.85Å; W1279-L1282 HydrophobicContact CZ3-CD2 3.68Å; W1279-R1283 WeakPolarHBondContact O-CB 3.37Å; W1279-R1283 PolarHBondContact O-N 3.42Å
1280	T	87.5	Confident	83.6	Confident	37 Å²	37	66.6 Å²	66.6	23%	0.227	33%	0.326	C	S	.	.	H	α-helix	trans	-68.1	-50.9	177.5	-60.8	0	0	0	0	110.5	E1276 L1277 F1278 L1282 R1283 E1284	E1276-T1280 WeakPolarHBondContact O-CB 3.43Å; E1276-T1280 PolarHBondContact O-N 3.01Å; E1276-T1280 PolarHBondContact O-OG1 2.98Å; L1277-T1280 WeakPolarHBondContact O-CB 3.42Å; L1277-T1280 PolarHBondContact O-N 3.31Å; L1277-T1280 VanDerWaalsContact O-N 3.09Å; F1278-T1280 VanDerWaalsContact C-N 3.34Å; T1280-L1282 PolarHBondContact O-N 3.33Å; T1280-R1283 WeakPolarHBondContact O-CB 3.45Å; T1280-R1283 PolarHBondContact O-N 3.12Å; T1280-E1284 WeakPolarHBondContact CG2-OE1 3.26Å; T1280-E1284 PolarHBondContact O-N 3.24Å
1281	D	87	Confident	82.7	Confident	112 Å²	112	68.5 Å²	68.5	60%	0.599	33%	0.329	S	S	*	.	H	α-helix	trans	-56.3	-48.8	173	-92.2	30	0	0	0	112.2	L1277 R1283 K1285	L1277-D1281 PolarHBondContact O-N 3.07Å; D1281-R1283 VanDerWaalsContact C-N 3.32Å; D1281-R1283 PolarHBondContact O-N 3.11Å; D1281-K1285 WeakPolarHBondContact O-CB 2.98Å; D1281-K1285 PolarHBondContact O-N 3.44Å
1282	L	86.7	Confident	81.7	Confident	8 Å²	8	73.7 Å²	73.7	4%	0.042	35%	0.353	C	S	.	.	H	α-helix	trans	-64.8	-37.8	-179.7	-173.9	71.9	0	0	0	111.6	Y770 F1278 W1279 T1280 Y1286 L1287	Y770-L1282 HydrophobicContact CD1-CD1 3.74Å; Y770-L1282 HydrophobicContact CD2-CD1 4.1Å; Y770-L1282 HydrophobicContact CE1-CD1 4.48Å; Y770-L1282 HydrophobicContact CG-CD1 3.51Å; F1278-L1282 HydrophobicContact CE1-CD2 3.89Å; F1278-L1282 HydrophobicContact CZ-CB 4.5Å; F1278-L1282 HydrophobicContact CZ-CD2 3.87Å; F1278-L1282 WeakPolarHBondContact O-CB 3.32Å; F1278-L1282 PolarHBondContact O-N 2.95Å; W1279-L1282 HydrophobicContact CE3-CD2 3.85Å; W1279-L1282 HydrophobicContact CZ3-CD2 3.68Å; T1280-L1282 PolarHBondContact O-N 3.33Å; L1282-Y1286 HydrophobicContact CD1-CD2 3.95Å; L1282-Y1286 PolarHBondContact O-N 2.95Å; L1282-Y1286 VanDerWaalsContact O-N 3.1Å; L1282-L1287 HydrophobicContact CD2-CD1 3.8Å; L1282-L1287 HydrophobicContact CG-CD1 3.86Å; L1282-L1287 HydrophobicContact CG-CG 4.32Å; L1282-L1287 PolarHBondContact O-N 2.7Å
1283	R	86.5	Confident	81.1	Confident	51 Å²	51	74.9 Å²	74.9	19%	0.192	36%	0.362	C	S	.	.	I	π-helix	trans	-61.3	-61.6	174.8	-179.3	-170.4	67	-164.2	-0.7	109.7	P732 W1279 T1280 D1281 K1285 Y1286 L1287 Y1288	P732-R1283 WeakPolarHBondContact O-CD 3.17Å; P732-R1283 PolarHBondContact O-NH1 3.43Å; P732-R1283 VanDerWaalsContact O-NH1 3.12Å; W1279-R1283 WeakPolarHBondContact O-CB 3.37Å; W1279-R1283 PolarHBondContact O-N 3.42Å; T1280-R1283 WeakPolarHBondContact O-CB 3.45Å; T1280-R1283 PolarHBondContact O-N 3.12Å; D1281-R1283 VanDerWaalsContact C-N 3.32Å; D1281-R1283 PolarHBondContact O-N 3.11Å; R1283-K1285 VanDerWaalsContact C-N 3.28Å; R1283-K1285 PolarHBondContact O-N 2.87Å; R1283-Y1286 PolarHBondContact O-N 3.03Å; R1283-L1287 CarbonylContact O-C 3.57Å; R1283-L1287 PolarHBondContact O-N 2.95Å; R1283-Y1288 HydrophobicContact CG-CD2 4.28Å; R1283-Y1288 WeakPolarHBondContact O-CB 3.33Å; R1283-Y1288 PolarHBondContact O-N 3.28Å
1284	E	84.9	Confident	80.8	Confident	121 Å²	121	71.3 Å²	71.3	57%	0.565	35%	0.354	S	S	*	.	I	π-helix	trans	-61.2	-36.7	-173.4	-74.7	167	-150.1	0	0	112.7	T1280	T1280-E1284 WeakPolarHBondContact CG2-OE1 3.26Å; T1280-E1284 PolarHBondContact O-N 3.24Å
1285	K	82.8	Confident	80.7	Confident	149 Å²	149	72.3 Å²	72.3	65%	0.648	36%	0.359	S	S	*	.	I	π-helix	trans	-82.6	-29.4	-176.2	-165.8	170.3	-178.7	169.4	0	115.2	D1281 R1283	D1281-K1285 WeakPolarHBondContact O-CB 2.98Å; D1281-K1285 PolarHBondContact O-N 3.44Å; R1283-K1285 VanDerWaalsContact C-N 3.28Å; R1283-K1285 PolarHBondContact O-N 2.87Å
1286	Y	82	Confident	80.3	Confident	51 Å²	51	75.7 Å²	75.7	20%	0.2	38%	0.375	C	S	.	.	I	π-helix	trans	-138	-34.1	-172.2	-63.2	-77	0	0	0	115.6	R758 W763 Y770 A888 L1282 R1283	R758-Y1286 PolarHBondContact NE-O 2.71Å; R758-Y1286 PolarHBondContact NH1-O 3.2Å; W763-Y1286 WeakPolarHBondContact CZ3-O 3.23Å; Y770-Y1286 HydrophobicContact CE1-CE2 4.32Å; A888-Y1286 HydrophobicContact CB-CD1 4.03Å; A888-Y1286 HydrophobicContact CB-CE1 4.26Å; L1282-Y1286 HydrophobicContact CD1-CD2 3.95Å; L1282-Y1286 PolarHBondContact O-N 2.95Å; L1282-Y1286 VanDerWaalsContact O-N 3.1Å; R1283-Y1286 PolarHBondContact O-N 3.03Å
1287	L	84.1	Confident	80	Confident	0 Å²	0	76 Å²	76	0%	0	38%	0.376	C	S	.	.	I	π-helix	trans	-108.1	-8.7	-167.2	-51.3	177.6	0	0	0	114.5	I757 R758 W763 V766 M767 L1282 R1283	I757-L1287 CarbonylContact C-O 3.59Å; I757-L1287 VanDerWaalsContact CA-O 3.31Å; I757-L1287 WeakPolarHBondContact CA-O 3.28Å; I757-L1287 HydrophobicContact CD1-CB 3.78Å; I757-L1287 HydrophobicContact CD1-CD1 3.77Å; I757-L1287 HydrophobicContact CD1-CG 4.42Å; I757-L1287 HydrophobicContact CG1-CB 4.01Å; I757-L1287 HydrophobicContact CG2-CB 4.25Å; R758-L1287 WeakPolarHBondContact CG-O 3.18Å; R758-L1287 PolarHBondContact N-O 2.87Å; W763-L1287 HydrophobicContact CE3-CD2 3.92Å; V766-L1287 HydrophobicContact CB-CD2 4.32Å; V766-L1287 HydrophobicContact CG1-CD2 3.94Å; M767-L1287 HydrophobicContact CB-CD1 4.03Å; M767-L1287 HydrophobicContact CG-CD1 3.96Å; L1282-L1287 HydrophobicContact CD2-CD1 3.8Å; L1282-L1287 HydrophobicContact CG-CD1 3.86Å; L1282-L1287 HydrophobicContact CG-CG 4.32Å; L1282-L1287 PolarHBondContact O-N 2.7Å; R1283-L1287 CarbonylContact O-C 3.57Å; R1283-L1287 PolarHBondContact O-N 2.95Å
1288	Y	82.9	Confident	79.8	Confident	115 Å²	115	79.5 Å²	79.5	45%	0.451	38%	0.383	S	S	.	.	S	Bend	trans	-60.1	135.1	179.1	-165.2	-93.5	0	0	0	110.6	R758 R1283 M1290	R758-Y1288 PolarHBondContact NE-O 3.01Å; R758-Y1288 PolarHBondContact NH2-O 3.35Å; R1283-Y1288 HydrophobicContact CG-CD2 4.28Å; R1283-Y1288 WeakPolarHBondContact O-CB 3.33Å; R1283-Y1288 PolarHBondContact O-N 3.28Å; Y1288-M1290 PolarHBondContact O-N 3.49Å
1289	P	74.7	Confident	79.7	Confident	31 Å²	31	83.4 Å²	83.4	20%	0.201	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-54.7	125.2	177.2	-24.2	34.3	0	0	0	110.2	K756 N1291	K756-P1289 WeakPolarHBondContact O-CD 2.95Å; P1289-N1291 PolarHBondContact O-N 3.22Å
1290	M	68.8	Low	79.5	Confident	83 Å²	83	84.2 Å²	84.2	41%	0.409	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-65.8	126.5	174.2	-69.3	-176	-78.8	0	0	108.2	T890 Y1288 Q1292	T890-M1290 HydrophobicContact CG2-CE 4.13Å; T890-M1290 HydrophobicContact CG2-SD 3.51Å; T890-M1290 VanDerWaalsContact CG2-SD 3.51Å; Y1288-M1290 PolarHBondContact O-N 3.49Å; M1290-Q1292 PolarHBondContact O-N 2.74Å
1291	N	58.7	Low	79.4	Confident	139 Å²	139	84.7 Å²	84.7	74%	0.743	41%	0.414	S	S	*	.			trans	-60.4	104.7	169.2	-82.7	-8.5	0	0	0	107.8	P1289 N1293	P1289-N1291 PolarHBondContact O-N 3.22Å; N1291-N1293 VanDerWaalsContact C-N 3.28Å; N1291-N1293 PolarHBondContact O-N 3.11Å
1292	Q	61.4	Low	79.5	Confident	136 Å²	136	84.5 Å²	84.5	64%	0.636	41%	0.409	S	S	*	.			trans	-76.9	82	-175.2	-78.5	171.1	7.7	0	0	109.1	M1290 A1294 Q1297	M1290-Q1292 PolarHBondContact O-N 2.74Å; Q1292-A1294 PolarHBondContact O-N 3.03Å; Q1292-Q1297 HydrophobicContact CB-CG 4.09Å; Q1292-Q1297 HydrophobicContact CG-CG 4.4Å
1293	N	69	Low	79.6	Confident	114 Å²	114	86.8 Å²	86.8	61%	0.61	42%	0.421	S	S	*	.			trans	-50.5	116.2	167.4	-76.1	-3.8	0	0	0	108.1	N1291 D1295 H1296 Q1297	N1291-N1293 VanDerWaalsContact C-N 3.28Å; N1291-N1293 PolarHBondContact O-N 3.11Å; N1293-D1295 PolarHBondContact O-N 2.75Å; N1293-D1295 VanDerWaalsContact O-N 3.08Å; N1293-H1296 HydrophobicContact CB-CB 4.08Å; N1293-H1296 PolarHBondContact O-N 3.34Å; N1293-Q1297 PolarHBondContact O-N 3.14Å
1294	A	76.7	Confident	79.7	Confident	47 Å²	47	84.8 Å²	84.8	39%	0.388	41%	0.414	S	S	.	.	H	α-helix	trans	-55.9	-33.2	-173.1	0	0	0	0	0	111.8	Q1292 Q1297 R1298	Q1292-A1294 PolarHBondContact O-N 3.03Å; A1294-Q1297 PolarHBondContact O-N 2.93Å; A1294-R1298 WeakPolarHBondContact O-CB 3.21Å; A1294-R1298 WeakPolarHBondContact O-CD 3.5Å; A1294-R1298 WeakPolarHBondContact O-CG 3.42Å; A1294-R1298 PolarHBondContact O-N 3.1Å
1295	D	81.3	Confident	79.9	Confident	106 Å²	106	86.1 Å²	86.1	57%	0.567	41%	0.414	S	S	*	.	H	α-helix	trans	-73	-33.7	177.6	-56.6	-55.8	0	0	0	113.4	N1293 R1298 Q1299	N1293-D1295 PolarHBondContact O-N 2.75Å; N1293-D1295 VanDerWaalsContact O-N 3.08Å; D1295-R1298 PolarHBondContact O-N 3.19Å; D1295-R1298 WeakPolarHBondContact OD1-CD 3.48Å; D1295-R1298 IonicContact OD1-CZ 2.79Å; D1295-R1298 IonicContact OD1-NH1 2.63Å; D1295-R1298 PolarHBondContact OD1-NH1 2.91Å; D1295-Q1299 WeakPolarHBondContact O-CB 3.4Å; D1295-Q1299 PolarHBondContact O-N 3.5Å
1296	H	79.9	Confident	80.3	Confident	86 Å²	86	83.2 Å²	83.2	40%	0.398	40%	0.403	S	S	.	.	H	α-helix	trans	-69.6	-35.7	171.1	-174.3	49.4	0	0	0	111.3	N1293 Q1299 I1300	N1293-H1296 HydrophobicContact CB-CB 4.08Å; N1293-H1296 PolarHBondContact O-N 3.34Å; H1296-Q1299 PolarHBondContact O-N 3.28Å; H1296-I1300 WeakPolarHBondContact NE2-CD1 3.46Å; H1296-I1300 WeakPolarHBondContact O-CB 3.49Å; H1296-I1300 WeakPolarHBondContact O-CG1 3.18Å; H1296-I1300 PolarHBondContact O-N 3.3Å
1297	Q	79.2	Confident	80.7	Confident	91 Å²	91	82.7 Å²	82.7	43%	0.425	40%	0.403	S	S	.	.	H	α-helix	trans	-66.1	-41.4	170.6	-68.5	-166.9	-53.7	0	0	112.7	Q1292 N1293 A1294 Q1299 I1300 A1301	Q1292-Q1297 HydrophobicContact CB-CG 4.09Å; Q1292-Q1297 HydrophobicContact CG-CG 4.4Å; N1293-Q1297 PolarHBondContact O-N 3.14Å; A1294-Q1297 PolarHBondContact O-N 2.93Å; Q1297-Q1299 VanDerWaalsContact C-N 3.32Å; Q1297-I1300 PolarHBondContact O-N 3.42Å; Q1297-A1301 WeakPolarHBondContact O-CB 3.45Å; Q1297-A1301 PolarHBondContact O-N 3.17Å
1298	R	83.8	Confident	81	Confident	164 Å²	164	84.3 Å²	84.3	62%	0.619	41%	0.409	S	S	*	.	H	α-helix	trans	-61	-42.2	174	-73.1	159.8	178.6	167.7	-2.2	110.9	A1294 D1295 A1301 H1302	A1294-R1298 WeakPolarHBondContact O-CB 3.21Å; A1294-R1298 WeakPolarHBondContact O-CD 3.5Å; A1294-R1298 WeakPolarHBondContact O-CG 3.42Å; A1294-R1298 PolarHBondContact O-N 3.1Å; D1295-R1298 PolarHBondContact O-N 3.19Å; D1295-R1298 WeakPolarHBondContact OD1-CD 3.48Å; D1295-R1298 IonicContact OD1-CZ 2.79Å; D1295-R1298 IonicContact OD1-NH1 2.63Å; D1295-R1298 PolarHBondContact OD1-NH1 2.91Å; R1298-A1301 PolarHBondContact O-N 3.27Å; R1298-H1302 WeakPolarHBondContact O-CB 3.22Å; R1298-H1302 PolarHBondContact O-N 2.8Å
1299	Q	86.9	Confident	81.5	Confident	109 Å²	109	82.4 Å²	82.4	51%	0.509	41%	0.407	S	S	.	.	H	α-helix	trans	-63.1	-53.4	174.8	-173.9	178.6	8.2	0	0	111.4	D1295 H1296 Q1297 A1301 H1302 D1303	D1295-Q1299 WeakPolarHBondContact O-CB 3.4Å; D1295-Q1299 PolarHBondContact O-N 3.5Å; H1296-Q1299 PolarHBondContact O-N 3.28Å; Q1297-Q1299 VanDerWaalsContact C-N 3.32Å; Q1299-A1301 VanDerWaalsContact C-N 3.26Å; Q1299-A1301 PolarHBondContact O-N 2.84Å; Q1299-H1302 CarbonylContact O-C 3.51Å; Q1299-H1302 WeakPolarHBondContact O-CA 3.29Å; Q1299-H1302 WeakPolarHBondContact O-CB 3.36Å; Q1299-H1302 PolarHBondContact O-N 3.34Å; Q1299-D1303 WeakPolarHBondContact O-CB 3.36Å; Q1299-D1303 PolarHBondContact O-N 2.79Å
1300	I	84.1	Confident	82.3	Confident	19 Å²	19	86.2 Å²	86.2	10%	0.097	42%	0.422	C	S	.	.	H	α-helix	trans	-57.3	-39.8	176.6	-70.7	161.2	0	0	0	111.4	Y897 H1296 Q1297 D1303 L1304	Y897-I1300 HydrophobicContact CD2-CG2 4.04Å; Y897-I1300 HydrophobicContact CE2-CD1 4Å; Y897-I1300 HydrophobicContact CE2-CG1 4.3Å; Y897-I1300 HydrophobicContact CE2-CG2 3.77Å; H1296-I1300 WeakPolarHBondContact NE2-CD1 3.46Å; H1296-I1300 WeakPolarHBondContact O-CB 3.49Å; H1296-I1300 WeakPolarHBondContact O-CG1 3.18Å; H1296-I1300 PolarHBondContact O-N 3.3Å; Q1297-I1300 PolarHBondContact O-N 3.42Å; I1300-D1303 PolarHBondContact O-N 3.27Å; I1300-L1304 HydrophobicContact CG2-CD1 3.74Å; I1300-L1304 HydrophobicContact CG2-CG 4.29Å; I1300-L1304 WeakPolarHBondContact O-CB 3.43Å; I1300-L1304 WeakPolarHBondContact O-CD1 3.45Å; I1300-L1304 WeakPolarHBondContact O-CG 3.46Å; I1300-L1304 PolarHBondContact O-N 3.05Å
1301	A	85.5	Confident	83.4	Confident	47 Å²	47	85.3 Å²	85.3	39%	0.388	42%	0.421	S	S	.	.	H	α-helix	trans	-70.2	-31.1	177	0	0	0	0	0	113.2	Q1297 R1298 Q1299 R1305	Q1297-A1301 WeakPolarHBondContact O-CB 3.45Å; Q1297-A1301 PolarHBondContact O-N 3.17Å; R1298-A1301 PolarHBondContact O-N 3.27Å; Q1299-A1301 VanDerWaalsContact C-N 3.26Å; Q1299-A1301 PolarHBondContact O-N 2.84Å; A1301-R1305 WeakPolarHBondContact O-CD 3.3Å; A1301-R1305 VanDerWaalsContact O-CG 3.24Å; A1301-R1305 WeakPolarHBondContact O-CG 3.3Å; A1301-R1305 PolarHBondContact O-N 3.01Å
1302	H	89.4	Confident	84.9	Confident	108 Å²	108	78.8 Å²	78.8	50%	0.5	39%	0.387	S	S	.	.	H	α-helix	trans	-66.8	-52.5	169	174.4	-84.7	0	0	0	110.5	R1298 Q1299 L1304 R1305 E1306	R1298-H1302 WeakPolarHBondContact O-CB 3.22Å; R1298-H1302 PolarHBondContact O-N 2.8Å; Q1299-H1302 CarbonylContact O-C 3.51Å; Q1299-H1302 WeakPolarHBondContact O-CA 3.29Å; Q1299-H1302 WeakPolarHBondContact O-CB 3.36Å; Q1299-H1302 PolarHBondContact O-N 3.34Å; H1302-L1304 VanDerWaalsContact C-N 3.3Å; H1302-L1304 PolarHBondContact O-N 3.01Å; H1302-R1305 CarbonylContact O-C 3.55Å; H1302-R1305 WeakPolarHBondContact O-CA 3.46Å; H1302-R1305 WeakPolarHBondContact O-CB 3.27Å; H1302-R1305 PolarHBondContact O-N 2.92Å; H1302-E1306 IonicContact CE1-OE2 2.85Å; H1302-E1306 PolarHBondContact O-N 3.32Å
1303	D	89.7	Confident	86.4	Confident	56 Å²	56	78.9 Å²	78.9	30%	0.299	39%	0.385	S	S	.	.	H	α-helix	trans	-66.8	-32.4	-175.4	-59.2	-7.4	0	0	0	111.6	A894 Q1299 I1300 E1306 L1307	A894-D1303 HydrophobicContact CB-CB 3.99Å; Q1299-D1303 WeakPolarHBondContact O-CB 3.36Å; Q1299-D1303 PolarHBondContact O-N 2.79Å; I1300-D1303 PolarHBondContact O-N 3.27Å; D1303-E1306 PolarHBondContact O-N 3.5Å; D1303-L1307 WeakPolarHBondContact O-CB 3.43Å; D1303-L1307 PolarHBondContact O-N 3.17Å
1304	L	87.9	Confident	87.5	Confident	8 Å²	8	75.2 Å²	75.2	4%	0.042	37%	0.374	C	S	.	.	H	α-helix	trans	-66.8	-35.5	168.6	-80.2	168.4	0	0	0	112.8	A894 I898 H1120 V1122 I1300 H1302 R1308	A894-L1304 HydrophobicContact CB-CD2 3.95Å; A894-L1304 HydrophobicContact CB-CG 3.97Å; A894-L1304 WeakPolarHBondContact O-CD2 3.37Å; I898-L1304 HydrophobicContact CD1-CD2 4.35Å; H1120-L1304 HydrophobicContact CB-CB 4.21Å; V1122-L1304 HydrophobicContact CG2-CD1 3.65Å; V1122-L1304 HydrophobicContact CG2-CD2 4.5Å; I1300-L1304 HydrophobicContact CG2-CD1 3.74Å; I1300-L1304 HydrophobicContact CG2-CG 4.29Å; I1300-L1304 WeakPolarHBondContact O-CB 3.43Å; I1300-L1304 WeakPolarHBondContact O-CD1 3.45Å; I1300-L1304 WeakPolarHBondContact O-CG 3.46Å; I1300-L1304 PolarHBondContact O-N 3.05Å; H1302-L1304 VanDerWaalsContact C-N 3.3Å; H1302-L1304 PolarHBondContact O-N 3.01Å; L1304-R1308 WeakPolarHBondContact O-CB 3.44Å; L1304-R1308 PolarHBondContact O-N 3.33Å
1305	R	88.7	Confident	88.3	Confident	150 Å²	150	74.1 Å²	74.1	57%	0.566	36%	0.361	S	S	*	.	H	α-helix	trans	-72.4	-36	173.1	-76.2	169.9	176.8	-169.3	0.6	111.6	H1120 A1301 H1302 R1308 N1309	H1120-R1305 HydrophobicContact CB-CG 4.25Å; A1301-R1305 WeakPolarHBondContact O-CD 3.3Å; A1301-R1305 VanDerWaalsContact O-CG 3.24Å; A1301-R1305 WeakPolarHBondContact O-CG 3.3Å; A1301-R1305 PolarHBondContact O-N 3.01Å; H1302-R1305 CarbonylContact O-C 3.55Å; H1302-R1305 WeakPolarHBondContact O-CA 3.46Å; H1302-R1305 WeakPolarHBondContact O-CB 3.27Å; H1302-R1305 PolarHBondContact O-N 2.92Å; R1305-R1308 WeakPolarHBondContact O-CB 3.44Å; R1305-N1309 WeakPolarHBondContact O-CB 3.45Å; R1305-N1309 PolarHBondContact O-N 2.87Å; R1305-N1309 PolarHBondContact O-ND2 3.48Å; R1305-N1309 PolarHBondContact O-OD1 3.39Å
1306	E	91.8	Very high	88.8	Confident	87 Å²	87	72.2 Å²	72.2	41%	0.407	35%	0.35	S	S	.	.	H	α-helix	trans	-68.8	-49	174.7	-165.6	-176.9	154.4	0	0	110.7	H1302 D1303 R1308 N1309 Q1310	H1302-E1306 IonicContact CE1-OE2 2.85Å; H1302-E1306 PolarHBondContact O-N 3.32Å; D1303-E1306 PolarHBondContact O-N 3.5Å; E1306-R1308 VanDerWaalsContact C-N 3.29Å; E1306-R1308 PolarHBondContact O-N 3.06Å; E1306-N1309 CarbonylContact O-C 3.5Å; E1306-N1309 WeakPolarHBondContact O-CA 3.34Å; E1306-N1309 WeakPolarHBondContact O-CB 3.41Å; E1306-N1309 PolarHBondContact O-N 2.94Å; E1306-Q1310 HydrophobicContact CG-CG 4.35Å; E1306-Q1310 WeakPolarHBondContact O-CG 3.5Å; E1306-Q1310 PolarHBondContact O-N 3.4Å; E1306-Q1310 PolarHBondContact OE1-NE2 3.04Å
1307	L	90	Very high	89.3	Confident	41 Å²	41	72.2 Å²	72.2	22%	0.215	35%	0.351	C	S	.	.	H	α-helix	trans	-57.7	-41.7	174.6	-177.8	61.4	0	0	0	111.5	A894 K895 I898 L1119 D1303 V1311	A894-L1307 HydrophobicContact CB-CB 4.46Å; A894-L1307 HydrophobicContact CB-CD2 3.91Å; K895-L1307 HydrophobicContact CB-CD2 4.49Å; I898-L1307 HydrophobicContact CD1-CD2 3.53Å; I898-L1307 HydrophobicContact CD1-CG 4.47Å; L1119-L1307 HydrophobicContact CD2-CG 4.19Å; D1303-L1307 WeakPolarHBondContact O-CB 3.43Å; D1303-L1307 PolarHBondContact O-N 3.17Å; L1307-V1311 HydrophobicContact CD1-CG2 3.87Å; L1307-V1311 HydrophobicContact CG-CG2 4.36Å; L1307-V1311 VanDerWaalsContact O-CB 3.29Å; L1307-V1311 WeakPolarHBondContact O-CB 3.26Å; L1307-V1311 WeakPolarHBondContact O-CG2 3.25Å; L1307-V1311 PolarHBondContact O-N 2.93Å
1308	R	91.1	Very high	90	Very high	33 Å²	33	71.3 Å²	71.3	13%	0.125	35%	0.348	C	S	.	.	H	α-helix	trans	-55.1	-49.7	169	173.8	-154.5	91.1	140	6.7	111.5	L1027 C1117 L1119 H1120 L1304 R1305 E1306 S1312	L1027-R1308 PolarHBondContact O-NH1 2.91Å; L1027-R1308 VanDerWaalsContact O-NH1 3.13Å; L1027-R1308 PolarHBondContact O-NH2 2.73Å; C1117-R1308 VanDerWaalsContact O-CD 3.23Å; C1117-R1308 WeakPolarHBondContact O-CD 3.45Å; C1117-R1308 VanDerWaalsContact O-CG 3.28Å; C1117-R1308 WeakPolarHBondContact O-CG 3.19Å; L1119-R1308 HydrophobicContact CB-CB 4.24Å; L1119-R1308 HydrophobicContact CB-CG 4.47Å; H1120-R1308 HydrophobicContact CB-CB 4.15Å; H1120-R1308 HydrophobicContact CB-CG 4.45Å; H1120-R1308 WeakPolarHBondContact ND1-CD 3.26Å; L1304-R1308 WeakPolarHBondContact O-CB 3.44Å; L1304-R1308 PolarHBondContact O-N 3.33Å; R1305-R1308 WeakPolarHBondContact O-CB 3.44Å; E1306-R1308 VanDerWaalsContact C-N 3.29Å; E1306-R1308 PolarHBondContact O-N 3.06Å; R1308-S1312 WeakPolarHBondContact O-CB 3.48Å; R1308-S1312 PolarHBondContact O-N 2.87Å; R1308-S1312 PolarHBondContact O-OG 2.78Å
1309	N	92.4	Very high	90.3	Very high	75 Å²	75	64.1 Å²	64.1	40%	0.401	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-48.6	-178.5	-67.4	-14.2	0	0	0	111.2	R1305 E1306 S1312 F1313	R1305-N1309 WeakPolarHBondContact O-CB 3.45Å; R1305-N1309 PolarHBondContact O-N 2.87Å; R1305-N1309 PolarHBondContact O-ND2 3.48Å; R1305-N1309 PolarHBondContact O-OD1 3.39Å; E1306-N1309 CarbonylContact O-C 3.5Å; E1306-N1309 WeakPolarHBondContact O-CA 3.34Å; E1306-N1309 WeakPolarHBondContact O-CB 3.41Å; E1306-N1309 PolarHBondContact O-N 2.94Å; N1309-S1312 PolarHBondContact O-N 3.42Å; N1309-F1313 WeakPolarHBondContact O-CB 3.44Å; N1309-F1313 PolarHBondContact O-N 3.03Å
1310	Q	92.5	Very high	90.5	Very high	112 Å²	112	61 Å²	61	52%	0.523	31%	0.314	S	S	.	.	H	α-helix	trans	-60.3	-49.3	178.4	-66.9	-179.9	9.5	0	0	111.6	E1306 F1313 G1314	E1306-Q1310 HydrophobicContact CG-CG 4.35Å; E1306-Q1310 WeakPolarHBondContact O-CG 3.5Å; E1306-Q1310 PolarHBondContact O-N 3.4Å; E1306-Q1310 PolarHBondContact OE1-NE2 3.04Å; Q1310-F1313 PolarHBondContact O-N 2.94Å; Q1310-G1314 PolarHBondContact O-N 3.41Å
1311	V	91	Very high	90.9	Very high	64 Å²	64	64.4 Å²	64.4	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-69	-41	-179.6	176.4	0	0	0	0	111.4	V1116 L1119 L1307 G1314 F1315	V1116-V1311 HydrophobicContact CG1-CG1 4.09Å; L1119-V1311 HydrophobicContact CD2-CB 4.2Å; L1119-V1311 HydrophobicContact CD2-CG1 4.39Å; L1119-V1311 HydrophobicContact CD2-CG2 4.25Å; L1307-V1311 HydrophobicContact CD1-CG2 3.87Å; L1307-V1311 HydrophobicContact CG-CG2 4.36Å; L1307-V1311 VanDerWaalsContact O-CB 3.29Å; L1307-V1311 WeakPolarHBondContact O-CB 3.26Å; L1307-V1311 WeakPolarHBondContact O-CG2 3.25Å; L1307-V1311 PolarHBondContact O-N 2.93Å; V1311-G1314 PolarHBondContact O-N 3.08Å; V1311-F1315 WeakPolarHBondContact O-CB 3.38Å; V1311-F1315 PolarHBondContact O-N 3.07Å
1312	S	91.4	Very high	91.1	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.014	32%	0.321	C	S	.	.	H	α-helix	trans	-64.4	-43.2	176	-58.3	0	0	0	0	111.6	R1308 N1309 F1315 I1316	R1308-S1312 WeakPolarHBondContact O-CB 3.48Å; R1308-S1312 PolarHBondContact O-N 2.87Å; R1308-S1312 PolarHBondContact O-OG 2.78Å; N1309-S1312 PolarHBondContact O-N 3.42Å; S1312-F1315 PolarHBondContact O-N 3.49Å; S1312-I1316 WeakPolarHBondContact O-CB 3.39Å; S1312-I1316 VanDerWaalsContact O-CG1 3.22Å; S1312-I1316 WeakPolarHBondContact O-CG1 3.49Å; S1312-I1316 PolarHBondContact O-N 3.39Å
1313	F	92.8	Very high	91	Very high	138 Å²	138	59 Å²	59	61%	0.605	30%	0.299	S	S	*	.	H	α-helix	trans	-61.2	-50.3	175.6	177	-100	0	0	0	111.1	N1309 Q1310 F1315 I1316 M1317	N1309-F1313 WeakPolarHBondContact O-CB 3.44Å; N1309-F1313 PolarHBondContact O-N 3.03Å; Q1310-F1313 PolarHBondContact O-N 2.94Å; F1313-F1315 VanDerWaalsContact C-N 3.35Å; F1313-F1315 PolarHBondContact O-N 2.76Å; F1313-I1316 PolarHBondContact O-N 3.41Å; F1313-M1317 HydrophobicContact CE1-CE 4.34Å; F1313-M1317 HydrophobicContact CE2-CE 3.85Å; F1313-M1317 HydrophobicContact CZ-CE 3.55Å; F1313-M1317 WeakPolarHBondContact O-CB 3.4Å; F1313-M1317 PolarHBondContact O-N 2.81Å
1314	G	92.1	Very high	90.9	Very high	37 Å²	37	60.6 Å²	60.6	38%	0.381	31%	0.307	S	S	.	.	H	α-helix	trans	-60.3	-41.8	177.4	0	0	0	0	0	113.2	Q1310 V1311 M1318	Q1310-G1314 PolarHBondContact O-N 3.41Å; V1311-G1314 PolarHBondContact O-N 3.08Å; G1314-M1318 WeakPolarHBondContact O-CB 3.41Å; G1314-M1318 PolarHBondContact O-N 3.06Å
1315	F	92.4	Very high	90.9	Very high	23 Å²	23	64 Å²	64	10%	0.101	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-46.9	178.2	175.6	-100	0	0	0	112.8	V986 P989 T1112 I1113 V1116 V1311 S1312 F1313 N1319	V986-F1315 HydrophobicContact CG1-CD2 4.11Å; V986-F1315 HydrophobicContact CG1-CE2 4.46Å; P989-F1315 HydrophobicContact CG-CE2 4.29Å; P989-F1315 HydrophobicContact CG-CZ 3.67Å; T1112-F1315 HydrophobicContact CG2-CE2 4.14Å; T1112-F1315 HydrophobicContact CG2-CZ 3.65Å; I1113-F1315 HydrophobicContact CG1-CE1 4.23Å; V1116-F1315 HydrophobicContact CB-CD1 4.31Å; V1116-F1315 HydrophobicContact CB-CE1 4.46Å; V1116-F1315 HydrophobicContact CG1-CB 4.14Å; V1116-F1315 HydrophobicContact CG1-CD1 4.12Å; V1116-F1315 HydrophobicContact CG1-CG 4.14Å; V1116-F1315 HydrophobicContact CG2-CD1 4.28Å; V1116-F1315 HydrophobicContact CG2-CD2 4.26Å; V1116-F1315 HydrophobicContact CG2-CE1 4.22Å; V1116-F1315 HydrophobicContact CG2-CE2 4.21Å; V1116-F1315 HydrophobicContact CG2-CG 4.29Å; V1116-F1315 HydrophobicContact CG2-CZ 4.17Å; V1311-F1315 WeakPolarHBondContact O-CB 3.38Å; V1311-F1315 PolarHBondContact O-N 3.07Å; S1312-F1315 PolarHBondContact O-N 3.49Å; F1313-F1315 VanDerWaalsContact C-N 3.35Å; F1313-F1315 PolarHBondContact O-N 2.76Å; F1315-N1319 PolarHBondContact O-N 3.17Å; F1315-N1319 VanDerWaalsContact O-N 3.1Å; F1315-N1319 PolarHBondContact O-ND2 3.4Å
1316	I	91.3	Very high	90.6	Very high	66 Å²	66	57.6 Å²	57.6	34%	0.338	30%	0.302	S	S	.	.	H	α-helix	trans	-66.6	-45.5	177	-68.2	167.6	0	0	0	109.8	A1023 L1027 S1312 F1313 M1318 N1319 A1320	A1023-I1316 HydrophobicContact CB-CD1 4.45Å; L1027-I1316 HydrophobicContact CD1-CD1 4.49Å; S1312-I1316 WeakPolarHBondContact O-CB 3.39Å; S1312-I1316 VanDerWaalsContact O-CG1 3.22Å; S1312-I1316 WeakPolarHBondContact O-CG1 3.49Å; S1312-I1316 PolarHBondContact O-N 3.39Å; F1313-I1316 PolarHBondContact O-N 3.41Å; I1316-M1318 PolarHBondContact O-N 3.23Å; I1316-N1319 PolarHBondContact O-N 2.92Å; I1316-A1320 VanDerWaalsContact O-CB 3.23Å; I1316-A1320 WeakPolarHBondContact O-CB 3.41Å; I1316-A1320 PolarHBondContact O-N 2.91Å
1317	M	92.3	Very high	90.1	Very high	86 Å²	86	54.5 Å²	54.5	42%	0.424	29%	0.287	S	S	.	.	H	α-helix	trans	-59.1	-48.3	177.6	-177.2	62.3	71.7	0	0	111.4	F1313 N1319 A1320 L1321	F1313-M1317 HydrophobicContact CE1-CE 4.34Å; F1313-M1317 HydrophobicContact CE2-CE 3.85Å; F1313-M1317 HydrophobicContact CZ-CE 3.55Å; F1313-M1317 WeakPolarHBondContact O-CB 3.4Å; F1313-M1317 PolarHBondContact O-N 2.81Å; M1317-N1319 PolarHBondContact O-N 3.22Å; M1317-A1320 PolarHBondContact O-N 3.08Å; M1317-L1321 WeakPolarHBondContact O-CB 3.39Å; M1317-L1321 PolarHBondContact O-N 3.38Å
1318	M	92.2	Very high	89.8	Confident	73 Å²	73	57 Å²	57	36%	0.36	30%	0.3	S	S	.	.	H	α-helix	trans	-63.7	-40.6	-180	179.9	174.3	152.4	0	0	112.3	L983 V986 L987 G1314 I1316 F1322	L983-M1318 HydrophobicContact CD1-CE 3.86Å; V986-M1318 HydrophobicContact CB-CE 4.12Å; V986-M1318 HydrophobicContact CG1-CE 3.56Å; V986-M1318 HydrophobicContact CG1-SD 3.81Å; L987-M1318 HydrophobicContact CD1-CE 4.45Å; L987-M1318 HydrophobicContact CD2-CE 3.52Å; L987-M1318 HydrophobicContact CD2-CG 4.06Å; L987-M1318 HydrophobicContact CG-CE 3.74Å; G1314-M1318 WeakPolarHBondContact O-CB 3.41Å; G1314-M1318 PolarHBondContact O-N 3.06Å; I1316-M1318 PolarHBondContact O-N 3.23Å; M1318-F1322 WeakPolarHBondContact O-CB 3.39Å; M1318-F1322 PolarHBondContact O-N 3.49Å
1319	N	92	Very high	89.2	Confident	13 Å²	13	57.6 Å²	57.6	7%	0.07	31%	0.305	C	S	.	.	H	α-helix	trans	-69.1	-40.5	174.1	-81.8	-89.1	0	0	0	111.9	V986 G990 F1315 I1316 M1317 F1322 V1323	V986-N1319 PolarHBondContact O-ND2 3.49Å; V986-N1319 PolarHBondContact O-OD1 3.48Å; G990-N1319 PolarHBondContact N-OD1 2.94Å; F1315-N1319 PolarHBondContact O-N 3.17Å; F1315-N1319 VanDerWaalsContact O-N 3.1Å; F1315-N1319 PolarHBondContact O-ND2 3.4Å; I1316-N1319 PolarHBondContact O-N 2.92Å; M1317-N1319 PolarHBondContact O-N 3.22Å; N1319-F1322 PolarHBondContact O-N 2.82Å; N1319-V1323 WeakPolarHBondContact O-CB 3.43Å; N1319-V1323 WeakPolarHBondContact O-CG2 3.39Å; N1319-V1323 PolarHBondContact O-N 2.81Å
1320	A	90.2	Very high	88.3	Confident	43 Å²	43	56.6 Å²	56.6	36%	0.355	30%	0.298	S	S	.	.	H	α-helix	trans	-64.6	-41.6	176.9	0	0	0	0	0	112.3	I1316 M1317 V1323 L1324	I1316-A1320 VanDerWaalsContact O-CB 3.23Å; I1316-A1320 WeakPolarHBondContact O-CB 3.41Å; I1316-A1320 PolarHBondContact O-N 2.91Å; M1317-A1320 PolarHBondContact O-N 3.08Å; A1320-V1323 PolarHBondContact O-N 3.03Å; A1320-L1324 VanDerWaalsContact O-CB 3.25Å; A1320-L1324 WeakPolarHBondContact O-CB 3.48Å; A1320-L1324 PolarHBondContact O-N 3.06Å
1321	L	91.3	Very high	87.7	Confident	90 Å²	90	54.4 Å²	54.4	47%	0.471	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-43.8	174.2	-115.9	165.8	0	0	0	111.5	M1317 L1324 I1325	M1317-L1321 WeakPolarHBondContact O-CB 3.39Å; M1317-L1321 PolarHBondContact O-N 3.38Å; L1321-L1324 PolarHBondContact O-N 3.41Å; L1321-I1325 HydrophobicContact CD2-CD1 3.98Å; L1321-I1325 HydrophobicContact CD2-CG1 4.36Å; L1321-I1325 WeakPolarHBondContact O-CB 3.39Å; L1321-I1325 WeakPolarHBondContact O-CD1 3.16Å; L1321-I1325 VanDerWaalsContact O-CG1 3.22Å; L1321-I1325 WeakPolarHBondContact O-CG1 3.49Å; L1321-I1325 PolarHBondContact O-N 3.31Å
1322	F	89.8	Confident	87.1	Confident	35 Å²	35	57.4 Å²	57.4	15%	0.154	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-49.6	174.7	176.6	-104.5	0	0	0	111.6	L987 L994 M1318 N1319 L1324 I1325 I1326 F1376	L987-F1322 HydrophobicContact CD1-CD2 4.3Å; L987-F1322 HydrophobicContact CD1-CE2 4.46Å; L987-F1322 HydrophobicContact CD2-CB 3.88Å; L987-F1322 HydrophobicContact CD2-CD1 4.47Å; L987-F1322 HydrophobicContact CD2-CD2 4.25Å; L987-F1322 HydrophobicContact CD2-CG 3.95Å; L994-F1322 HydrophobicContact CD1-CD1 4.28Å; L994-F1322 HydrophobicContact CD1-CE1 3.88Å; M1318-F1322 WeakPolarHBondContact O-CB 3.39Å; M1318-F1322 PolarHBondContact O-N 3.49Å; N1319-F1322 PolarHBondContact O-N 2.82Å; F1322-L1324 VanDerWaalsContact C-N 3.34Å; F1322-L1324 PolarHBondContact O-N 3.44Å; F1322-I1325 PolarHBondContact O-N 3.14Å; F1322-I1326 HydrophobicContact CD2-CG1 4.49Å; F1322-I1326 HydrophobicContact CE1-CG1 4.25Å; F1322-I1326 HydrophobicContact CE2-CD1 4.13Å; F1322-I1326 HydrophobicContact CE2-CG1 4.1Å; F1322-I1326 HydrophobicContact CZ-CD1 4.27Å; F1322-I1326 HydrophobicContact CZ-CG1 3.96Å; F1322-I1326 WeakPolarHBondContact O-CG1 3.38Å; F1322-I1326 PolarHBondContact O-N 3.45Å; F1322-F1376 HydrophobicContact CE2-CD2 4.41Å; F1322-F1376 HydrophobicContact CE2-CE2 4.4Å; F1322-F1376 AromaticContact CZ-CD2 3.93Å; F1322-F1376 HydrophobicContact CZ-CD2 3.93Å; F1322-F1376 AromaticContact CZ-CE2 3.68Å; F1322-F1376 HydrophobicContact CZ-CE2 3.68Å
1323	V	88.9	Confident	86.2	Confident	7 Å²	7	60.6 Å²	60.6	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-58.5	-44.7	176.9	169	0	0	0	0	111.4	L993 L994 F1012 N1319 A1320 I1326 F1327	L993-V1323 HydrophobicContact CD2-CG1 3.99Å; L993-V1323 HydrophobicContact CD2-CG2 4.28Å; L994-V1323 HydrophobicContact CD1-CG2 4.27Å; L994-V1323 HydrophobicContact CD2-CG1 4.18Å; L994-V1323 HydrophobicContact CG-CG1 4.46Å; L994-V1323 HydrophobicContact CG-CG2 4.19Å; F1012-V1323 HydrophobicContact CE2-CG1 3.46Å; F1012-V1323 VanDerWaalsContact CE2-CG1 3.46Å; F1012-V1323 HydrophobicContact CZ-CG1 3.65Å; N1319-V1323 WeakPolarHBondContact O-CB 3.43Å; N1319-V1323 WeakPolarHBondContact O-CG2 3.39Å; N1319-V1323 PolarHBondContact O-N 2.81Å; A1320-V1323 PolarHBondContact O-N 3.03Å; V1323-I1326 PolarHBondContact O-N 3.48Å; V1323-F1327 VanDerWaalsContact O-CB 3.24Å; V1323-F1327 WeakPolarHBondContact O-CB 2.96Å; V1323-F1327 PolarHBondContact O-N 2.84Å
1324	L	87.9	Confident	85.1	Confident	89 Å²	89	60.8 Å²	60.8	47%	0.466	32%	0.318	S	S	.	.	H	α-helix	trans	-62.6	-43.6	177	179.3	63.2	0	0	0	112.2	A1320 L1321 F1322 F1327 L1328	A1320-L1324 VanDerWaalsContact O-CB 3.25Å; A1320-L1324 WeakPolarHBondContact O-CB 3.48Å; A1320-L1324 PolarHBondContact O-N 3.06Å; L1321-L1324 PolarHBondContact O-N 3.41Å; F1322-L1324 VanDerWaalsContact C-N 3.34Å; F1322-L1324 PolarHBondContact O-N 3.44Å; L1324-F1327 PolarHBondContact O-N 2.98Å; L1324-L1328 HydrophobicContact CD1-CD1 3.93Å; L1324-L1328 HydrophobicContact CD1-CG 4.03Å; L1324-L1328 HydrophobicContact CG-CD1 3.9Å; L1324-L1328 HydrophobicContact CG-CG 4.41Å; L1324-L1328 WeakPolarHBondContact O-CB 3.35Å; L1324-L1328 VanDerWaalsContact O-CG 3.26Å; L1324-L1328 WeakPolarHBondContact O-CG 3.4Å; L1324-L1328 PolarHBondContact O-N 3.44Å
1325	I	86.4	Confident	84.4	Confident	81 Å²	81	63.8 Å²	63.8	42%	0.415	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-49.6	178.1	-72.4	163.5	0	0	0	110.6	L1321 F1322 F1327 L1328 L1329	L1321-I1325 HydrophobicContact CD2-CD1 3.98Å; L1321-I1325 HydrophobicContact CD2-CG1 4.36Å; L1321-I1325 WeakPolarHBondContact O-CB 3.39Å; L1321-I1325 WeakPolarHBondContact O-CD1 3.16Å; L1321-I1325 VanDerWaalsContact O-CG1 3.22Å; L1321-I1325 WeakPolarHBondContact O-CG1 3.49Å; L1321-I1325 PolarHBondContact O-N 3.31Å; F1322-I1325 PolarHBondContact O-N 3.14Å; I1325-F1327 PolarHBondContact O-N 3.36Å; I1325-L1328 PolarHBondContact O-N 3.45Å; I1325-L1329 HydrophobicContact CG2-CD1 3.92Å; I1325-L1329 WeakPolarHBondContact O-CD1 3.36Å; I1325-L1329 VanDerWaalsContact O-CG 3.26Å; I1325-L1329 WeakPolarHBondContact O-CG 3.38Å; I1325-L1329 PolarHBondContact O-N 3.41Å
1326	I	82.9	Confident	83.4	Confident	15 Å²	15	67.3 Å²	67.3	8%	0.077	35%	0.352	C	S	.	.	H	α-helix	trans	-61.9	-44.3	177.9	-58.8	-54	0	0	0	110.9	L994 F1322 V1323 L1328 L1329 Q1330 I1372	L994-I1326 HydrophobicContact CD1-CB 3.67Å; L994-I1326 HydrophobicContact CD1-CG1 3.69Å; L994-I1326 HydrophobicContact CD1-CG2 3.84Å; L994-I1326 HydrophobicContact CD2-CB 4.14Å; L994-I1326 HydrophobicContact CD2-CG2 4.02Å; F1322-I1326 HydrophobicContact CD2-CG1 4.49Å; F1322-I1326 HydrophobicContact CE1-CG1 4.25Å; F1322-I1326 HydrophobicContact CE2-CD1 4.13Å; F1322-I1326 HydrophobicContact CE2-CG1 4.1Å; F1322-I1326 HydrophobicContact CZ-CD1 4.27Å; F1322-I1326 HydrophobicContact CZ-CG1 3.96Å; F1322-I1326 WeakPolarHBondContact O-CG1 3.38Å; F1322-I1326 PolarHBondContact O-N 3.45Å; V1323-I1326 PolarHBondContact O-N 3.48Å; I1326-L1328 PolarHBondContact O-N 3.4Å; I1326-L1329 WeakPolarHBondContact O-CB 3.48Å; I1326-L1329 PolarHBondContact O-N 3.42Å; I1326-Q1330 HydrophobicContact CG2-CG 4.44Å; I1326-Q1330 WeakPolarHBondContact O-CG 3.37Å; I1326-Q1330 PolarHBondContact O-N 3.09Å; I1326-I1372 HydrophobicContact CD1-CG2 3.4Å; I1326-I1372 VanDerWaalsContact CD1-CG2 3.4Å
1327	F	81.1	Confident	82.7	Confident	21 Å²	21	68.8 Å²	68.8	9%	0.092	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-41.8	-178.9	-172.5	-106	0	0	0	112.7	T1008 Y1009 F1012 V1323 L1324 I1325 L1329 Q1330 L1331	T1008-F1327 HydrophobicContact CG2-CE2 3.92Å; Y1009-F1327 HydrophobicContact CD1-CE1 4.05Å; Y1009-F1327 AromaticContact CD1-CZ 3.64Å; Y1009-F1327 HydrophobicContact CD1-CZ 3.64Å; Y1009-F1327 AromaticContact CE1-CE1 3.94Å; Y1009-F1327 HydrophobicContact CE1-CE1 3.94Å; Y1009-F1327 AromaticContact CE1-CZ 3.85Å; Y1009-F1327 HydrophobicContact CE1-CZ 3.85Å; Y1009-F1327 HydrophobicContact CG-CZ 4.45Å; F1012-F1327 HydrophobicContact CB-CE2 4.13Å; F1012-F1327 HydrophobicContact CB-CZ 4.48Å; F1012-F1327 AromaticContact CD2-CD2 3.76Å; F1012-F1327 HydrophobicContact CD2-CD2 3.76Å; F1012-F1327 AromaticContact CD2-CE2 3.87Å; F1012-F1327 HydrophobicContact CD2-CE2 3.87Å; F1012-F1327 HydrophobicContact CD2-CG 4.31Å; F1012-F1327 HydrophobicContact CE2-CD2 4.16Å; F1012-F1327 HydrophobicContact CE2-CG 4.3Å; F1012-F1327 HydrophobicContact CG-CD2 4.5Å; F1012-F1327 HydrophobicContact CG-CE2 4.18Å; V1323-F1327 VanDerWaalsContact O-CB 3.24Å; V1323-F1327 WeakPolarHBondContact O-CB 2.96Å; V1323-F1327 PolarHBondContact O-N 2.84Å; L1324-F1327 PolarHBondContact O-N 2.98Å; I1325-F1327 PolarHBondContact O-N 3.36Å; F1327-L1329 VanDerWaalsContact C-N 3.26Å; F1327-L1329 PolarHBondContact O-N 3.05Å; F1327-Q1330 WeakPolarHBondContact O-CB 3.4Å; F1327-Q1330 PolarHBondContact O-N 3.49Å; F1327-L1331 HydrophobicContact CD1-CD1 4.01Å; F1327-L1331 HydrophobicContact CD1-CG 4.49Å; F1327-L1331 HydrophobicContact CE1-CD1 3.66Å; F1327-L1331 HydrophobicContact CE1-CG 4.25Å; F1327-L1331 HydrophobicContact CZ-CD1 4.26Å; F1327-L1331 HydrophobicContact CZ-CD2 4.47Å; F1327-L1331 HydrophobicContact CZ-CG 4.48Å; F1327-L1331 WeakPolarHBondContact O-CG 3.4Å; F1327-L1331 PolarHBondContact O-N 3.18Å
1328	L	83.5	Confident	82	Confident	95 Å²	95	68.4 Å²	68.4	50%	0.497	35%	0.353	S	S	.	.	H	α-helix	trans	-63.5	-31.7	174.9	-73.1	171.2	0	0	0	112.7	L1324 I1325 I1326 K1332	L1324-L1328 HydrophobicContact CD1-CD1 3.93Å; L1324-L1328 HydrophobicContact CD1-CG 4.03Å; L1324-L1328 HydrophobicContact CG-CD1 3.9Å; L1324-L1328 HydrophobicContact CG-CG 4.41Å; L1324-L1328 WeakPolarHBondContact O-CB 3.35Å; L1324-L1328 VanDerWaalsContact O-CG 3.26Å; L1324-L1328 WeakPolarHBondContact O-CG 3.4Å; L1324-L1328 PolarHBondContact O-N 3.44Å; I1325-L1328 PolarHBondContact O-N 3.45Å; I1326-L1328 PolarHBondContact O-N 3.4Å; L1328-K1332 PolarHBondContact O-N 2.89Å
1329	L	78.1	Confident	81.2	Confident	44 Å²	44	69 Å²	69	23%	0.23	36%	0.355	C	S	.	.	H	α-helix	trans	-73.8	-40.8	174.9	-68	161.7	0	0	0	111.8	I1325 I1326 F1327 L1331 K1332 K1333 I1372	I1325-L1329 HydrophobicContact CG2-CD1 3.92Å; I1325-L1329 WeakPolarHBondContact O-CD1 3.36Å; I1325-L1329 VanDerWaalsContact O-CG 3.26Å; I1325-L1329 WeakPolarHBondContact O-CG 3.38Å; I1325-L1329 PolarHBondContact O-N 3.41Å; I1326-L1329 WeakPolarHBondContact O-CB 3.48Å; I1326-L1329 PolarHBondContact O-N 3.42Å; F1327-L1329 VanDerWaalsContact C-N 3.26Å; F1327-L1329 PolarHBondContact O-N 3.05Å; L1329-L1331 VanDerWaalsContact C-N 3.3Å; L1329-L1331 PolarHBondContact O-N 3.36Å; L1329-K1332 CarbonylContact O-C 3.59Å; L1329-K1332 WeakPolarHBondContact O-CA 3.5Å; L1329-K1332 PolarHBondContact O-N 2.93Å; L1329-K1333 PolarHBondContact O-N 2.99Å; L1329-I1372 HydrophobicContact CD1-CB 4.05Å; L1329-I1372 HydrophobicContact CD1-CD1 3.47Å; L1329-I1372 VanDerWaalsContact CD1-CD1 3.47Å; L1329-I1372 HydrophobicContact CD1-CG1 4.28Å; L1329-I1372 HydrophobicContact CD1-CG2 4.35Å
1330	Q	75.1	Confident	80.5	Confident	55 Å²	55	70.6 Å²	70.6	26%	0.257	36%	0.36	S	S	.	.	H	α-helix	trans	-55.9	-44.4	171.8	-76.1	171.9	-14.6	0	0	111.4	I1326 F1327 K1332 K1333 E1370	I1326-Q1330 HydrophobicContact CG2-CG 4.44Å; I1326-Q1330 WeakPolarHBondContact O-CG 3.37Å; I1326-Q1330 PolarHBondContact O-N 3.09Å; F1327-Q1330 WeakPolarHBondContact O-CB 3.4Å; F1327-Q1330 PolarHBondContact O-N 3.49Å; Q1330-K1332 PolarHBondContact O-N 3.38Å; Q1330-K1333 WeakPolarHBondContact O-CB 3.46Å; Q1330-K1333 PolarHBondContact O-N 3.06Å; Q1330-E1370 WeakPolarHBondContact CG-OE2 3.27Å
1331	L	78.1	Confident	79.7	Confident	66 Å²	66	72.9 Å²	72.9	35%	0.346	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-11.6	174.9	-65	-179.8	0	0	0	114.5	Y1009 F1327 L1329	Y1009-L1331 HydrophobicContact CE1-CD1 3.86Å; Y1009-L1331 HydrophobicContact CE1-CD2 4.08Å; Y1009-L1331 HydrophobicContact CE2-CD2 4.19Å; Y1009-L1331 WeakPolarHBondContact OH-CD1 3.41Å; Y1009-L1331 WeakPolarHBondContact OH-CD2 3.3Å; F1327-L1331 HydrophobicContact CD1-CD1 4.01Å; F1327-L1331 HydrophobicContact CD1-CG 4.49Å; F1327-L1331 HydrophobicContact CE1-CD1 3.66Å; F1327-L1331 HydrophobicContact CE1-CG 4.25Å; F1327-L1331 HydrophobicContact CZ-CD1 4.26Å; F1327-L1331 HydrophobicContact CZ-CD2 4.47Å; F1327-L1331 HydrophobicContact CZ-CG 4.48Å; F1327-L1331 WeakPolarHBondContact O-CG 3.4Å; F1327-L1331 PolarHBondContact O-N 3.18Å; L1329-L1331 VanDerWaalsContact C-N 3.3Å; L1329-L1331 PolarHBondContact O-N 3.36Å
1332	K	79.9	Confident	78.6	Confident	127 Å²	127	75.6 Å²	75.6	55%	0.552	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	13.6	177.3	-67.8	-60.4	-174.3	-175.6	0	113.8	L1328 L1329 Q1330 N1334 C1335 L1336	L1328-K1332 PolarHBondContact O-N 2.89Å; L1329-K1332 CarbonylContact O-C 3.59Å; L1329-K1332 WeakPolarHBondContact O-CA 3.5Å; L1329-K1332 PolarHBondContact O-N 2.93Å; Q1330-K1332 PolarHBondContact O-N 3.38Å; K1332-N1334 PolarHBondContact O-N 3.4Å; K1332-N1334 VanDerWaalsContact O-N 3.14Å; K1332-C1335 PolarHBondContact O-N 2.94Å; K1332-L1336 PolarHBondContact O-N 2.97Å
1333	K	71.7	Confident	77.3	Confident	69 Å²	69	74.7 Å²	74.7	30%	0.3	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-46.4	-45.2	177.2	-179.2	173.6	179.7	169	0	113.2	L1329 Q1330 C1335 L1336 Q1368 E1370	L1329-K1333 PolarHBondContact O-N 2.99Å; Q1330-K1333 WeakPolarHBondContact O-CB 3.46Å; Q1330-K1333 PolarHBondContact O-N 3.06Å; K1333-C1335 PolarHBondContact O-N 3.4Å; K1333-L1336 CarbonylContact O-C 3.33Å; K1333-L1336 PolarHBondContact O-N 3.27Å; K1333-L1336 VanDerWaalsContact O-N 3.12Å; K1333-Q1368 WeakPolarHBondContact CE-O 3.33Å; K1333-Q1368 PolarHBondContact NZ-O 2.89Å; K1333-E1370 HydrophobicContact CB-CG 4.38Å; K1333-E1370 HydrophobicContact CD-CG 4.34Å; K1333-E1370 HydrophobicContact CG-CG 4.25Å
1334	N	70.6	Confident	75.9	Confident	141 Å²	141	78 Å²	78	75%	0.754	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-61.4	-17.2	-179.6	-59.3	13.9	0	0	0	114.2	K1332	K1332-N1334 PolarHBondContact O-N 3.4Å; K1332-N1334 VanDerWaalsContact O-N 3.14Å
1335	C	76.3	Confident	74.3	Confident	101 Å²	101	76.6 Å²	76.6	68%	0.682	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-110.3	-11.1	179.4	-54.4	0	0	0	0	113.2	K1332 K1333	K1332-C1335 PolarHBondContact O-N 2.94Å; K1333-C1335 PolarHBondContact O-N 3.4Å
1336	L	71.7	Confident	72.6	Confident	96 Å²	96	78.4 Å²	78.4	50%	0.503	41%	0.406	S	S	.	.	S	Bend	trans	-150.8	73.7	-166.5	-118.7	162.2	0	0	0	110	K1332 K1333 P1371	K1332-L1336 PolarHBondContact O-N 2.97Å; K1333-L1336 CarbonylContact O-C 3.33Å; K1333-L1336 PolarHBondContact O-N 3.27Å; K1333-L1336 VanDerWaalsContact O-N 3.12Å; L1336-P1371 HydrophobicContact CD2-CG 4Å; L1336-P1371 WeakPolarHBondContact O-CD 3Å
1337	Y	77.3	Confident	71.1	Confident	98 Å²	98	82.4 Å²	82.4	38%	0.384	43%	0.428	S	S	.	.			trans	-120.7	156.6	177.7	59.7	-92.4	0	0	0	112.1	E1339 Q1368 L1369	Y1337-E1339 HydrophobicContact CD2-CG 4.33Å; Y1337-E1339 HydrophobicContact CE2-CG 4.18Å; Y1337-Q1368 HydrophobicContact CD1-CG 4.45Å; Y1337-Q1368 HydrophobicContact CD2-CB 4.15Å; Y1337-Q1368 HydrophobicContact CD2-CG 3.64Å; Y1337-Q1368 HydrophobicContact CE2-CG 4Å; Y1337-Q1368 HydrophobicContact CG-CB 4.05Å; Y1337-Q1368 HydrophobicContact CG-CG 3.89Å; Y1337-L1369 CarbonylContact C-O 3.53Å; Y1337-L1369 VanDerWaalsContact CA-O 3.27Å; Y1337-L1369 WeakPolarHBondContact CA-O 3.11Å
1338	I	77.4	Confident	69.4	Low	77 Å²	77	89.1 Å²	89.1	40%	0.395	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.7	164.1	-64	179.3	0	0	0	107.1	L1369 P1371 L1374	I1338-L1369 PolarHBondContact N-O 2.84Å; I1338-L1369 PolarHBondContact O-N 3.03Å; I1338-P1371 HydrophobicContact CD1-CB 3.75Å; I1338-P1371 HydrophobicContact CG1-CB 4.11Å; I1338-L1374 HydrophobicContact CD1-CD2 4.39Å; I1338-L1374 HydrophobicContact CG2-CD2 4.34Å
1339	E	75.4	Confident	67.7	Low	87 Å²	87	88.8 Å²	88.8	41%	0.407	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	135.9	174	-60.8	-170.7	160.7	0	0	111.4	Y1337 R1366	Y1337-E1339 HydrophobicContact CD2-CG 4.33Å; Y1337-E1339 HydrophobicContact CE2-CG 4.18Å; E1339-R1366 HydrophobicContact CB-CB 4.27Å; E1339-R1366 WeakPolarHBondContact OE2-CD 3.46Å; E1339-R1366 IonicContact OE2-CZ 2.66Å; E1339-R1366 IonicContact OE2-NE 3.72Å; E1339-R1366 IonicContact OE2-NH1 3.72Å; E1339-R1366 PolarHBondContact OE2-NH1 3.26Å
1340	W	76.9	Confident	66.1	Low	46 Å²	46	93.7 Å²	93.7	17%	0.174	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121.3	173.5	-165.5	-124.7	0	0	0	111.5	Y1066 P1068 F1342 L1367 L1369 L1374	Y1066-W1340 PolarHBondContact O-NE1 2.92Å; P1068-W1340 HydrophobicContact CB-CH2 4.4Å; P1068-W1340 HydrophobicContact CB-CZ2 4.31Å; W1340-F1342 HydrophobicContact CH2-CD2 4.31Å; W1340-F1342 AromaticContact CZ2-CD2 3.88Å; W1340-F1342 HydrophobicContact CZ2-CD2 3.88Å; W1340-F1342 PolarHBondContact O-N 3.42Å; W1340-L1367 HydrophobicContact CB-CB 4.17Å; W1340-L1367 PolarHBondContact N-O 2.97Å; W1340-L1369 HydrophobicContact CB-CD1 3.74Å; W1340-L1369 HydrophobicContact CB-CG 4.48Å; W1340-L1369 HydrophobicContact CD2-CD1 3.89Å; W1340-L1369 HydrophobicContact CE3-CD1 3.62Å; W1340-L1369 HydrophobicContact CG-CD1 3.98Å; W1340-L1369 HydrophobicContact CZ3-CD1 4.5Å; W1340-L1374 HydrophobicContact CZ3-CD1 4.07Å
1341	P	72.9	Confident	65	Low	90 Å²	90	97.8 Å²	97.8	58%	0.584	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	-18.7	-174.2	29.8	-35.1	0	0	0	114
1342	F	69.8	Low	63.6	Low	148 Å²	148	100.4 Å²	100.4	65%	0.649	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	8.1	-169.8	-60.8	-65.1	0	0	0	115.3	W1340	W1340-F1342 HydrophobicContact CH2-CD2 4.31Å; W1340-F1342 AromaticContact CZ2-CD2 3.88Å; W1340-F1342 HydrophobicContact CZ2-CD2 3.88Å; W1340-F1342 PolarHBondContact O-N 3.42Å
1343	S	61.6	Low	61.5	Low	16 Å²	16	99.8 Å²	99.8	11%	0.112	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	90.9	178	-163.7	0	0	0	0	112.7
1344	P	59	Low	60.1	Low	76 Å²	76	103.7 Å²	103.7	49%	0.494	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.3	131.7	165.7	30.4	-32.1	0	0	0	110.4	V1364	P1344-V1364 HydrophobicContact CB-CG1 3.56Å
1345	L	55.2	Low	59	Low	59 Å²	59	105 Å²	105	31%	0.309	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.5	106.5	167.5	-79.1	161.8	0	0	0	108	N1347 S1365	L1345-N1347 VanDerWaalsContact C-N 3.33Å; L1345-N1347 PolarHBondContact O-N 3.18Å; L1345-S1365 PolarHBondContact N-O 3.28Å; L1345-S1365 VanDerWaalsContact O-O 3.13Å; L1345-S1365 PolarHBondContact O-OG 3.43Å
1346	T	51.3	Low	57.6	Low	120 Å²	120	107.3 Å²	107.3	74%	0.736	57%	0.568	S	S	*	*			trans	-80.8	77.9	178.3	53	0	0	0	0	110.5
1347	N	51	Low	56.3	Low	99 Å²	99	108.2 Å²	108.2	53%	0.529	58%	0.578	S	S	.	*			trans	-84.1	117.5	175.4	-72.9	-40.2	0	0	0	110.6	L1345 T1349 S1365	L1345-N1347 VanDerWaalsContact C-N 3.33Å; L1345-N1347 PolarHBondContact O-N 3.18Å; N1347-T1349 PolarHBondContact O-N 2.68Å; N1347-T1349 VanDerWaalsContact O-N 3.09Å; N1347-S1365 PolarHBondContact ND2-OG 3.26Å
1348	H	45.4	Very low	55	Low	161 Å²	161	111.8 Å²	111.8	75%	0.745	60%	0.604	S	S	*	*			trans	-70.4	101.3	171.2	-106.8	-68.8	0	0	0	110.4
1349	T	46.5	Very low	53.7	Low	89 Å²	89	115.8 Å²	115.8	55%	0.546	62%	0.621	S	S	.	*			trans	-112.8	90.3	168.3	52.8	0	0	0	0	110.4	N1347 I1351	N1347-T1349 PolarHBondContact O-N 2.68Å; N1347-T1349 VanDerWaalsContact O-N 3.09Å; T1349-I1351 PolarHBondContact O-N 2.98Å
1350	I	46	Very low	52.6	Low	147 Å²	147	116.5 Å²	116.5	75%	0.754	63%	0.633	S	S	*	*			trans	-70.6	117.7	167.2	-58.3	173.7	0	0	0	107.2	P1352	I1350-P1352 WeakPolarHBondContact O-CD 3.4Å
1351	I	52	Low	51.3	Low	141 Å²	141	122.3 Å²	122.3	72%	0.723	66%	0.662	S	S	*	*			trans	-98.9	105.8	176.2	-57.6	175.6	0	0	0	108.3	T1349 C1353	T1349-I1351 PolarHBondContact O-N 2.98Å; I1351-C1353 PolarHBondContact O-N 3.24Å
1352	P	47.2	Very low	50.3	Low	121 Å²	121	127.9 Å²	127.9	79%	0.786	67%	0.672	S	S	*	*			trans	-89.9	87.5	-176.1	34.5	-32.8	0	0	0	111.1	I1350	I1350-P1352 WeakPolarHBondContact O-CD 3.4Å
1353	C	35.3	Very low	49.6	Very low	113 Å²	113	124.6 Å²	124.6	76%	0.764	66%	0.664	S	S	*	*			trans	-148.5	71.9	177.8	-134.2	0	0	0	0	116.6	I1351	I1351-C1353 PolarHBondContact O-N 3.24Å
1354	N	43.8	Very low	49.5	Very low	151 Å²	151	127.9 Å²	127.9	81%	0.807	68%	0.683	S	S	*	*			trans	69.3	124.3	143.5	-131.8	-8.8	0	0	0	120.4
1355	K	46.6	Very low	49.6	Very low	168 Å²	168	126.6 Å²	126.6	73%	0.73	68%	0.676	S	S	*	*	S	Bend	trans	75.1	108.9	168.8	-62.8	-163.1	173.4	-168.2	0	119.3
1356	D	46.5	Very low	50.1	Low	150 Å²	150	129.9 Å²	129.9	80%	0.802	68%	0.684	S	S	*	*	S	Bend	trans	75.1	27.4	135.3	-47.2	-21.8	0	0	0	119.6
1357	T	46.3	Very low	51.1	Low	115 Å²	115	125.2 Å²	125.2	71%	0.706	66%	0.655	S	S	*	*			trans	-153.7	133.9	143.4	11.4	0	0	0	0	111.2
1358	N	49	Very low	52.2	Low	173 Å²	173	123.9 Å²	123.9	93%	0.925	65%	0.645	S	S	*	*			trans	-104.9	55.6	177.6	-83.8	-17.6	0	0	0	111.1
1359	E	50.1	Low	53.4	Low	162 Å²	162	116.9 Å²	116.9	76%	0.757	61%	0.613	S	S	*	*			trans	-109.2	126.8	175.9	-67.5	-171.7	-169.4	0	0	110.5	E1361	E1359-E1361 PolarHBondContact O-N 3.36Å
1360	P	52.5	Low	54.7	Low	101 Å²	101	114.7 Å²	114.7	66%	0.656	60%	0.597	S	S	*	*			trans	-78.3	102.8	-179.4	30.4	-32.9	0	0	0	110.7	W1362	P1360-W1362 PolarHBondContact O-N 3.07Å; P1360-W1362 VanDerWaalsContact O-N 3.17Å
1361	E	49.3	Very low	55.9	Low	169 Å²	169	109 Å²	109	79%	0.79	57%	0.569	S	S	*	*			trans	-69.7	108.9	177.9	-167	179.9	-171.1	0	0	111.6	E1359 T1363	E1359-E1361 PolarHBondContact O-N 3.36Å; E1361-T1363 VanDerWaalsContact C-N 3.33Å; E1361-T1363 HydrophobicContact CG-CG2 4.22Å; E1361-T1363 PolarHBondContact O-N 3.21Å
1362	W	51.9	Low	56.9	Low	207 Å²	207	105.9 Å²	105.9	78%	0.784	55%	0.553	S	S	*	*			trans	-76.9	75	-177.4	-67.3	91.3	0	0	0	112.4	P1360 V1364	P1360-W1362 PolarHBondContact O-N 3.07Å; P1360-W1362 VanDerWaalsContact O-N 3.17Å; W1362-V1364 PolarHBondContact O-N 3.37Å
1363	T	55.2	Low	58.1	Low	79 Å²	79	101.5 Å²	101.5	49%	0.485	53%	0.53	S	S	.	.			trans	-72.1	98	177.7	48.8	0	0	0	0	112.2	E1361 S1365	E1361-T1363 VanDerWaalsContact C-N 3.33Å; E1361-T1363 HydrophobicContact CG-CG2 4.22Å; E1361-T1363 PolarHBondContact O-N 3.21Å; T1363-S1365 PolarHBondContact O-N 3.04Å
1364	V	60.1	Low	60.1	Low	85 Å²	85	98 Å²	98	52%	0.515	50%	0.503	S	S	.	.			trans	-74.6	88.3	178.7	-176.5	0	0	0	0	110.8	P1344 W1362 R1366	P1344-V1364 HydrophobicContact CB-CG1 3.56Å; W1362-V1364 PolarHBondContact O-N 3.37Å; V1364-R1366 PolarHBondContact O-N 2.84Å
1365	S	59.5	Low	61.8	Low	49 Å²	49	95.6 Å²	95.6	34%	0.343	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	104.5	177.1	59.9	0	0	0	0	112	L1345 N1347 T1363	L1345-S1365 PolarHBondContact N-O 3.28Å; L1345-S1365 VanDerWaalsContact O-O 3.13Å; L1345-S1365 PolarHBondContact O-OG 3.43Å; N1347-S1365 PolarHBondContact ND2-OG 3.26Å; T1363-S1365 PolarHBondContact O-N 3.04Å
1366	R	67.4	Low	63.3	Low	127 Å²	127	90.1 Å²	90.1	48%	0.479	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	152.1	172.6	-70	173	179.2	156.7	1.9	111.2	E1339 V1364 Q1368	E1339-R1366 HydrophobicContact CB-CB 4.27Å; E1339-R1366 WeakPolarHBondContact OE2-CD 3.46Å; E1339-R1366 IonicContact OE2-CZ 2.66Å; E1339-R1366 IonicContact OE2-NE 3.72Å; E1339-R1366 IonicContact OE2-NH1 3.72Å; E1339-R1366 PolarHBondContact OE2-NH1 3.26Å; V1364-R1366 PolarHBondContact O-N 2.84Å; R1366-Q1368 PolarHBondContact O-N 3.04Å
1367	L	71.2	Confident	64.9	Low	23 Å²	23	84.2 Å²	84.2	12%	0.12	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	115.4	177.8	-170.7	72.1	0	0	0	110.7	D1063 W1340 L1369	D1063-L1367 HydrophobicContact CB-CD1 4.49Å; D1063-L1367 HydrophobicContact CB-CD2 4.47Å; W1340-L1367 HydrophobicContact CB-CB 4.17Å; W1340-L1367 PolarHBondContact N-O 2.97Å; L1367-L1369 HydrophobicContact CD2-CD2 4.06Å; L1367-L1369 HydrophobicContact CG-CD2 4.39Å
1368	Q	74.4	Confident	66.7	Low	71 Å²	71	81.7 Å²	81.7	33%	0.332	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	118.5	177.1	-67.8	-176.8	-11.8	0	0	111.1	K1333 Y1337 R1366	K1333-Q1368 WeakPolarHBondContact CE-O 3.33Å; K1333-Q1368 PolarHBondContact NZ-O 2.89Å; Y1337-Q1368 HydrophobicContact CD1-CG 4.45Å; Y1337-Q1368 HydrophobicContact CD2-CB 4.15Å; Y1337-Q1368 HydrophobicContact CD2-CG 3.64Å; Y1337-Q1368 HydrophobicContact CE2-CG 4Å; Y1337-Q1368 HydrophobicContact CG-CB 4.05Å; Y1337-Q1368 HydrophobicContact CG-CG 3.89Å; R1366-Q1368 PolarHBondContact O-N 3.04Å
1369	L	70.2	Confident	68.5	Low	14 Å²	14	76.9 Å²	76.9	7%	0.073	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	145.2	-176.9	-65.2	167.8	0	0	0	111.9	P1068 Y1337 I1338 W1340 L1367 L1374	P1068-L1369 HydrophobicContact CG-CD1 3.72Å; P1068-L1369 HydrophobicContact CG-CD2 3.57Å; P1068-L1369 HydrophobicContact CG-CG 4.31Å; Y1337-L1369 CarbonylContact C-O 3.53Å; Y1337-L1369 VanDerWaalsContact CA-O 3.27Å; Y1337-L1369 WeakPolarHBondContact CA-O 3.11Å; I1338-L1369 PolarHBondContact N-O 2.84Å; I1338-L1369 PolarHBondContact O-N 3.03Å; W1340-L1369 HydrophobicContact CB-CD1 3.74Å; W1340-L1369 HydrophobicContact CB-CG 4.48Å; W1340-L1369 HydrophobicContact CD2-CD1 3.89Å; W1340-L1369 HydrophobicContact CE3-CD1 3.62Å; W1340-L1369 HydrophobicContact CG-CD1 3.98Å; W1340-L1369 HydrophobicContact CZ3-CD1 4.5Å; L1367-L1369 HydrophobicContact CD2-CD2 4.06Å; L1367-L1369 HydrophobicContact CG-CD2 4.39Å; L1369-L1374 HydrophobicContact CD1-CD1 4.5Å
1370	E	74.2	Confident	70.2	Confident	43 Å²	43	71.5 Å²	71.5	20%	0.201	37%	0.371	C	S	.	.			trans	-74.2	128.7	173.4	-72.4	153.4	-144.5	0	0	110.6	Q1330 K1333 I1372 G1373 L1374	Q1330-E1370 WeakPolarHBondContact CG-OE2 3.27Å; K1333-E1370 HydrophobicContact CB-CG 4.38Å; K1333-E1370 HydrophobicContact CD-CG 4.34Å; K1333-E1370 HydrophobicContact CG-CG 4.25Å; E1370-I1372 PolarHBondContact O-N 2.91Å; E1370-G1373 PolarHBondContact O-N 3.26Å; E1370-L1374 PolarHBondContact O-N 3.46Å
1371	P	71.6	Confident	71.9	Confident	27 Å²	27	68.1 Å²	68.1	18%	0.175	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-41.7	-171.6	20.9	-32.5	0	0	0	113.1	L1336 I1338 L1374 V1375	L1336-P1371 HydrophobicContact CD2-CG 4Å; L1336-P1371 WeakPolarHBondContact O-CD 3Å; I1338-P1371 HydrophobicContact CD1-CB 3.75Å; I1338-P1371 HydrophobicContact CG1-CB 4.11Å; P1371-L1374 PolarHBondContact O-N 3.45Å; P1371-V1375 WeakPolarHBondContact O-CG2 3.21Å; P1371-V1375 PolarHBondContact O-N 2.87Å
1372	I	72.6	Confident	73.8	Confident	75 Å²	75	64 Å²	64	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-76.5	-30.7	179.2	-76.5	167	0	0	0	111.8	I1326 L1329 E1370 L1374 V1375 F1376	I1326-I1372 HydrophobicContact CD1-CG2 3.4Å; I1326-I1372 VanDerWaalsContact CD1-CG2 3.4Å; L1329-I1372 HydrophobicContact CD1-CB 4.05Å; L1329-I1372 HydrophobicContact CD1-CD1 3.47Å; L1329-I1372 VanDerWaalsContact CD1-CD1 3.47Å; L1329-I1372 HydrophobicContact CD1-CG1 4.28Å; L1329-I1372 HydrophobicContact CD1-CG2 4.35Å; E1370-I1372 PolarHBondContact O-N 2.91Å; I1372-L1374 VanDerWaalsContact C-N 3.32Å; I1372-L1374 PolarHBondContact O-N 2.83Å; I1372-V1375 PolarHBondContact O-N 3.43Å; I1372-F1376 VanDerWaalsContact O-CB 3.23Å; I1372-F1376 WeakPolarHBondContact O-CB 3.21Å; I1372-F1376 PolarHBondContact O-N 3.44Å
1373	G	72.5	Confident	75.6	Confident	29 Å²	29	55 Å²	55	30%	0.299	30%	0.3	S	S	.	.	H	α-helix	trans	-61.3	-41.2	169.2	0	0	0	0	0	112	E1370 F1376 L1377	E1370-G1373 PolarHBondContact O-N 3.26Å; G1373-F1376 PolarHBondContact O-N 3.33Å; G1373-L1377 WeakPolarHBondContact O-CB 3.24Å; G1373-L1377 PolarHBondContact O-N 3.22Å
1374	L	77.4	Confident	77.3	Confident	39 Å²	39	52.1 Å²	52.1	20%	0.204	28%	0.282	C	S	.	.	H	α-helix	trans	-67.8	-43.4	175.1	-177	61.3	0	0	0	112.5	I1338 W1340 L1369 E1370 P1371 I1372 F1376 L1377 S1378	I1338-L1374 HydrophobicContact CD1-CD2 4.39Å; I1338-L1374 HydrophobicContact CG2-CD2 4.34Å; W1340-L1374 HydrophobicContact CZ3-CD1 4.07Å; L1369-L1374 HydrophobicContact CD1-CD1 4.5Å; E1370-L1374 PolarHBondContact O-N 3.46Å; P1371-L1374 PolarHBondContact O-N 3.45Å; I1372-L1374 VanDerWaalsContact C-N 3.32Å; I1372-L1374 PolarHBondContact O-N 2.83Å; L1374-F1376 VanDerWaalsContact C-N 3.33Å; L1374-F1376 PolarHBondContact O-N 2.83Å; L1374-L1377 PolarHBondContact O-N 2.96Å; L1374-S1378 WeakPolarHBondContact O-CB 3.14Å; L1374-S1378 PolarHBondContact O-N 2.88Å
1375	V	80.4	Confident	78.8	Confident	102 Å²	102	52.1 Å²	52.1	62%	0.618	28%	0.279	S	S	*	.	H	α-helix	trans	-61.1	-42.4	174.2	168.4	0	0	0	0	111.2	P1371 I1372 S1378 F1379	P1371-V1375 WeakPolarHBondContact O-CG2 3.21Å; P1371-V1375 PolarHBondContact O-N 2.87Å; I1372-V1375 PolarHBondContact O-N 3.43Å; V1375-S1378 PolarHBondContact O-N 2.89Å; V1375-F1379 WeakPolarHBondContact O-CB 3.42Å; V1375-F1379 PolarHBondContact O-N 3.27Å
1376	F	76.7	Confident	80.2	Confident	52 Å²	52	52.7 Å²	52.7	23%	0.228	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-50.1	177.4	-173.3	-85.2	0	0	0	111.7	T991 F1322 I1372 G1373 L1374 S1378 F1379 F1380	T991-F1376 HydrophobicContact CG2-CE1 3.48Å; T991-F1376 VanDerWaalsContact CG2-CE1 3.48Å; T991-F1376 HydrophobicContact CG2-CE2 4.39Å; T991-F1376 HydrophobicContact CG2-CZ 3.29Å; T991-F1376 WeakPolarHBondContact OG1-CZ 3.45Å; F1322-F1376 HydrophobicContact CE2-CD2 4.41Å; F1322-F1376 HydrophobicContact CE2-CE2 4.4Å; F1322-F1376 AromaticContact CZ-CD2 3.93Å; F1322-F1376 HydrophobicContact CZ-CD2 3.93Å; F1322-F1376 AromaticContact CZ-CE2 3.68Å; F1322-F1376 HydrophobicContact CZ-CE2 3.68Å; I1372-F1376 VanDerWaalsContact O-CB 3.23Å; I1372-F1376 WeakPolarHBondContact O-CB 3.21Å; I1372-F1376 PolarHBondContact O-N 3.44Å; G1373-F1376 PolarHBondContact O-N 3.33Å; L1374-F1376 VanDerWaalsContact C-N 3.33Å; L1374-F1376 PolarHBondContact O-N 2.83Å; F1376-S1378 VanDerWaalsContact C-N 3.3Å; F1376-S1378 PolarHBondContact O-N 3.09Å; F1376-F1379 WeakPolarHBondContact O-CB 3.36Å; F1376-F1379 PolarHBondContact O-N 3.16Å; F1376-F1379 VanDerWaalsContact O-N 3.15Å; F1376-F1380 AromaticContact CD1-CD2 3.9Å; F1376-F1380 HydrophobicContact CD1-CD2 3.9Å; F1376-F1380 HydrophobicContact CD1-CE2 4.19Å; F1376-F1380 HydrophobicContact CD2-CE2 4.25Å; F1376-F1380 AromaticContact CE1-CD2 3.46Å; F1376-F1380 HydrophobicContact CE1-CD2 3.46Å; F1376-F1380 VanDerWaalsContact CE1-CD2 3.46Å; F1376-F1380 AromaticContact CE1-CE2 3.45Å; F1376-F1380 HydrophobicContact CE1-CE2 3.45Å; F1376-F1380 VanDerWaalsContact CE1-CE2 3.45Å; F1376-F1380 HydrophobicContact CE1-CG 4.38Å; F1376-F1380 HydrophobicContact CE1-CZ 4.31Å; F1376-F1380 HydrophobicContact CE2-CD2 4.2Å; F1376-F1380 AromaticContact CE2-CE2 3.54Å; F1376-F1380 HydrophobicContact CE2-CE2 3.54Å; F1376-F1380 HydrophobicContact CE2-CZ 4.43Å; F1376-F1380 HydrophobicContact CG-CD2 4.42Å; F1376-F1380 AromaticContact CZ-CD2 3.62Å; F1376-F1380 HydrophobicContact CZ-CD2 3.62Å; F1376-F1380 AromaticContact CZ-CE2 3.06Å; F1376-F1380 HydrophobicContact CZ-CE2 3.06Å; F1376-F1380 AromaticContact CZ-CZ 3.78Å; F1376-F1380 HydrophobicContact CZ-CZ 3.78Å; F1376-F1380 WeakPolarHBondContact O-CD2 3.12Å; F1376-F1380 PolarHBondContact O-N 3.09Å
1377	L	80	Confident	81.4	Confident	26 Å²	26	48 Å²	48	14%	0.136	26%	0.261	C	S	.	.	H	α-helix	trans	-60.7	-40.1	176.9	-175.4	145.5	0	0	0	111.2	P1068 F1072 G1373 L1374 F1380 M1381	P1068-L1377 HydrophobicContact CB-CD2 4.24Å; F1072-L1377 HydrophobicContact CB-CD1 3.99Å; F1072-L1377 HydrophobicContact CB-CD2 4.22Å; F1072-L1377 HydrophobicContact CB-CG 4.17Å; F1072-L1377 HydrophobicContact CD2-CD2 4.46Å; F1072-L1377 HydrophobicContact CD2-CG 4.15Å; F1072-L1377 HydrophobicContact CG-CD1 4.28Å; F1072-L1377 HydrophobicContact CG-CG 4.21Å; G1373-L1377 WeakPolarHBondContact O-CB 3.24Å; G1373-L1377 PolarHBondContact O-N 3.22Å; L1374-L1377 PolarHBondContact O-N 2.96Å; L1377-F1380 PolarHBondContact O-N 3.33Å; L1377-M1381 WeakPolarHBondContact O-CB 3.13Å; L1377-M1381 PolarHBondContact O-N 3.41Å
1378	S	84	Confident	82.5	Confident	63 Å²	63	48.8 Å²	48.8	44%	0.441	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-40.4	173.8	-176.6	0	0	0	0	112.9	L1374 V1375 F1376 M1381 T1382	L1374-S1378 WeakPolarHBondContact O-CB 3.14Å; L1374-S1378 PolarHBondContact O-N 2.88Å; V1375-S1378 PolarHBondContact O-N 2.89Å; F1376-S1378 VanDerWaalsContact C-N 3.3Å; F1376-S1378 PolarHBondContact O-N 3.09Å; S1378-M1381 PolarHBondContact O-N 2.76Å; S1378-T1382 VanDerWaalsContact O-CB 3.26Å; S1378-T1382 WeakPolarHBondContact O-CB 3.22Å; S1378-T1382 PolarHBondContact O-N 2.71Å; S1378-T1382 PolarHBondContact O-OG1 2.93Å
1379	F	87	Confident	83.3	Confident	71 Å²	71	47.8 Å²	47.8	31%	0.311	27%	0.267	S	S	.	.	H	α-helix	trans	-63	-47.7	175.5	171.3	-97.2	0	0	0	111.9	A980 V1375 F1376 T1382 L1383	A980-F1379 HydrophobicContact CB-CE2 3.93Å; A980-F1379 HydrophobicContact CB-CZ 3.88Å; V1375-F1379 WeakPolarHBondContact O-CB 3.42Å; V1375-F1379 PolarHBondContact O-N 3.27Å; F1376-F1379 WeakPolarHBondContact O-CB 3.36Å; F1376-F1379 PolarHBondContact O-N 3.16Å; F1376-F1379 VanDerWaalsContact O-N 3.15Å; F1379-T1382 PolarHBondContact O-N 3.48Å; F1379-L1383 HydrophobicContact CD1-CD1 4.15Å; F1379-L1383 HydrophobicContact CE1-CD1 3.59Å; F1379-L1383 HydrophobicContact CE2-CD1 4.29Å; F1379-L1383 HydrophobicContact CZ-CD1 3.69Å; F1379-L1383 HydrophobicContact CZ-CG 4.49Å; F1379-L1383 WeakPolarHBondContact O-CG 3.32Å; F1379-L1383 PolarHBondContact O-N 2.95Å
1380	F	86.3	Confident	84.2	Confident	50 Å²	50	47.1 Å²	47.1	22%	0.219	26%	0.264	C	S	.	.	H	α-helix	trans	-67.7	-39.1	176.6	-82.7	-93.1	0	0	0	112.7	S984 F1072 F1376 L1377 T1382 L1383 L1384	S984-F1380 VanDerWaalsContact OG-CE1 3.26Å; S984-F1380 WeakPolarHBondContact OG-CE1 3.41Å; S984-F1380 WeakPolarHBondContact OG-CZ 3.48Å; F1072-F1380 HydrophobicContact CE2-CB 4.01Å; F1072-F1380 HydrophobicContact CZ-CB 4.25Å; F1376-F1380 AromaticContact CD1-CD2 3.9Å; F1376-F1380 HydrophobicContact CD1-CD2 3.9Å; F1376-F1380 HydrophobicContact CD1-CE2 4.19Å; F1376-F1380 HydrophobicContact CD2-CE2 4.25Å; F1376-F1380 AromaticContact CE1-CD2 3.46Å; F1376-F1380 HydrophobicContact CE1-CD2 3.46Å; F1376-F1380 VanDerWaalsContact CE1-CD2 3.46Å; F1376-F1380 AromaticContact CE1-CE2 3.45Å; F1376-F1380 HydrophobicContact CE1-CE2 3.45Å; F1376-F1380 VanDerWaalsContact CE1-CE2 3.45Å; F1376-F1380 HydrophobicContact CE1-CG 4.38Å; F1376-F1380 HydrophobicContact CE1-CZ 4.31Å; F1376-F1380 HydrophobicContact CE2-CD2 4.2Å; F1376-F1380 AromaticContact CE2-CE2 3.54Å; F1376-F1380 HydrophobicContact CE2-CE2 3.54Å; F1376-F1380 HydrophobicContact CE2-CZ 4.43Å; F1376-F1380 HydrophobicContact CG-CD2 4.42Å; F1376-F1380 AromaticContact CZ-CD2 3.62Å; F1376-F1380 HydrophobicContact CZ-CD2 3.62Å; F1376-F1380 AromaticContact CZ-CE2 3.06Å; F1376-F1380 HydrophobicContact CZ-CE2 3.06Å; F1376-F1380 AromaticContact CZ-CZ 3.78Å; F1376-F1380 HydrophobicContact CZ-CZ 3.78Å; F1376-F1380 WeakPolarHBondContact O-CD2 3.12Å; F1376-F1380 PolarHBondContact O-N 3.09Å; L1377-F1380 PolarHBondContact O-N 3.33Å; F1380-T1382 VanDerWaalsContact C-N 3.32Å; F1380-T1382 PolarHBondContact O-N 3.33Å; F1380-L1383 PolarHBondContact O-N 3.46Å; F1380-L1384 WeakPolarHBondContact O-CB 3.38Å; F1380-L1384 PolarHBondContact O-N 3.25Å
1381	M	88.2	Confident	85.1	Confident	30 Å²	30	45.1 Å²	45.1	15%	0.148	26%	0.255	C	S	.	.	H	α-helix	trans	-60.4	-42.7	173	-168.2	69.3	144.7	0	0	111.1	V1071 F1072 V1075 L1377 S1378 L1384 L1385	V1071-M1381 HydrophobicContact CG1-CE 4Å; F1072-M1381 HydrophobicContact CD2-CB 4.19Å; F1072-M1381 HydrophobicContact CD2-SD 3.78Å; F1072-M1381 HydrophobicContact CE2-CB 4.47Å; F1072-M1381 HydrophobicContact CE2-SD 4.48Å; V1075-M1381 HydrophobicContact CB-CE 3.8Å; V1075-M1381 HydrophobicContact CB-SD 4.09Å; V1075-M1381 HydrophobicContact CG1-CE 4.04Å; V1075-M1381 HydrophobicContact CG1-SD 3.89Å; V1075-M1381 HydrophobicContact CG2-CE 3.65Å; L1377-M1381 WeakPolarHBondContact O-CB 3.13Å; L1377-M1381 PolarHBondContact O-N 3.41Å; S1378-M1381 PolarHBondContact O-N 2.76Å; M1381-L1384 PolarHBondContact O-N 3.48Å; M1381-L1385 HydrophobicContact CG-CD1 4Å; M1381-L1385 WeakPolarHBondContact O-CB 3.38Å; M1381-L1385 VanDerWaalsContact O-CG 3.23Å; M1381-L1385 WeakPolarHBondContact O-CG 3.44Å; M1381-L1385 PolarHBondContact O-N 2.91Å
1382	T	90	Very high	85.9	Confident	82 Å²	82	47.4 Å²	47.4	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-64.3	-46.1	177.2	-60.9	0	0	0	0	111.4	S1378 F1379 F1380 L1385 L1386	S1378-T1382 VanDerWaalsContact O-CB 3.26Å; S1378-T1382 WeakPolarHBondContact O-CB 3.22Å; S1378-T1382 PolarHBondContact O-N 2.71Å; S1378-T1382 PolarHBondContact O-OG1 2.93Å; F1379-T1382 PolarHBondContact O-N 3.48Å; F1380-T1382 VanDerWaalsContact C-N 3.32Å; F1380-T1382 PolarHBondContact O-N 3.33Å; T1382-L1385 PolarHBondContact O-N 3.3Å; T1382-L1386 WeakPolarHBondContact O-CB 3.32Å; T1382-L1386 PolarHBondContact O-N 3.47Å
1383	L	89.6	Confident	86.6	Confident	17 Å²	17	49 Å²	49	9%	0.089	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-45.1	175.1	-72.9	176.9	0	0	0	111.7	Y977 A980 F1379 F1380 L1386 Q1387	Y977-L1383 HydrophobicContact CD2-CD2 4.03Å; Y977-L1383 HydrophobicContact CE2-CD2 4.06Å; A980-L1383 HydrophobicContact CB-CD2 4.33Å; F1379-L1383 HydrophobicContact CD1-CD1 4.15Å; F1379-L1383 HydrophobicContact CE1-CD1 3.59Å; F1379-L1383 HydrophobicContact CE2-CD1 4.29Å; F1379-L1383 HydrophobicContact CZ-CD1 3.69Å; F1379-L1383 HydrophobicContact CZ-CG 4.49Å; F1379-L1383 WeakPolarHBondContact O-CG 3.32Å; F1379-L1383 PolarHBondContact O-N 2.95Å; F1380-L1383 PolarHBondContact O-N 3.46Å; L1383-L1386 PolarHBondContact O-N 3.19Å; L1383-Q1387 WeakPolarHBondContact O-CB 3.26Å; L1383-Q1387 VanDerWaalsContact O-CG 3.25Å; L1383-Q1387 WeakPolarHBondContact O-CG 3.19Å; L1383-Q1387 PolarHBondContact O-N 3.03Å
1384	L	89.9	Confident	87.4	Confident	19 Å²	19	47.9 Å²	47.9	10%	0.099	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-45.7	178.8	180	64.7	0	0	0	112.1	F852 V1075 V1076 F1080 F1380 M1381 Q1387 F1388	F852-L1384 HydrophobicContact CE1-CD1 4.29Å; V1075-L1384 HydrophobicContact CG1-CD2 4.16Å; V1076-L1384 HydrophobicContact CB-CD2 4.42Å; V1076-L1384 HydrophobicContact CG2-CD2 3.63Å; F1080-L1384 HydrophobicContact CE1-CD1 4.42Å; F1380-L1384 WeakPolarHBondContact O-CB 3.38Å; F1380-L1384 PolarHBondContact O-N 3.25Å; M1381-L1384 PolarHBondContact O-N 3.48Å; L1384-Q1387 PolarHBondContact O-N 2.71Å; L1384-F1388 VanDerWaalsContact O-CB 3.26Å; L1384-F1388 WeakPolarHBondContact O-CB 3.48Å; L1384-F1388 PolarHBondContact O-N 3.05Å
1385	L	91.2	Very high	87.8	Confident	85 Å²	85	48 Å²	48	45%	0.445	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-39.8	177.3	-71.9	171.3	0	0	0	111.8	V1075 M1381 T1382 F1388 A1389	V1075-L1385 HydrophobicContact CG1-CD2 4.21Å; M1381-L1385 HydrophobicContact CG-CD1 4Å; M1381-L1385 WeakPolarHBondContact O-CB 3.38Å; M1381-L1385 VanDerWaalsContact O-CG 3.23Å; M1381-L1385 WeakPolarHBondContact O-CG 3.44Å; M1381-L1385 PolarHBondContact O-N 2.91Å; T1382-L1385 PolarHBondContact O-N 3.3Å; L1385-F1388 PolarHBondContact O-N 2.93Å; L1385-A1389 WeakPolarHBondContact O-CB 3.49Å; L1385-A1389 PolarHBondContact O-N 3.45Å
1386	L	90.3	Very high	88	Confident	62 Å²	62	48.5 Å²	48.5	33%	0.325	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-44.9	173.8	-168.8	77.6	0	0	0	111.2	F860 Y977 T1382 L1383 A1390	F860-L1386 HydrophobicContact CE1-CD1 4.1Å; F860-L1386 HydrophobicContact CE2-CD1 3.94Å; F860-L1386 HydrophobicContact CE2-CD2 4.22Å; F860-L1386 HydrophobicContact CE2-CG 3.69Å; F860-L1386 HydrophobicContact CZ-CD1 3.37Å; F860-L1386 HydrophobicContact CZ-CD2 4.36Å; F860-L1386 HydrophobicContact CZ-CG 3.69Å; Y977-L1386 HydrophobicContact CD2-CD2 3.83Å; Y977-L1386 HydrophobicContact CE2-CD2 4.27Å; T1382-L1386 WeakPolarHBondContact O-CB 3.32Å; T1382-L1386 PolarHBondContact O-N 3.47Å; L1383-L1386 PolarHBondContact O-N 3.19Å; L1386-A1390 WeakPolarHBondContact O-CB 3.46Å; L1386-A1390 PolarHBondContact O-N 2.91Å; L1386-A1390 VanDerWaalsContact O-N 3.07Å
1387	Q	92.5	Very high	88.2	Confident	27 Å²	27	48.8 Å²	48.8	13%	0.126	26%	0.258	C	S	.	.	H	α-helix	trans	-68.8	-39.5	177.5	-71.2	177.4	-3.8	0	0	112.6	F852 T856 Y977 L1383 L1384 A1390 M1391	F852-Q1387 HydrophobicContact CB-CB 4.28Å; F852-Q1387 HydrophobicContact CD1-CB 3.98Å; T856-Q1387 HydrophobicContact CG2-CG 3.93Å; T856-Q1387 VanDerWaalsContact OG1-CA 3.23Å; T856-Q1387 WeakPolarHBondContact OG1-CA 3.39Å; T856-Q1387 WeakPolarHBondContact OG1-CB 3.48Å; T856-Q1387 WeakPolarHBondContact OG1-CG 3.38Å; Y977-Q1387 HydrophobicContact CE2-CG 4.49Å; Y977-Q1387 PolarHBondContact OH-NE2 2.97Å; L1383-Q1387 WeakPolarHBondContact O-CB 3.26Å; L1383-Q1387 VanDerWaalsContact O-CG 3.25Å; L1383-Q1387 WeakPolarHBondContact O-CG 3.19Å; L1383-Q1387 PolarHBondContact O-N 3.03Å; L1384-Q1387 PolarHBondContact O-N 2.71Å; Q1387-A1390 PolarHBondContact O-N 3.07Å; Q1387-M1391 WeakPolarHBondContact O-CB 3.4Å; Q1387-M1391 PolarHBondContact O-N 2.91Å
1388	F	92.7	Very high	88.1	Confident	40 Å²	40	48 Å²	48	18%	0.175	26%	0.255	C	S	.	.	H	α-helix	trans	-66.9	-44.5	178	-178.2	-113.2	0	0	0	111.9	F852 I1082 L1384 L1385 A1390 M1391 I1392	F852-F1388 HydrophobicContact CE1-CB 4.12Å; F852-F1388 HydrophobicContact CE1-CD2 4.02Å; F852-F1388 HydrophobicContact CZ-CD2 4.4Å; I1082-F1388 HydrophobicContact CB-CE2 4.03Å; I1082-F1388 HydrophobicContact CB-CZ 4.07Å; I1082-F1388 HydrophobicContact CD1-CZ 4.02Å; I1082-F1388 HydrophobicContact CG2-CE2 3.94Å; I1082-F1388 HydrophobicContact CG2-CZ 3.82Å; L1384-F1388 VanDerWaalsContact O-CB 3.26Å; L1384-F1388 WeakPolarHBondContact O-CB 3.48Å; L1384-F1388 PolarHBondContact O-N 3.05Å; L1385-F1388 PolarHBondContact O-N 2.93Å; F1388-A1390 VanDerWaalsContact C-N 3.33Å; F1388-A1390 PolarHBondContact O-N 3.17Å; F1388-M1391 HydrophobicContact CD2-CE 3.46Å; F1388-M1391 VanDerWaalsContact CD2-CE 3.46Å; F1388-M1391 HydrophobicContact CE2-CE 3.49Å; F1388-M1391 VanDerWaalsContact CE2-CE 3.49Å; F1388-M1391 HydrophobicContact CG-CE 4.48Å; F1388-M1391 WeakPolarHBondContact O-CB 3.18Å; F1388-M1391 PolarHBondContact O-N 3.26Å; F1388-I1392 HydrophobicContact CD1-CD1 4.12Å; F1388-I1392 HydrophobicContact CE1-CD1 3.74Å; F1388-I1392 HydrophobicContact CE2-CD1 4.45Å; F1388-I1392 HydrophobicContact CZ-CD1 3.93Å; F1388-I1392 WeakPolarHBondContact O-CG1 3.45Å; F1388-I1392 PolarHBondContact O-N 3.43Å
1389	A	91	Very high	88	Confident	50 Å²	50	47.9 Å²	47.9	41%	0.413	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-41.7	173.4	0	0	0	0	0	111.6	L1385 I1392 L1393	L1385-A1389 WeakPolarHBondContact O-CB 3.49Å; L1385-A1389 PolarHBondContact O-N 3.45Å; A1389-I1392 PolarHBondContact O-N 2.9Å; A1389-L1393 WeakPolarHBondContact O-CG 3.36Å; A1389-L1393 PolarHBondContact O-N 3.08Å; A1389-L1393 VanDerWaalsContact O-N 3.1Å
1390	A	90.2	Very high	87.7	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-66.4	-38.8	174.6	0	0	0	0	0	112.9	T856 M859 F860 L1386 Q1387 F1388 I1392 L1393 H1394	T856-A1390 HydrophobicContact CG2-CB 4.24Å; M859-A1390 HydrophobicContact CB-CB 4.13Å; M859-A1390 HydrophobicContact CG-CB 4.38Å; F860-A1390 HydrophobicContact CD2-CB 4.36Å; F860-A1390 HydrophobicContact CE2-CB 3.84Å; L1386-A1390 WeakPolarHBondContact O-CB 3.46Å; L1386-A1390 PolarHBondContact O-N 2.91Å; L1386-A1390 VanDerWaalsContact O-N 3.07Å; Q1387-A1390 PolarHBondContact O-N 3.07Å; F1388-A1390 VanDerWaalsContact C-N 3.33Å; F1388-A1390 PolarHBondContact O-N 3.17Å; A1390-I1392 VanDerWaalsContact C-N 3.34Å; A1390-I1392 PolarHBondContact O-N 3.17Å; A1390-L1393 PolarHBondContact O-N 3.26Å; A1390-H1394 WeakPolarHBondContact O-CB 3.41Å; A1390-H1394 PolarHBondContact O-N 3.29Å
1391	M	91.9	Very high	87.3	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-57.7	-45.3	173.3	179.5	-80.1	-64.1	0	0	111.1	W851 A1083 L1086 Q1387 F1388 H1394 R1395	W851-M1391 HydrophobicContact CB-CG 4.44Å; W851-M1391 VanDerWaalsContact O-CB 3.25Å; W851-M1391 WeakPolarHBondContact O-CB 3.34Å; W851-M1391 WeakPolarHBondContact O-CG 3.34Å; A1083-M1391 HydrophobicContact CB-CE 3.86Å; A1083-M1391 HydrophobicContact CB-SD 4.38Å; L1086-M1391 HydrophobicContact CD1-CE 3.94Å; L1086-M1391 HydrophobicContact CD1-SD 3.78Å; Q1387-M1391 WeakPolarHBondContact O-CB 3.4Å; Q1387-M1391 PolarHBondContact O-N 2.91Å; F1388-M1391 HydrophobicContact CD2-CE 3.46Å; F1388-M1391 VanDerWaalsContact CD2-CE 3.46Å; F1388-M1391 HydrophobicContact CE2-CE 3.49Å; F1388-M1391 VanDerWaalsContact CE2-CE 3.49Å; F1388-M1391 HydrophobicContact CG-CE 4.48Å; F1388-M1391 WeakPolarHBondContact O-CB 3.18Å; F1388-M1391 PolarHBondContact O-N 3.26Å; M1391-H1394 PolarHBondContact O-N 2.84Å; M1391-R1395 VanDerWaalsContact O-CB 3.26Å; M1391-R1395 WeakPolarHBondContact O-CB 3.45Å; M1391-R1395 PolarHBondContact O-N 3.44Å
1392	I	90.3	Very high	86.7	Confident	75 Å²	75	43.6 Å²	43.6	39%	0.385	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-47.2	176.7	-65.9	170.9	0	0	0	111.2	L1086 F1388 A1389 A1390 H1394 R1395 F1396	L1086-I1392 HydrophobicContact CD1-CG1 4.39Å; F1388-I1392 HydrophobicContact CD1-CD1 4.12Å; F1388-I1392 HydrophobicContact CE1-CD1 3.74Å; F1388-I1392 HydrophobicContact CE2-CD1 4.45Å; F1388-I1392 HydrophobicContact CZ-CD1 3.93Å; F1388-I1392 WeakPolarHBondContact O-CG1 3.45Å; F1388-I1392 PolarHBondContact O-N 3.43Å; A1389-I1392 PolarHBondContact O-N 2.9Å; A1390-I1392 VanDerWaalsContact C-N 3.34Å; A1390-I1392 PolarHBondContact O-N 3.17Å; I1392-H1394 PolarHBondContact O-N 2.93Å; I1392-R1395 PolarHBondContact O-N 3.46Å; I1392-F1396 WeakPolarHBondContact O-CB 3.1Å; I1392-F1396 PolarHBondContact O-N 2.95Å
1393	L	87.5	Confident	86.4	Confident	107 Å²	107	39.9 Å²	39.9	56%	0.56	21%	0.209	S	C	*	.	H	α-helix	trans	-64.7	-38.1	178.4	-68.6	171.8	0	0	0	112.6	M859 A1389 A1390 T1397	M859-L1393 HydrophobicContact CG-CB 4.49Å; M859-L1393 HydrophobicContact SD-CB 4.32Å; A1389-L1393 WeakPolarHBondContact O-CG 3.36Å; A1389-L1393 PolarHBondContact O-N 3.08Å; A1389-L1393 VanDerWaalsContact O-N 3.1Å; A1390-L1393 PolarHBondContact O-N 3.26Å; L1393-T1397 WeakPolarHBondContact O-CB 3.18Å; L1393-T1397 PolarHBondContact O-N 3.34Å; L1393-T1397 PolarHBondContact O-OG1 3.44Å
1394	H	87.5	Confident	85.8	Confident	6 Å²	6	39.3 Å²	39.3	3%	0.028	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-42.1	174.1	-174.7	-113.9	0	0	0	111.3	A855 H858 M859 Y921 A1390 M1391 I1392 T1397 T1398	A855-H1394 HydrophobicContact CB-CB 3.76Å; A855-H1394 WeakPolarHBondContact CB-ND1 3.41Å; H858-H1394 AromaticContact CE1-NE2 3.86Å; H858-H1394 AromaticContact ND1-CD2 3.25Å; H858-H1394 PolarHBondContact ND1-CD2 2.86Å; H858-H1394 VanDerWaalsContact ND1-CD2 3.25Å; H858-H1394 AromaticContact ND1-NE2 3Å; H858-H1394 PolarHBondContact ND1-NE2 3.24Å; M859-H1394 HydrophobicContact CG-CB 3.81Å; M859-H1394 HydrophobicContact SD-CB 4.08Å; Y921-H1394 AromaticContact CD1-CE1 3.58Å; Y921-H1394 AromaticContact CD1-NE2 3.87Å; Y921-H1394 AromaticContact CE1-CE1 3.65Å; A1390-H1394 WeakPolarHBondContact O-CB 3.41Å; A1390-H1394 PolarHBondContact O-N 3.29Å; M1391-H1394 PolarHBondContact O-N 2.84Å; I1392-H1394 PolarHBondContact O-N 2.93Å; H1394-T1397 WeakPolarHBondContact O-CB 3.44Å; H1394-T1397 PolarHBondContact O-N 2.68Å; H1394-T1398 WeakPolarHBondContact O-CB 3.41Å; H1394-T1398 PolarHBondContact O-N 2.88Å; H1394-T1398 PolarHBondContact O-OG1 3.46Å
1395	R	87.3	Confident	85.1	Confident	41 Å²	41	40.1 Å²	40.1	16%	0.155	21%	0.214	C	C	.	.	H	α-helix	trans	-67	-41.2	178	-166.6	67.1	176.7	159	5.7	111.6	L1086 H1087 M1391 I1392 T1397 T1398 L1399	L1086-R1395 HydrophobicContact CB-CG 4.25Å; L1086-R1395 PolarHBondContact O-NE 3.24Å; L1086-R1395 PolarHBondContact O-NH2 3.44Å; H1087-R1395 VanDerWaalsContact CD2-CZ 3.46Å; H1087-R1395 PolarHBondContact CD2-NH1 2.91Å; H1087-R1395 WeakPolarHBondContact NE2-CD 3.19Å; H1087-R1395 PolarHBondContact NE2-NH1 2.85Å; M1391-R1395 VanDerWaalsContact O-CB 3.26Å; M1391-R1395 WeakPolarHBondContact O-CB 3.45Å; M1391-R1395 PolarHBondContact O-N 3.44Å; I1392-R1395 PolarHBondContact O-N 3.46Å; R1395-T1397 VanDerWaalsContact C-N 3.29Å; R1395-T1397 PolarHBondContact O-N 2.85Å; R1395-T1398 PolarHBondContact O-N 3.42Å; R1395-L1399 VanDerWaalsContact O-CB 3.31Å; R1395-L1399 WeakPolarHBondContact O-CB 3.44Å; R1395-L1399 PolarHBondContact O-N 2.91Å
1396	F	83.5	Confident	84.4	Confident	114 Å²	114	37.2 Å²	37.2	50%	0.5	20%	0.2	S	C	.	.	H	α-helix	trans	-61.7	-37.6	172.3	-173.5	-100.9	0	0	0	112.2	F449 I1392 A1400	F449-F1396 AromaticContact CD2-CE1 3.61Å; F449-F1396 HydrophobicContact CD2-CE1 3.61Å; F449-F1396 HydrophobicContact CD2-CE2 4.23Å; F449-F1396 AromaticContact CD2-CZ 3.31Å; F449-F1396 HydrophobicContact CD2-CZ 3.31Å; F449-F1396 AromaticContact CE2-CE1 3.74Å; F449-F1396 HydrophobicContact CE2-CE1 3.74Å; F449-F1396 AromaticContact CE2-CE2 3.84Å; F449-F1396 HydrophobicContact CE2-CE2 3.84Å; F449-F1396 AromaticContact CE2-CZ 3.35Å; F449-F1396 HydrophobicContact CE2-CZ 3.35Å; F449-F1396 HydrophobicContact CG-CZ 4.36Å; F449-F1396 HydrophobicContact CZ-CZ 4.42Å; I1392-F1396 WeakPolarHBondContact O-CB 3.1Å; I1392-F1396 PolarHBondContact O-N 2.95Å; F1396-A1400 WeakPolarHBondContact O-CB 3.22Å; F1396-A1400 PolarHBondContact O-N 3.1Å
1397	T	80.3	Confident	83.4	Confident	58 Å²	58	40.2 Å²	40.2	36%	0.356	22%	0.216	S	C	.	.	H	α-helix	trans	-67.9	-37.8	174.1	-58.7	0	0	0	0	112.1	L1393 H1394 R1395 A1400 H1401	L1393-T1397 WeakPolarHBondContact O-CB 3.18Å; L1393-T1397 PolarHBondContact O-N 3.34Å; L1393-T1397 PolarHBondContact O-OG1 3.44Å; H1394-T1397 WeakPolarHBondContact O-CB 3.44Å; H1394-T1397 PolarHBondContact O-N 2.68Å; R1395-T1397 VanDerWaalsContact C-N 3.29Å; R1395-T1397 PolarHBondContact O-N 2.85Å; T1397-A1400 PolarHBondContact O-N 3.5Å; T1397-H1401 PolarHBondContact O-N 3.38Å; T1397-H1401 VanDerWaalsContact O-N 3.08Å
1398	T	79	Confident	82.3	Confident	9 Å²	9	39.8 Å²	39.8	6%	0.055	22%	0.215	C	C	.	.	H	α-helix	trans	-68.9	-42.6	175.5	-55	0	0	0	0	111.4	A923 A924 H1394 R1395 A1400 H1401 I1402	A923-T1398 HydrophobicContact CB-CG2 4.07Å; A924-T1398 HydrophobicContact CB-CG2 4.35Å; H1394-T1398 WeakPolarHBondContact O-CB 3.41Å; H1394-T1398 PolarHBondContact O-N 2.88Å; H1394-T1398 PolarHBondContact O-OG1 3.46Å; R1395-T1398 PolarHBondContact O-N 3.42Å; T1398-A1400 VanDerWaalsContact C-N 3.32Å; T1398-A1400 PolarHBondContact O-N 2.89Å; T1398-H1401 WeakPolarHBondContact O-CA 3.45Å; T1398-H1401 VanDerWaalsContact O-CB 3.3Å; T1398-H1401 WeakPolarHBondContact O-CB 3.3Å; T1398-H1401 PolarHBondContact O-N 3.05Å; T1398-I1402 HydrophobicContact CG2-CD1 4.12Å; T1398-I1402 WeakPolarHBondContact O-CG1 3.29Å; T1398-I1402 PolarHBondContact O-N 2.88Å
1399	L	82.2	Confident	80.7	Confident	61 Å²	61	46 Å²	46	32%	0.319	24%	0.237	S	C	.	.	H	α-helix	trans	-57.8	-44.9	172.8	-173.4	74.4	0	0	0	110.7	L55 R1395 H1401 I1402 L1403	L55-L1399 HydrophobicContact CD1-CD1 4.5Å; L55-L1399 HydrophobicContact CD2-CD1 3.91Å; R1395-L1399 VanDerWaalsContact O-CB 3.31Å; R1395-L1399 WeakPolarHBondContact O-CB 3.44Å; R1395-L1399 PolarHBondContact O-N 2.91Å; L1399-H1401 VanDerWaalsContact C-N 3.28Å; L1399-H1401 PolarHBondContact O-N 3.44Å; L1399-I1402 PolarHBondContact O-N 3.47Å; L1399-L1403 HydrophobicContact CD2-CD1 4.49Å; L1399-L1403 HydrophobicContact CG-CD1 3.99Å; L1399-L1403 VanDerWaalsContact O-CB 3.31Å; L1399-L1403 WeakPolarHBondContact O-CB 3.3Å; L1399-L1403 VanDerWaalsContact O-CG 3.27Å; L1399-L1403 WeakPolarHBondContact O-CG 3.38Å; L1399-L1403 PolarHBondContact O-N 3.38Å
1400	A	80.7	Confident	78.8	Confident	6 Å²	6	47.1 Å²	47.1	5%	0.05	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-33.8	173.8	0	0	0	0	0	112.6	F449 T453 L542 F1396 T1397 T1398 A1404	F449-A1400 HydrophobicContact CE2-CB 3.83Å; F449-A1400 HydrophobicContact CZ-CB 4.27Å; T453-A1400 HydrophobicContact CG2-CB 4.23Å; L542-A1400 HydrophobicContact CD2-CB 3.92Å; F1396-A1400 WeakPolarHBondContact O-CB 3.22Å; F1396-A1400 PolarHBondContact O-N 3.1Å; T1397-A1400 PolarHBondContact O-N 3.5Å; T1398-A1400 VanDerWaalsContact C-N 3.32Å; T1398-A1400 PolarHBondContact O-N 2.89Å; A1400-A1404 VanDerWaalsContact O-CB 3.26Å; A1400-A1404 WeakPolarHBondContact O-CB 3.47Å; A1400-A1404 PolarHBondContact O-N 3.43Å
1401	H	76.8	Confident	76.9	Confident	15 Å²	15	50.2 Å²	50.2	7%	0.069	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-50.5	175.4	-165.5	-168.8	0	0	0	111.4	L542 T1397 T1398 L1399 L1403 A1404 S1405	L542-H1401 HydrophobicContact CD1-CB 3.7Å; T1397-H1401 PolarHBondContact O-N 3.38Å; T1397-H1401 VanDerWaalsContact O-N 3.08Å; T1398-H1401 WeakPolarHBondContact O-CA 3.45Å; T1398-H1401 VanDerWaalsContact O-CB 3.3Å; T1398-H1401 WeakPolarHBondContact O-CB 3.3Å; T1398-H1401 PolarHBondContact O-N 3.05Å; L1399-H1401 VanDerWaalsContact C-N 3.28Å; L1399-H1401 PolarHBondContact O-N 3.44Å; H1401-L1403 VanDerWaalsContact C-N 3.31Å; H1401-L1403 PolarHBondContact O-N 3.45Å; H1401-A1404 WeakPolarHBondContact O-CA 3.45Å; H1401-A1404 WeakPolarHBondContact O-CB 3.46Å; H1401-A1404 PolarHBondContact O-N 3.25Å; H1401-S1405 PolarHBondContact O-N 3.49Å; H1401-S1405 PolarHBondContact O-OG 3.47Å
1402	I	77.2	Confident	74.7	Confident	39 Å²	39	54.4 Å²	54.4	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-41.2	178	-66.8	167.6	0	0	0	110.6	L52 A924 T1398 L1399 A1404 S1405 T1406	L52-I1402 HydrophobicContact CD2-CG2 3.28Å; A924-I1402 HydrophobicContact CB-CG1 4.17Å; T1398-I1402 HydrophobicContact CG2-CD1 4.12Å; T1398-I1402 WeakPolarHBondContact O-CG1 3.29Å; T1398-I1402 PolarHBondContact O-N 2.88Å; L1399-I1402 PolarHBondContact O-N 3.47Å; I1402-A1404 VanDerWaalsContact C-N 3.29Å; I1402-A1404 PolarHBondContact O-N 3.03Å; I1402-S1405 PolarHBondContact O-N 3.18Å; I1402-S1405 PolarHBondContact O-OG 3.47Å; I1402-T1406 HydrophobicContact CG2-CG2 4.32Å; I1402-T1406 WeakPolarHBondContact O-CB 3.4Å; I1402-T1406 VanDerWaalsContact O-CG2 3.26Å; I1402-T1406 WeakPolarHBondContact O-CG2 3.33Å; I1402-T1406 PolarHBondContact O-N 2.69Å; I1402-T1406 PolarHBondContact O-OG1 3.36Å
1403	L	82.3	Confident	72.3	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-69.5	-19.9	173.6	-72.8	171.1	0	0	0	113.9	L55 K56 A59 F449 T453 M455 L1399 H1401	L55-L1403 HydrophobicContact CG-CD2 4.36Å; K56-L1403 HydrophobicContact CB-CD2 3.72Å; K56-L1403 HydrophobicContact CD-CD2 4.46Å; K56-L1403 WeakPolarHBondContact CE-O 3.46Å; K56-L1403 HydrophobicContact CG-CD2 4.09Å; K56-L1403 PolarHBondContact NZ-O 3.21Å; A59-L1403 HydrophobicContact CB-CD1 4.33Å; A59-L1403 HydrophobicContact CB-CD2 4.33Å; F449-L1403 HydrophobicContact CE1-CD1 4.15Å; F449-L1403 HydrophobicContact CZ-CD1 3.79Å; T453-L1403 HydrophobicContact CG2-CB 4.03Å; M455-L1403 HydrophobicContact CE-CB 4.39Å; M455-L1403 HydrophobicContact CE-CD2 4.08Å; L1399-L1403 HydrophobicContact CD2-CD1 4.49Å; L1399-L1403 HydrophobicContact CG-CD1 3.99Å; L1399-L1403 VanDerWaalsContact O-CB 3.31Å; L1399-L1403 WeakPolarHBondContact O-CB 3.3Å; L1399-L1403 VanDerWaalsContact O-CG 3.27Å; L1399-L1403 WeakPolarHBondContact O-CG 3.38Å; L1399-L1403 PolarHBondContact O-N 3.38Å; H1401-L1403 VanDerWaalsContact C-N 3.31Å; H1401-L1403 PolarHBondContact O-N 3.45Å
1404	A	77.1	Confident	70.1	Confident	6 Å²	6	52.4 Å²	52.4	5%	0.05	29%	0.291	C	S	.	.	H	α-helix	trans	-90.1	-23.9	175.9	0	0	0	0	0	113.6	R541 L542 A1400 H1401 I1402	R541-A1404 HydrophobicContact CB-CB 4.39Å; L542-A1404 HydrophobicContact CD2-CB 4.31Å; L542-A1404 HydrophobicContact CG-CB 4.29Å; A1400-A1404 VanDerWaalsContact O-CB 3.26Å; A1400-A1404 WeakPolarHBondContact O-CB 3.47Å; A1400-A1404 PolarHBondContact O-N 3.43Å; H1401-A1404 WeakPolarHBondContact O-CA 3.45Å; H1401-A1404 WeakPolarHBondContact O-CB 3.46Å; H1401-A1404 PolarHBondContact O-N 3.25Å; I1402-A1404 VanDerWaalsContact C-N 3.29Å; I1402-A1404 PolarHBondContact O-N 3.03Å
1405	S	75.1	Confident	67.7	Low	36 Å²	36	55 Å²	55	25%	0.252	31%	0.305	S	S	.	.	H	α-helix	trans	-92.2	-36.4	178.1	58.8	0	0	0	0	113.4	H1401 I1402	H1401-S1405 PolarHBondContact O-N 3.49Å; H1401-S1405 PolarHBondContact O-OG 3.47Å; I1402-S1405 PolarHBondContact O-N 3.18Å; I1402-S1405 PolarHBondContact O-OG 3.47Å
1406	T	76.2	Confident	65.4	Low	23 Å²	23	61.7 Å²	61.7	14%	0.141	34%	0.338	C	S	.	.			trans	-61.9	139.6	176.1	45.9	0	0	0	0	112.8	L52 K56 I1402	L52-T1406 HydrophobicContact CB-CG2 4.16Å; L52-T1406 HydrophobicContact CD1-CG2 4.24Å; L52-T1406 HydrophobicContact CD2-CG2 4.29Å; L52-T1406 HydrophobicContact CG-CG2 4.49Å; K56-T1406 VanDerWaalsContact CD-OG1 3.3Å; K56-T1406 WeakPolarHBondContact CD-OG1 3.35Å; K56-T1406 PolarHBondContact NZ-O 3.05Å; I1402-T1406 HydrophobicContact CG2-CG2 4.32Å; I1402-T1406 WeakPolarHBondContact O-CB 3.4Å; I1402-T1406 VanDerWaalsContact O-CG2 3.26Å; I1402-T1406 WeakPolarHBondContact O-CG2 3.33Å; I1402-T1406 PolarHBondContact O-N 2.69Å; I1402-T1406 PolarHBondContact O-OG1 3.36Å
1407	N	70.8	Confident	63.5	Low	125 Å²	125	66.5 Å²	66.5	67%	0.668	36%	0.359	S	S	*	.			trans	-111.3	140.1	175.1	-69.4	-50.9	0	0	0	110.1
1408	L	69.6	Low	61.8	Low	19 Å²	19	65.4 Å²	65.4	10%	0.099	35%	0.352	C	S	.	.			trans	-86	138.4	179.9	-76.8	-178.3	0	0	0	112.2	Q53 K56 L57 Y60 C1410 S1411	Q53-L1408 HydrophobicContact CB-CD2 4.42Å; K56-L1408 HydrophobicContact CB-CD2 3.92Å; K56-L1408 HydrophobicContact CD-CD2 4.43Å; K56-L1408 HydrophobicContact CD-CG 4.22Å; K56-L1408 HydrophobicContact CG-CD1 4.34Å; K56-L1408 HydrophobicContact CG-CD2 3.9Å; K56-L1408 HydrophobicContact CG-CG 3.97Å; L57-L1408 HydrophobicContact CB-CD2 4.26Å; L57-L1408 HydrophobicContact CD1-CD1 4.43Å; L57-L1408 HydrophobicContact CD1-CD2 4.49Å; Y60-L1408 HydrophobicContact CD2-CD1 3.62Å; Y60-L1408 HydrophobicContact CE2-CD1 3.46Å; Y60-L1408 VanDerWaalsContact CE2-CD1 3.46Å; Y60-L1408 HydrophobicContact CE2-CG 4.35Å; L1408-C1410 PolarHBondContact O-N 2.86Å; L1408-S1411 PolarHBondContact O-N 2.84Å
1409	W	58.2	Low	60.5	Low	171 Å²	171	67.8 Å²	67.8	65%	0.648	37%	0.369	S	S	*	.	H	α-helix	trans	-58.8	-35.9	171.9	-128	-51.8	0	0	0	112.8	S1411 K1412 A1413	W1409-S1411 PolarHBondContact O-N 2.8Å; W1409-K1412 CarbonylContact O-C 3.46Å; W1409-K1412 WeakPolarHBondContact O-CA 3.48Å; W1409-K1412 WeakPolarHBondContact O-CB 3.42Å; W1409-K1412 PolarHBondContact O-N 3.02Å; W1409-A1413 PolarHBondContact O-N 2.85Å; W1409-A1413 VanDerWaalsContact O-N 3.07Å
1410	C	52	Low	59.4	Low	73 Å²	73	69.2 Å²	69.2	49%	0.493	37%	0.374	S	S	.	.	H	α-helix	trans	-61.6	-28	179.7	-55.3	0	0	0	0	112.9	L1408 K1412 A1413 A1414	L1408-C1410 PolarHBondContact O-N 2.86Å; C1410-K1412 VanDerWaalsContact C-N 3.3Å; C1410-A1413 PolarHBondContact O-N 3.33Å; C1410-A1413 VanDerWaalsContact O-N 3.08Å; C1410-A1414 PolarHBondContact O-N 2.83Å
1411	S	50	Low	58.5	Low	66 Å²	66	73.4 Å²	73.4	46%	0.462	39%	0.392	S	S	.	.	H	α-helix	trans	-73.3	-20.3	172.2	-58	0	0	0	0	113.2	L1408 W1409 N1415	L1408-S1411 PolarHBondContact O-N 2.84Å; W1409-S1411 PolarHBondContact O-N 2.8Å; S1411-N1415 PolarHBondContact O-ND2 2.95Å
1412	K	44.6	Very low	57.7	Low	88 Å²	88	77.5 Å²	77.5	38%	0.383	41%	0.411	S	S	.	.	H	α-helix	trans	-83.7	-17.1	165	-58.7	-168.5	-177.5	-171.1	0	112.4	W1409 C1410 M1426 N1427	W1409-K1412 CarbonylContact O-C 3.46Å; W1409-K1412 WeakPolarHBondContact O-CA 3.48Å; W1409-K1412 WeakPolarHBondContact O-CB 3.42Å; W1409-K1412 PolarHBondContact O-N 3.02Å; C1410-K1412 VanDerWaalsContact C-N 3.3Å; K1412-M1426 HydrophobicContact CG-CE 4.23Å; K1412-N1427 PolarHBondContact NZ-OD1 2.78Å
1413	A	39.9	Very low	56.8	Low	51 Å²	51	78.7 Å²	78.7	42%	0.421	42%	0.42	S	S	.	.	H	α-helix	trans	-94.4	-39.5	-175.4	0	0	0	0	0	114.5	W1409 C1410 N1415 Q1416	W1409-A1413 PolarHBondContact O-N 2.85Å; W1409-A1413 VanDerWaalsContact O-N 3.07Å; C1410-A1413 PolarHBondContact O-N 3.33Å; C1410-A1413 VanDerWaalsContact O-N 3.08Å; A1413-N1415 PolarHBondContact O-N 2.8Å; A1413-N1415 VanDerWaalsContact O-N 3.14Å; A1413-Q1416 WeakPolarHBondContact O-CG 3.24Å; A1413-Q1416 PolarHBondContact O-N 3.45Å
1414	A	41.5	Very low	56	Low	89 Å²	89	78.5 Å²	78.5	74%	0.736	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-60.1	-22.3	170	0	0	0	0	0	111.9	C1410 Q1416	C1410-A1414 PolarHBondContact O-N 2.83Å; A1414-Q1416 PolarHBondContact O-N 3.31Å
1415	N	37.8	Very low	55.5	Low	60 Å²	60	81.8 Å²	81.8	32%	0.321	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-74.1	29.8	172	-74.6	7.4	0	0	0	113.5	S1411 A1413 K1417 V1418	S1411-N1415 PolarHBondContact O-ND2 2.95Å; A1413-N1415 PolarHBondContact O-N 2.8Å; A1413-N1415 VanDerWaalsContact O-N 3.14Å; N1415-K1417 PolarHBondContact O-N 2.82Å; N1415-V1418 HydrophobicContact CB-CB 3.77Å; N1415-V1418 HydrophobicContact CB-CG1 4.5Å; N1415-V1418 HydrophobicContact CB-CG2 3.5Å; N1415-V1418 WeakPolarHBondContact O-CB 3.14Å; N1415-V1418 PolarHBondContact O-N 2.93Å; N1415-V1418 VanDerWaalsContact O-N 3.12Å
1416	Q	39.5	Very low	54.8	Low	182 Å²	182	84.9 Å²	84.9	85%	0.85	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-71.5	-7.6	172.1	-89.2	177.1	-5.2	0	0	114.3	A1413 A1414	A1413-Q1416 WeakPolarHBondContact O-CG 3.24Å; A1413-Q1416 PolarHBondContact O-N 3.45Å; A1414-Q1416 PolarHBondContact O-N 3.31Å
1417	K	42.6	Very low	54.6	Low	215 Å²	215	86 Å²	86	94%	0.935	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-113.6	19.6	165.4	-80.6	-167.5	174.6	-176.5	0	113.6	N1415	N1415-K1417 PolarHBondContact O-N 2.82Å
1418	V	44.6	Very low	54.9	Low	35 Å²	35	80.3 Å²	80.3	21%	0.212	42%	0.423	C	S	.	.	S	Bend	trans	-77.4	143.6	173	146.2	0	0	0	0	110.8	N1415 E1422 V1423	N1415-V1418 HydrophobicContact CB-CB 3.77Å; N1415-V1418 HydrophobicContact CB-CG1 4.5Å; N1415-V1418 HydrophobicContact CB-CG2 3.5Å; N1415-V1418 WeakPolarHBondContact O-CB 3.14Å; N1415-V1418 PolarHBondContact O-N 2.93Å; N1415-V1418 VanDerWaalsContact O-N 3.12Å; V1418-E1422 HydrophobicContact CG1-CB 3.33Å; V1418-E1422 HydrophobicContact CG1-CG 4.42Å; V1418-V1423 HydrophobicContact CG1-CG2 3.97Å
1419	S	51.3	Low	55.2	Low	59 Å²	59	80.9 Å²	80.9	41%	0.413	43%	0.427	S	S	.	.			trans	-55.5	142.4	173.8	177.7	0	0	0	0	110.9	E1421 E1422 V1423	S1419-E1421 PolarHBondContact O-N 3.49Å; S1419-E1421 PolarHBondContact OG-N 2.86Å; S1419-E1422 PolarHBondContact O-N 2.91Å; S1419-V1423 PolarHBondContact O-N 2.91Å
1420	E	59	Low	56.1	Low	91 Å²	91	78.9 Å²	78.9	43%	0.425	43%	0.425	S	S	.	.	H	α-helix	trans	-55.6	-29	176.2	-56.5	-165.2	141.1	0	0	111.6	V1423 V1424 S1519 A1523	E1420-V1423 PolarHBondContact O-N 2.94Å; E1420-V1424 PolarHBondContact O-N 2.82Å; E1420-S1519 WeakPolarHBondContact OE1-CB 3.43Å; E1420-A1523 HydrophobicContact CB-CB 4.1Å
1421	E	62.5	Low	57.3	Low	94 Å²	94	75.7 Å²	75.7	44%	0.439	40%	0.403	S	S	.	.	H	α-helix	trans	-64.6	-35.9	173.9	-59.1	-174.4	113.2	0	0	114.2	S1419 V1424 L1425	S1419-E1421 PolarHBondContact O-N 3.49Å; S1419-E1421 PolarHBondContact OG-N 2.86Å; E1421-V1424 PolarHBondContact O-N 2.89Å; E1421-L1425 PolarHBondContact O-N 2.83Å
1422	E	60.5	Low	58.9	Low	101 Å²	101	72.6 Å²	72.6	47%	0.472	38%	0.382	S	S	.	.	H	α-helix	trans	-75.7	-29.5	-178.5	-112.9	-173.5	142.7	0	0	111	V1418 S1419 L1425 M1426	V1418-E1422 HydrophobicContact CG1-CB 3.33Å; V1418-E1422 HydrophobicContact CG1-CG 4.42Å; S1419-E1422 PolarHBondContact O-N 2.91Å; E1422-L1425 HydrophobicContact CG-CD1 4.49Å; E1422-L1425 WeakPolarHBondContact O-CB 3.49Å; E1422-L1425 PolarHBondContact O-N 3.45Å; E1422-M1426 WeakPolarHBondContact O-CG 3.34Å; E1422-M1426 PolarHBondContact O-N 2.8Å
1423	V	58.2	Low	60.6	Low	64 Å²	64	71.6 Å²	71.6	39%	0.388	38%	0.377	S	S	.	.	H	α-helix	trans	-66.4	-41.2	171	-174.7	0	0	0	0	110.9	V1418 S1419 E1420 L1425 M1426 N1427	V1418-V1423 HydrophobicContact CG1-CG2 3.97Å; S1419-V1423 PolarHBondContact O-N 2.91Å; E1420-V1423 PolarHBondContact O-N 2.94Å; V1423-L1425 VanDerWaalsContact C-N 3.34Å; V1423-M1426 PolarHBondContact O-N 2.83Å; V1423-N1427 PolarHBondContact O-N 3.15Å
1424	V	65.3	Low	62.5	Low	0 Å²	0	72 Å²	72	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-43.5	171.9	173.3	0	0	0	0	110.7	L668 E1420 E1421 A1428 I1431 T1520 A1523 L1524	L668-V1424 HydrophobicContact CD1-CG1 4.38Å; E1420-V1424 PolarHBondContact O-N 2.82Å; E1421-V1424 PolarHBondContact O-N 2.89Å; V1424-A1428 VanDerWaalsContact O-CA 3.23Å; V1424-A1428 WeakPolarHBondContact O-CA 3.37Å; V1424-A1428 WeakPolarHBondContact O-CB 3.28Å; V1424-A1428 PolarHBondContact O-N 2.94Å; V1424-I1431 HydrophobicContact CG1-CD1 4.46Å; V1424-T1520 HydrophobicContact CG2-CG2 3.94Å; V1424-A1523 HydrophobicContact CG2-CB 3.64Å; V1424-L1524 HydrophobicContact CG1-CD2 3.91Å; V1424-L1524 HydrophobicContact CG2-CG 4.48Å
1425	L	66.2	Low	64.4	Low	75 Å²	75	67.9 Å²	67.9	39%	0.393	34%	0.336	S	S	.	.	H	α-helix	trans	-57.9	-46.2	174.5	-101.8	144.8	0	0	0	112.9	V670 E1421 E1422 V1423 N1427	V670-L1425 HydrophobicContact CB-CD2 4.17Å; V670-L1425 HydrophobicContact CG1-CD2 3.61Å; V670-L1425 HydrophobicContact CG2-CD2 3.57Å; V670-L1425 HydrophobicContact CG2-CG 3.82Å; E1421-L1425 PolarHBondContact O-N 2.83Å; E1422-L1425 HydrophobicContact CG-CD1 4.49Å; E1422-L1425 WeakPolarHBondContact O-CB 3.49Å; E1422-L1425 PolarHBondContact O-N 3.45Å; V1423-L1425 VanDerWaalsContact C-N 3.34Å; L1425-N1427 PolarHBondContact O-N 3.36Å
1426	M	61.8	Low	66.6	Low	101 Å²	101	65 Å²	65	50%	0.498	32%	0.32	S	S	.	.	H	α-helix	trans	-69.1	-29.1	-176.8	-75.5	-160.7	78.7	0	0	114.5	K1412 E1422 V1423	K1412-M1426 HydrophobicContact CG-CE 4.23Å; E1422-M1426 WeakPolarHBondContact O-CG 3.34Å; E1422-M1426 PolarHBondContact O-N 2.8Å; V1423-M1426 PolarHBondContact O-N 2.83Å
1427	N	70.5	Confident	68.5	Low	47 Å²	47	57.9 Å²	57.9	25%	0.251	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	11.8	-178.9	-66.1	-4.5	0	0	0	112.6	K1412 V1423 L1425 V1429 E1430 I1431	K1412-N1427 PolarHBondContact NZ-OD1 2.78Å; V1423-N1427 PolarHBondContact O-N 3.15Å; L1425-N1427 PolarHBondContact O-N 3.36Å; N1427-V1429 PolarHBondContact O-N 3.3Å; N1427-V1429 VanDerWaalsContact O-N 3.17Å; N1427-E1430 WeakPolarHBondContact O-CB 3.49Å; N1427-E1430 PolarHBondContact O-N 3.44Å; N1427-I1431 HydrophobicContact CB-CD1 3.96Å; N1427-I1431 HydrophobicContact CB-CG1 4.15Å; N1427-I1431 WeakPolarHBondContact O-CG1 3.3Å; N1427-I1431 PolarHBondContact O-N 3.42Å
1428	A	77.2	Confident	70	Confident	5 Å²	5	48.6 Å²	48.6	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-52.1	-46.1	-164.2	0	0	0	0	0	114.5	V664 L668 V1424 E1430 I1431 A1432	V664-A1428 HydrophobicContact CB-CB 4.42Å; V664-A1428 HydrophobicContact CG1-CB 3.65Å; V664-A1428 HydrophobicContact CG2-CB 3.83Å; V664-A1428 VanDerWaalsContact CG2-O 3.22Å; V664-A1428 WeakPolarHBondContact CG2-O 3.44Å; L668-A1428 HydrophobicContact CD1-CB 3.96Å; V1424-A1428 VanDerWaalsContact O-CA 3.23Å; V1424-A1428 WeakPolarHBondContact O-CA 3.37Å; V1424-A1428 WeakPolarHBondContact O-CB 3.28Å; V1424-A1428 PolarHBondContact O-N 2.94Å; A1428-E1430 VanDerWaalsContact C-N 3.33Å; A1428-E1430 PolarHBondContact O-N 3.44Å; A1428-I1431 PolarHBondContact O-N 3.31Å; A1428-A1432 WeakPolarHBondContact O-CB 3.15Å; A1428-A1432 PolarHBondContact O-N 3.03Å
1429	V	77.2	Confident	71.1	Confident	31 Å²	31	49.8 Å²	49.8	19%	0.188	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-32.9	-178.2	-177.8	0	0	0	0	112	A660 R661 V664 N1427 A1432 K1433	A660-V1429 HydrophobicContact CB-CG1 4.16Å; R661-V1429 HydrophobicContact CG-CG1 3.79Å; R661-V1429 HydrophobicContact CG-CG2 4.03Å; V664-V1429 HydrophobicContact CG2-CB 4.43Å; V664-V1429 HydrophobicContact CG2-CG2 4.05Å; N1427-V1429 PolarHBondContact O-N 3.3Å; N1427-V1429 VanDerWaalsContact O-N 3.17Å; V1429-A1432 PolarHBondContact O-N 3.36Å; V1429-K1433 WeakPolarHBondContact O-CG 3.36Å; V1429-K1433 PolarHBondContact O-N 3.5Å
1430	E	76.6	Confident	71.6	Confident	129 Å²	129	47.6 Å²	47.6	60%	0.603	24%	0.242	S	C	*	.	H	α-helix	trans	-75.4	-42.3	179.2	-164.9	159	-127.4	0	0	110.9	N1427 A1428 A1432 K1433 E1434	N1427-E1430 WeakPolarHBondContact O-CB 3.49Å; N1427-E1430 PolarHBondContact O-N 3.44Å; A1428-E1430 VanDerWaalsContact C-N 3.33Å; A1428-E1430 PolarHBondContact O-N 3.44Å; E1430-A1432 VanDerWaalsContact C-N 3.29Å; E1430-A1432 PolarHBondContact O-N 3.15Å; E1430-K1433 PolarHBondContact O-N 2.99Å; E1430-E1434 PolarHBondContact O-N 2.89Å; E1430-E1434 VanDerWaalsContact O-N 3.1Å
1431	I	76.4	Confident	72	Confident	7 Å²	7	44 Å²	44	4%	0.036	23%	0.225	C	C	.	.	H	α-helix	trans	-57.5	-42.9	168.9	-62.9	169.8	0	0	0	110.4	V1424 N1427 A1428 K1433 E1434 L1435 L1516 T1520 L1524	V1424-I1431 HydrophobicContact CG1-CD1 4.46Å; N1427-I1431 HydrophobicContact CB-CD1 3.96Å; N1427-I1431 HydrophobicContact CB-CG1 4.15Å; N1427-I1431 WeakPolarHBondContact O-CG1 3.3Å; N1427-I1431 PolarHBondContact O-N 3.42Å; A1428-I1431 PolarHBondContact O-N 3.31Å; I1431-K1433 VanDerWaalsContact C-N 3.34Å; I1431-K1433 PolarHBondContact O-N 3.42Å; I1431-E1434 PolarHBondContact O-N 3.38Å; I1431-L1435 HydrophobicContact CG2-CD1 3.86Å; I1431-L1435 HydrophobicContact CG2-CG 4.39Å; I1431-L1435 VanDerWaalsContact O-CG 3.31Å; I1431-L1435 WeakPolarHBondContact O-CG 3.45Å; I1431-L1435 PolarHBondContact O-N 2.84Å; I1431-L1516 HydrophobicContact CB-CD2 4.34Å; I1431-L1516 HydrophobicContact CG1-CD2 3.84Å; I1431-L1516 HydrophobicContact CG2-CD1 4.21Å; I1431-L1516 HydrophobicContact CG2-CD2 4.05Å; I1431-T1520 HydrophobicContact CD1-CG2 3.82Å; I1431-L1524 HydrophobicContact CG2-CD1 4.02Å; I1431-L1524 HydrophobicContact CG2-CD2 4.45Å
1432	A	83	Confident	71.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-34	178.1	0	0	0	0	0	113.2	A660 V664 A1428 V1429 E1430 L1435 Q1436 F1485	A660-A1432 HydrophobicContact CB-CB 4.13Å; V664-A1432 HydrophobicContact CG2-CB 3.69Å; A1428-A1432 WeakPolarHBondContact O-CB 3.15Å; A1428-A1432 PolarHBondContact O-N 3.03Å; V1429-A1432 PolarHBondContact O-N 3.36Å; E1430-A1432 VanDerWaalsContact C-N 3.29Å; E1430-A1432 PolarHBondContact O-N 3.15Å; A1432-L1435 PolarHBondContact O-N 3.08Å; A1432-Q1436 WeakPolarHBondContact O-CB 3.41Å; A1432-Q1436 WeakPolarHBondContact O-CG 3.34Å; A1432-Q1436 PolarHBondContact O-N 3.3Å; A1432-F1485 HydrophobicContact CB-CD2 4.5Å; A1432-F1485 HydrophobicContact CB-CE2 4.04Å
1433	K	81.8	Confident	71.7	Confident	66 Å²	66	41.3 Å²	41.3	29%	0.287	21%	0.214	S	C	.	.	H	α-helix	trans	-65.1	-44.1	172.5	-74.3	177.3	-177.6	-178.4	0	112.3	D657 A660 V1429 E1430 I1431 L1435 Q1436 A1437	D657-K1433 WeakPolarHBondContact OD1-CE 3.27Å; D657-K1433 IonicContact OD1-NZ 2.72Å; D657-K1433 PolarHBondContact OD1-NZ 3.49Å; A660-K1433 HydrophobicContact CB-CD 4.45Å; A660-K1433 HydrophobicContact CB-CG 3.55Å; V1429-K1433 WeakPolarHBondContact O-CG 3.36Å; V1429-K1433 PolarHBondContact O-N 3.5Å; E1430-K1433 PolarHBondContact O-N 2.99Å; I1431-K1433 VanDerWaalsContact C-N 3.34Å; I1431-K1433 PolarHBondContact O-N 3.42Å; K1433-L1435 VanDerWaalsContact C-N 3.34Å; K1433-L1435 PolarHBondContact O-N 3.07Å; K1433-Q1436 PolarHBondContact O-N 3.5Å; K1433-A1437 WeakPolarHBondContact O-CB 3.39Å; K1433-A1437 PolarHBondContact O-N 2.85Å
1434	E	78.7	Confident	71.3	Confident	61 Å²	61	41.7 Å²	41.7	29%	0.285	21%	0.214	S	C	.	.	H	α-helix	trans	-61.9	-41.2	173.8	-66.7	-169.7	158	0	0	112.3	E1430 I1431 R1488 T1515 L1516	E1430-E1434 PolarHBondContact O-N 2.89Å; E1430-E1434 VanDerWaalsContact O-N 3.1Å; I1431-E1434 PolarHBondContact O-N 3.38Å; E1434-R1488 PolarHBondContact O-NH1 3.46Å; E1434-T1515 WeakPolarHBondContact OE1-CB 3.25Å; E1434-T1515 PolarHBondContact OE1-OG1 3.2Å; E1434-T1515 PolarHBondContact OE2-OG1 3.43Å; E1434-L1516 VanDerWaalsContact OE2-CD2 3.26Å; E1434-L1516 WeakPolarHBondContact OE2-CD2 3.44Å
1435	L	81	Confident	70.4	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-73.5	-29.4	-178.4	-68	176.2	0	0	0	113.7	I1431 A1432 K1433 F1485 R1488 F1489 L1492 L1514 L1516 L1524	I1431-L1435 HydrophobicContact CG2-CD1 3.86Å; I1431-L1435 HydrophobicContact CG2-CG 4.39Å; I1431-L1435 VanDerWaalsContact O-CG 3.31Å; I1431-L1435 WeakPolarHBondContact O-CG 3.45Å; I1431-L1435 PolarHBondContact O-N 2.84Å; A1432-L1435 PolarHBondContact O-N 3.08Å; K1433-L1435 VanDerWaalsContact C-N 3.34Å; K1433-L1435 PolarHBondContact O-N 3.07Å; L1435-F1485 HydrophobicContact CB-CD2 3.61Å; L1435-F1485 HydrophobicContact CB-CE2 3.78Å; L1435-F1485 HydrophobicContact CD1-CE2 3.86Å; L1435-F1485 HydrophobicContact CD1-CZ 4.33Å; L1435-F1485 HydrophobicContact CG-CE2 4.49Å; L1435-F1485 WeakPolarHBondContact O-CA 3.39Å; L1435-R1488 HydrophobicContact CD2-CB 3.95Å; L1435-R1488 WeakPolarHBondContact O-CD 3.32Å; L1435-F1489 HydrophobicContact CD1-CD2 4.49Å; L1435-L1492 HydrophobicContact CD1-CD1 4.24Å; L1435-L1492 HydrophobicContact CD2-CD1 3.88Å; L1435-L1514 HydrophobicContact CD2-CD1 3.87Å; L1435-L1514 HydrophobicContact CD2-CD2 4.23Å; L1435-L1516 HydrophobicContact CD2-CD1 4.22Å; L1435-L1524 HydrophobicContact CD1-CD1 4.49Å
1436	Q	84.8	Confident	69.4	Low	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-87.7	-10.9	176.6	79.6	-174.5	11.2	0	0	114.3	E656 C659 N663 A1432 K1433 I1438 L1481 A1484 F1485	E656-Q1436 PolarHBondContact O-NE2 2.89Å; C659-Q1436 PolarHBondContact SG-OE1 3.34Å; C659-Q1436 VanDerWaalsContact SG-OE1 3.35Å; N663-Q1436 PolarHBondContact ND2-OE1 2.97Å; A1432-Q1436 WeakPolarHBondContact O-CB 3.41Å; A1432-Q1436 WeakPolarHBondContact O-CG 3.34Å; A1432-Q1436 PolarHBondContact O-N 3.3Å; K1433-Q1436 PolarHBondContact O-N 3.5Å; Q1436-I1438 PolarHBondContact O-N 3.06Å; Q1436-I1438 VanDerWaalsContact O-N 3.09Å; Q1436-L1481 HydrophobicContact CB-CB 4.18Å; Q1436-L1481 WeakPolarHBondContact CB-O 3.36Å; Q1436-L1481 HydrophobicContact CG-CB 4.37Å; Q1436-L1481 HydrophobicContact CG-CD2 4.29Å; Q1436-L1481 WeakPolarHBondContact O-CD2 3.33Å; Q1436-A1484 VanDerWaalsContact O-CB 3.32Å; Q1436-A1484 WeakPolarHBondContact O-CB 3.48Å; Q1436-F1485 HydrophobicContact CB-CB 4.03Å
1437	A	79.2	Confident	68.5	Low	32 Å²	32	43.2 Å²	43.2	26%	0.264	23%	0.227	S	C	.	.			trans	-64.7	109.3	-174.5	0	0	0	0	0	112.6	K1433 K1439 R1488	K1433-A1437 WeakPolarHBondContact O-CB 3.39Å; K1433-A1437 PolarHBondContact O-N 2.85Å; A1437-K1439 PolarHBondContact O-N 3.11Å; A1437-K1439 VanDerWaalsContact O-N 3.11Å; A1437-R1488 PolarHBondContact O-NH1 3.49Å; A1437-R1488 PolarHBondContact O-NH2 3.08Å
1438	I	73.5	Confident	67.2	Low	20 Å²	20	47 Å²	47	10%	0.103	25%	0.248	C	C	.	.			trans	-56.1	-32.8	-172.6	-56.3	175.6	0	0	0	112.9	M721 Q1436 G1440 I1441 L1481 A1484	M721-I1438 HydrophobicContact CE-CD1 3.81Å; M721-I1438 HydrophobicContact SD-CD1 3.81Å; Q1436-I1438 PolarHBondContact O-N 3.06Å; Q1436-I1438 VanDerWaalsContact O-N 3.09Å; I1438-G1440 PolarHBondContact O-N 2.97Å; I1438-I1441 WeakPolarHBondContact O-CB 3.21Å; I1438-I1441 WeakPolarHBondContact O-CG1 3.23Å; I1438-I1441 PolarHBondContact O-N 2.9Å; I1438-I1441 VanDerWaalsContact O-N 3.1Å; I1438-L1481 HydrophobicContact CD1-CD2 3.87Å; I1438-L1481 HydrophobicContact CG1-CD2 3.78Å; I1438-A1484 HydrophobicContact CG1-CB 4.46Å
1439	K	68.5	Low	65.6	Low	61 Å²	61	52 Å²	52	27%	0.265	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	121.3	179.8	-175.2	177.2	173.3	-177.1	0	112.3	L34 L35 T719 A1437 R1488	L34-K1439 PolarHBondContact O-NZ 3.02Å; L35-K1439 PolarHBondContact O-NZ 3.07Å; L35-K1439 VanDerWaalsContact O-NZ 3.1Å; T719-K1439 HydrophobicContact CG2-CB 3.89Å; T719-K1439 HydrophobicContact CG2-CG 4.34Å; A1437-K1439 PolarHBondContact O-N 3.11Å; A1437-K1439 VanDerWaalsContact O-N 3.11Å; K1439-R1488 PolarHBondContact O-NH2 3.24Å
1440	G	62.9	Low	64	Low	12 Å²	12	53.8 Å²	53.8	12%	0.124	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-3.3	176.5	0	0	0	0	0	116.6	I1438 D1442	I1438-G1440 PolarHBondContact O-N 2.97Å; G1440-D1442 PolarHBondContact O-N 2.99Å
1441	I	65.6	Low	62.3	Low	15 Å²	15	55.4 Å²	55.4	8%	0.077	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-33.8	-174.7	-67.4	-176.2	0	0	0	113.6	I1438 T1478 A1484 K1487 R1488	I1438-I1441 WeakPolarHBondContact O-CB 3.21Å; I1438-I1441 WeakPolarHBondContact O-CG1 3.23Å; I1438-I1441 PolarHBondContact O-N 2.9Å; I1438-I1441 VanDerWaalsContact O-N 3.1Å; I1441-T1478 VanDerWaalsContact CG2-OG1 3.26Å; I1441-T1478 WeakPolarHBondContact CG2-OG1 3.45Å; I1441-A1484 HydrophobicContact CD1-CB 3.35Å; I1441-K1487 HydrophobicContact CG2-CD 3.45Å; I1441-K1487 VanDerWaalsContact CG2-CD 3.45Å; I1441-R1488 HydrophobicContact CD1-CG 4.49Å
1442	D	60.2	Low	60.5	Low	47 Å²	47	59.3 Å²	59.3	25%	0.251	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-3.4	-178.7	-64.4	-49.8	0	0	0	113.1	G1440 T1478 K1487	G1440-D1442 PolarHBondContact O-N 2.99Å; D1442-T1478 VanDerWaalsContact CG-OG1 3.29Å; D1442-T1478 PolarHBondContact OD1-OG1 3.1Å; D1442-T1478 PolarHBondContact OD2-N 3.18Å; D1442-T1478 PolarHBondContact OD2-OG1 2.89Å; D1442-K1487 IonicContact OD1-NZ 2.89Å; D1442-K1487 PolarHBondContact OD1-NZ 3.45Å; D1442-K1487 IonicContact OD2-NZ 3.76Å
1443	E	56.9	Low	58.3	Low	92 Å²	92	66.8 Å²	66.8	43%	0.43	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-38.5	173.7	-77.9	-178.8	-136.1	0	0	112.2	N1445 I1446 A1447 R1512	E1443-N1445 PolarHBondContact O-N 3.32Å; E1443-I1446 WeakPolarHBondContact O-CB 3.28Å; E1443-I1446 PolarHBondContact O-N 3.5Å; E1443-A1447 PolarHBondContact O-N 3.11Å; E1443-R1512 IonicContact OE1-NH1 3.75Å; E1443-R1512 IonicContact OE2-CZ 2.66Å; E1443-R1512 IonicContact OE2-NH1 2.93Å; E1443-R1512 PolarHBondContact OE2-NH1 3.47Å; E1443-R1512 IonicContact OE2-NH2 3.77Å
1444	D	49.7	Very low	56.2	Low	73 Å²	73	73.7 Å²	73.7	39%	0.39	38%	0.384	S	S	.	.	H	α-helix	trans	-58.4	-37.3	-176.3	-62.3	-23.2	0	0	0	111.8	I1446 A1447 D1448	D1444-I1446 PolarHBondContact O-N 3.04Å; D1444-I1446 VanDerWaalsContact O-N 3.09Å; D1444-A1447 PolarHBondContact O-N 3.05Å; D1444-A1447 VanDerWaalsContact O-N 3.15Å; D1444-D1448 PolarHBondContact O-N 3.2Å
1445	N	45.7	Very low	54.2	Low	71 Å²	71	77.7 Å²	77.7	38%	0.38	40%	0.402	S	S	.	.	H	α-helix	trans	-64.1	-15.4	177.8	-85.9	-111.8	0	0	0	114.1	E1443 K1475	E1443-N1445 PolarHBondContact O-N 3.32Å; N1445-K1475 PolarHBondContact OD1-NZ 3.06Å
1446	I	45.8	Very low	52.4	Low	109 Å²	109	83 Å²	83	56%	0.559	44%	0.437	S	S	*	.	H	α-helix	trans	-94.2	-34.8	178.5	-53.9	177.5	0	0	0	110	E1443 D1444	E1443-I1446 WeakPolarHBondContact O-CB 3.28Å; E1443-I1446 PolarHBondContact O-N 3.5Å; D1444-I1446 PolarHBondContact O-N 3.04Å; D1444-I1446 VanDerWaalsContact O-N 3.09Å
1447	A	42.9	Very low	50.2	Low	27 Å²	27	90.4 Å²	90.4	22%	0.223	48%	0.475	C	S	.	.	H	α-helix	trans	-67.8	-44.2	-179.9	0	0	0	0	0	112.6	E1443 D1444 K1449 A1450 K1510	E1443-A1447 PolarHBondContact O-N 3.11Å; D1444-A1447 PolarHBondContact O-N 3.05Å; D1444-A1447 VanDerWaalsContact O-N 3.15Å; A1447-K1449 PolarHBondContact O-N 2.88Å; A1447-K1449 VanDerWaalsContact O-N 3.07Å; A1447-A1450 WeakPolarHBondContact O-CB 3.49Å; A1447-A1450 PolarHBondContact O-N 2.73Å; A1447-K1510 HydrophobicContact CB-CD 4.34Å
1448	D	44.2	Very low	48.9	Very low	128 Å²	128	91.8 Å²	91.8	68%	0.684	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.8	-175	-65.6	-16.7	0	0	0	113.9	D1444	D1444-D1448 PolarHBondContact O-N 3.2Å
1449	K	43	Very low	47.9	Very low	109 Å²	109	101.5 Å²	101.5	47%	0.474	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.4	174.2	-70.9	-172.5	177.1	-175.5	0	114.5	A1447 S1468	A1447-K1449 PolarHBondContact O-N 2.88Å; A1447-K1449 VanDerWaalsContact O-N 3.07Å; K1449-S1468 PolarHBondContact NZ-O 3.45Å
1450	A	44.5	Very low	47.3	Very low	68 Å²	68	108.8 Å²	108.8	56%	0.562	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-17.5	-177.7	0	0	0	0	0	113.1	A1447	A1447-A1450 WeakPolarHBondContact O-CB 3.49Å; A1447-A1450 PolarHBondContact O-N 2.73Å
1451	F	39.5	Very low	46.8	Very low	164 Å²	164	112.4 Å²	112.4	72%	0.719	56%	0.56	S	S	*	*	S	Bend	trans	-109	15.6	-166.2	-118.2	-83.1	0	0	0	115.2	F1508	F1451-F1508 HydrophobicContact CE2-CB 4.27Å; F1451-F1508 HydrophobicContact CZ-CB 4.28Å
1452	V	39.4	Very low	46.4	Very low	88 Å²	88	114.8 Å²	114.8	53%	0.533	58%	0.576	S	S	.	*	S	Bend	trans	-105.5	118.1	174.5	-178.2	0	0	0	0	109.7
1453	E	36.9	Very low	46.6	Very low	158 Å²	158	117 Å²	117	74%	0.738	59%	0.591	S	S	*	*			trans	65.3	113.6	162.8	-70.2	152.9	-178.2	0	0	118.7	E1455	E1453-E1455 PolarHBondContact O-N 3.29Å; E1453-E1455 VanDerWaalsContact O-N 3.15Å
1454	E	36.7	Very low	46.9	Very low	212 Å²	212	119.4 Å²	119.4	99%	0.991	60%	0.6	S	S	*	*			trans	-78.7	67.5	160	-64.8	-174.4	139.2	0	0	110.3
1455	E	38	Very low	47.2	Very low	145 Å²	145	121.8 Å²	121.8	68%	0.678	61%	0.607	S	S	*	*			trans	-106.5	150.9	173.4	-85.6	-147.8	157.8	0	0	113.2	E1453	E1453-E1455 PolarHBondContact O-N 3.29Å; E1453-E1455 VanDerWaalsContact O-N 3.15Å
1456	P	42.1	Very low	48.1	Very low	111 Å²	111	124 Å²	124	72%	0.721	62%	0.617	S	S	*	*			trans	-61.6	144.9	-171.8	22.7	-33.4	0	0	0	113.9	S1458	P1456-S1458 PolarHBondContact O-N 2.98Å
1457	I	38.6	Very low	48.9	Very low	156 Å²	156	123 Å²	123	80%	0.8	61%	0.611	S	S	*	*			trans	-75	83.1	-163.6	-54.4	173	0	0	0	111.9	V1462	I1457-V1462 HydrophobicContact CG2-CG2 3.61Å
1458	S	51.6	Low	49.8	Very low	62 Å²	62	123.3 Å²	123.3	43%	0.434	61%	0.611	S	S	.	*			trans	-71.1	131.8	168.3	178.4	0	0	0	0	111.4	P1456 R1460 N1461 V1462	P1456-S1458 PolarHBondContact O-N 2.98Å; S1458-R1460 PolarHBondContact O-N 3.33Å; S1458-N1461 WeakPolarHBondContact O-CB 3.45Å; S1458-N1461 PolarHBondContact O-N 3.44Å; S1458-V1462 PolarHBondContact O-N 3.09Å
1459	R	54.1	Low	50.3	Low	223 Å²	223	120.1 Å²	120.1	84%	0.842	60%	0.596	S	S	*	*	H	α-helix	trans	-53.5	-30.6	179.8	-155.6	176.4	-169.5	-179.8	3.3	112.8	V1463	R1459-V1463 PolarHBondContact O-N 3.42Å
1460	R	55.6	Low	51.1	Low	214 Å²	214	122.7 Å²	122.7	81%	0.808	60%	0.603	S	S	*	*	H	α-helix	trans	-71	-35.4	177.3	-140.3	173.2	-166.6	163.4	3.8	112.4	S1458 K1464	S1458-R1460 PolarHBondContact O-N 3.33Å; R1460-K1464 WeakPolarHBondContact O-CB 3.21Å; R1460-K1464 PolarHBondContact O-N 3.03Å
1461	N	52.1	Low	51.6	Low	88 Å²	88	125.6 Å²	125.6	47%	0.471	60%	0.603	S	S	.	*	H	α-helix	trans	-73.1	-32.9	176.1	-76.1	-6.7	0	0	0	111.8	S1458 K1464 K1465	S1458-N1461 WeakPolarHBondContact O-CB 3.45Å; S1458-N1461 PolarHBondContact O-N 3.44Å; N1461-K1464 PolarHBondContact O-N 2.94Å; N1461-K1465 VanDerWaalsContact O-CB 3.25Å; N1461-K1465 WeakPolarHBondContact O-CB 3.46Å; N1461-K1465 PolarHBondContact O-N 3.01Å
1462	V	57.4	Low	52.2	Low	66 Å²	66	119.3 Å²	119.3	40%	0.4	58%	0.579	S	S	.	*	H	α-helix	trans	-61.1	-47.6	172.9	-179.1	0	0	0	0	111.1	I1457 S1458 K1464 K1465 L1466	I1457-V1462 HydrophobicContact CG2-CG2 3.61Å; S1458-V1462 PolarHBondContact O-N 3.09Å; V1462-K1464 PolarHBondContact O-N 3.44Å; V1462-K1465 PolarHBondContact O-N 3.49Å; V1462-L1466 HydrophobicContact CG1-CD1 4.14Å; V1462-L1466 WeakPolarHBondContact O-CB 3.25Å; V1462-L1466 WeakPolarHBondContact O-CG 3.38Å; V1462-L1466 PolarHBondContact O-N 3.36Å
1463	V	64.3	Low	52.5	Low	94 Å²	94	122.1 Å²	122.1	57%	0.57	59%	0.588	S	S	*	*	H	α-helix	trans	-60.3	-46.5	174.6	176.8	0	0	0	0	110.8	R1459 K1465 L1466 E1467	R1459-V1463 PolarHBondContact O-N 3.42Å; V1463-K1465 VanDerWaalsContact C-N 3.32Å; V1463-K1465 PolarHBondContact O-N 2.82Å; V1463-L1466 PolarHBondContact O-N 3.2Å; V1463-E1467 VanDerWaalsContact O-CB 3.27Å; V1463-E1467 WeakPolarHBondContact O-CB 3.32Å; V1463-E1467 PolarHBondContact O-N 3.2Å
1464	K	62	Low	53	Low	142 Å²	142	120.8 Å²	120.8	62%	0.617	58%	0.584	S	S	*	*	H	α-helix	trans	-63.5	-35.4	179.1	-151.3	176.9	-170.8	-177.6	0	112.5	R1460 N1461 V1462 S1468	R1460-K1464 WeakPolarHBondContact O-CB 3.21Å; R1460-K1464 PolarHBondContact O-N 3.03Å; N1461-K1464 PolarHBondContact O-N 2.94Å; V1462-K1464 PolarHBondContact O-N 3.44Å; K1464-S1468 VanDerWaalsContact O-CB 3.26Å; K1464-S1468 WeakPolarHBondContact O-CB 3.23Å; K1464-S1468 PolarHBondContact O-N 3.13Å
1465	K	57.8	Low	53.6	Low	123 Å²	123	116.5 Å²	116.5	54%	0.535	56%	0.562	S	S	.	*	H	α-helix	trans	-70.2	-49.7	176.6	-153.3	158.1	-171.4	165.5	0	109.8	N1461 V1462 V1463 E1467 S1468 T1469	N1461-K1465 VanDerWaalsContact O-CB 3.25Å; N1461-K1465 WeakPolarHBondContact O-CB 3.46Å; N1461-K1465 PolarHBondContact O-N 3.01Å; V1462-K1465 PolarHBondContact O-N 3.49Å; V1463-K1465 VanDerWaalsContact C-N 3.32Å; V1463-K1465 PolarHBondContact O-N 2.82Å; K1465-E1467 PolarHBondContact O-N 2.86Å; K1465-S1468 CarbonylContact O-C 3.54Å; K1465-S1468 PolarHBondContact O-N 3.27Å; K1465-S1468 VanDerWaalsContact O-N 3.13Å; K1465-S1468 PolarHBondContact O-OG 3.28Å; K1465-T1469 PolarHBondContact O-N 3.4Å; K1465-T1469 PolarHBondContact O-OG1 2.94Å
1466	L	64.5	Low	54.2	Low	116 Å²	116	118.5 Å²	118.5	61%	0.607	57%	0.568	S	S	*	*	H	α-helix	trans	-55	-46.6	171.7	-80.7	167.9	0	0	0	112.7	V1462 V1463 S1468 T1469 R1470	V1462-L1466 HydrophobicContact CG1-CD1 4.14Å; V1462-L1466 WeakPolarHBondContact O-CB 3.25Å; V1462-L1466 WeakPolarHBondContact O-CG 3.38Å; V1462-L1466 PolarHBondContact O-N 3.36Å; V1463-L1466 PolarHBondContact O-N 3.2Å; L1466-S1468 VanDerWaalsContact C-N 3.33Å; L1466-S1468 PolarHBondContact O-N 2.91Å; L1466-T1469 PolarHBondContact O-N 3.4Å; L1466-R1470 WeakPolarHBondContact O-CB 3.24Å; L1466-R1470 PolarHBondContact O-N 2.94Å
1467	E	62.6	Low	55	Low	89 Å²	89	119.3 Å²	119.3	42%	0.416	56%	0.562	S	S	.	*	H	α-helix	trans	-64.4	-38.5	177.3	-163.5	-152.8	156.8	0	0	111.1	V1463 K1465 T1469 R1470 K1471	V1463-E1467 VanDerWaalsContact O-CB 3.27Å; V1463-E1467 WeakPolarHBondContact O-CB 3.32Å; V1463-E1467 PolarHBondContact O-N 3.2Å; K1465-E1467 PolarHBondContact O-N 2.86Å; E1467-T1469 VanDerWaalsContact C-N 3.35Å; E1467-R1470 PolarHBondContact O-N 3.18Å; E1467-K1471 HydrophobicContact CG-CD 4.42Å; E1467-K1471 VanDerWaalsContact O-CB 3.27Å; E1467-K1471 WeakPolarHBondContact O-CB 3.41Å; E1467-K1471 WeakPolarHBondContact O-CG 3.44Å; E1467-K1471 PolarHBondContact O-N 3.49Å; E1467-K1471 VanDerWaalsContact OE1-CE 3.26Å; E1467-K1471 WeakPolarHBondContact OE1-CE 3.26Å; E1467-K1471 IonicContact OE1-NZ 3.09Å; E1467-K1471 PolarHBondContact OE1-NZ 3.05Å
1468	S	61.6	Low	55.9	Low	33 Å²	33	112.5 Å²	112.5	23%	0.231	53%	0.528	C	S	.	.	H	α-helix	trans	-69.8	-30.7	175.5	91.9	0	0	0	0	113.3	K1449 K1464 K1465 L1466 S1472	K1449-S1468 PolarHBondContact NZ-O 3.45Å; K1464-S1468 VanDerWaalsContact O-CB 3.26Å; K1464-S1468 WeakPolarHBondContact O-CB 3.23Å; K1464-S1468 PolarHBondContact O-N 3.13Å; K1465-S1468 CarbonylContact O-C 3.54Å; K1465-S1468 PolarHBondContact O-N 3.27Å; K1465-S1468 VanDerWaalsContact O-N 3.13Å; K1465-S1468 PolarHBondContact O-OG 3.28Å; L1466-S1468 VanDerWaalsContact C-N 3.33Å; L1466-S1468 PolarHBondContact O-N 2.91Å; S1468-S1472 PolarHBondContact O-N 3.04Å; S1468-S1472 PolarHBondContact O-OG 3.12Å
1469	T	54.3	Low	56.6	Low	61 Å²	61	113 Å²	113	37%	0.374	52%	0.524	S	S	.	.	H	α-helix	trans	-74.7	-43.5	174.3	-58.6	0	0	0	0	110.6	K1465 L1466 E1467 K1471 S1472 M1473	K1465-T1469 PolarHBondContact O-N 3.4Å; K1465-T1469 PolarHBondContact O-OG1 2.94Å; L1466-T1469 PolarHBondContact O-N 3.4Å; E1467-T1469 VanDerWaalsContact C-N 3.35Å; T1469-K1471 VanDerWaalsContact C-N 3.32Å; T1469-K1471 PolarHBondContact O-N 3.4Å; T1469-S1472 WeakPolarHBondContact CA-OG 3.3Å; T1469-S1472 CarbonylContact O-C 3.38Å; T1469-S1472 PolarHBondContact O-N 3.14Å; T1469-S1472 VanDerWaalsContact O-N 3.09Å; T1469-S1472 PolarHBondContact O-OG 2.89Å; T1469-M1473 HydrophobicContact CG2-CE 4.1Å; T1469-M1473 HydrophobicContact CG2-SD 4.44Å; T1469-M1473 WeakPolarHBondContact O-CG 3.4Å; T1469-M1473 PolarHBondContact O-N 3.2Å
1470	R	59.2	Low	57.8	Low	163 Å²	163	103.8 Å²	103.8	62%	0.615	49%	0.492	S	S	*	.	H	α-helix	trans	-58.6	-43.4	169.6	176.4	172.7	166.1	158.5	-5.8	110.7	L1466 E1467 S1472 M1473 M1474	L1466-R1470 WeakPolarHBondContact O-CB 3.24Å; L1466-R1470 PolarHBondContact O-N 2.94Å; E1467-R1470 PolarHBondContact O-N 3.18Å; R1470-S1472 VanDerWaalsContact C-N 3.32Å; R1470-S1472 PolarHBondContact O-N 3.18Å; R1470-M1473 PolarHBondContact O-N 2.94Å; R1470-M1474 HydrophobicContact CG-CG 4.45Å; R1470-M1474 HydrophobicContact CG-SD 3.81Å; R1470-M1474 VanDerWaalsContact O-CB 3.29Å; R1470-M1474 WeakPolarHBondContact O-CB 3.35Å; R1470-M1474 VanDerWaalsContact O-CG 3.28Å; R1470-M1474 WeakPolarHBondContact O-CG 3.29Å; R1470-M1474 PolarHBondContact O-N 3.4Å
1471	K	55.2	Low	59	Low	130 Å²	130	93.6 Å²	93.6	57%	0.565	45%	0.453	S	S	*	.	H	α-helix	trans	-69.2	-20.6	174.3	-77.7	173.7	168.7	172.1	0	114.1	E1467 T1469 K1475	E1467-K1471 HydrophobicContact CG-CD 4.42Å; E1467-K1471 VanDerWaalsContact O-CB 3.27Å; E1467-K1471 WeakPolarHBondContact O-CB 3.41Å; E1467-K1471 WeakPolarHBondContact O-CG 3.44Å; E1467-K1471 PolarHBondContact O-N 3.49Å; E1467-K1471 VanDerWaalsContact OE1-CE 3.26Å; E1467-K1471 WeakPolarHBondContact OE1-CE 3.26Å; E1467-K1471 IonicContact OE1-NZ 3.09Å; E1467-K1471 PolarHBondContact OE1-NZ 3.05Å; T1469-K1471 VanDerWaalsContact C-N 3.32Å; T1469-K1471 PolarHBondContact O-N 3.4Å; K1471-K1475 PolarHBondContact O-N 3.27Å
1472	S	52.8	Low	60.3	Low	31 Å²	31	89.9 Å²	89.9	22%	0.217	43%	0.434	C	S	.	.	H	α-helix	trans	-85.9	-30.2	167.4	52.8	0	0	0	0	113.6	S1468 T1469 R1470 M1474 K1475	S1468-S1472 PolarHBondContact O-N 3.04Å; S1468-S1472 PolarHBondContact O-OG 3.12Å; T1469-S1472 WeakPolarHBondContact CA-OG 3.3Å; T1469-S1472 CarbonylContact O-C 3.38Å; T1469-S1472 PolarHBondContact O-N 3.14Å; T1469-S1472 VanDerWaalsContact O-N 3.09Å; T1469-S1472 PolarHBondContact O-OG 2.89Å; R1470-S1472 VanDerWaalsContact C-N 3.32Å; R1470-S1472 PolarHBondContact O-N 3.18Å; S1472-M1474 VanDerWaalsContact C-N 3.32Å; S1472-K1475 PolarHBondContact O-N 3.06Å
1473	M	45.2	Very low	61.4	Low	148 Å²	148	88.5 Å²	88.5	73%	0.729	43%	0.429	S	S	*	.	H	α-helix	trans	-69.7	-31.1	169.1	-70.7	173.1	171	0	0	111.8	T1469 R1470	T1469-M1473 HydrophobicContact CG2-CE 4.1Å; T1469-M1473 HydrophobicContact CG2-SD 4.44Å; T1469-M1473 WeakPolarHBondContact O-CG 3.4Å; T1469-M1473 PolarHBondContact O-N 3.2Å; R1470-M1473 PolarHBondContact O-N 2.94Å
1474	M	47	Very low	62.2	Low	130 Å²	130	84 Å²	84	64%	0.64	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-1.2	174.8	-70.2	177.1	140.7	0	0	114	R1470 S1472 K1476	R1470-M1474 HydrophobicContact CG-CG 4.45Å; R1470-M1474 HydrophobicContact CG-SD 3.81Å; R1470-M1474 VanDerWaalsContact O-CB 3.29Å; R1470-M1474 WeakPolarHBondContact O-CB 3.35Å; R1470-M1474 VanDerWaalsContact O-CG 3.28Å; R1470-M1474 WeakPolarHBondContact O-CG 3.29Å; R1470-M1474 PolarHBondContact O-N 3.4Å; S1472-M1474 VanDerWaalsContact C-N 3.32Å; M1474-K1476 PolarHBondContact O-N 3.38Å
1475	K	49.4	Very low	63.2	Low	121 Å²	121	77.4 Å²	77.4	53%	0.526	37%	0.373	S	S	.	.	S	Bend	trans	-69.2	129	165.4	-101.2	-177	170.3	-176.4	0	107.8	N1445 K1471 S1472 Q1477	N1445-K1475 PolarHBondContact OD1-NZ 3.06Å; K1471-K1475 PolarHBondContact O-N 3.27Å; S1472-K1475 PolarHBondContact O-N 3.06Å; K1475-Q1477 PolarHBondContact O-N 2.82Å; K1475-Q1477 VanDerWaalsContact O-N 3.08Å
1476	K	52	Low	64.4	Low	188 Å²	188	74.6 Å²	74.6	82%	0.817	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-52.8	118.2	169.1	-74	-170.6	173.4	-174.4	0	109.3	M1474	M1474-K1476 PolarHBondContact O-N 3.38Å
1477	Q	58.9	Low	65.2	Low	127 Å²	127	73.4 Å²	73.4	59%	0.593	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-67.6	165.9	175	-68.1	-178.8	-13.7	0	0	110	K1475 E1479	K1475-Q1477 PolarHBondContact O-N 2.82Å; K1475-Q1477 VanDerWaalsContact O-N 3.08Å; Q1477-E1479 VanDerWaalsContact C-N 3.28Å; Q1477-E1479 PolarHBondContact O-N 3.1Å
1478	T	57.4	Low	66	Low	14 Å²	14	71.7 Å²	71.7	9%	0.086	34%	0.341	C	S	.	.			trans	-76.7	78.1	179	-9.4	0	0	0	0	112.1	I1441 D1442 T1480 A1483 K1487	I1441-T1478 VanDerWaalsContact CG2-OG1 3.26Å; I1441-T1478 WeakPolarHBondContact CG2-OG1 3.45Å; D1442-T1478 VanDerWaalsContact CG-OG1 3.29Å; D1442-T1478 PolarHBondContact OD1-OG1 3.1Å; D1442-T1478 PolarHBondContact OD2-N 3.18Å; D1442-T1478 PolarHBondContact OD2-OG1 2.89Å; T1478-T1480 PolarHBondContact O-N 2.73Å; T1478-T1480 VanDerWaalsContact O-N 3.13Å; T1478-A1483 HydrophobicContact CG2-CB 4.09Å; T1478-K1487 HydrophobicContact CG2-CD 4Å; T1478-K1487 PolarHBondContact OG1-NZ 2.96Å
1479	E	65	Low	66.8	Low	73 Å²	73	70.2 Å²	70.2	34%	0.341	33%	0.33	S	S	.	.			trans	-60.2	-15	-175.7	-69.7	163.3	-154.8	0	0	116.1	M721 K724 Q1477	M721-E1479 WeakPolarHBondContact CE-O 3.5Å; K724-E1479 WeakPolarHBondContact CE-OE2 3.37Å; K724-E1479 IonicContact NZ-OE2 3.67Å; Q1477-E1479 VanDerWaalsContact C-N 3.28Å; Q1477-E1479 PolarHBondContact O-N 3.1Å
1480	T	79.3	Confident	68.1	Low	28 Å²	28	71.6 Å²	71.6	17%	0.172	33%	0.331	C	S	.	.			trans	-135.7	145.3	-174.4	59.2	0	0	0	0	114	P742 T1478 D1482 A1483 A1484	P742-T1480 CarbonylContact O-C 3.57Å; P742-T1480 VanDerWaalsContact O-CA 3.28Å; P742-T1480 WeakPolarHBondContact O-CA 3.48Å; P742-T1480 WeakPolarHBondContact O-CB 3.4Å; T1478-T1480 PolarHBondContact O-N 2.73Å; T1478-T1480 VanDerWaalsContact O-N 3.13Å; T1480-D1482 PolarHBondContact O-N 2.63Å; T1480-A1483 PolarHBondContact O-N 3.32Å; T1480-A1483 VanDerWaalsContact OG1-CB 3.27Å; T1480-A1483 WeakPolarHBondContact OG1-CB 3.26Å; T1480-A1484 PolarHBondContact O-N 3.44Å
1481	L	82.1	Confident	68.8	Low	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-37	-177.9	-63.2	177.5	0	0	0	112.6	E656 C659 P742 Q1436 I1438 A1484 F1485	E656-L1481 HydrophobicContact CB-CD1 4.44Å; C659-L1481 HydrophobicContact CB-CD1 4.21Å; C659-L1481 VanDerWaalsContact SG-CB 3.57Å; P742-L1481 HydrophobicContact CB-CD1 4.34Å; P742-L1481 HydrophobicContact CB-CG 4.02Å; P742-L1481 PolarHBondContact O-N 3.26Å; Q1436-L1481 HydrophobicContact CB-CB 4.18Å; Q1436-L1481 WeakPolarHBondContact CB-O 3.36Å; Q1436-L1481 HydrophobicContact CG-CB 4.37Å; Q1436-L1481 HydrophobicContact CG-CD2 4.29Å; Q1436-L1481 WeakPolarHBondContact O-CD2 3.33Å; I1438-L1481 HydrophobicContact CD1-CD2 3.87Å; I1438-L1481 HydrophobicContact CG1-CD2 3.78Å; L1481-A1484 WeakPolarHBondContact O-CB 3.31Å; L1481-A1484 PolarHBondContact O-N 3.46Å; L1481-F1485 WeakPolarHBondContact O-CB 3.23Å; L1481-F1485 PolarHBondContact O-N 2.96Å
1482	D	78.3	Confident	69.5	Low	11 Å²	11	62.2 Å²	62.2	6%	0.059	31%	0.311	C	S	.	.	H	α-helix	trans	-68.4	-35.4	174.1	175.3	44.5	0	0	0	112	Y667 K744 T1480 F1485 K1486	Y667-D1482 WeakPolarHBondContact CE2-OD1 3.48Å; Y667-D1482 PolarHBondContact OH-OD1 3.39Å; K744-D1482 HydrophobicContact CD-CB 4.27Å; K744-D1482 IonicContact NZ-OD2 3.56Å; K744-D1482 PolarHBondContact NZ-OD2 2.95Å; T1480-D1482 PolarHBondContact O-N 2.63Å; D1482-F1485 PolarHBondContact O-N 3.49Å; D1482-K1486 WeakPolarHBondContact O-CB 3.28Å; D1482-K1486 PolarHBondContact O-N 3.46Å
1483	A	80.6	Confident	70	Confident	37 Å²	37	62.4 Å²	62.4	31%	0.306	31%	0.312	S	S	.	.	H	α-helix	trans	-71	-38.9	173.7	0	0	0	0	0	112.3	T1478 T1480 K1486 K1487	T1478-A1483 HydrophobicContact CG2-CB 4.09Å; T1480-A1483 PolarHBondContact O-N 3.32Å; T1480-A1483 VanDerWaalsContact OG1-CB 3.27Å; T1480-A1483 WeakPolarHBondContact OG1-CB 3.26Å; A1483-K1486 PolarHBondContact O-N 2.88Å; A1483-K1487 WeakPolarHBondContact O-CB 3.17Å; A1483-K1487 PolarHBondContact O-N 3.09Å
1484	A	81.3	Confident	70.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-48.5	170.5	0	0	0	0	0	111.6	Q1436 I1438 I1441 T1480 L1481 K1487 R1488	Q1436-A1484 VanDerWaalsContact O-CB 3.32Å; Q1436-A1484 WeakPolarHBondContact O-CB 3.48Å; I1438-A1484 HydrophobicContact CG1-CB 4.46Å; I1441-A1484 HydrophobicContact CD1-CB 3.35Å; T1480-A1484 PolarHBondContact O-N 3.44Å; L1481-A1484 WeakPolarHBondContact O-CB 3.31Å; L1481-A1484 PolarHBondContact O-N 3.46Å; A1484-K1487 PolarHBondContact O-N 3.25Å; A1484-R1488 PolarHBondContact O-N 3.28Å; A1484-R1488 VanDerWaalsContact O-N 3.09Å
1485	F	83.7	Confident	70.8	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-51.7	174.9	-176.6	-82.5	0	0	0	111.5	N663 Y667 A1432 L1435 Q1436 L1481 D1482 K1487 R1488 F1489	N663-F1485 HydrophobicContact CB-CD1 4.39Å; N663-F1485 HydrophobicContact CB-CD2 4.13Å; N663-F1485 HydrophobicContact CB-CE2 4.21Å; N663-F1485 HydrophobicContact CB-CG 4.23Å; N663-F1485 HydrophobicContact CB-CZ 4.41Å; Y667-F1485 AromaticContact CD2-CD1 3.55Å; Y667-F1485 HydrophobicContact CD2-CD1 3.55Å; Y667-F1485 AromaticContact CD2-CE1 3.2Å; Y667-F1485 HydrophobicContact CD2-CE1 3.2Å; Y667-F1485 HydrophobicContact CD2-CZ 4.05Å; Y667-F1485 AromaticContact CE2-CD1 3.71Å; Y667-F1485 HydrophobicContact CE2-CD1 3.71Å; Y667-F1485 AromaticContact CE2-CE1 3.87Å; Y667-F1485 HydrophobicContact CE2-CE1 3.87Å; Y667-F1485 HydrophobicContact CG-CD1 4.32Å; Y667-F1485 AromaticContact CG-CE1 3.64Å; Y667-F1485 HydrophobicContact CG-CE1 3.64Å; Y667-F1485 HydrophobicContact CG-CZ 4.46Å; A1432-F1485 HydrophobicContact CB-CD2 4.5Å; A1432-F1485 HydrophobicContact CB-CE2 4.04Å; L1435-F1485 HydrophobicContact CB-CD2 3.61Å; L1435-F1485 HydrophobicContact CB-CE2 3.78Å; L1435-F1485 HydrophobicContact CD1-CE2 3.86Å; L1435-F1485 HydrophobicContact CD1-CZ 4.33Å; L1435-F1485 HydrophobicContact CG-CE2 4.49Å; L1435-F1485 WeakPolarHBondContact O-CA 3.39Å; Q1436-F1485 HydrophobicContact CB-CB 4.03Å; L1481-F1485 WeakPolarHBondContact O-CB 3.23Å; L1481-F1485 PolarHBondContact O-N 2.96Å; D1482-F1485 PolarHBondContact O-N 3.49Å; F1485-K1487 PolarHBondContact O-N 3.39Å; F1485-R1488 PolarHBondContact O-N 2.99Å; F1485-F1489 HydrophobicContact CD1-CB 4.08Å; F1485-F1489 HydrophobicContact CE1-CB 3.7Å; F1485-F1489 HydrophobicContact CE1-CD1 4.39Å; F1485-F1489 HydrophobicContact CE1-CD2 4.05Å; F1485-F1489 AromaticContact CE1-CG 3.79Å; F1485-F1489 HydrophobicContact CE1-CG 3.79Å; F1485-F1489 HydrophobicContact CZ-CB 4.18Å; F1485-F1489 AromaticContact CZ-CD2 3.92Å; F1485-F1489 HydrophobicContact CZ-CD2 3.92Å; F1485-F1489 HydrophobicContact CZ-CG 4.14Å; F1485-F1489 WeakPolarHBondContact O-CB 3.37Å; F1485-F1489 PolarHBondContact O-N 2.64Å
1486	K	82.2	Confident	71	Confident	64 Å²	64	56.5 Å²	56.5	28%	0.278	29%	0.285	S	S	.	.	H	α-helix	trans	-54.7	-49.8	176.7	-81.8	-162.6	175.3	-165	0	110.6	E586 Y667 D1482 A1483 R1488 F1489 F1490	E586-K1486 IonicContact OE1-NZ 2.69Å; E586-K1486 PolarHBondContact OE1-NZ 3.26Å; E586-K1486 VanDerWaalsContact OE1-NZ 3.08Å; Y667-K1486 HydrophobicContact CE1-CG 4.47Å; Y667-K1486 WeakPolarHBondContact OH-CE 3.47Å; D1482-K1486 WeakPolarHBondContact O-CB 3.28Å; D1482-K1486 PolarHBondContact O-N 3.46Å; A1483-K1486 PolarHBondContact O-N 2.88Å; K1486-R1488 PolarHBondContact O-N 3.36Å; K1486-F1489 PolarHBondContact O-N 3.09Å; K1486-F1490 HydrophobicContact CB-CD2 4.29Å; K1486-F1490 HydrophobicContact CB-CE2 4.35Å; K1486-F1490 HydrophobicContact CD-CE2 4.43Å; K1486-F1490 HydrophobicContact CG-CE2 4.19Å; K1486-F1490 WeakPolarHBondContact O-CD2 3.42Å; K1486-F1490 PolarHBondContact O-N 2.94Å
1487	K	80.7	Confident	70.8	Confident	91 Å²	91	50.4 Å²	50.4	40%	0.396	26%	0.261	S	S	.	.	H	α-helix	trans	-50.4	-56.7	176.7	-98	-171.6	-176.6	171.9	0	111.3	I1441 D1442 T1478 A1483 A1484 F1485 A1491	I1441-K1487 HydrophobicContact CG2-CD 3.45Å; I1441-K1487 VanDerWaalsContact CG2-CD 3.45Å; D1442-K1487 IonicContact OD1-NZ 2.89Å; D1442-K1487 PolarHBondContact OD1-NZ 3.45Å; D1442-K1487 IonicContact OD2-NZ 3.76Å; T1478-K1487 HydrophobicContact CG2-CD 4Å; T1478-K1487 PolarHBondContact OG1-NZ 2.96Å; A1483-K1487 WeakPolarHBondContact O-CB 3.17Å; A1483-K1487 PolarHBondContact O-N 3.09Å; A1484-K1487 PolarHBondContact O-N 3.25Å; F1485-K1487 PolarHBondContact O-N 3.39Å; K1487-A1491 WeakPolarHBondContact O-CB 3.27Å; K1487-A1491 PolarHBondContact O-N 2.78Å; K1487-A1491 VanDerWaalsContact O-N 3.12Å
1488	R	80	Confident	70	Confident	54 Å²	54	51.2 Å²	51.2	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-69.7	-40.3	-176.5	-72.9	-169.9	171.1	145.6	8.7	112.8	E1434 L1435 A1437 K1439 I1441 A1484 F1485 K1486 A1491 L1492	E1434-R1488 PolarHBondContact O-NH1 3.46Å; L1435-R1488 HydrophobicContact CD2-CB 3.95Å; L1435-R1488 WeakPolarHBondContact O-CD 3.32Å; A1437-R1488 PolarHBondContact O-NH1 3.49Å; A1437-R1488 PolarHBondContact O-NH2 3.08Å; K1439-R1488 PolarHBondContact O-NH2 3.24Å; I1441-R1488 HydrophobicContact CD1-CG 4.49Å; A1484-R1488 PolarHBondContact O-N 3.28Å; A1484-R1488 VanDerWaalsContact O-N 3.09Å; F1485-R1488 PolarHBondContact O-N 2.99Å; K1486-R1488 PolarHBondContact O-N 3.36Å; R1488-A1491 PolarHBondContact O-N 2.82Å; R1488-L1492 WeakPolarHBondContact O-CG 3.47Å; R1488-L1492 PolarHBondContact O-N 2.95Å
1489	F	79.3	Confident	69.3	Low	2 Å²	2	57.1 Å²	57.1	1%	0.009	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-39.4	-178.6	-176.4	-101.7	0	0	0	112.9	L668 L1435 F1485 K1486 L1524 R1528 L1531	L668-F1489 HydrophobicContact CD2-CE2 3.96Å; L1435-F1489 HydrophobicContact CD1-CD2 4.49Å; F1485-F1489 HydrophobicContact CD1-CB 4.08Å; F1485-F1489 HydrophobicContact CE1-CB 3.7Å; F1485-F1489 HydrophobicContact CE1-CD1 4.39Å; F1485-F1489 HydrophobicContact CE1-CD2 4.05Å; F1485-F1489 AromaticContact CE1-CG 3.79Å; F1485-F1489 HydrophobicContact CE1-CG 3.79Å; F1485-F1489 HydrophobicContact CZ-CB 4.18Å; F1485-F1489 AromaticContact CZ-CD2 3.92Å; F1485-F1489 HydrophobicContact CZ-CD2 3.92Å; F1485-F1489 HydrophobicContact CZ-CG 4.14Å; F1485-F1489 WeakPolarHBondContact O-CB 3.37Å; F1485-F1489 PolarHBondContact O-N 2.64Å; K1486-F1489 PolarHBondContact O-N 3.09Å; F1489-L1524 HydrophobicContact CE2-CD2 4.18Å; F1489-R1528 HydrophobicContact CE1-CB 3.9Å; F1489-R1528 HydrophobicContact CE1-CG 4.07Å; F1489-R1528 HydrophobicContact CZ-CB 3.99Å; F1489-L1531 HydrophobicContact CE1-CD1 4.33Å
1490	F	80.1	Confident	67.8	Low	89 Å²	89	58.9 Å²	58.9	39%	0.39	30%	0.302	S	S	.	.	H	α-helix	trans	-76.9	-35.9	175.4	-71.4	-67.7	0	0	0	112.6	K1486 L1492 R1528 L1532	K1486-F1490 HydrophobicContact CB-CD2 4.29Å; K1486-F1490 HydrophobicContact CB-CE2 4.35Å; K1486-F1490 HydrophobicContact CD-CE2 4.43Å; K1486-F1490 HydrophobicContact CG-CE2 4.19Å; K1486-F1490 WeakPolarHBondContact O-CD2 3.42Å; K1486-F1490 PolarHBondContact O-N 2.94Å; F1490-L1492 VanDerWaalsContact C-N 3.32Å; F1490-L1492 PolarHBondContact O-N 2.92Å; F1490-R1528 HydrophobicContact CD1-CG 3.82Å; F1490-R1528 HydrophobicContact CE1-CG 4.05Å; F1490-R1528 PolarHBondContact O-NH1 3.08Å; F1490-L1532 HydrophobicContact CE1-CD2 4.47Å
1491	A	74.8	Confident	65.6	Low	82 Å²	82	62.6 Å²	62.6	68%	0.678	33%	0.327	S	S	*	.	H	α-helix	trans	-72.8	-15.6	177.8	0	0	0	0	0	115	K1487 R1488 S1493	K1487-A1491 WeakPolarHBondContact O-CB 3.27Å; K1487-A1491 PolarHBondContact O-N 2.78Å; K1487-A1491 VanDerWaalsContact O-N 3.12Å; R1488-A1491 PolarHBondContact O-N 2.82Å; A1491-S1493 PolarHBondContact O-N 3.33Å; A1491-S1493 VanDerWaalsContact O-N 3.13Å
1492	L	70.6	Confident	63.1	Low	14 Å²	14	69.4 Å²	69.4	7%	0.073	37%	0.368	C	S	.	.			trans	-60.9	111.4	175.7	-90.9	170.3	0	0	0	111.5	L1435 R1488 F1490 L1514 I1521 L1524 R1528	L1435-L1492 HydrophobicContact CD1-CD1 4.24Å; L1435-L1492 HydrophobicContact CD2-CD1 3.88Å; R1488-L1492 WeakPolarHBondContact O-CG 3.47Å; R1488-L1492 PolarHBondContact O-N 2.95Å; F1490-L1492 VanDerWaalsContact C-N 3.32Å; F1490-L1492 PolarHBondContact O-N 2.92Å; L1492-L1514 HydrophobicContact CD2-CD1 3.92Å; L1492-I1521 HydrophobicContact CD2-CB 4.48Å; L1492-I1521 HydrophobicContact CD2-CD1 4.32Å; L1492-I1521 HydrophobicContact CD2-CG1 3.96Å; L1492-I1521 HydrophobicContact CD2-CG2 4.02Å; L1492-L1524 HydrophobicContact CD1-CB 4.38Å; L1492-L1524 HydrophobicContact CD1-CD1 3.93Å; L1492-R1528 PolarHBondContact O-NH1 3.33Å
1493	S	62.3	Low	60.6	Low	36 Å²	36	74.4 Å²	74.4	25%	0.252	40%	0.399	S	S	.	.			trans	-137.2	140.4	167.7	-172.3	0	0	0	0	112.9	A1491 E1495 E1525	A1491-S1493 PolarHBondContact O-N 3.33Å; A1491-S1493 VanDerWaalsContact O-N 3.13Å; S1493-E1495 VanDerWaalsContact C-N 3.28Å; S1493-E1495 PolarHBondContact O-N 3.49Å; S1493-E1525 VanDerWaalsContact CA-OE1 3.31Å; S1493-E1525 WeakPolarHBondContact CA-OE1 3.49Å; S1493-E1525 VanDerWaalsContact CB-OE1 3.31Å; S1493-E1525 WeakPolarHBondContact CB-OE1 3.41Å; S1493-E1525 PolarHBondContact OG-OE1 3.13Å
1494	S	57.7	Low	58.2	Low	19 Å²	19	78 Å²	78	13%	0.133	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-10.8	-177.7	61.2	0	0	0	0	114.5	R1518 E1525	S1494-R1518 PolarHBondContact O-NH2 3.49Å; S1494-E1525 VanDerWaalsContact CB-OE2 3.27Å; S1494-E1525 WeakPolarHBondContact CB-OE2 3.5Å; S1494-E1525 PolarHBondContact N-OE2 3.32Å; S1494-E1525 PolarHBondContact OG-OE2 2.97Å
1495	E	50.9	Low	55.7	Low	128 Å²	128	85.1 Å²	85.1	60%	0.598	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-30.3	177.6	-60.2	-152.5	117.3	0	0	113.4	S1493 L1497 K1498	S1493-E1495 VanDerWaalsContact C-N 3.28Å; S1493-E1495 PolarHBondContact O-N 3.49Å; E1495-L1497 PolarHBondContact O-N 3.35Å; E1495-L1497 VanDerWaalsContact O-N 3.14Å; E1495-K1498 WeakPolarHBondContact O-CA 3.34Å; E1495-K1498 WeakPolarHBondContact O-CB 3.42Å; E1495-K1498 PolarHBondContact O-N 2.93Å
1496	H	54.6	Low	52.9	Low	128 Å²	128	93.3 Å²	93.3	59%	0.593	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.9	179.1	-121.1	84.8	0	0	0	113	K1498 Q1511	H1496-K1498 VanDerWaalsContact C-N 3.33Å; H1496-Q1511 PolarHBondContact CD2-NE2 3.38Å; H1496-Q1511 PolarHBondContact NE2-NE2 3.21Å
1497	L	46.8	Very low	50.3	Low	60 Å²	60	93.7 Å²	93.7	31%	0.314	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	1.5	172.6	-92	78	0	0	0	113.9	E1495 M1513 R1518	E1495-L1497 PolarHBondContact O-N 3.35Å; E1495-L1497 VanDerWaalsContact O-N 3.14Å; L1497-M1513 HydrophobicContact CD2-CE 3.81Å; L1497-M1513 HydrophobicContact CG-CE 4.42Å; L1497-R1518 HydrophobicContact CD2-CG 4.26Å; L1497-R1518 VanDerWaalsContact O-CZ 3.3Å; L1497-R1518 PolarHBondContact O-NH1 3.49Å; L1497-R1518 PolarHBondContact O-NH2 3.37Å
1498	K	43.2	Very low	47.7	Very low	143 Å²	143	97.4 Å²	97.4	62%	0.622	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-25.7	-174.8	-142.5	-177.3	-176.8	-169.7	0	112.2	E1495 H1496	E1495-K1498 WeakPolarHBondContact O-CA 3.34Å; E1495-K1498 WeakPolarHBondContact O-CB 3.42Å; E1495-K1498 PolarHBondContact O-N 2.93Å; H1496-K1498 VanDerWaalsContact C-N 3.33Å
1499	N	42.6	Very low	45.2	Very low	139 Å²	139	104.6 Å²	104.6	74%	0.743	57%	0.565	S	S	*	*	S	Bend	trans	-106.4	30	-171.2	-62.1	4.3	0	0	0	113.9	P1501	N1499-P1501 VanDerWaalsContact O-CD 3.29Å; N1499-P1501 WeakPolarHBondContact O-CD 3.42Å
1500	Q	32.6	Very low	43.1	Very low	109 Å²	109	111.1 Å²	111.1	51%	0.509	59%	0.593	S	S	.	*			trans	-98.8	100.4	165.1	-76.7	-169.3	16.3	0	0	109.5
1501	P	32.6	Very low	41.1	Very low	107 Å²	107	113 Å²	113	70%	0.695	60%	0.603	S	S	*	*			trans	-68.6	154.9	169.3	30.6	-34.8	0	0	0	110.8	N1499 T1503	N1499-P1501 VanDerWaalsContact O-CD 3.29Å; N1499-P1501 WeakPolarHBondContact O-CD 3.42Å; P1501-T1503 PolarHBondContact O-N 2.81Å
1502	T	30	Very low	39.6	Very low	142 Å²	142	116.9 Å²	116.9	87%	0.871	60%	0.6	S	S	*	*			trans	-87.4	88.6	-178.7	50.2	0	0	0	0	111.7
1503	T	26.8	Very low	38.4	Very low	116 Å²	116	123.5 Å²	123.5	71%	0.712	63%	0.633	S	S	*	*			trans	-125.1	126.9	165.9	49.3	0	0	0	0	110.1	P1501	P1501-T1503 PolarHBondContact O-N 2.81Å
1504	P	29.7	Very low	37.9	Very low	112 Å²	112	124 Å²	124	73%	0.727	63%	0.632	S	S	*	*			trans	-75.1	173.2	165.7	35.1	-34.9	0	0	0	110.4
1505	I	28.1	Very low	37.9	Very low	151 Å²	151	128.4 Å²	128.4	77%	0.774	66%	0.658	S	S	*	*	S	Bend	trans	78.1	127.5	173.8	-49.6	175.5	0	0	0	114.2
1506	L	26.2	Very low	38.4	Very low	174 Å²	174	123.3 Å²	123.3	91%	0.911	64%	0.635	S	S	*	*	S	Bend	trans	27.7	93.7	174.5	-76.6	87.1	0	0	0	119.2
1507	G	25.8	Very low	38.7	Very low	72 Å²	72	126.7 Å²	126.7	74%	0.742	64%	0.643	S	S	*	*			trans	-167.5	122.4	160.2	0	0	0	0	0	111.1	R1509	G1507-R1509 PolarHBondContact O-N 2.89Å
1508	F	26.6	Very low	39.5	Very low	168 Å²	168	128.8 Å²	128.8	74%	0.737	65%	0.647	S	S	*	*			trans	-77.5	92.7	-165.9	-114.1	-80.4	0	0	0	113.8	F1451 K1510	F1451-F1508 HydrophobicContact CE2-CB 4.27Å; F1451-F1508 HydrophobicContact CZ-CB 4.28Å; F1508-K1510 PolarHBondContact O-N 2.65Å
1509	R	28.4	Very low	40.4	Very low	206 Å²	206	124 Å²	124	78%	0.777	63%	0.631	S	S	*	*			trans	-55.7	118.6	164.5	-82.8	178.3	157.5	173.2	-5.6	111	G1507	G1507-R1509 PolarHBondContact O-N 2.89Å
1510	K	34.2	Very low	41.5	Very low	139 Å²	139	118.2 Å²	118.2	60%	0.604	60%	0.601	S	S	*	*			trans	-131.9	-1.2	168.7	-97.4	-169.6	178.8	-178.5	0	117.9	A1447 F1508 R1512	A1447-K1510 HydrophobicContact CB-CD 4.34Å; F1508-K1510 PolarHBondContact O-N 2.65Å; K1510-R1512 PolarHBondContact O-N 2.89Å
1511	Q	38.9	Very low	43.3	Very low	129 Å²	129	113.7 Å²	113.7	60%	0.603	58%	0.58	S	S	*	*			trans	-64.2	98.8	162.6	-77.7	-174.1	-10.1	0	0	109.4	H1496 M1513	H1496-Q1511 PolarHBondContact CD2-NE2 3.38Å; H1496-Q1511 PolarHBondContact NE2-NE2 3.21Å; Q1511-M1513 PolarHBondContact O-N 2.85Å; Q1511-M1513 VanDerWaalsContact O-N 3.08Å
1512	R	43	Very low	45.1	Very low	162 Å²	162	115 Å²	115	61%	0.611	57%	0.571	S	S	*	*			trans	-67.2	105.6	174.2	-78.5	-175.1	177.2	135.6	-6.1	108.6	E1443 K1510 L1514	E1443-R1512 IonicContact OE1-NH1 3.75Å; E1443-R1512 IonicContact OE2-CZ 2.66Å; E1443-R1512 IonicContact OE2-NH1 2.93Å; E1443-R1512 PolarHBondContact OE2-NH1 3.47Å; E1443-R1512 IonicContact OE2-NH2 3.77Å; K1510-R1512 PolarHBondContact O-N 2.89Å; R1512-L1514 PolarHBondContact O-N 2.97Å
1513	M	45.5	Very low	46.9	Very low	153 Å²	153	108.3 Å²	108.3	75%	0.754	53%	0.53	S	S	*	.			trans	-55.5	127.9	-177.3	-128.1	170.7	-178.5	0	0	111.5	L1497 Q1511	L1497-M1513 HydrophobicContact CD2-CE 3.81Å; L1497-M1513 HydrophobicContact CG-CE 4.42Å; Q1511-M1513 PolarHBondContact O-N 2.85Å; Q1511-M1513 VanDerWaalsContact O-N 3.08Å
1514	L	51.7	Low	49.1	Very low	48 Å²	48	102.8 Å²	102.8	25%	0.251	50%	0.496	S	S	.	.			trans	-58.6	141.7	157.9	-75.9	163.4	0	0	0	108.5	L1435 L1492 R1512 L1516	L1435-L1514 HydrophobicContact CD2-CD1 3.87Å; L1435-L1514 HydrophobicContact CD2-CD2 4.23Å; L1492-L1514 HydrophobicContact CD2-CD1 3.92Å; R1512-L1514 PolarHBondContact O-N 2.97Å; L1514-L1516 HydrophobicContact CB-CB 4.44Å; L1514-L1516 HydrophobicContact CB-CD1 4.41Å; L1514-L1516 HydrophobicContact CB-CG 4.25Å; L1514-L1516 HydrophobicContact CD1-CD1 4.34Å; L1514-L1516 PolarHBondContact O-N 3.43Å; L1514-L1516 VanDerWaalsContact O-N 3.08Å
1515	T	57.8	Low	51.3	Low	110 Å²	110	98.6 Å²	98.6	68%	0.675	47%	0.467	S	S	*	.	S	Bend	trans	-68.9	-3.2	179.5	7.9	0	0	0	0	113.7	E1434	E1434-T1515 WeakPolarHBondContact OE1-CB 3.25Å; E1434-T1515 PolarHBondContact OE1-OG1 3.2Å; E1434-T1515 PolarHBondContact OE2-OG1 3.43Å
1516	L	60.2	Low	53.4	Low	22 Å²	22	97.1 Å²	97.1	12%	0.115	46%	0.456	C	S	.	.	S	Bend	trans	-69.5	135.1	179	-55.8	177.8	0	0	0	112.7	I1431 E1434 L1435 L1514 T1520 I1521 L1524	I1431-L1516 HydrophobicContact CB-CD2 4.34Å; I1431-L1516 HydrophobicContact CG1-CD2 3.84Å; I1431-L1516 HydrophobicContact CG2-CD1 4.21Å; I1431-L1516 HydrophobicContact CG2-CD2 4.05Å; E1434-L1516 VanDerWaalsContact OE2-CD2 3.26Å; E1434-L1516 WeakPolarHBondContact OE2-CD2 3.44Å; L1435-L1516 HydrophobicContact CD2-CD1 4.22Å; L1514-L1516 HydrophobicContact CB-CB 4.44Å; L1514-L1516 HydrophobicContact CB-CD1 4.41Å; L1514-L1516 HydrophobicContact CB-CG 4.25Å; L1514-L1516 HydrophobicContact CD1-CD1 4.34Å; L1514-L1516 PolarHBondContact O-N 3.43Å; L1514-L1516 VanDerWaalsContact O-N 3.08Å; L1516-T1520 HydrophobicContact CD2-CG2 4.32Å; L1516-I1521 HydrophobicContact CB-CG1 4.21Å; L1516-L1524 HydrophobicContact CD1-CD1 4.04Å
1517	R	61.3	Low	55.5	Low	199 Å²	199	90.5 Å²	90.5	75%	0.751	42%	0.42	S	S	*	.			trans	-68.7	152.1	174.1	-71.7	-176.9	172.7	-171.1	-3.1	111.5	S1519 T1520 I1521	R1517-S1519 PolarHBondContact O-N 3.1Å; R1517-S1519 VanDerWaalsContact O-N 3.15Å; R1517-T1520 WeakPolarHBondContact O-CA 3.26Å; R1517-T1520 VanDerWaalsContact O-CB 3.23Å; R1517-T1520 WeakPolarHBondContact O-CB 3.46Å; R1517-T1520 PolarHBondContact O-N 2.92Å; R1517-I1521 PolarHBondContact O-N 3.4Å
1518	R	63.7	Low	58	Low	104 Å²	104	88.7 Å²	88.7	39%	0.392	39%	0.39	S	S	.	.	H	α-helix	trans	-58.2	-29.1	-178.5	-164.2	174.7	-174.3	160.5	7.3	114.2	S1494 L1497 R1522	S1494-R1518 PolarHBondContact O-NH2 3.49Å; L1497-R1518 HydrophobicContact CD2-CG 4.26Å; L1497-R1518 VanDerWaalsContact O-CZ 3.3Å; L1497-R1518 PolarHBondContact O-NH1 3.49Å; L1497-R1518 PolarHBondContact O-NH2 3.37Å; R1518-R1522 PolarHBondContact O-N 3.29Å
1519	S	62	Low	60.4	Low	42 Å²	42	83.9 Å²	83.9	29%	0.294	37%	0.372	S	S	.	.	H	α-helix	trans	-71.6	-44.2	170.6	42.8	0	0	0	0	112.7	E1420 R1517 I1521 R1522 A1523	E1420-S1519 WeakPolarHBondContact OE1-CB 3.43Å; R1517-S1519 PolarHBondContact O-N 3.1Å; R1517-S1519 VanDerWaalsContact O-N 3.15Å; S1519-I1521 PolarHBondContact O-N 2.81Å; S1519-R1522 WeakPolarHBondContact O-CB 3.33Å; S1519-R1522 PolarHBondContact O-N 2.92Å; S1519-A1523 PolarHBondContact O-N 2.85Å
1520	T	66.4	Low	62.5	Low	17 Å²	17	77.1 Å²	77.1	10%	0.104	36%	0.356	C	S	.	.	H	α-helix	trans	-55.8	-41.3	172.2	-43.6	0	0	0	0	111.1	V1424 I1431 L1516 R1517 A1523 L1524	V1424-T1520 HydrophobicContact CG2-CG2 3.94Å; I1431-T1520 HydrophobicContact CD1-CG2 3.82Å; L1516-T1520 HydrophobicContact CD2-CG2 4.32Å; R1517-T1520 WeakPolarHBondContact O-CA 3.26Å; R1517-T1520 VanDerWaalsContact O-CB 3.23Å; R1517-T1520 WeakPolarHBondContact O-CB 3.46Å; R1517-T1520 PolarHBondContact O-N 2.92Å; T1520-A1523 PolarHBondContact O-N 2.86Å; T1520-L1524 HydrophobicContact CG2-CD1 4.37Å; T1520-L1524 VanDerWaalsContact O-CG 3.25Å; T1520-L1524 WeakPolarHBondContact O-CG 3.47Å; T1520-L1524 PolarHBondContact O-N 2.98Å
1521	I	70.3	Confident	64.1	Low	14 Å²	14	72.3 Å²	72.3	7%	0.072	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-44.3	173.8	-65.8	175.2	0	0	0	111.5	L1492 L1516 R1517 S1519 L1524 E1525	L1492-I1521 HydrophobicContact CD2-CB 4.48Å; L1492-I1521 HydrophobicContact CD2-CD1 4.32Å; L1492-I1521 HydrophobicContact CD2-CG1 3.96Å; L1492-I1521 HydrophobicContact CD2-CG2 4.02Å; L1516-I1521 HydrophobicContact CB-CG1 4.21Å; R1517-I1521 PolarHBondContact O-N 3.4Å; S1519-I1521 PolarHBondContact O-N 2.81Å; I1521-L1524 PolarHBondContact O-N 3.21Å; I1521-E1525 VanDerWaalsContact O-CB 3.3Å; I1521-E1525 WeakPolarHBondContact O-CB 3.48Å; I1521-E1525 PolarHBondContact O-N 3.33Å
1522	R	69.5	Low	65.6	Low	135 Å²	135	70.3 Å²	70.3	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-64.1	-42.3	176.8	-81.4	-179.1	166.9	175.3	-4.8	113.5	R1518 S1519 L1524 E1525 Q1526	R1518-R1522 PolarHBondContact O-N 3.29Å; S1519-R1522 WeakPolarHBondContact O-CB 3.33Å; S1519-R1522 PolarHBondContact O-N 2.92Å; R1522-L1524 VanDerWaalsContact C-N 3.34Å; R1522-E1525 PolarHBondContact O-N 2.96Å; R1522-Q1526 PolarHBondContact O-N 3.43Å
1523	A	68	Low	66.5	Low	1 Å²	1	69.9 Å²	69.9	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-67.8	-33.9	178	0	0	0	0	0	112.3	E1420 V1424 S1519 T1520 R1527	E1420-A1523 HydrophobicContact CB-CB 4.1Å; V1424-A1523 HydrophobicContact CG2-CB 3.64Å; S1519-A1523 PolarHBondContact O-N 2.85Å; T1520-A1523 PolarHBondContact O-N 2.86Å; A1523-R1527 PolarHBondContact O-N 3.09Å
1524	L	72.8	Confident	67	Low	1 Å²	1	65.9 Å²	65.9	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-67.3	-42.5	169	-69	166.9	0	0	0	111.5	L668 V1424 I1431 L1435 F1489 L1492 L1516 T1520 I1521 R1522 R1527 R1528	L668-L1524 HydrophobicContact CD2-CD2 3.59Å; V1424-L1524 HydrophobicContact CG1-CD2 3.91Å; V1424-L1524 HydrophobicContact CG2-CG 4.48Å; I1431-L1524 HydrophobicContact CG2-CD1 4.02Å; I1431-L1524 HydrophobicContact CG2-CD2 4.45Å; L1435-L1524 HydrophobicContact CD1-CD1 4.49Å; F1489-L1524 HydrophobicContact CE2-CD2 4.18Å; L1492-L1524 HydrophobicContact CD1-CB 4.38Å; L1492-L1524 HydrophobicContact CD1-CD1 3.93Å; L1516-L1524 HydrophobicContact CD1-CD1 4.04Å; T1520-L1524 HydrophobicContact CG2-CD1 4.37Å; T1520-L1524 VanDerWaalsContact O-CG 3.25Å; T1520-L1524 WeakPolarHBondContact O-CG 3.47Å; T1520-L1524 PolarHBondContact O-N 2.98Å; I1521-L1524 PolarHBondContact O-N 3.21Å; R1522-L1524 VanDerWaalsContact C-N 3.34Å; L1524-R1527 PolarHBondContact O-N 3.34Å; L1524-R1528 PolarHBondContact O-N 3.47Å
1525	E	76	Confident	67	Low	23 Å²	23	68.3 Å²	68.3	11%	0.107	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-40.3	176.7	176.1	153.2	-125.2	0	0	112	S1493 S1494 I1521 R1522 R1528 N1529	S1493-E1525 VanDerWaalsContact CA-OE1 3.31Å; S1493-E1525 WeakPolarHBondContact CA-OE1 3.49Å; S1493-E1525 VanDerWaalsContact CB-OE1 3.31Å; S1493-E1525 WeakPolarHBondContact CB-OE1 3.41Å; S1493-E1525 PolarHBondContact OG-OE1 3.13Å; S1494-E1525 VanDerWaalsContact CB-OE2 3.27Å; S1494-E1525 WeakPolarHBondContact CB-OE2 3.5Å; S1494-E1525 PolarHBondContact N-OE2 3.32Å; S1494-E1525 PolarHBondContact OG-OE2 2.97Å; I1521-E1525 VanDerWaalsContact O-CB 3.3Å; I1521-E1525 WeakPolarHBondContact O-CB 3.48Å; I1521-E1525 PolarHBondContact O-N 3.33Å; R1522-E1525 PolarHBondContact O-N 2.96Å; E1525-R1528 PolarHBondContact O-N 3.34Å; E1525-R1528 IonicContact OE1-CZ 3.12Å; E1525-R1528 IonicContact OE1-NH1 3.65Å; E1525-R1528 IonicContact OE1-NH2 3.25Å; E1525-R1528 PolarHBondContact OE1-NH2 2.98Å; E1525-N1529 VanDerWaalsContact O-CB 3.29Å; E1525-N1529 WeakPolarHBondContact O-CB 3.27Å; E1525-N1529 PolarHBondContact O-N 3.25Å; E1525-N1529 PolarHBondContact O-ND2 2.92Å; E1525-N1529 PolarHBondContact O-OD1 2.95Å
1526	Q	73.7	Confident	66.4	Low	120 Å²	120	67.6 Å²	67.6	56%	0.561	34%	0.337	S	S	*	.	H	α-helix	trans	-61.2	-43.4	171.1	-78.8	-177.3	-43.8	0	0	112.4	R1522 N1529 S1530	R1522-Q1526 PolarHBondContact O-N 3.43Å; Q1526-N1529 PolarHBondContact O-N 3.1Å; Q1526-S1530 PolarHBondContact O-N 3.4Å
1527	R	70.6	Confident	65.3	Low	36 Å²	36	70.3 Å²	70.3	14%	0.136	36%	0.359	C	S	.	.	H	α-helix	trans	-65.2	-43.2	175.7	-96.6	175.5	156.4	98.6	-8.9	112.9	L668 A1523 L1524 N1529 S1530 L1531	L668-R1527 PolarHBondContact O-NE 2.95Å; L668-R1527 PolarHBondContact O-NH2 3.16Å; A1523-R1527 PolarHBondContact O-N 3.09Å; L1524-R1527 PolarHBondContact O-N 3.34Å; R1527-N1529 VanDerWaalsContact C-N 3.29Å; R1527-N1529 PolarHBondContact O-N 3.31Å; R1527-S1530 PolarHBondContact O-N 3.36Å; R1527-S1530 PolarHBondContact O-OG 3.26Å; R1527-L1531 PolarHBondContact O-N 2.93Å
1528	R	78.2	Confident	64	Low	33 Å²	33	69.2 Å²	69.2	13%	0.125	35%	0.354	C	S	.	.	H	α-helix	trans	-56.1	-47.5	171.9	-175.7	-161.4	68.3	-160.5	-13.5	110.3	F1489 F1490 L1492 L1524 E1525 S1530 L1531 L1532	F1489-R1528 HydrophobicContact CE1-CB 3.9Å; F1489-R1528 HydrophobicContact CE1-CG 4.07Å; F1489-R1528 HydrophobicContact CZ-CB 3.99Å; F1490-R1528 HydrophobicContact CD1-CG 3.82Å; F1490-R1528 HydrophobicContact CE1-CG 4.05Å; F1490-R1528 PolarHBondContact O-NH1 3.08Å; L1492-R1528 PolarHBondContact O-NH1 3.33Å; L1524-R1528 PolarHBondContact O-N 3.47Å; E1525-R1528 PolarHBondContact O-N 3.34Å; E1525-R1528 IonicContact OE1-CZ 3.12Å; E1525-R1528 IonicContact OE1-NH1 3.65Å; E1525-R1528 IonicContact OE1-NH2 3.25Å; E1525-R1528 PolarHBondContact OE1-NH2 2.98Å; R1528-S1530 VanDerWaalsContact C-N 3.33Å; R1528-S1530 PolarHBondContact O-N 3.06Å; R1528-L1531 PolarHBondContact O-N 3.4Å; R1528-L1532 HydrophobicContact CG-CD1 4.09Å; R1528-L1532 WeakPolarHBondContact O-CG 3.4Å; R1528-L1532 PolarHBondContact O-N 3.42Å
1529	N	76.7	Confident	62.4	Low	67 Å²	67	69.3 Å²	69.3	36%	0.358	37%	0.368	S	S	.	.	H	α-helix	trans	-70.1	-27.4	-178.1	-64.2	-3.7	0	0	0	112.6	E1525 Q1526 R1527 K1533	E1525-N1529 VanDerWaalsContact O-CB 3.29Å; E1525-N1529 WeakPolarHBondContact O-CB 3.27Å; E1525-N1529 PolarHBondContact O-N 3.25Å; E1525-N1529 PolarHBondContact O-ND2 2.92Å; E1525-N1529 PolarHBondContact O-OD1 2.95Å; Q1526-N1529 PolarHBondContact O-N 3.1Å; R1527-N1529 VanDerWaalsContact C-N 3.29Å; R1527-N1529 PolarHBondContact O-N 3.31Å; N1529-K1533 WeakPolarHBondContact O-CG 3.45Å; N1529-K1533 PolarHBondContact O-N 3.34Å; N1529-K1533 VanDerWaalsContact O-N 3.13Å
1530	S	71.9	Confident	60.8	Low	64 Å²	64	75.1 Å²	75.1	45%	0.448	40%	0.396	S	S	.	.	H	α-helix	trans	-74.8	-41.1	173.3	75.6	0	0	0	0	112.4	Q1526 R1527 R1528 L1532 K1533 T1534	Q1526-S1530 PolarHBondContact O-N 3.4Å; R1527-S1530 PolarHBondContact O-N 3.36Å; R1527-S1530 PolarHBondContact O-OG 3.26Å; R1528-S1530 VanDerWaalsContact C-N 3.33Å; R1528-S1530 PolarHBondContact O-N 3.06Å; S1530-L1532 PolarHBondContact O-N 2.97Å; S1530-K1533 WeakPolarHBondContact O-CB 3.29Å; S1530-K1533 PolarHBondContact O-N 2.85Å; S1530-K1533 VanDerWaalsContact O-N 3.17Å; S1530-T1534 PolarHBondContact O-N 2.92Å; S1530-T1534 PolarHBondContact O-OG1 3.32Å; S1530-T1534 VanDerWaalsContact O-OG1 3.13Å
1531	L	67.2	Low	59	Low	38 Å²	38	80.9 Å²	80.9	20%	0.199	43%	0.431	C	S	.	.	H	α-helix	trans	-57.8	-47.3	172.3	-73.7	174.7	0	0	0	111.9	Y667 K669 F1489 R1527 R1528 K1533 T1534 S1535	Y667-L1531 WeakPolarHBondContact O-CD1 3.11Å; K669-L1531 HydrophobicContact CD-CD2 4.48Å; F1489-L1531 HydrophobicContact CE1-CD1 4.33Å; R1527-L1531 PolarHBondContact O-N 2.93Å; R1528-L1531 PolarHBondContact O-N 3.4Å; L1531-K1533 VanDerWaalsContact C-N 3.3Å; L1531-K1533 PolarHBondContact O-N 2.88Å; L1531-T1534 WeakPolarHBondContact CA-OG1 3.35Å; L1531-T1534 PolarHBondContact O-N 3.05Å; L1531-T1534 PolarHBondContact O-OG1 2.85Å; L1531-S1535 PolarHBondContact O-N 3.38Å; L1531-S1535 VanDerWaalsContact O-N 3.1Å
1532	L	71.3	Confident	56.9	Low	88 Å²	88	88 Å²	88	46%	0.461	47%	0.467	S	S	.	.	H	α-helix	trans	-60.3	-39.2	175.9	-71.2	167.8	0	0	0	111.6	F1490 R1528 S1530 S1535 S1536	F1490-L1532 HydrophobicContact CE1-CD2 4.47Å; R1528-L1532 HydrophobicContact CG-CD1 4.09Å; R1528-L1532 WeakPolarHBondContact O-CG 3.4Å; R1528-L1532 PolarHBondContact O-N 3.42Å; S1530-L1532 PolarHBondContact O-N 2.97Å; L1532-S1535 PolarHBondContact O-N 2.79Å; L1532-S1536 PolarHBondContact O-N 2.81Å; L1532-S1536 VanDerWaalsContact O-N 3.07Å; L1532-S1536 PolarHBondContact O-OG 3.27Å
1533	K	62.1	Low	54.8	Low	152 Å²	152	87.3 Å²	87.3	66%	0.661	48%	0.483	S	S	*	.	H	α-helix	trans	-63.4	-44.2	175.1	-81.5	-177	176.7	-170.2	0	112.8	N1529 S1530 L1531 S1535 S1536 S1537	N1529-K1533 WeakPolarHBondContact O-CG 3.45Å; N1529-K1533 PolarHBondContact O-N 3.34Å; N1529-K1533 VanDerWaalsContact O-N 3.13Å; S1530-K1533 WeakPolarHBondContact O-CB 3.29Å; S1530-K1533 PolarHBondContact O-N 2.85Å; S1530-K1533 VanDerWaalsContact O-N 3.17Å; L1531-K1533 VanDerWaalsContact C-N 3.3Å; L1531-K1533 PolarHBondContact O-N 2.88Å; K1533-S1535 VanDerWaalsContact C-N 3.29Å; K1533-S1535 PolarHBondContact O-N 3.26Å; K1533-S1536 WeakPolarHBondContact CA-OG 3.31Å; K1533-S1536 PolarHBondContact O-N 3.07Å; K1533-S1536 VanDerWaalsContact O-N 3.12Å; K1533-S1536 PolarHBondContact O-OG 3.3Å; K1533-S1537 PolarHBondContact O-N 3.26Å; K1533-S1537 PolarHBondContact O-OG 3.18Å
1534	T	55.5	Low	52.8	Low	70 Å²	70	91.4 Å²	91.4	43%	0.429	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-34.5	175.1	31.3	0	0	0	0	113.1	S1530 L1531 S1537	S1530-T1534 PolarHBondContact O-N 2.92Å; S1530-T1534 PolarHBondContact O-OG1 3.32Å; S1530-T1534 VanDerWaalsContact O-OG1 3.13Å; L1531-T1534 WeakPolarHBondContact CA-OG1 3.35Å; L1531-T1534 PolarHBondContact O-N 3.05Å; L1531-T1534 PolarHBondContact O-OG1 2.85Å; T1534-S1537 PolarHBondContact O-N 3.01Å; T1534-S1537 PolarHBondContact O-OG 3.39Å
1535	S	52.4	Low	50.6	Low	98 Å²	98	102.2 Å²	102.2	69%	0.685	55%	0.554	S	S	*	*	H	α-helix	trans	-65.6	-38.3	172.9	175.6	0	0	0	0	112.1	L1531 L1532 K1533 S1537	L1531-S1535 PolarHBondContact O-N 3.38Å; L1531-S1535 VanDerWaalsContact O-N 3.1Å; L1532-S1535 PolarHBondContact O-N 2.79Å; K1533-S1535 VanDerWaalsContact C-N 3.29Å; K1533-S1535 PolarHBondContact O-N 3.26Å; S1535-S1537 VanDerWaalsContact C-N 3.29Å; S1535-S1537 PolarHBondContact O-N 3.37Å
1536	S	44.6	Very low	48.1	Very low	95 Å²	95	106 Å²	106	66%	0.664	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-4.1	179	66.6	0	0	0	0	115.7	L1532 K1533	L1532-S1536 PolarHBondContact O-N 2.81Å; L1532-S1536 VanDerWaalsContact O-N 3.07Å; L1532-S1536 PolarHBondContact O-OG 3.27Å; K1533-S1536 WeakPolarHBondContact CA-OG 3.31Å; K1533-S1536 PolarHBondContact O-N 3.07Å; K1533-S1536 VanDerWaalsContact O-N 3.12Å; K1533-S1536 PolarHBondContact O-OG 3.3Å
1537	S	37.6	Very low	45.8	Very low	80 Å²	80	107.1 Å²	107.1	56%	0.559	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.9	20.2	-169.7	66.6	0	0	0	0	115.6	K1533 T1534 S1535 P1539	K1533-S1537 PolarHBondContact O-N 3.26Å; K1533-S1537 PolarHBondContact O-OG 3.18Å; T1534-S1537 PolarHBondContact O-N 3.01Å; T1534-S1537 PolarHBondContact O-OG 3.39Å; S1535-S1537 VanDerWaalsContact C-N 3.29Å; S1535-S1537 PolarHBondContact O-N 3.37Å; S1537-P1539 WeakPolarHBondContact O-CD 3.37Å
1538	R	32.9	Very low	43.6	Very low	176 Å²	176	109.7 Å²	109.7	66%	0.664	63%	0.628	S	S	*	*			trans	-86.1	112.4	161.9	-81.1	-174.6	175.9	172.7	0.6	108.6	D585	D585-R1538 IonicContact OD1-CZ 3.87Å; D585-R1538 IonicContact OD1-NH1 2.66Å; D585-R1538 PolarHBondContact OD1-NH1 3.38Å; D585-R1538 IonicContact OD1-NH2 2.66Å; D585-R1538 PolarHBondContact OD1-NH2 3.28Å
1539	P	30.4	Very low	41.2	Very low	105 Å²	105	113.9 Å²	113.9	68%	0.682	66%	0.662	S	S	*	*			trans	-75.3	165.4	174.3	33.5	-35.7	0	0	0	111.5	S1537 V1541	S1537-P1539 WeakPolarHBondContact O-CD 3.37Å; P1539-V1541 PolarHBondContact O-N 2.79Å
1540	D	27.9	Very low	38.6	Very low	165 Å²	165	121.8 Å²	121.8	88%	0.882	69%	0.687	S	S	*	*			trans	-59.5	117.8	-169.5	-53.1	-83.1	0	0	0	114.3
1541	V	28.6	Very low	36.4	Very low	137 Å²	137	126.9 Å²	126.9	83%	0.83	70%	0.703	S	S	*	*			trans	-128	53.1	165.1	-166.6	0	0	0	0	109.3	P1539	P1539-V1541 PolarHBondContact O-N 2.79Å
1542	I	27.7	Very low	34.6	Very low	163 Å²	163	130.8 Å²	130.8	84%	0.836	72%	0.724	S	S	*	*			trans	-130.3	79.8	166.6	-54.5	-179.1	0	0	0	107.1
1543	S	25.6	Very low	32.7	Very low	121 Å²	121	135.1 Å²	135.1	85%	0.846	74%	0.742	S	S	*	*			trans	-141.4	34.8	-179.2	-175.6	0	0	0	0	112
1544	S	25.6	Very low	31	Very low	88 Å²	88	139.2 Å²	139.2	62%	0.615	75%	0.753	S	S	*	*	S	Bend	trans	-156.1	159.4	166.5	48.1	0	0	0	0	108
1545	Y	27.1	Very low	30	Very low	227 Å²	227	138.5 Å²	138.5	89%	0.89	76%	0.76	S	S	*	*			trans	63.5	63.1	-171.3	-53.5	-72.9	0	0	0	114.9
1546	S	23.7	Very low	29	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	76%	0.762	S	S	*	*			trans	-68.3	168.3	146.5	50.3	0	0	0	0	111
1547	T	25.2	Very low	28.6	Very low	143 Å²	143	139.1 Å²	139.1	88%	0.877	77%	0.767	S	S	*	*	S	Bend	trans	64.8	61.9	171	47.7	0	0	0	0	117.7
1548	A	24.7	Very low	28.4	Very low	90 Å²	90	145.1 Å²	145.1	74%	0.744	78%	0.778	S	S	*	*	S	Bend	trans	-150.1	164.3	142.8	0	0	0	0	0	110
1549	S	27	Very low	28.5	Very low	120 Å²	120	144.9 Å²	144.9	84%	0.839	78%	0.776	S	S	*	*			trans	40.1	99.2	172.5	50.4	0	0	0	0	119.1
1550	R	22.2	Very low	28.8	Very low	233 Å²	233	144.3 Å²	144.3	88%	0.879	77%	0.774	S	S	*	*			trans	-84.8	165.4	143.5	-79	179.9	170	172.6	-2.8	109
1551	Q	25.1	Very low	29.1	Very low	171 Å²	171	143.4 Å²	143.4	80%	0.799	77%	0.769	S	S	*	*			trans	65.2	97.1	174.2	-66.3	158	-104.7	0	0	116.1
1552	L	29.7	Very low	29.3	Very low	121 Å²	121	142.6 Å²	142.6	63%	0.634	76%	0.756	S	S	*	*				-158.7	-176.6	111.7	-130.8	68.9	0	0	0	110.7
1553	Q	30.8	Very low	29.6	Very low	179 Å²	179	145 Å²	145	84%	0.836	75%	0.754	S	S	*	*			trans	-86.3	139.1	-150.1	-57	-172	15.1	0	0	116.3	G1555	Q1553-G1555 PolarHBondContact O-N 2.88Å
1554	R	27.7	Very low	30	Very low	237 Å²	237	147.4 Å²	147.4	89%	0.894	75%	0.754	S	S	*	*			trans	-81.4	113.7	172.8	-69.7	-179.9	176	177.2	-0.7	111.7
1555	G	34.2	Very low	30.4	Very low	55 Å²	55	150.2 Å²	150.2	57%	0.567	76%	0.762	S	S	*	*			trans	-65.1	165.2	-178.5	0	0	0	0	0	116.1	Q1553 A1557	Q1553-G1555 PolarHBondContact O-N 2.88Å; G1555-A1557 PolarHBondContact O-N 3.26Å
1556	P	31.4	Very low	30.4	Very low	112 Å²	112	146.2 Å²	146.2	73%	0.727	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-73	-16.7	-161.2	-21.3	34.6	0	0	0	116.7	R1558 R1559	P1556-R1558 PolarHBondContact O-N 2.96Å; P1556-R1559 PolarHBondContact O-N 3.48Å
1557	A	36.1	Very low	30.6	Very low	94 Å²	94	151 Å²	151	78%	0.777	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-61.9	-35	-163.6	0	0	0	0	0	114.9	G1555 R1559	G1555-A1557 PolarHBondContact O-N 3.26Å; A1557-R1559 PolarHBondContact O-N 3.18Å
1558	R	33.2	Very low	30.7	Very low	207 Å²	207	147.9 Å²	147.9	78%	0.781	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-68.5	-30.1	179.1	-94.7	-174.8	172.9	173.6	-1	113.9	P1556 C1560 L1561 E1562	P1556-R1558 PolarHBondContact O-N 2.96Å; R1558-C1560 PolarHBondContact O-N 3.23Å; R1558-L1561 PolarHBondContact O-N 2.91Å; R1558-E1562 PolarHBondContact O-N 3.01Å
1559	R	35	Very low	30.8	Very low	170 Å²	170	152.8 Å²	152.8	64%	0.642	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-66.6	-10.6	-173	-65	-174.5	-177.7	170.7	2.5	114.7	P1556 A1557 R1563	P1556-R1559 PolarHBondContact O-N 3.48Å; A1557-R1559 PolarHBondContact O-N 3.18Å; R1559-R1563 WeakPolarHBondContact O-CG 3.25Å
1560	C	35.9	Very low	30.8	Very low	93 Å²	93	152.4 Å²	152.4	63%	0.628	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-81.6	-42.2	175.8	-156	0	0	0	0	111.8	R1558 R1563	R1558-C1560 PolarHBondContact O-N 3.23Å; C1560-R1563 PolarHBondContact O-N 2.95Å
1561	L	33.7	Very low	31.1	Very low	147 Å²	147	148.6 Å²	148.6	77%	0.77	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-41.8	-177.7	-136.6	75.7	0	0	0	111.6	R1558 R1563 M1564	R1558-L1561 PolarHBondContact O-N 2.91Å; L1561-R1563 PolarHBondContact O-N 3.2Å; L1561-M1564 PolarHBondContact O-N 3.15Å
1562	E	33.8	Very low	31.3	Very low	120 Å²	120	147 Å²	147	56%	0.561	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-24.7	177.5	-66.9	171.5	149.1	0	0	112.7	R1558	R1558-E1562 PolarHBondContact O-N 3.01Å
1563	R	34	Very low	31.2	Very low	214 Å²	214	144 Å²	144	81%	0.808	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-15.9	179.7	-86.7	-176.2	170.3	-172.7	-2.5	115	R1559 C1560 L1561	R1559-R1563 WeakPolarHBondContact O-CG 3.25Å; C1560-R1563 PolarHBondContact O-N 2.95Å; L1561-R1563 PolarHBondContact O-N 3.2Å
1564	M	34.4	Very low	31.1	Very low	171 Å²	171	141.5 Å²	141.5	84%	0.842	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-14.8	174.8	-75.7	-174.9	160.7	0	0	113.4	L1561	L1561-M1564 PolarHBondContact O-N 3.15Å
1565	N	33.6	Very low	31.1	Very low	147 Å²	147	139.7 Å²	139.7	79%	0.786	75%	0.752	S	S	*	*	S	Bend	trans	-115.5	16.7	-171.5	-141.5	51.2	0	0	0	113.7
1566	N	27.7	Very low	30.9	Very low	142 Å²	142	145.8 Å²	145.8	76%	0.759	76%	0.763	S	S	*	*	S	Bend	trans	-151.6	55	-173.4	-112.1	-22.5	0	0	0	113.3
1567	K	27	Very low	30.8	Very low	204 Å²	204	143.7 Å²	143.7	89%	0.887	76%	0.755	S	S	*	*			trans	-150.4	116.1	163.4	-86.1	-154.4	171.7	-165.8	0	112.1
1568	G	27	Very low	30.4	Very low	79 Å²	79	144.7 Å²	144.7	81%	0.814	76%	0.757	S	S	*	*			trans	90.1	96.5	176.8	0	0	0	0	0	111.5
1569	E	26.2	Very low	30.2	Very low	193 Å²	193	140 Å²	140	90%	0.902	76%	0.756	S	S	*	*				-151.9	170.4	63.7	-89.5	177.5	173.1	0	0	113.7
1570	S	27.8	Very low	29.8	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	76%	0.764	S	S	*	*			trans	99	135.7	175.6	76.9	0	0	0	0	116.7
1571	N	27.8	Very low	29.4	Very low	153 Å²	153	136 Å²	136	82%	0.818	77%	0.765	S	S	*	*			cis	-162.7	-176.5	-33.1	-131	-32.5	0	0	0	110.3
1572	V	29.6	Very low	28.9	Very low	139 Å²	139	134.7 Å²	134.7	84%	0.842	77%	0.768	S	S	*	*			trans	82.4	126.1	177.9	-168.6	0	0	0	0	113.9
1573	G	28.4	Very low	28.4	Very low	56 Å²	56	133.4 Å²	133.4	58%	0.577	77%	0.773	S	S	*	*			cis	150.8	167	-9.7	0	0	0	0	0	113.9
1574	T	29.3	Very low	28.1	Very low	127 Å²	127	129.3 Å²	129.3	78%	0.779	77%	0.767	S	S	*	*			trans	79.4	143.6	168.7	77.3	0	0	0	0	117.8
1575	R	27.5	Very low	27.7	Very low	200 Å²	200	129.8 Å²	129.8	76%	0.755	77%	0.767	S	S	*	*			cis	-164.2	144	-16.3	-112.3	-172.1	-176.9	164.4	0.1	111.9
1576	F	29.5	Very low	27.3	Very low	182 Å²	182	130 Å²	130	80%	0.798	76%	0.763	S	S	*	*			trans	71.2	158.2	138.3	-78.7	-147.8	0	0	0	121
1577	A	29.5	Very low	27.2	Very low	68 Å²	68	128.5 Å²	128.5	56%	0.562	76%	0.755	S	S	*	*			cis	-175.6	168.7	-25.5	0	0	0	0	0	112.7
1578	S	28.1	Very low	27.5	Very low	116 Å²	116	123.2 Å²	123.2	81%	0.811	74%	0.737	S	S	*	*			trans	65.5	147	148.5	43.6	0	0	0	0	120.2
1579	S	28.9	Very low	27.8	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	73%	0.731	S	S	*	*			cis	-167.4	-163.8	-12.9	55.7	0	0	0	0	108
1580	S	26.3	Very low	28.2	Very low	115 Å²	115	125.1 Å²	125.1	80%	0.804	72%	0.72	S	S	*	*			cis	-167.5	155	5.1	11.5	0	0	0	0	110.4
1581	G	26.6	Very low	28.1	Very low	64 Å²	64	125.8 Å²	125.8	66%	0.66	72%	0.715	S	S	*	*			trans	123.3	129.4	170.7	0	0	0	0	0	112
1582	S	23.6	Very low	28.1	Very low	119 Å²	119	126.8 Å²	126.8	83%	0.832	71%	0.712	S	S	*	*			cis	73.9	126.5	40.5	78.5	0	0	0	0	113.7
1583	S	23.3	Very low	28.1	Very low	94 Å²	94	127.4 Å²	127.4	66%	0.657	71%	0.709	S	S	*	*			cis	-154.9	-149.7	-4.7	45.9	0	0	0	0	110
1584	D	28.4	Very low	28.1	Very low	128 Å²	128	131 Å²	131	68%	0.684	71%	0.713	S	S	*	*			trans	78.1	133.7	163.1	-37.9	-24.3	0	0	0	114.4
1585	E	25.6	Very low	27.9	Very low	181 Å²	181	132.8 Å²	132.8	85%	0.846	71%	0.713	S	S	*	*				66.1	135.2	101.3	-63.7	-168.2	160.7	0	0	114.6
1586	E	25.1	Very low	28.5	Very low	152 Å²	152	128.1 Å²	128.1	71%	0.71	71%	0.708	S	S	*	*			cis	-150.1	-164	-2.6	-142.4	-155.3	135	0	0	110.6
1587	N	25.8	Very low	28.4	Very low	110 Å²	110	124.8 Å²	124.8	59%	0.588	70%	0.703	S	S	*	*			trans	-13.5	150.2	142.6	-87.6	-42.1	0	0	0	116.9
1588	D	33.7	Very low	28.2	Very low	93 Å²	93	126.7 Å²	126.7	50%	0.497	71%	0.708	S	S	.	*			cis	-161.6	147.6	48.7	-138.6	15.3	0	0	0	115.3
1589	R	32.7	Very low	28.2	Very low	186 Å²	186	130.5 Å²	130.5	70%	0.702	71%	0.712	S	S	*	*			trans	45	141.6	139.9	-69.2	168.8	-144	155.7	32.7	121.2
1590	N	34	Very low	28	Very low	126 Å²	126	128.1 Å²	128.1	67%	0.674	71%	0.705	S	S	*	*			cis	-142	132.9	-5.6	-97.2	-40.1	0	0	0	107.9
1591	L	27	Very low	28.2	Very low	125 Å²	125	130.8 Å²	130.8	65%	0.654	71%	0.711	S	S	*	*			cis	76.4	128.3	49.4	-158.5	84.6	0	0	0	113
1592	K	27.3	Very low	28	Very low	173 Å²	173	131 Å²	131	75%	0.752	71%	0.713	S	S	*	*			trans	31.3	145.7	153.8	-59.4	164.8	-170.9	170.8	0	119.2
1593	I	28.7	Very low	28.2	Very low	152 Å²	152	135.5 Å²	135.5	78%	0.779	72%	0.718	S	S	*	*				169.4	143.8	93.1	-88.8	-178.2	0	0	0	104.9
1594	I	29.4	Very low	28.4	Very low	131 Å²	131	137.7 Å²	137.7	67%	0.672	72%	0.722	S	S	*	*			cis	-155.6	140.7	-11.4	-107.5	175.4	0	0	0	104.1
1595	H	25.5	Very low	28.3	Very low	166 Å²	166	136.2 Å²	136.2	77%	0.769	72%	0.721	S	S	*	*				54.2	168.1	80.6	-100.9	-79.9	0	0	0	115.5
1596	P	40.6	Very low	28.5	Very low	101 Å²	101	134.6 Å²	134.6	66%	0.656	72%	0.724	S	S	*	*				-93.1	-139.1	-53.5	15.9	7.5	0	0	0	107.1
1597	T	27	Very low	28.6	Very low	112 Å²	112	130.8 Å²	130.8	69%	0.687	73%	0.726	S	S	*	*			cis	-130.4	170.6	-11	63.6	0	0	0	0	108
1598	T	25.3	Very low	28.8	Very low	109 Å²	109	136.8 Å²	136.8	67%	0.669	74%	0.74	S	S	*	*			cis	80.4	144.7	13.3	66.4	0	0	0	0	118
1599	E	27.7	Very low	28.5	Very low	195 Å²	195	142.2 Å²	142.2	91%	0.911	76%	0.759	S	S	*	*			trans	67.8	141.5	-179	-59.9	166.9	-142	0	0	115.4
1600	G	25.4	Very low	28.5	Very low	59 Å²	59	138.1 Å²	138.1	61%	0.608	77%	0.765	S	S	*	*			cis	-173.6	151.4	-7.3	0	0	0	0	0	112.8
1601	N	28.7	Very low	27.9	Very low	171 Å²	171	143.5 Å²	143.5	91%	0.914	78%	0.776	S	S	*	*			trans	69.1	140.8	175.3	-47.1	-31	0	0	0	116.1
1602	G	24.4	Very low	28	Very low	68 Å²	68	145.7 Å²	145.7	70%	0.701	79%	0.787	S	S	*	*			cis	117	99.7	-1.6	0	0	0	0	0	112.7
1603	F	27.5	Very low	27.7	Very low	214 Å²	214	142.1 Å²	142.1	94%	0.939	78%	0.784	S	S	*	*			trans	-156.9	161.2	149.2	-132.8	-88.5	0	0	0	111.7
1604	D	26.8	Very low	27.5	Very low	140 Å²	140	140.3 Å²	140.3	75%	0.749	78%	0.783	S	S	*	*			trans	-92.3	167.4	-162.9	-95.9	-61.7	0	0	0	117
1605	S	26.9	Very low	27.2	Very low	96 Å²	96	141.4 Å²	141.4	67%	0.671	79%	0.786	S	S	*	*			trans	100.3	134.5	137.7	82.4	0	0	0	0	122
1606	T	28.3	Very low	27.2	Very low	147 Å²	147	141.8 Å²	141.8	90%	0.902	79%	0.785	S	S	*	*			trans	70	144.3	161.8	78.2	0	0	0	0	118.2
1607	G	28.6	Very low	26.5	Very low	73 Å²	73	142.5 Å²	142.5	75%	0.753	79%	0.788	S	S	*	*			trans	173.8	-20	176.6	0	0	0	0	0	121.9
1608	R	29.7	Very low	26.4	Very low	236 Å²	236	146.1 Å²	146.1	89%	0.891	80%	0.797	S	S	*	*			trans	68	133.3	178.5	-59.9	175.1	169.3	168.5	-2.3	118.7
1609	K	28.1	Very low	26.5	Very low	206 Å²	206	146.4 Å²	146.4	90%	0.896	80%	0.803	S	S	*	*				32.2	138.6	129.7	-54.9	-175.8	177.7	-175.5	0	119.4
1610	A	30.8	Very low	26.7	Very low	100 Å²	100	142.8 Å²	142.8	83%	0.826	80%	0.796	S	S	*	*			cis	-152	162.5	21	0	0	0	0	0	114.9
1611	R	22.9	Very low	26.8	Very low	240 Å²	240	144 Å²	144	91%	0.906	80%	0.801	S	S	*	*			trans	-133	170.5	168.1	-164	-175.6	-164.4	178.1	5.7	106.3
1612	I	28	Very low	26.7	Very low	170 Å²	170	142.9 Å²	142.9	87%	0.872	79%	0.793	S	S	*	*			trans	153.6	158.3	147.8	-81.2	156.8	0	0	0	111.9
1613	S	22.4	Very low	26.8	Very low	98 Å²	98	145.9 Å²	145.9	69%	0.685	79%	0.793	S	S	*	*			trans	-140.7	160	-170.1	52	0	0	0	0	113.1
1614	C	23.1	Very low	26.8	Very low	115 Å²	115	142 Å²	142	78%	0.777	78%	0.782	S	S	*	*			trans	70.3	121.9	155.1	-69	0	0	0	0	123
1615	Q	24.7	Very low	26.8	Very low	153 Å²	153	146.9 Å²	146.9	72%	0.715	79%	0.79	S	S	*	*				57.2	126.6	128.7	-67.2	-161.7	10.7	0	0	124.5
1616	K	25.5	Very low	26.8	Very low	175 Å²	175	148 Å²	148	76%	0.761	79%	0.793	S	S	*	*			trans	68.3	147.2	136.5	-67.4	-177	178.4	179.2	0	118.4
1617	T	24.3	Very low	27	Very low	116 Å²	116	146.8 Å²	146.8	71%	0.712	79%	0.788	S	S	*	*			cis	-158.8	166.9	-3.8	3.7	0	0	0	0	112.3
1618	Q	26	Very low	26.8	Very low	188 Å²	188	153.2 Å²	153.2	88%	0.879	80%	0.795	S	S	*	*			trans	75.4	157.7	158.7	-75	171.1	-19.3	0	0	120
1619	S	26.9	Very low	26.5	Very low	114 Å²	114	147.8 Å²	147.8	80%	0.797	79%	0.794	S	S	*	*			trans	-119.8	172.2	-167.8	-34.1	0	0	0	0	110.2
1620	P	32.6	Very low	26.3	Very low	119 Å²	119	141.7 Å²	141.7	77%	0.773	79%	0.789	S	S	*	*				-156.6	166	66.9	42.6	-21.5	0	0	0	119.8
1621	A	26	Very low	26.2	Very low	84 Å²	84	145.7 Å²	145.7	69%	0.694	79%	0.791	S	S	*	*			trans	68.2	131.5	136.6	0	0	0	0	0	125.3
1622	I	26.9	Very low	26.3	Very low	149 Å²	149	142.8 Å²	142.8	76%	0.764	79%	0.788	S	S	*	*			trans	69.2	105.1	141.8	-62	161.6	0	0	0	119
1623	N	28.1	Very low	26.1	Very low	131 Å²	131	145.9 Å²	145.9	70%	0.701	79%	0.788	S	S	*	*				-167.7	133.3	93.7	-121.7	-33.2	0	0	0	116
1624	N	26.1	Very low	26.3	Very low	132 Å²	132	146 Å²	146	71%	0.706	80%	0.795	S	S	*	*			trans	37.5	99.1	150.5	-63.3	-19.2	0	0	0	122.9
1625	R	27.5	Very low	26.5	Very low	242 Å²	242	149.1 Å²	149.1	91%	0.913	80%	0.803	S	S	*	*				-163.2	86.9	113.2	-105.8	178.6	-173.8	-166	2.3	113.3
1626	T	27.1	Very low	26.5	Very low	120 Å²	120	145.9 Å²	145.9	74%	0.736	80%	0.802	S	S	*	*				33.8	140.4	124.2	50.5	0	0	0	0	120.9
1627	P	31.9	Very low	26.5	Very low	122 Å²	122	144.7 Å²	144.7	79%	0.792	80%	0.804	S	S	*	*				-140.9	-158.8	-95	41.6	-22.4	0	0	0	114.6
1628	F	24.4	Very low	26.6	Very low	207 Å²	207	147.2 Å²	147.2	91%	0.908	81%	0.814	S	S	*	*			trans	-47	134.1	172.3	-78.6	-114	0	0	0	115.1
1629	S	23.6	Very low	26.5	Very low	123 Å²	123	144.1 Å²	144.1	86%	0.86	81%	0.807	S	S	*	*				-170.1	151.5	122.7	58.9	0	0	0	0	111.4
1630	G	24.9	Very low	26.4	Very low	77 Å²	77	147.2 Å²	147.2	79%	0.794	81%	0.809	S	S	*	*			trans	81.7	77.7	158.7	0	0	0	0	0	118.9
1631	Q	28.6	Very low	26.3	Very low	185 Å²	185	149.9 Å²	149.9	86%	0.864	81%	0.813	S	S	*	*			trans	-143.9	59.9	146.1	-150.9	157.2	49.1	0	0	114.1
1632	Q	23.8	Very low	26.3	Very low	179 Å²	179	149.2 Å²	149.2	84%	0.836	81%	0.814	S	S	*	*			trans	-59.4	157.7	144	-71.3	178.3	-21.7	0	0	109.5
1633	R	24.9	Very low	26.2	Very low	234 Å²	234	149.5 Å²	149.5	88%	0.883	82%	0.816	S	S	*	*			trans	66.9	103.4	176.6	-55.7	175.2	173.7	170.6	-2.6	116
1634	A	26.7	Very low	26.1	Very low	100 Å²	100	154.3 Å²	154.3	83%	0.826	82%	0.824	S	S	*	*	S	Bend	trans	-174.4	12.9	130.1	0	0	0	0	0	114.7
1635	L	26.6	Very low	26.2	Very low	182 Å²	182	157.1 Å²	157.1	95%	0.953	83%	0.833	S	S	*	*	S	Bend	trans	-118.6	56.7	175.3	-95	165.6	0	0	0	111.7
1636	A	24.9	Very low	26.1	Very low	84 Å²	84	154.1 Å²	154.1	69%	0.694	83%	0.834	S	S	*	*			trans	-151	99.4	170.3	0	0	0	0	0	108.7
1637	N	24.4	Very low	26.1	Very low	150 Å²	150	160.3 Å²	160.3	80%	0.802	84%	0.844	S	S	*	*			trans	166.4	73.6	158.2	-90.5	-19.4	0	0	0	110.9
1638	D	26.9	Very low	25.8	Very low	170 Å²	170	159.1 Å²	159.1	91%	0.909	84%	0.838	S	S	*	*	S	Bend	trans	-147.7	31	153.8	-120.1	-14.9	0	0	0	110.8
1639	T	24.7	Very low	25.9	Very low	122 Å²	122	157.7 Å²	157.7	75%	0.748	83%	0.834	S	S	*	*			trans	-137.9	60.4	-174.4	52.1	0	0	0	0	111
1640	H	24.4	Very low	26.2	Very low	180 Å²	180	160 Å²	160	83%	0.833	83%	0.832	S	S	*	*			trans	-152.6	71	169.4	-110.7	-73.1	0	0	0	113.6
1641	M	29.4	Very low	26.3	Very low	175 Å²	175	161 Å²	161	86%	0.862	83%	0.826	S	S	*	*	S	Bend	trans	-145.9	114.1	149.9	-88.5	-165.7	-67	0	0	107.1
1642	G	26.6	Very low	26.4	Very low	69 Å²	69	162.4 Å²	162.4	71%	0.711	82%	0.824	S	S	*	*			cis	-179.7	80.7	-5.5	0	0	0	0	0	111.9
1643	I	24.7	Very low	26.7	Very low	156 Å²	156	161.5 Å²	161.5	80%	0.8	82%	0.824	S	S	*	*			trans	-127.4	109.2	179.1	-57.7	177	0	0	0	109.8
1644	R	26.3	Very low	27	Very low	231 Å²	231	154.6 Å²	154.6	87%	0.872	82%	0.818	S	S	*	*			trans	167.2	113.7	141.9	-96.1	170.7	-173.6	-166.3	2.2	110
1645	H	27.6	Very low	27.2	Very low	192 Å²	192	154.2 Å²	154.2	89%	0.889	81%	0.809	S	S	*	*			trans	-164.3	82.1	139.8	-104.9	-69.1	0	0	0	108.9
1646	L	25.1	Very low	27.4	Very low	179 Å²	179	153 Å²	153	94%	0.937	80%	0.802	S	S	*	*			trans	-143.6	82.7	165.5	-83.6	-177.4	0	0	0	109.6
1647	R	27.1	Very low	27.8	Very low	249 Å²	249	154 Å²	154	94%	0.94	80%	0.804	S	S	*	*			trans	-152.4	149.7	140.5	-123.1	177.8	-176.9	171.1	1.4	108.3
1648	S	25.8	Very low	28.1	Very low	97 Å²	97	156.5 Å²	156.5	68%	0.678	81%	0.808	S	S	*	*			trans	-80.5	151.7	-172.1	46	0	0	0	0	112.6
1649	E	27.7	Very low	28.5	Very low	177 Å²	177	153.5 Å²	153.5	83%	0.827	81%	0.807	S	S	*	*				-167.8	141.9	115.1	-100.8	152.8	-154	0	0	113.5
1650	E	29.7	Very low	28.9	Very low	173 Å²	173	151.6 Å²	151.6	81%	0.808	80%	0.803	S	S	*	*			trans	32	95.2	152.3	-53.8	-161.4	135.5	0	0	124.4
1651	S	27.2	Very low	29.3	Very low	97 Å²	97	150.4 Å²	150.4	68%	0.678	80%	0.803	S	S	*	*				87.3	156.6	111.7	88.4	0	0	0	0	123.2
1652	R	30.1	Very low	29.5	Very low	215 Å²	215	147.9 Å²	147.9	81%	0.811	80%	0.797	S	S	*	*			trans	72.4	100.1	157.8	-67.3	176.6	-179.4	-170.3	0.6	120.6
1653	N	30.3	Very low	29.8	Very low	159 Å²	159	150.2 Å²	150.2	85%	0.85	80%	0.798	S	S	*	*				66.5	142.6	126	-57.6	-2.6	0	0	0	119
1654	A	31.5	Very low	30.3	Very low	90 Å²	90	148.7 Å²	148.7	74%	0.744	80%	0.798	S	S	*	*			cis	-169.2	172.4	5.9	0	0	0	0	0	109.4
1655	S	30.7	Very low	30.6	Very low	92 Å²	92	143.2 Å²	143.2	64%	0.643	80%	0.795	S	S	*	*			cis	-175.3	164.4	-26.7	62.2	0	0	0	0	109.1
1656	I	30	Very low	30.9	Very low	155 Å²	155	138.4 Å²	138.4	80%	0.795	79%	0.788	S	S	*	*			trans	66.8	131	162.7	-58.4	158.5	0	0	0	115
1657	S	32.7	Very low	31.3	Very low	107 Å²	107	140.2 Å²	140.2	75%	0.748	79%	0.789	S	S	*	*			cis	-128.1	148	33.2	47.6	0	0	0	0	113.1
1658	K	32.1	Very low	31.3	Very low	202 Å²	202	136.5 Å²	136.5	88%	0.878	78%	0.782	S	S	*	*				78.7	92.8	52.6	-94	-161.6	173.8	-168	0	115.5
1659	A	34.5	Very low	31.7	Very low	107 Å²	107	140.3 Å²	140.3	88%	0.884	79%	0.789	S	S	*	*			trans	-145.4	130.7	132.8	0	0	0	0	0	107.9
1660	A	33.8	Very low	31.9	Very low	82 Å²	82	138.8 Å²	138.8	68%	0.678	79%	0.787	S	S	*	*			trans	-121.9	-174.6	169.6	0	0	0	0	0	106.8
1661	D	32.2	Very low	32.1	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	78%	0.779	S	S	*	*			cis	-159	-166.6	31.3	-80.7	-70.7	0	0	0	106.4
1662	V	34.2	Very low	32.3	Very low	121 Å²	121	137.1 Å²	137.1	73%	0.733	78%	0.783	S	S	*	*			cis	-165	162.9	-3.3	103.8	0	0	0	0	105.9
1663	T	31.7	Very low	32.5	Very low	118 Å²	118	131.5 Å²	131.5	72%	0.724	78%	0.776	S	S	*	*			cis	-141.1	158.9	-0.7	7.8	0	0	0	0	109.2
1664	P	36.4	Very low	32.7	Very low	125 Å²	125	132.1 Å²	132.1	81%	0.812	77%	0.774	S	S	*	*			trans	-110.8	163.8	162.5	39	-30.9	0	0	0	113.8
1665	S	33.2	Very low	32.9	Very low	115 Å²	115	139.4 Å²	139.4	80%	0.804	80%	0.799	S	S	*	*			trans	-165.3	132.2	159.2	-173	0	0	0	0	108.4
1666	A	33.5	Very low	33	Very low	91 Å²	91	141.8 Å²	141.8	75%	0.752	81%	0.807	S	S	*	*			cis	117.5	108.9	9.2	0	0	0	0	0	112.6
1667	K	32.6	Very low	33.2	Very low	218 Å²	218	141.1 Å²	141.1	95%	0.948	81%	0.808	S	S	*	*			trans	-162.5	166.5	146.1	-115.1	-176.4	-178.1	-166.4	0	111.4
1668	Q	28	Very low	33.2	Very low	170 Å²	170	143 Å²	143	79%	0.794	81%	0.811	S	S	*	*			trans	-157.9	139.9	-152.8	-173.8	-177.4	-16.5	0	0	110.6
1669	E	33.6	Very low	33.2	Very low	178 Å²	178	139.5 Å²	139.5	83%	0.832	81%	0.807	S	S	*	*			trans	177.7	123.8	156.8	-99	150.8	-159.6	0	0	106.7
1670	N	32.4	Very low	33.2	Very low	145 Å²	145	141.6 Å²	141.6	78%	0.775	80%	0.802	S	S	*	*				69.6	133.1	75	-75.3	-6.8	0	0	0	113.4
1671	S	32.8	Very low	33.1	Very low	91 Å²	91	145.5 Å²	145.5	64%	0.636	81%	0.81	S	S	*	*			cis	-169.3	162.5	4	51.7	0	0	0	0	114.6
1672	N	32.9	Very low	33.2	Very low	143 Å²	143	144.9 Å²	144.9	77%	0.765	81%	0.809	S	S	*	*			trans	72.8	122.3	145.9	-66.8	-4.6	0	0	0	123.6
1673	S	32.9	Very low	33.1	Very low	97 Å²	97	146.7 Å²	146.7	68%	0.678	82%	0.815	S	S	*	*			trans	54.7	138.5	132.1	71.1	0	0	0	0	120.7
1674	H	35	Very low	33.2	Very low	173 Å²	173	149.1 Å²	149.1	80%	0.801	82%	0.822	S	S	*	*			cis	-160.1	165.5	42.5	-110.3	-78.1	0	0	0	111.9
1675	L	35.6	Very low	32.9	Very low	243 Å²	243	151.3 Å²	151.3	100%	1.272	82%	0.823	S	S	*	*			trans	71.6	0	174	-81.3	146.4	0	0	0	116.1

Retrieved 1,675 of 1,675 residues in 606.9 ms (Link to these results)

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